A0A5K4EWL8_SCHMA Loading...

Netrin receptor UNC5

Receptor for netrin required for axon guidance. Mediates axon repulsion of neuronal growth cones in the developing nervous system upon ligand binding.

AlphaFold DB (A0A3Q0KSB1), UniProt , Accession A0A5K4EWL8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,226 aa.

						>A0A5K4EWL8_SCHMA|A0A5K4EWL8
MLQRFLLTVAELFLTLSYPIPADSQEDLVQPDETHLEGVPVFIQHPKPLYYTTKNKPATIECVAEPVSHAAIKCAEQTIPYKGPGESGILEIQKLNSDNLPDPDGKRWKLRLEVRAKDVEEWFDTYVCHCEAWNKVVKLQRPKKVISNTTEIKEAYLDEKFQLEPVSTDLAVSKRLVLTCLPPEGDPDPEVYWLKDGKRVDTKSFPHIVINDYNHLIIENTTTSDSGNYTCVAACLNGEKRRAVARVNIFPYNSAMNRPVSGDLTNWGEWGTCYKLTAEGSNARTVCQQTRYRVCASQITSKTEFKSLDLSHLVTDQCPLPLFQTRNCSSSQCINSMNNVVLKGAHLSDMKPPTTTLKIPSSPMFRTEEIAIYVGLFLSLAVLLAVVALITRRKSLKFSTTRAIRYSACLHSKRSCRQEIANKKAQDLLLPGDMTQTTITIMNPSVADTQNQEMNRMKPNYNSNNINSKTFGVNVINGGINGILFQHQYNTTPVNNIPLSTAGQTLVFPNGTSLGTTTSILANLPPPPAPPPPPPTPPPPLPLSLPPIPTTSINFDGSHGASDISGYTGFSSTLPNTQHFMNPASCQISGYLTSDPYLQTNIEFNNQVVNSGTEPTYFESEVGLSRVNCGPHFSTPLAVSNLGGPIESSSDPSTANTGTTVTAIGSCNGGSSTGSVGLPLNRCLTNRSPNNYNINFLNVEIDECNEKCEPESGLYHELSLDTVSSDRSILCEFIDPLELNTTVRKTISCDGDQLALPQSGVFLTIPQGALQSNSLVEVYLAVCREDKHRPTLGDHQTLLSPVIQFGPVGLNLSKPVLLSFPHCAELNQSNWLIRVLALGPNLNRSPNNLNTSNINGYKCNYSALHTNLHNFIWQEVGIIGYESNVTKYICHLDSNMAHLMTDVARRYCLVGETQKLLGGNRLISNHKNLNHTEFQNFPNGISTNGLQNINITNLTNSNNIMTDSAQDSGLLSDIQPATKILKLAAFSGPLTPTIDYNIRVYVLTDTKDALEHVLYVEKRLEGRLLDDPKSLLFKDNGGGLCFCIEDISPGWRSRLQTKSQEIPFRHIWNGTQMSTLHCAFSLEHLDPRQLNVSCKIKVYQENSQVQEQVLKISNQKFELKTEHPRTRFFSSEDRSSDIRSFTSPYRLPVVTTQRLCKLLDEKEGEWQKLAKHMRMERYIFYLKSQPSPTTVLLNMWEACNRDEPSVNELKAIFSAMDRADCANLLE
					

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(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	42.8	Very low	63.8	Low	220 Å²	220	120.6 Å²	120.6	100%	1.084	60%	0.597	S	S	*	*				0	-60.6	0	-104.1	-175.1	-84	0	0	112.5	Q3 R4 F5	M1-Q3 VanDerWaalsContact C-N 3.28Å; M1-Q3 PolarHBondContact O-N 3.31Å; M1-R4 PolarHBondContact O-N 3.44Å; M1-F5 PolarHBondContact O-N 3.4Å
2	L	47.2	Very low	64	Low	128 Å²	128	119.5 Å²	119.5	67%	0.67	59%	0.594	S	S	*	*	H	α-helix	trans	-44.9	-43.4	-172.8	-163.4	72.7	0	0	0	115.2	R4 F5 L6	L2-R4 VanDerWaalsContact C-N 3.34Å; L2-R4 PolarHBondContact O-N 3.46Å; L2-F5 WeakPolarHBondContact O-CB 3.41Å; L2-F5 PolarHBondContact O-N 2.74Å; L2-F5 VanDerWaalsContact O-N 3.1Å; L2-L6 HydrophobicContact CD2-CD1 4.5Å; L2-L6 HydrophobicContact CG-CD1 4.17Å; L2-L6 WeakPolarHBondContact O-CG 3.38Å; L2-L6 PolarHBondContact O-N 3.05Å
3	Q	53.4	Low	63.7	Low	156 Å²	156	121.5 Å²	121.5	73%	0.729	60%	0.597	S	S	*	*	H	α-helix	trans	-59.4	-36.8	177.3	-169.2	179.5	8.9	0	0	114.1	M1 L7	M1-Q3 VanDerWaalsContact C-N 3.28Å; M1-Q3 PolarHBondContact O-N 3.31Å; Q3-L7 WeakPolarHBondContact O-CG 3.48Å; Q3-L7 PolarHBondContact O-N 3.24Å
4	R	66	Low	63.2	Low	207 Å²	207	119.6 Å²	119.6	78%	0.781	59%	0.59	S	S	*	*	H	α-helix	trans	-73	-33	174.1	-75.4	-171.1	176.7	-178.5	-2.2	112.2	M1 L2 T8	M1-R4 PolarHBondContact O-N 3.44Å; L2-R4 VanDerWaalsContact C-N 3.34Å; L2-R4 PolarHBondContact O-N 3.46Å; R4-T8 PolarHBondContact O-N 2.72Å; R4-T8 PolarHBondContact O-OG1 2.82Å
5	F	71.6	Confident	62.4	Low	132 Å²	132	119 Å²	119	58%	0.579	60%	0.596	S	S	*	*	H	α-helix	trans	-67.1	-44.6	174	-177	-98.5	0	0	0	111	M1 L2 L7 T8 V9	M1-F5 PolarHBondContact O-N 3.4Å; L2-F5 WeakPolarHBondContact O-CB 3.41Å; L2-F5 PolarHBondContact O-N 2.74Å; L2-F5 VanDerWaalsContact O-N 3.1Å; F5-L7 PolarHBondContact O-N 2.87Å; F5-T8 WeakPolarHBondContact CA-OG1 3.36Å; F5-T8 PolarHBondContact O-N 2.99Å; F5-T8 PolarHBondContact O-OG1 2.61Å; F5-T8 VanDerWaalsContact O-OG1 3.06Å; F5-V9 HydrophobicContact CD1-CG2 4.19Å; F5-V9 HydrophobicContact CE1-CG2 3.84Å; F5-V9 HydrophobicContact CE2-CG2 4.35Å; F5-V9 HydrophobicContact CZ-CG2 3.93Å; F5-V9 WeakPolarHBondContact O-CB 3.48Å; F5-V9 WeakPolarHBondContact O-CG2 3.45Å; F5-V9 PolarHBondContact O-N 3.16Å
6	L	70.4	Confident	61.4	Low	104 Å²	104	120.4 Å²	120.4	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-63.8	-37.8	175.4	-69.2	169.4	0	0	0	112.5	L2 A10	L2-L6 HydrophobicContact CD2-CD1 4.5Å; L2-L6 HydrophobicContact CG-CD1 4.17Å; L2-L6 WeakPolarHBondContact O-CG 3.38Å; L2-L6 PolarHBondContact O-N 3.05Å; L6-A10 WeakPolarHBondContact O-CB 3.39Å; L6-A10 PolarHBondContact O-N 2.91Å
7	L	71.6	Confident	60.4	Low	99 Å²	99	118.1 Å²	118.1	52%	0.518	60%	0.602	S	S	.	*	H	α-helix	trans	-60.8	-51.2	171.3	-85.7	160.4	0	0	0	112	Q3 F5 V9 A10 E11	Q3-L7 WeakPolarHBondContact O-CG 3.48Å; Q3-L7 PolarHBondContact O-N 3.24Å; F5-L7 PolarHBondContact O-N 2.87Å; L7-V9 VanDerWaalsContact C-N 3.34Å; L7-V9 PolarHBondContact O-N 3.47Å; L7-A10 WeakPolarHBondContact O-CB 3.26Å; L7-A10 PolarHBondContact O-N 2.72Å; L7-A10 VanDerWaalsContact O-N 3.14Å; L7-E11 WeakPolarHBondContact O-CG 3.46Å; L7-E11 PolarHBondContact O-N 2.83Å
8	T	70.8	Confident	58.8	Low	64 Å²	64	119.3 Å²	119.3	39%	0.393	60%	0.6	S	S	.	*	H	α-helix	trans	-66.3	-32	-179.9	40.6	0	0	0	0	113.5	R4 F5 L12	R4-T8 PolarHBondContact O-N 2.72Å; R4-T8 PolarHBondContact O-OG1 2.82Å; F5-T8 WeakPolarHBondContact CA-OG1 3.36Å; F5-T8 PolarHBondContact O-N 2.99Å; F5-T8 PolarHBondContact O-OG1 2.61Å; F5-T8 VanDerWaalsContact O-OG1 3.06Å; T8-L12 VanDerWaalsContact O-CD1 3.28Å; T8-L12 WeakPolarHBondContact O-CD1 3.32Å; T8-L12 PolarHBondContact O-N 3.42Å
9	V	71.8	Confident	57.7	Low	56 Å²	56	119 Å²	119	34%	0.339	61%	0.607	S	S	.	*	H	α-helix	trans	-70.5	-37	172	172.2	0	0	0	0	111.5	F5 L7 L12 F13	F5-V9 HydrophobicContact CD1-CG2 4.19Å; F5-V9 HydrophobicContact CE1-CG2 3.84Å; F5-V9 HydrophobicContact CE2-CG2 4.35Å; F5-V9 HydrophobicContact CZ-CG2 3.93Å; F5-V9 WeakPolarHBondContact O-CB 3.48Å; F5-V9 WeakPolarHBondContact O-CG2 3.45Å; F5-V9 PolarHBondContact O-N 3.16Å; L7-V9 VanDerWaalsContact C-N 3.34Å; L7-V9 PolarHBondContact O-N 3.47Å; V9-L12 PolarHBondContact O-N 3.37Å; V9-F13 HydrophobicContact CG1-CD2 4.19Å; V9-F13 PolarHBondContact O-N 3.08Å
10	A	69.9	Low	56.4	Low	48 Å²	48	121.1 Å²	121.1	40%	0.397	62%	0.617	S	S	.	*	H	α-helix	trans	-66.6	-41.4	173.2	0	0	0	0	0	111.9	L6 L7 F13 L14	L6-A10 WeakPolarHBondContact O-CB 3.39Å; L6-A10 PolarHBondContact O-N 2.91Å; L7-A10 WeakPolarHBondContact O-CB 3.26Å; L7-A10 PolarHBondContact O-N 2.72Å; L7-A10 VanDerWaalsContact O-N 3.14Å; A10-F13 PolarHBondContact O-N 3.33Å; A10-L14 WeakPolarHBondContact O-CB 3.44Å; A10-L14 WeakPolarHBondContact O-CD1 3.28Å; A10-L14 VanDerWaalsContact O-CG 3.25Å; A10-L14 WeakPolarHBondContact O-CG 3.32Å; A10-L14 PolarHBondContact O-N 3.34Å
11	E	65.8	Low	55.5	Low	113 Å²	113	120.8 Å²	120.8	53%	0.528	62%	0.624	S	S	.	*	H	α-helix	trans	-57.7	-48.7	172.5	-72.8	167.6	173.5	0	0	111.3	L7 F13 L14 T15	L7-E11 WeakPolarHBondContact O-CG 3.46Å; L7-E11 PolarHBondContact O-N 2.83Å; E11-F13 PolarHBondContact O-N 2.82Å; E11-L14 PolarHBondContact O-N 3.28Å; E11-T15 WeakPolarHBondContact O-CG2 3.35Å; E11-T15 PolarHBondContact O-N 2.88Å; E11-T15 PolarHBondContact O-OG1 2.97Å
12	L	66.1	Low	55	Low	107 Å²	107	115 Å²	115	56%	0.56	61%	0.611	S	S	*	*	H	α-helix	trans	-60.1	-47.7	175.7	-98.5	91.8	0	0	0	112.4	T8 V9 L14 T15 L16	T8-L12 VanDerWaalsContact O-CD1 3.28Å; T8-L12 WeakPolarHBondContact O-CD1 3.32Å; T8-L12 PolarHBondContact O-N 3.42Å; V9-L12 PolarHBondContact O-N 3.37Å; L12-L14 VanDerWaalsContact C-N 3.3Å; L12-L14 PolarHBondContact O-N 3.27Å; L12-T15 WeakPolarHBondContact CA-OG1 3.48Å; L12-T15 PolarHBondContact O-N 3.09Å; L12-T15 PolarHBondContact O-OG1 3.05Å; L12-L16 WeakPolarHBondContact O-CG 3.44Å; L12-L16 PolarHBondContact O-N 3.03Å
13	F	61	Low	54.7	Low	145 Å²	145	113.8 Å²	113.8	64%	0.636	61%	0.605	S	S	*	*	H	α-helix	trans	-62	-37.4	179	-102.5	-87.1	0	0	0	112.5	V9 A10 E11 L16 S17	V9-F13 HydrophobicContact CG1-CD2 4.19Å; V9-F13 PolarHBondContact O-N 3.08Å; A10-F13 PolarHBondContact O-N 3.33Å; E11-F13 PolarHBondContact O-N 2.82Å; F13-L16 PolarHBondContact O-N 2.88Å; F13-S17 VanDerWaalsContact O-CB 3.28Å; F13-S17 WeakPolarHBondContact O-CB 3.42Å; F13-S17 PolarHBondContact O-N 2.89Å; F13-S17 PolarHBondContact O-OG 2.8Å
14	L	56.9	Low	54.7	Low	96 Å²	96	110 Å²	110	50%	0.503	60%	0.596	S	S	.	*	H	α-helix	trans	-63.8	-47.6	173.2	-71.8	164.6	0	0	0	110.9	A10 E11 L12 L16 S17 Y18	A10-L14 WeakPolarHBondContact O-CB 3.44Å; A10-L14 WeakPolarHBondContact O-CD1 3.28Å; A10-L14 VanDerWaalsContact O-CG 3.25Å; A10-L14 WeakPolarHBondContact O-CG 3.32Å; A10-L14 PolarHBondContact O-N 3.34Å; E11-L14 PolarHBondContact O-N 3.28Å; L12-L14 VanDerWaalsContact C-N 3.3Å; L12-L14 PolarHBondContact O-N 3.27Å; L14-L16 PolarHBondContact O-N 2.94Å; L14-S17 PolarHBondContact O-N 3.05Å; L14-Y18 HydrophobicContact CD2-CE2 3.97Å; L14-Y18 VanDerWaalsContact O-CD2 3.31Å; L14-Y18 WeakPolarHBondContact O-CD2 3.42Å
15	T	50.5	Low	54.3	Low	110 Å²	110	106.4 Å²	106.4	68%	0.675	59%	0.588	S	S	*	*	H	α-helix	trans	-62.8	-23.4	178.8	57.9	0	0	0	0	114.5	E11 L12	E11-T15 WeakPolarHBondContact O-CG2 3.35Å; E11-T15 PolarHBondContact O-N 2.88Å; E11-T15 PolarHBondContact O-OG1 2.97Å; L12-T15 WeakPolarHBondContact CA-OG1 3.48Å; L12-T15 PolarHBondContact O-N 3.09Å; L12-T15 PolarHBondContact O-OG1 3.05Å
16	L	47.3	Very low	53.9	Low	141 Å²	141	106.7 Å²	106.7	74%	0.738	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-3.3	-179.8	-68.5	169.4	0	0	0	114.2	L12 F13 L14	L12-L16 WeakPolarHBondContact O-CG 3.44Å; L12-L16 PolarHBondContact O-N 3.03Å; F13-L16 PolarHBondContact O-N 2.88Å; L14-L16 PolarHBondContact O-N 2.94Å
17	S	43.2	Very low	54.3	Low	81 Å²	81	104.4 Å²	104.4	57%	0.566	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	-6	-172.2	-58.3	0	0	0	0	115.4	F13 L14	F13-S17 VanDerWaalsContact O-CB 3.28Å; F13-S17 WeakPolarHBondContact O-CB 3.42Å; F13-S17 PolarHBondContact O-N 2.89Å; F13-S17 PolarHBondContact O-OG 2.8Å; L14-S17 PolarHBondContact O-N 3.05Å
18	Y	32.6	Very low	54.9	Low	141 Å²	141	101.8 Å²	101.8	55%	0.553	57%	0.566	S	S	*	*	S	Bend	trans	-100.3	128.9	178.8	-75.7	-70.3	0	0	0	112.1	L14 I20 I404	L14-Y18 HydrophobicContact CD2-CE2 3.97Å; L14-Y18 VanDerWaalsContact O-CD2 3.31Å; L14-Y18 WeakPolarHBondContact O-CD2 3.42Å; Y18-I20 PolarHBondContact O-N 2.96Å; Y18-I404 HydrophobicContact CE1-CD1 3.62Å
19	P	38.4	Very low	55.5	Low	113 Å²	113	100.1 Å²	100.1	73%	0.734	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-62.3	130.4	164.2	-16.1	29.9	0	0	0	109.3	P21	P19-P21 VanDerWaalsContact O-CD 3.3Å; P19-P21 WeakPolarHBondContact O-CD 3.39Å
20	I	31.8	Very low	56.1	Low	160 Å²	160	101.3 Å²	101.3	82%	0.821	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-63	120.2	173.7	-60.2	170	0	0	0	107.9	Y18 A22	Y18-I20 PolarHBondContact O-N 2.96Å; I20-A22 PolarHBondContact O-N 3.03Å
21	P	35.5	Very low	56.6	Low	116 Å²	116	103.6 Å²	103.6	75%	0.753	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-65.4	126.5	167.9	-14.2	29.8	0	0	0	108	P19 D23	P19-P21 VanDerWaalsContact O-CD 3.3Å; P19-P21 WeakPolarHBondContact O-CD 3.39Å; P21-D23 PolarHBondContact O-N 3.26Å
22	A	34.2	Very low	57.4	Low	98 Å²	98	104.2 Å²	104.2	81%	0.81	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-57.2	137.6	174.9	0	0	0	0	0	110	I20 S24	I20-A22 PolarHBondContact O-N 3.03Å; A22-S24 PolarHBondContact O-N 3.5Å; A22-S24 VanDerWaalsContact O-N 3.16Å
23	D	40	Very low	58.3	Low	103 Å²	103	99.8 Å²	99.8	55%	0.551	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-67.2	117.1	-171.2	-172.5	-0.7	0	0	0	111.3	P21 Q25 E26	P21-D23 PolarHBondContact O-N 3.26Å; D23-Q25 PolarHBondContact O-N 3.42Å; D23-Q25 VanDerWaalsContact OD1-CB 3.3Å; D23-Q25 WeakPolarHBondContact OD1-CB 3.48Å; D23-Q25 PolarHBondContact OD1-N 3.23Å; D23-E26 PolarHBondContact O-N 2.85Å
24	S	53.6	Low	59.2	Low	77 Å²	77	96.4 Å²	96.4	54%	0.538	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-5	178.9	66.4	0	0	0	0	114.4	A22	A22-S24 PolarHBondContact O-N 3.5Å; A22-S24 VanDerWaalsContact O-N 3.16Å
25	Q	56.9	Low	60.6	Low	131 Å²	131	100.2 Å²	100.2	61%	0.612	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-24.5	-178.2	-143.9	153.2	-65.9	0	0	113.4	D23 L28	D23-Q25 PolarHBondContact O-N 3.42Å; D23-Q25 VanDerWaalsContact OD1-CB 3.3Å; D23-Q25 WeakPolarHBondContact OD1-CB 3.48Å; D23-Q25 PolarHBondContact OD1-N 3.23Å; Q25-L28 HydrophobicContact CG-CD1 3.94Å; Q25-L28 PolarHBondContact O-N 3.06Å
26	E	64	Low	62.3	Low	137 Å²	137	96.2 Å²	96.2	64%	0.64	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-35	176.1	-67.9	-161.8	164	0	0	113.3	D23 L28 K143	D23-E26 PolarHBondContact O-N 2.85Å; E26-L28 PolarHBondContact O-N 3.38Å; E26-K143 PolarHBondContact O-NZ 3.24Å
27	D	78.6	Confident	64.1	Low	56 Å²	56	97.7 Å²	97.7	30%	0.299	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-16.5	179.6	-97.5	2.5	0	0	0	112.8	K143 K144	D27-K143 CarbonylContact O-C 3.46Å; D27-K143 WeakPolarHBondContact O-CA 3.22Å; D27-K143 WeakPolarHBondContact O-CD 3.36Å; D27-K144 HydrophobicContact CB-CB 4.34Å; D27-K144 WeakPolarHBondContact O-CB 3.42Å; D27-K144 PolarHBondContact O-N 3.44Å
28	L	83.6	Confident	66.3	Low	45 Å²	45	94.7 Å²	94.7	24%	0.236	52%	0.517	C	S	.	.	B	Isolated β-bridge	trans	-69	137.3	-179	-66.2	174.1	0	0	0	111.7	Q25 E26 Q30 K143 K144 I146	Q25-L28 HydrophobicContact CG-CD1 3.94Å; Q25-L28 PolarHBondContact O-N 3.06Å; E26-L28 PolarHBondContact O-N 3.38Å; L28-Q30 PolarHBondContact O-N 3.34Å; L28-Q30 PolarHBondContact O-NE2 2.98Å; L28-Q30 VanDerWaalsContact O-NE2 3.09Å; L28-K143 PolarHBondContact O-NZ 2.77Å; L28-K144 HydrophobicContact CD2-CB 4.47Å; L28-K144 VanDerWaalsContact CD2-CE 3.44Å; L28-I146 HydrophobicContact CD2-CD1 3.76Å; L28-I146 HydrophobicContact CD2-CG1 4.08Å
29	V	84.5	Confident	69.1	Low	29 Å²	29	88.6 Å²	88.6	18%	0.176	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-61.8	118.9	169.8	173.4	0	0	0	0	109.4	E33 T34 V39 K143 K144 V145	V29-E33 WeakPolarHBondContact CA-OE2 3.44Å; V29-E33 HydrophobicContact CG1-CB 4Å; V29-T34 HydrophobicContact CG1-CG2 3.89Å; V29-V39 HydrophobicContact CG1-CG1 4.19Å; V29-V39 HydrophobicContact CG2-CG1 3.98Å; V29-V39 HydrophobicContact CG2-CG2 4.31Å; V29-K143 HydrophobicContact CG2-CB 3.77Å; V29-K143 HydrophobicContact CG2-CG 4.41Å; V29-K144 PolarHBondContact N-O 3.11Å; V29-V145 HydrophobicContact CB-CG2 4.02Å; V29-V145 HydrophobicContact CG2-CG2 3.56Å
30	Q	83.6	Confident	71.7	Confident	81 Å²	81	83.3 Å²	83.3	38%	0.379	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-77	157.8	174.2	-57.7	-55.1	-52.2	0	0	110.9	L28 D32 E33 T34	L28-Q30 PolarHBondContact O-N 3.34Å; L28-Q30 PolarHBondContact O-NE2 2.98Å; L28-Q30 VanDerWaalsContact O-NE2 3.09Å; Q30-D32 WeakPolarHBondContact CB-OD1 2.96Å; Q30-D32 PolarHBondContact O-N 3.16Å; Q30-D32 VanDerWaalsContact O-N 3.12Å; Q30-E33 HydrophobicContact CB-CB 4.42Å; Q30-E33 HydrophobicContact CB-CG 4.1Å; Q30-E33 PolarHBondContact N-OE2 3.42Å; Q30-E33 WeakPolarHBondContact O-CA 3.47Å; Q30-E33 WeakPolarHBondContact O-CB 3.22Å; Q30-E33 PolarHBondContact O-N 3.01Å; Q30-T34 PolarHBondContact O-N 2.81Å
31	P	80.9	Confident	74.7	Confident	96 Å²	96	80 Å²	80	62%	0.623	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-33.2	-174.9	-28.1	36.5	0	0	0	114.6	T34	P31-T34 WeakPolarHBondContact O-CG2 3.36Å; P31-T34 PolarHBondContact O-OG1 3.43Å
32	D	82.6	Confident	77.5	Confident	125 Å²	125	75.4 Å²	75.4	67%	0.668	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-24.2	175.5	62.5	-57	0	0	0	113.9	Q30 T34	Q30-D32 WeakPolarHBondContact CB-OD1 2.96Å; Q30-D32 PolarHBondContact O-N 3.16Å; Q30-D32 VanDerWaalsContact O-N 3.12Å; D32-T34 VanDerWaalsContact C-N 3.28Å; D32-T34 PolarHBondContact O-N 3.1Å
33	E	84.4	Confident	80.3	Confident	15 Å²	15	75.1 Å²	75.1	7%	0.07	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-74.2	-16.8	173.4	-68	176.8	148.6	0	0	112.2	V29 Q30 H35 L36 V39 L139 R141 K143	V29-E33 WeakPolarHBondContact CA-OE2 3.44Å; V29-E33 HydrophobicContact CG1-CB 4Å; Q30-E33 HydrophobicContact CB-CB 4.42Å; Q30-E33 HydrophobicContact CB-CG 4.1Å; Q30-E33 PolarHBondContact N-OE2 3.42Å; Q30-E33 WeakPolarHBondContact O-CA 3.47Å; Q30-E33 WeakPolarHBondContact O-CB 3.22Å; Q30-E33 PolarHBondContact O-N 3.01Å; E33-H35 PolarHBondContact O-N 3.05Å; E33-H35 VanDerWaalsContact O-N 3.12Å; E33-L36 HydrophobicContact CB-CD1 3.88Å; E33-L36 HydrophobicContact CG-CD1 4.07Å; E33-L36 VanDerWaalsContact O-CB 3.28Å; E33-L36 WeakPolarHBondContact O-CB 3.35Å; E33-L36 WeakPolarHBondContact O-CG 3.46Å; E33-L36 PolarHBondContact O-N 3.35Å; E33-V39 WeakPolarHBondContact O-CG2 3.42Å; E33-L139 HydrophobicContact CG-CD1 4.1Å; E33-L139 WeakPolarHBondContact OE1-CD1 3.41Å; E33-R141 IonicContact OE1-NH2 3.18Å; E33-R141 PolarHBondContact OE1-NH2 3.48Å; E33-K143 WeakPolarHBondContact OE1-CE 3.43Å; E33-K143 IonicContact OE1-NZ 2.74Å; E33-K143 PolarHBondContact OE1-NZ 3.23Å; E33-K143 VanDerWaalsContact OE1-NZ 3.14Å; E33-K143 WeakPolarHBondContact OE2-CE 3.38Å; E33-K143 IonicContact OE2-NZ 2.65Å; E33-K143 PolarHBondContact OE2-NZ 3.37Å
34	T	81.2	Confident	82.9	Confident	73 Å²	73	74.3 Å²	74.3	45%	0.448	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-57.8	-27.6	-174.4	58.2	0	0	0	0	115.3	V29 Q30 P31 D32 L36	V29-T34 HydrophobicContact CG1-CG2 3.89Å; Q30-T34 PolarHBondContact O-N 2.81Å; P31-T34 WeakPolarHBondContact O-CG2 3.36Å; P31-T34 PolarHBondContact O-OG1 3.43Å; D32-T34 VanDerWaalsContact C-N 3.28Å; D32-T34 PolarHBondContact O-N 3.1Å; T34-L36 VanDerWaalsContact C-N 3.33Å
35	H	84.5	Confident	84.8	Confident	177 Å²	177	74.2 Å²	74.2	82%	0.819	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-86.8	4.6	179.7	-63	-68.7	0	0	0	114.1	E33	E33-H35 PolarHBondContact O-N 3.05Å; E33-H35 VanDerWaalsContact O-N 3.12Å
36	L	86.9	Confident	86.7	Confident	26 Å²	26	68.4 Å²	68.4	14%	0.136	36%	0.357	C	S	.	.	S	Bend	trans	-83.4	133.3	-174.8	-61.3	174.6	0	0	0	112.3	E33 T34 G38 V39 V136 K138 L139	E33-L36 HydrophobicContact CB-CD1 3.88Å; E33-L36 HydrophobicContact CG-CD1 4.07Å; E33-L36 VanDerWaalsContact O-CB 3.28Å; E33-L36 WeakPolarHBondContact O-CB 3.35Å; E33-L36 WeakPolarHBondContact O-CG 3.46Å; E33-L36 PolarHBondContact O-N 3.35Å; T34-L36 VanDerWaalsContact C-N 3.33Å; L36-G38 PolarHBondContact O-N 2.95Å; L36-V39 HydrophobicContact CB-CG2 4.01Å; L36-V39 WeakPolarHBondContact O-CB 3.18Å; L36-V39 WeakPolarHBondContact O-CG2 3.45Å; L36-V39 PolarHBondContact O-N 3.44Å; L36-V39 VanDerWaalsContact O-N 3.12Å; L36-V136 HydrophobicContact CB-CG1 3.76Å; L36-V136 HydrophobicContact CD1-CG1 4.13Å; L36-K138 HydrophobicContact CD2-CB 4.44Å; L36-K138 HydrophobicContact CD2-CD 3.68Å; L36-K138 HydrophobicContact CD2-CG 4.25Å; L36-L139 HydrophobicContact CD1-CD1 3.75Å; L36-L139 HydrophobicContact CD1-CD2 3.93Å; L36-L139 HydrophobicContact CD1-CG 3.78Å
37	E	86.1	Confident	88	Confident	171 Å²	171	68.5 Å²	68.5	80%	0.799	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	128.8	177.3	-167.6	-171.3	164.3	0	0	111.5
38	G	88.6	Confident	88.7	Confident	19 Å²	19	71 Å²	71	20%	0.196	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	2.3	-177.6	0	0	0	0	0	115.2	L36 N134	L36-G38 PolarHBondContact O-N 2.95Å; G38-N134 WeakPolarHBondContact O-CB 3.14Å; G38-N134 PolarHBondContact O-ND2 2.95Å
39	V	91.5	Very high	89.1	Confident	13 Å²	13	71.6 Å²	71.6	8%	0.079	38%	0.378	C	S	.	.			trans	-64.2	132	165.3	163.8	0	0	0	0	110	V29 E33 L36 V136 V145	V29-V39 HydrophobicContact CG1-CG1 4.19Å; V29-V39 HydrophobicContact CG2-CG1 3.98Å; V29-V39 HydrophobicContact CG2-CG2 4.31Å; E33-V39 WeakPolarHBondContact O-CG2 3.42Å; L36-V39 HydrophobicContact CB-CG2 4.01Å; L36-V39 WeakPolarHBondContact O-CB 3.18Å; L36-V39 WeakPolarHBondContact O-CG2 3.45Å; L36-V39 PolarHBondContact O-N 3.44Å; L36-V39 VanDerWaalsContact O-N 3.12Å; V39-V136 HydrophobicContact CG2-CG1 4.44Å; V39-V136 HydrophobicContact CG2-CG2 3.66Å; V39-V145 HydrophobicContact CG1-CG2 4.18Å
40	P	93	Very high	89.6	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.013	38%	0.375	C	S	.	.			trans	-63.1	137.6	173.9	-20.3	31.5	0	0	0	112.3	A132 N134 V145	P40-A132 HydrophobicContact CB-CB 4.22Å; P40-N134 HydrophobicContact CG-CB 3.76Å; P40-V145 HydrophobicContact CB-CG2 4.41Å; P40-V145 VanDerWaalsContact O-CG2 3.28Å; P40-V145 WeakPolarHBondContact O-CG2 3.14Å
41	V	93.5	Very high	90	Very high	90 Å²	90	70.7 Å²	70.7	55%	0.545	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.9	172.2	-177.9	0	0	0	0	109	I43 A64 E65	V41-I43 PolarHBondContact O-N 2.86Å; V41-A64 CarbonylContact O-C 3.59Å; V41-A64 WeakPolarHBondContact O-CA 3.33Å; V41-A64 WeakPolarHBondContact O-CB 3.3Å; V41-E65 PolarHBondContact N-O 3.26Å; V41-E65 PolarHBondContact O-N 2.94Å
42	F	94.7	Very high	90.5	Very high	20 Å²	20	66.1 Å²	66.1	9%	0.088	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	120.5	170.5	-78.1	-84.2	0	0	0	109.9	H45 C62 V63 A64 C130 A132 V145	F42-H45 VanDerWaalsContact CB-CE1 3.48Å; F42-H45 WeakPolarHBondContact CB-CE1 3.28Å; F42-H45 AromaticContact CG-CE1 3.94Å; F42-C62 HydrophobicContact CE1-CB 4.21Å; F42-V63 CarbonylContact C-O 3.58Å; F42-V63 WeakPolarHBondContact CA-O 3.48Å; F42-A64 HydrophobicContact CD1-CB 3.85Å; F42-A64 HydrophobicContact CE1-CB 4Å; F42-A64 HydrophobicContact CG-CB 4.24Å; F42-C130 HydrophobicContact CE1-CB 3.73Å; F42-C130 HydrophobicContact CZ-CB 3.92Å; F42-A132 HydrophobicContact CE1-CB 4.42Å; F42-A132 HydrophobicContact CE2-CB 4.14Å; F42-A132 HydrophobicContact CZ-CB 3.76Å; F42-V145 HydrophobicContact CD2-CG1 3.99Å; F42-V145 HydrophobicContact CE2-CB 4.35Å; F42-V145 HydrophobicContact CE2-CG1 4.02Å
43	I	93	Very high	90.8	Very high	91 Å²	91	62 Å²	62	47%	0.467	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-34.5	172.7	-62.1	173.5	0	0	0	109.6	V41 V63 E65 R107	V41-I43 PolarHBondContact O-N 2.86Å; I43-V63 HydrophobicContact CB-CB 4.46Å; I43-V63 HydrophobicContact CB-CG1 4.26Å; I43-V63 PolarHBondContact N-O 3.31Å; I43-E65 HydrophobicContact CD1-CB 3.77Å; I43-R107 HydrophobicContact CD1-CG 4.13Å
44	Q	94.9	Very high	90.7	Very high	86 Å²	86	68.6 Å²	68.6	40%	0.402	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117	174	-175.5	-177.4	-19.4	0	0	109.5	C62 V63	Q44-C62 WeakPolarHBondContact O-CA 3.25Å; Q44-V63 HydrophobicContact CB-CB 3.77Å; Q44-V63 HydrophobicContact CB-CG2 3.88Å; Q44-V63 PolarHBondContact N-O 2.95Å; Q44-V63 PolarHBondContact O-N 3.12Å
45	H	94.6	Very high	90.8	Very high	76 Å²	76	72.8 Å²	72.8	35%	0.352	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-79	158.1	167.2	-70.1	-74.3	0	0	0	110.7	F42 N148	F42-H45 VanDerWaalsContact CB-CE1 3.48Å; F42-H45 WeakPolarHBondContact CB-CE1 3.28Å; F42-H45 AromaticContact CG-CE1 3.94Å; H45-N148 HydrophobicContact CB-CB 4.32Å; H45-N148 PolarHBondContact ND1-N 3.4Å
46	P	95.1	Very high	90.9	Very high	8 Å²	8	70.7 Å²	70.7	5%	0.052	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-66.8	158.9	172.9	31.4	-33.4	0	0	0	110.2	Y50 I60 E61 C62 N148 T150	P46-Y50 HydrophobicContact CB-CE2 4.34Å; P46-I60 HydrophobicContact CB-CG2 4.02Å; P46-E61 WeakPolarHBondContact CA-O 3.24Å; P46-C62 VanDerWaalsContact CD-SG 3.56Å; P46-N148 VanDerWaalsContact CG-O 3.3Å; P46-N148 WeakPolarHBondContact CG-O 3.39Å; P46-T150 HydrophobicContact CB-CG2 4.02Å; P46-T150 HydrophobicContact CG-CG2 4.15Å
47	K	92	Very high	91.1	Very high	139 Å²	139	71.2 Å²	71.2	60%	0.604	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-63.9	148	171.9	-63	-178.6	178.3	-178.3	0	109.6	L49 Y50 T150	K47-L49 PolarHBondContact O-N 3.48Å; K47-L49 VanDerWaalsContact O-N 3.14Å; K47-Y50 HydrophobicContact CB-CD2 4.39Å; K47-Y50 HydrophobicContact CB-CE1 4.37Å; K47-Y50 HydrophobicContact CB-CE2 3.77Å; K47-Y50 HydrophobicContact CD-CE1 4.08Å; K47-Y50 HydrophobicContact CG-CE1 4.36Å; K47-Y50 HydrophobicContact CG-CE2 4.47Å; K47-Y50 PolarHBondContact N-OH 3.27Å; K47-T150 WeakPolarHBondContact O-CB 3.33Å; K47-T150 PolarHBondContact O-OG1 3.3Å
48	P	93.3	Very high	91.4	Very high	110 Å²	110	63.2 Å²	63.2	71%	0.714	32%	0.322	S	S	*	.	S	Bend	trans	-59.2	-27.8	179.8	-26.4	35.5	0	0	0	114.7	T150 E151	P48-T150 WeakPolarHBondContact O-CA 3.2Å; P48-E151 PolarHBondContact O-N 3.25Å
49	L	92.9	Very high	91.7	Very high	57 Å²	57	64.1 Å²	64.1	30%	0.298	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	140.7	-177.7	179	60.7	0	0	0	110.5	K47 Y51 E151 K153	K47-L49 PolarHBondContact O-N 3.48Å; K47-L49 VanDerWaalsContact O-N 3.14Å; L49-Y51 HydrophobicContact CD2-CE2 4Å; L49-Y51 WeakPolarHBondContact CD2-OH 3.4Å; L49-Y51 HydrophobicContact CG-CE2 4.22Å; L49-E151 CarbonylContact C-O 3.53Å; L49-E151 WeakPolarHBondContact CA-O 3.4Å; L49-E151 HydrophobicContact CD1-CB 3.82Å; L49-E151 HydrophobicContact CD1-CG 3.76Å; L49-K153 HydrophobicContact CD1-CD 4.12Å; L49-K153 HydrophobicContact CD1-CG 4.01Å
50	Y	93.8	Very high	91.8	Very high	29 Å²	29	63.6 Å²	63.6	11%	0.114	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.1	166.4	-66.7	-97.7	0	0	0	110.6	P46 K47 T59 I60 T150 E151 I152 K153	P46-Y50 HydrophobicContact CB-CE2 4.34Å; K47-Y50 HydrophobicContact CB-CD2 4.39Å; K47-Y50 HydrophobicContact CB-CE1 4.37Å; K47-Y50 HydrophobicContact CB-CE2 3.77Å; K47-Y50 HydrophobicContact CD-CE1 4.08Å; K47-Y50 HydrophobicContact CG-CE1 4.36Å; K47-Y50 HydrophobicContact CG-CE2 4.47Å; K47-Y50 PolarHBondContact N-OH 3.27Å; Y50-T59 WeakPolarHBondContact CE1-O 3.3Å; Y50-I60 HydrophobicContact CD2-CG1 4.33Å; Y50-I60 HydrophobicContact CE2-CG1 4.25Å; Y50-T150 WeakPolarHBondContact CD2-OG1 3.18Å; Y50-T150 HydrophobicContact CE2-CG2 4.46Å; Y50-T150 WeakPolarHBondContact CE2-OG1 3.47Å; Y50-E151 PolarHBondContact N-O 2.87Å; Y50-I152 WeakPolarHBondContact O-CA 3.3Å; Y50-K153 PolarHBondContact O-N 3.02Å
51	Y	92.3	Very high	91.8	Very high	61 Å²	61	65.7 Å²	65.7	24%	0.239	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.3	170	-64.2	-80.7	0	0	0	110.8	L49 K153 A155 D186 P187	L49-Y51 HydrophobicContact CD2-CE2 4Å; L49-Y51 WeakPolarHBondContact CD2-OH 3.4Å; L49-Y51 HydrophobicContact CG-CE2 4.22Å; Y51-K153 WeakPolarHBondContact CA-O 3.28Å; Y51-K153 HydrophobicContact CD1-CB 3.85Å; Y51-K153 HydrophobicContact CE1-CB 3.94Å; Y51-K153 HydrophobicContact CE1-CD 3.91Å; Y51-A155 HydrophobicContact CD1-CB 3.83Å; Y51-A155 HydrophobicContact CG-CB 4.17Å; Y51-D186 WeakPolarHBondContact CE1-OD1 3.21Å; Y51-D186 PolarHBondContact OH-OD1 2.91Å; Y51-P187 HydrophobicContact CD2-CG 4.14Å; Y51-P187 HydrophobicContact CE1-CB 4.47Å; Y51-P187 HydrophobicContact CE1-CG 4.5Å; Y51-P187 HydrophobicContact CE2-CB 3.79Å; Y51-P187 HydrophobicContact CE2-CG 3.86Å
52	T	91.1	Very high	91.9	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	155.6	166	179.5	0	0	0	0	109.4	K56 A116 V119 I152 K153 E154 A155	T52-K56 WeakPolarHBondContact CA-O 3.22Å; T52-K56 PolarHBondContact OG1-O 3.31Å; T52-K56 VanDerWaalsContact OG1-O 3.05Å; T52-A116 HydrophobicContact CG2-CB 4.15Å; T52-A116 PolarHBondContact OG1-N 3.41Å; T52-V119 HydrophobicContact CG2-CG2 4.02Å; T52-I152 HydrophobicContact CG2-CG2 4Å; T52-K153 WeakPolarHBondContact CG2-O 3.39Å; T52-K153 PolarHBondContact N-O 3.23Å; T52-E154 WeakPolarHBondContact O-CA 3.43Å; T52-A155 PolarHBondContact O-N 2.95Å
53	T	88.5	Confident	92	Very high	37 Å²	37	60.9 Å²	60.9	23%	0.227	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-132.6	169	167.4	68.6	0	0	0	0	109.7	N55 K56 A155 L236	T53-N55 PolarHBondContact O-N 3.42Å; T53-K56 PolarHBondContact N-O 2.68Å; T53-K56 CarbonylContact O-C 3.58Å; T53-K56 PolarHBondContact O-N 3.34Å; T53-K56 VanDerWaalsContact O-O 3.11Å; T53-K56 PolarHBondContact OG1-N 3.38Å; T53-A155 HydrophobicContact CG2-CB 4.14Å; T53-L236 HydrophobicContact CG2-CD1 3.86Å
54	K	83.4	Confident	92.1	Very high	154 Å²	154	56.5 Å²	56.5	67%	0.67	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-25.2	176.9	-68.1	166.1	-176.8	162.1	0	113.8	A116 E154	K54-A116 HydrophobicContact CG-CB 4.48Å; K54-E154 WeakPolarHBondContact CE-OE1 3.13Å; K54-E154 WeakPolarHBondContact CG-OE1 3.37Å
55	N	82.3	Confident	92.1	Very high	161 Å²	161	55 Å²	55	86%	0.861	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-6.2	179.5	-65.7	-26.7	0	0	0	114.7	T53	T53-N55 PolarHBondContact O-N 3.42Å
56	K	86.6	Confident	92.1	Very high	133 Å²	133	52.9 Å²	52.9	58%	0.578	27%	0.266	S	S	*	.	B	Isolated β-bridge	trans	-149.1	116.7	-174.4	-173.9	-177.6	178.2	-175.2	0	112.1	T52 T53	T52-K56 WeakPolarHBondContact CA-O 3.22Å; T52-K56 PolarHBondContact OG1-O 3.31Å; T52-K56 VanDerWaalsContact OG1-O 3.05Å; T53-K56 PolarHBondContact N-O 2.68Å; T53-K56 CarbonylContact O-C 3.58Å; T53-K56 PolarHBondContact O-N 3.34Å; T53-K56 VanDerWaalsContact O-O 3.11Å; T53-K56 PolarHBondContact OG1-N 3.38Å
57	P	91.8	Very high	92	Very high	38 Å²	38	53 Å²	53	25%	0.247	27%	0.267	C	S	.	.			trans	-70	156.5	176	30.4	-34.7	0	0	0	112.5	E113 V114 R115	P57-E113 HydrophobicContact CB-CB 4.14Å; P57-E113 HydrophobicContact CG-CB 4.26Å; P57-E113 HydrophobicContact CG-CG 4.42Å; P57-V114 CarbonylContact C-O 3.59Å; P57-V114 WeakPolarHBondContact CA-O 3.14Å; P57-V114 WeakPolarHBondContact CB-O 3.46Å; P57-R115 HydrophobicContact CB-CG 4.3Å
58	A	92.8	Very high	91.9	Very high	2 Å²	2	48.3 Å²	48.3	2%	0.017	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	121.3	166	0	0	0	0	0	109.9	E113 V114 I152	A58-E113 WeakPolarHBondContact O-CA 3.18Å; A58-V114 PolarHBondContact N-O 3.08Å; A58-V114 PolarHBondContact O-N 2.69Å; A58-I152 HydrophobicContact CB-CD1 4.32Å; A58-I152 HydrophobicContact CB-CG2 3.62Å
59	T	93.8	Very high	91.8	Very high	39 Å²	39	49.1 Å²	49.1	24%	0.239	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	103.2	176.4	-49.3	0	0	0	0	110.6	Y50 E61 R111 L112 E113	Y50-T59 WeakPolarHBondContact CE1-O 3.3Å; T59-E61 HydrophobicContact CG2-CG 4.19Å; T59-R111 HydrophobicContact CG2-CG 3.72Å; T59-L112 CarbonylContact C-O 3.51Å; T59-L112 WeakPolarHBondContact CA-O 3.39Å; T59-E113 HydrophobicContact CG2-CG 4.25Å
60	I	94.3	Very high	91.8	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	136.1	170.8	-61.6	165.7	0	0	0	108.8	P46 Y50 I72 R111 L112 V114 C128 T150 I152	P46-I60 HydrophobicContact CB-CG2 4.02Å; Y50-I60 HydrophobicContact CD2-CG1 4.33Å; Y50-I60 HydrophobicContact CE2-CG1 4.25Å; I60-I72 HydrophobicContact CG2-CD1 4.19Å; I60-R111 WeakPolarHBondContact O-CA 3.33Å; I60-L112 HydrophobicContact CD1-CD2 4.48Å; I60-L112 PolarHBondContact N-O 3.16Å; I60-L112 PolarHBondContact O-N 3.17Å; I60-V114 HydrophobicContact CD1-CG2 4.44Å; I60-C128 HydrophobicContact CD1-CB 3.68Å; I60-C128 WeakPolarHBondContact CD1-SG 2.98Å; I60-T150 HydrophobicContact CD1-CG2 4.14Å; I60-T150 HydrophobicContact CG1-CG2 4.3Å; I60-T150 HydrophobicContact CG2-CG2 4.46Å; I60-I152 HydrophobicContact CD1-CD1 3.84Å; I60-I152 HydrophobicContact CG1-CD1 4.38Å
61	E	94	Very high	91.7	Very high	47 Å²	47	45.3 Å²	45.3	22%	0.22	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	136.8	172.9	-59.2	-162.3	141.9	0	0	111.5	P46 T59 K109 L110 R111	P46-E61 WeakPolarHBondContact CA-O 3.24Å; T59-E61 HydrophobicContact CG2-CG 4.19Å; E61-K109 VanDerWaalsContact OE1-CE 3.22Å; E61-K109 WeakPolarHBondContact OE1-CE 3.36Å; E61-K109 IonicContact OE1-NZ 2.73Å; E61-K109 PolarHBondContact OE1-NZ 3.23Å; E61-K109 WeakPolarHBondContact OE2-CE 3.37Å; E61-K109 IonicContact OE2-NZ 3.57Å; E61-K109 PolarHBondContact OE2-NZ 2.71Å; E61-L110 WeakPolarHBondContact CA-O 3.48Å; E61-R111 HydrophobicContact CG-CG 4.35Å; E61-R111 IonicContact OE1-NE 3.3Å
62	C	95.5	Very high	91.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.5	175.8	-66.5	0	0	0	0	109.8	F42 Q44 P46 K109 L110 C130	F42-C62 HydrophobicContact CE1-CB 4.21Å; Q44-C62 WeakPolarHBondContact O-CA 3.25Å; P46-C62 VanDerWaalsContact CD-SG 3.56Å; C62-K109 CarbonylContact O-C 3.56Å; C62-K109 WeakPolarHBondContact O-CA 3.3Å; C62-L110 HydrophobicContact CB-CB 4.25Å; C62-L110 PolarHBondContact N-O 3.05Å; C62-L110 PolarHBondContact O-N 3.32Å; C62-C130 HydrophobicContact CB-CB 3.77Å; C62-C130 WeakPolarHBondContact CB-SG 3.45Å; C62-C130 WeakPolarHBondContact SG-CB 3.45Å; C62-C130 CovalentContact SG-SG 2.04Å; C62-C130 PolarHBondContact SG-SG 2.87Å
63	V	96	Very high	91.9	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.048	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.2	172.3	-174.2	0	0	0	0	109.6	F42 I43 Q44 R107 W108 K109	F42-V63 CarbonylContact C-O 3.58Å; F42-V63 WeakPolarHBondContact CA-O 3.48Å; I43-V63 HydrophobicContact CB-CB 4.46Å; I43-V63 HydrophobicContact CB-CG1 4.26Å; I43-V63 PolarHBondContact N-O 3.31Å; Q44-V63 HydrophobicContact CB-CB 3.77Å; Q44-V63 HydrophobicContact CB-CG2 3.88Å; Q44-V63 PolarHBondContact N-O 2.95Å; Q44-V63 PolarHBondContact O-N 3.12Å; V63-R107 HydrophobicContact CG1-CG 3.56Å; V63-W108 WeakPolarHBondContact CA-O 3.35Å; V63-K109 HydrophobicContact CG2-CB 4.02Å; V63-K109 HydrophobicContact CG2-CG 3.96Å
64	A	95.7	Very high	92.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	156.7	176.2	0	0	0	0	0	112.4	V41 F42 V67 R107 W108 A132	V41-A64 CarbonylContact O-C 3.59Å; V41-A64 WeakPolarHBondContact O-CA 3.33Å; V41-A64 WeakPolarHBondContact O-CB 3.3Å; F42-A64 HydrophobicContact CD1-CB 3.85Å; F42-A64 HydrophobicContact CE1-CB 4Å; F42-A64 HydrophobicContact CG-CB 4.24Å; A64-V67 HydrophobicContact CB-CG2 3.68Å; A64-V67 WeakPolarHBondContact O-CG2 3.29Å; A64-R107 CarbonylContact O-C 3.48Å; A64-R107 WeakPolarHBondContact O-CA 3.38Å; A64-W108 PolarHBondContact N-O 3.35Å; A64-W108 VanDerWaalsContact N-O 3.11Å; A64-W108 PolarHBondContact O-N 3.13Å; A64-A132 HydrophobicContact CB-CB 4.04Å
65	E	94.3	Very high	92.4	Very high	53 Å²	53	36.8 Å²	36.8	25%	0.248	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	143.8	178.9	-173.4	176.8	179.2	0	0	110.9	V41 I43 K106 R107	V41-E65 PolarHBondContact N-O 3.26Å; V41-E65 PolarHBondContact O-N 2.94Å; I43-E65 HydrophobicContact CD1-CB 3.77Å; E65-K106 HydrophobicContact CG-CB 4.39Å; E65-R107 HydrophobicContact CB-CB 4.03Å; E65-R107 HydrophobicContact CB-CG 4.27Å; E65-R107 HydrophobicContact CG-CB 4.05Å; E65-R107 IonicContact OE2-CZ 2.81Å; E65-R107 IonicContact OE2-NE 2.71Å; E65-R107 PolarHBondContact OE2-NE 2.6Å; E65-R107 IonicContact OE2-NH2 3.16Å; E65-R107 PolarHBondContact OE2-NH2 3.44Å
66	P	94.4	Very high	92.5	Very high	32 Å²	32	34.1 Å²	34.1	21%	0.208	17%	0.174	C	C	.	.	S	Bend	cis	-74	146.9	-19.7	32.3	-34.6	0	0	0	110.9	K106 N134	P66-K106 WeakPolarHBondContact CA-O 3.49Å; P66-K106 HydrophobicContact CB-CB 4.2Å; P66-K106 HydrophobicContact CB-CD 4.49Å; P66-N134 WeakPolarHBondContact O-CB 3.3Å
67	V	92.6	Very high	92.5	Very high	10 Å²	10	31.6 Å²	31.6	6%	0.061	17%	0.165	C	C	.	.			trans	-127.6	139.2	-179.4	-174.4	0	0	0	0	110.8	A64 H69 A70 K106 W108 A132	A64-V67 HydrophobicContact CB-CG2 3.68Å; A64-V67 WeakPolarHBondContact O-CG2 3.29Å; V67-H69 VanDerWaalsContact CG1-O 3.24Å; V67-H69 WeakPolarHBondContact CG1-O 3.48Å; V67-A70 HydrophobicContact CG1-CB 4.17Å; V67-K106 PolarHBondContact N-O 2.78Å; V67-W108 HydrophobicContact CB-CB 4.05Å; V67-W108 HydrophobicContact CB-CD2 3.81Å; V67-W108 HydrophobicContact CB-CE3 4.13Å; V67-W108 HydrophobicContact CB-CG 3.78Å; V67-W108 HydrophobicContact CG1-CB 4.32Å; V67-W108 HydrophobicContact CG1-CD2 3.69Å; V67-W108 HydrophobicContact CG1-CE3 3.46Å; V67-W108 VanDerWaalsContact CG1-CE3 3.46Å; V67-W108 HydrophobicContact CG1-CG 4.09Å; V67-W108 HydrophobicContact CG1-CZ3 4.03Å; V67-W108 HydrophobicContact CG2-CB 4.24Å; V67-W108 HydrophobicContact CG2-CG 4.47Å; V67-A132 HydrophobicContact CG2-CB 4.35Å
68	S	90.6	Very high	92.4	Very high	42 Å²	42	33.2 Å²	33.2	29%	0.294	17%	0.174	S	C	.	.	S	Bend	trans	-119.6	-28.3	170.3	74.6	0	0	0	0	113.5	W108 W133	S68-W108 WeakPolarHBondContact O-CH2 3.28Å; S68-W133 PolarHBondContact N-O 2.76Å; S68-W133 PolarHBondContact OG-O 3.07Å
69	H	90.6	Very high	92.3	Very high	126 Å²	126	33.8 Å²	33.8	58%	0.583	18%	0.177	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140	151.7	171.7	-57	71.4	0	0	0	109.4	V67 W133	V67-H69 VanDerWaalsContact CG1-O 3.24Å; V67-H69 WeakPolarHBondContact CG1-O 3.48Å; H69-W133 HydrophobicContact CB-CB 4.16Å; H69-W133 HydrophobicContact CB-CE3 4.46Å; H69-W133 PolarHBondContact N-O 2.99Å; H69-W133 PolarHBondContact O-N 3.12Å
70	A	92.8	Very high	92.1	Very high	4 Å²	4	35.3 Å²	35.3	3%	0.033	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	149	-173.7	0	0	0	0	0	111.2	V67 Y81 I92 W108 L110 E131	V67-A70 HydrophobicContact CG1-CB 4.17Å; A70-Y81 WeakPolarHBondContact O-CB 3.26Å; A70-Y81 PolarHBondContact O-N 2.9Å; A70-I92 HydrophobicContact CB-CD1 3.54Å; A70-W108 HydrophobicContact CB-CE3 3.95Å; A70-W108 HydrophobicContact CB-CZ3 4.16Å; A70-L110 HydrophobicContact CB-CD1 4.1Å; A70-L110 HydrophobicContact CB-CD2 3.99Å; A70-L110 HydrophobicContact CB-CG 4.08Å; A70-E131 WeakPolarHBondContact CA-O 3.28Å
71	A	93	Very high	91.9	Very high	2 Å²	2	38.4 Å²	38.4	2%	0.017	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	161.7	174.7	0	0	0	0	0	110	T78 I79 P80 E131 W133	A71-T78 HydrophobicContact CB-CG2 3.88Å; A71-I79 VanDerWaalsContact CA-O 3.28Å; A71-I79 WeakPolarHBondContact CA-O 3.5Å; A71-I79 WeakPolarHBondContact CB-O 3.48Å; A71-P80 HydrophobicContact CB-CB 4.45Å; A71-E131 PolarHBondContact N-O 3.42Å; A71-E131 PolarHBondContact O-N 2.9Å; A71-W133 HydrophobicContact CB-CH2 3.87Å; A71-W133 HydrophobicContact CB-CZ3 3.72Å
72	I	94.2	Very high	91.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.9	162.8	-59.4	-173.6	0	0	0	107.1	I60 I79 L90 L110 L112 C128 H129 C130	I60-I72 HydrophobicContact CG2-CD1 4.19Å; I72-I79 PolarHBondContact N-O 3.13Å; I72-I79 WeakPolarHBondContact O-CA 3.28Å; I72-I79 VanDerWaalsContact O-CB 3.24Å; I72-I79 WeakPolarHBondContact O-CB 3.27Å; I72-I79 PolarHBondContact O-N 3.13Å; I72-L90 HydrophobicContact CD1-CD1 3.77Å; I72-L90 HydrophobicContact CG1-CD1 3.94Å; I72-L90 HydrophobicContact CG1-CD2 4.47Å; I72-L110 HydrophobicContact CD1-CB 4.32Å; I72-L110 HydrophobicContact CG1-CD2 4.13Å; I72-L112 HydrophobicContact CB-CD2 4.02Å; I72-L112 HydrophobicContact CD1-CB 3.83Å; I72-L112 HydrophobicContact CD1-CD2 4.32Å; I72-L112 HydrophobicContact CG2-CD2 3.83Å; I72-C128 HydrophobicContact CG2-CB 4.27Å; I72-H129 CarbonylContact C-O 3.43Å; I72-H129 WeakPolarHBondContact CA-O 3.22Å; I72-H129 WeakPolarHBondContact CG2-O 3.34Å; I72-C130 VanDerWaalsContact CD1-SG 3.59Å; I72-C130 HydrophobicContact CG1-CB 4.42Å
73	K	93.3	Very high	90.3	Very high	61 Å²	61	42.2 Å²	42.2	27%	0.265	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.4	175.3	-178.2	176.6	166.7	-164	0	107.8	E76 Q77 C128 H129	K73-E76 VanDerWaalsContact CE-O 3.31Å; K73-E76 WeakPolarHBondContact CE-O 3.38Å; K73-Q77 WeakPolarHBondContact CA-O 3.37Å; K73-C128 CarbonylContact O-C 3.58Å; K73-C128 WeakPolarHBondContact O-CA 3.46Å; K73-H129 PolarHBondContact N-O 3.02Å; K73-H129 PolarHBondContact O-N 2.84Å
74	C	93	Very high	89	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	134	-178	-77.8	0	0	0	0	109.3	E76 Q77 I79 Y126 V127 C128	C74-E76 VanDerWaalsContact C-N 3.27Å; C74-E76 PolarHBondContact O-N 2.89Å; C74-Q77 PolarHBondContact N-O 3.39Å; C74-Q77 WeakPolarHBondContact O-CA 3.36Å; C74-Q77 WeakPolarHBondContact O-CB 3.25Å; C74-Q77 PolarHBondContact O-N 3.25Å; C74-I79 HydrophobicContact CB-CD1 4.29Å; C74-Y126 HydrophobicContact CB-CE1 3.83Å; C74-V127 WeakPolarHBondContact CA-O 3.27Å; C74-C128 VanDerWaalsContact CA-SG 3.52Å; C74-C128 HydrophobicContact CB-CB 4.08Å; C74-C128 WeakPolarHBondContact CB-SG 3.44Å; C74-C128 WeakPolarHBondContact SG-CB 3.34Å; C74-C128 CovalentContact SG-SG 2.03Å; C74-C128 PolarHBondContact SG-SG 2.82Å
75	A	89.6	Confident	87.4	Confident	13 Å²	13	51.9 Å²	51.9	11%	0.107	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	51.6	178.1	0	0	0	0	0	111.9	Q77 W122 Y126 V127	A75-Q77 PolarHBondContact O-N 3.43Å; A75-W122 HydrophobicContact CB-CD2 3.6Å; A75-W122 HydrophobicContact CB-CE3 3.84Å; A75-W122 HydrophobicContact CB-CG 4.13Å; A75-W122 HydrophobicContact CB-CH2 4.04Å; A75-W122 HydrophobicContact CB-CZ2 3.82Å; A75-W122 HydrophobicContact CB-CZ3 4.04Å; A75-W122 WeakPolarHBondContact O-CH2 3.4Å; A75-Y126 HydrophobicContact CB-CD2 3.75Å; A75-Y126 HydrophobicContact CB-CE2 3.47Å; A75-Y126 VanDerWaalsContact CB-CE2 3.47Å; A75-Y126 HydrophobicContact CB-CG 4.39Å; A75-V127 PolarHBondContact N-O 3.38Å
76	E	83.3	Confident	85.9	Confident	104 Å²	104	55.4 Å²	55.4	49%	0.486	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	-20.2	-166.4	-58.4	-156.3	151.5	0	0	118.4	K73 C74 T78 W122 R405	K73-E76 VanDerWaalsContact CE-O 3.31Å; K73-E76 WeakPolarHBondContact CE-O 3.38Å; C74-E76 VanDerWaalsContact C-N 3.27Å; C74-E76 PolarHBondContact O-N 2.89Å; E76-T78 PolarHBondContact O-N 3.14Å; E76-W122 HydrophobicContact CG-CH2 4.38Å; E76-R405 IonicContact OE1-NH1 3.81Å; E76-R405 WeakPolarHBondContact OE2-CD 3.43Å; E76-R405 IonicContact OE2-CZ 2.75Å; E76-R405 IonicContact OE2-NE 2.74Å; E76-R405 IonicContact OE2-NH1 2.76Å; E76-R405 PolarHBondContact OE2-NH1 2.9Å
77	Q	87.2	Confident	83.9	Confident	81 Å²	81	59.3 Å²	59.3	38%	0.379	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	113.9	-178	-172.3	-179	-79.8	0	0	111.5	K73 C74 A75 I79	K73-Q77 WeakPolarHBondContact CA-O 3.37Å; C74-Q77 PolarHBondContact N-O 3.39Å; C74-Q77 WeakPolarHBondContact O-CA 3.36Å; C74-Q77 WeakPolarHBondContact O-CB 3.25Å; C74-Q77 PolarHBondContact O-N 3.25Å; A75-Q77 PolarHBondContact O-N 3.43Å; Q77-I79 PolarHBondContact O-N 3.34Å
78	T	89.3	Confident	82.7	Confident	71 Å²	71	60.7 Å²	60.7	44%	0.436	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	126	168.6	-52.6	0	0	0	0	110.6	A71 E76 P80	A71-T78 HydrophobicContact CB-CG2 3.88Å; E76-T78 PolarHBondContact O-N 3.14Å; T78-P80 WeakPolarHBondContact O-CD 3.23Å
79	I	91.3	Very high	82.3	Confident	15 Å²	15	63.9 Å²	63.9	8%	0.077	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	91.8	176	-56.5	163.4	0	0	0	107	A71 I72 C74 Q77 I89 L90 L112	A71-I79 VanDerWaalsContact CA-O 3.28Å; A71-I79 WeakPolarHBondContact CA-O 3.5Å; A71-I79 WeakPolarHBondContact CB-O 3.48Å; I72-I79 PolarHBondContact N-O 3.13Å; I72-I79 WeakPolarHBondContact O-CA 3.28Å; I72-I79 VanDerWaalsContact O-CB 3.24Å; I72-I79 WeakPolarHBondContact O-CB 3.27Å; I72-I79 PolarHBondContact O-N 3.13Å; C74-I79 HydrophobicContact CB-CD1 4.29Å; Q77-I79 PolarHBondContact O-N 3.34Å; I79-I89 HydrophobicContact CD1-CD1 4.07Å; I79-I89 HydrophobicContact CG1-CD1 4.44Å; I79-I89 HydrophobicContact CG2-CD1 4.02Å; I79-I89 HydrophobicContact CG2-CG1 3.56Å; I79-L90 HydrophobicContact CG2-CB 4.05Å; I79-L90 WeakPolarHBondContact O-CD2 3.42Å; I79-L112 HydrophobicContact CD1-CD1 4.21Å; I79-L112 HydrophobicContact CD1-CD2 3.65Å
80	P	89.9	Confident	82.3	Confident	71 Å²	71	58.2 Å²	58.2	46%	0.461	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	151.5	-179.1	32.4	-35.7	0	0	0	112.1	A71 T78	A71-P80 HydrophobicContact CB-CB 4.45Å; T78-P80 WeakPolarHBondContact O-CD 3.23Å
81	Y	89.4	Confident	82.1	Confident	65 Å²	65	63 Å²	63	26%	0.255	37%	0.369	S	S	.	.			trans	-71.2	132.5	165	178.5	-118.4	0	0	0	110	A70 G83 I92 W108	A70-Y81 WeakPolarHBondContact O-CB 3.26Å; A70-Y81 PolarHBondContact O-N 2.9Å; Y81-G83 VanDerWaalsContact CE1-CA 3.42Å; Y81-I92 HydrophobicContact CD1-CD1 3.91Å; Y81-I92 HydrophobicContact CD2-CB 4.1Å; Y81-I92 HydrophobicContact CD2-CD1 3.7Å; Y81-I92 HydrophobicContact CD2-CG1 3.68Å; Y81-I92 HydrophobicContact CE1-CD1 4.47Å; Y81-I92 HydrophobicContact CE2-CB 3.91Å; Y81-I92 HydrophobicContact CE2-CD1 4.31Å; Y81-I92 HydrophobicContact CE2-CG1 4.04Å; Y81-I92 HydrophobicContact CG-CD1 3.48Å; Y81-I92 VanDerWaalsContact CG-CD1 3.48Å; Y81-I92 HydrophobicContact CG-CG1 4.02Å; Y81-W108 HydrophobicContact CD1-CH2 4.4Å; Y81-W108 AromaticContact CD1-CZ3 3.97Å; Y81-W108 HydrophobicContact CD1-CZ3 3.97Å; Y81-W108 HydrophobicContact CE1-CH2 4.34Å; Y81-W108 HydrophobicContact CE1-CZ3 4.23Å
82	K	82.9	Confident	82	Confident	105 Å²	105	64.3 Å²	64.3	46%	0.457	38%	0.375	S	S	.	.			trans	-99	2.8	-175.4	-61.9	-175.1	178.7	178.5	0	114.6	E86 S87	K82-E86 HydrophobicContact CB-CB 3.49Å; K82-E86 VanDerWaalsContact CB-CB 3.49Å; K82-E86 HydrophobicContact CB-CG 4.37Å; K82-E86 HydrophobicContact CD-CB 4.09Å; K82-E86 HydrophobicContact CG-CB 4.5Å; K82-S87 PolarHBondContact NZ-O 2.92Å
83	G	73.6	Confident	81.9	Confident	22 Å²	22	68.7 Å²	68.7	23%	0.227	40%	0.396	C	S	.	.			trans	87.3	170.8	-173	0	0	0	0	0	113.7	Y81 G85	Y81-G83 VanDerWaalsContact CE1-CA 3.42Å; G83-G85 PolarHBondContact O-N 3.41Å
84	P	67.9	Low	81.8	Confident	125 Å²	125	69.4 Å²	69.4	81%	0.812	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	123.3	-179	28.9	-33.9	0	0	0	111
85	G	62.1	Low	81.8	Confident	86 Å²	86	69.8 Å²	69.8	89%	0.887	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.5	-13.2	177.3	0	0	0	0	0	115.2	G83	G83-G85 PolarHBondContact O-N 3.41Å
86	E	62.8	Low	81.8	Confident	128 Å²	128	71 Å²	71	60%	0.598	41%	0.405	S	S	*	.	S	Bend	trans	-89.2	132.4	169.8	-77.9	-156.6	-156.2	0	0	111.8	K82 G88	K82-E86 HydrophobicContact CB-CB 3.49Å; K82-E86 VanDerWaalsContact CB-CB 3.49Å; K82-E86 HydrophobicContact CB-CG 4.37Å; K82-E86 HydrophobicContact CD-CB 4.09Å; K82-E86 HydrophobicContact CG-CB 4.5Å; E86-G88 PolarHBondContact O-N 3.47Å
87	S	52.6	Low	81.9	Confident	114 Å²	114	70 Å²	70	80%	0.797	41%	0.41	S	S	*	.			trans	-71	96.7	178.1	-50.4	0	0	0	0	111.6	K82	K82-S87 PolarHBondContact NZ-O 2.92Å
88	G	66.3	Low	81.9	Confident	38 Å²	38	71.6 Å²	71.6	39%	0.392	42%	0.421	S	S	.	.			trans	-114.5	162.3	164.4	0	0	0	0	0	111.2	E86	E86-G88 PolarHBondContact O-N 3.47Å
89	I	83.7	Confident	81.7	Confident	109 Å²	109	72.6 Å²	72.6	56%	0.559	42%	0.424	S	S	*	.	S	Bend	trans	-90.1	-5.7	175.5	62.2	175.3	0	0	0	113.3	I79 L112	I79-I89 HydrophobicContact CD1-CD1 4.07Å; I79-I89 HydrophobicContact CG1-CD1 4.44Å; I79-I89 HydrophobicContact CG2-CD1 4.02Å; I79-I89 HydrophobicContact CG2-CG1 3.56Å; I89-L112 HydrophobicContact CB-CD1 4.29Å; I89-L112 HydrophobicContact CD1-CD1 4.02Å; I89-L112 HydrophobicContact CG1-CD1 3.85Å; I89-L112 VanDerWaalsContact O-CD1 3.3Å; I89-L112 WeakPolarHBondContact O-CD1 3.31Å
90	L	89.4	Confident	81.5	Confident	7 Å²	7	76.9 Å²	76.9	4%	0.037	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	109.4	172.7	173.5	60.7	0	0	0	108.9	I72 I79 I92 L110 L112	I72-L90 HydrophobicContact CD1-CD1 3.77Å; I72-L90 HydrophobicContact CG1-CD1 3.94Å; I72-L90 HydrophobicContact CG1-CD2 4.47Å; I79-L90 HydrophobicContact CG2-CB 4.05Å; I79-L90 WeakPolarHBondContact O-CD2 3.42Å; L90-I92 HydrophobicContact CG-CG1 4.32Å; L90-L110 HydrophobicContact CD1-CB 4.12Å; L90-L110 HydrophobicContact CD1-CG 4.47Å; L90-L112 HydrophobicContact CD1-CB 4.37Å
91	E	90	Very high	81.4	Confident	104 Å²	104	78 Å²	78	49%	0.486	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	143.2	172.3	-60.7	177.7	152.9	0	0	109.9	R111	E91-R111 HydrophobicContact CB-CB 4.19Å; E91-R111 PolarHBondContact N-O 3.07Å; E91-R111 PolarHBondContact O-N 2.96Å; E91-R111 IonicContact OE1-NH1 3.26Å; E91-R111 VanDerWaalsContact OE2-CD 3.28Å; E91-R111 WeakPolarHBondContact OE2-CD 3.08Å; E91-R111 IonicContact OE2-CZ 2.72Å; E91-R111 IonicContact OE2-NE 3.43Å; E91-R111 IonicContact OE2-NH1 2.78Å; E91-R111 PolarHBondContact OE2-NH1 3.2Å
92	I	90.7	Very high	81.4	Confident	30 Å²	30	77.5 Å²	77.5	15%	0.154	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.9	172.1	-63	-164.2	0	0	0	110.5	A70 Y81 L90 W108 K109 L110	A70-I92 HydrophobicContact CB-CD1 3.54Å; Y81-I92 HydrophobicContact CD1-CD1 3.91Å; Y81-I92 HydrophobicContact CD2-CB 4.1Å; Y81-I92 HydrophobicContact CD2-CD1 3.7Å; Y81-I92 HydrophobicContact CD2-CG1 3.68Å; Y81-I92 HydrophobicContact CE1-CD1 4.47Å; Y81-I92 HydrophobicContact CE2-CB 3.91Å; Y81-I92 HydrophobicContact CE2-CD1 4.31Å; Y81-I92 HydrophobicContact CE2-CG1 4.04Å; Y81-I92 HydrophobicContact CG-CD1 3.48Å; Y81-I92 VanDerWaalsContact CG-CD1 3.48Å; Y81-I92 HydrophobicContact CG-CG1 4.02Å; L90-I92 HydrophobicContact CG-CG1 4.32Å; I92-W108 HydrophobicContact CD1-CE3 3.66Å; I92-W108 HydrophobicContact CD1-CZ3 3.99Å; I92-W108 HydrophobicContact CG2-CB 4.02Å; I92-W108 HydrophobicContact CG2-CD2 3.98Å; I92-W108 HydrophobicContact CG2-CE3 3.86Å; I92-W108 HydrophobicContact CG2-CG 4.07Å; I92-K109 WeakPolarHBondContact CA-O 3.38Å; I92-L110 HydrophobicContact CD1-CD1 4.38Å; I92-L110 HydrophobicContact CD1-CG 4.17Å; I92-L110 HydrophobicContact CG1-CG 4.42Å
93	Q	90.6	Very high	81.5	Confident	92 Å²	92	77.3 Å²	77.3	43%	0.43	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119	169	-176.1	178.5	43.2	0	0	108.5	L95 K109	Q93-L95 HydrophobicContact CG-CD2 3.88Å; Q93-K109 HydrophobicContact CB-CB 4.37Å; Q93-K109 PolarHBondContact N-O 3.04Å; Q93-K109 PolarHBondContact O-N 3.44Å
94	K	92.3	Very high	82.1	Confident	77 Å²	77	82.9 Å²	82.9	34%	0.335	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	141.6	171.2	-64.7	-174.3	-178.5	-174.4	0	110.2	P101 D102 P103	K94-P101 WeakPolarHBondContact O-CA 3.46Å; K94-D102 CarbonylContact C-O 3.59Å; K94-D102 WeakPolarHBondContact CB-O 3.28Å; K94-D102 PolarHBondContact O-N 3.09Å; K94-P103 WeakPolarHBondContact CD-O 3.09Å; K94-P103 WeakPolarHBondContact CE-O 3.41Å; K94-P103 PolarHBondContact NZ-O 3.13Å
95	L	92.6	Very high	83.1	Confident	8 Å²	8	77.2 Å²	77.2	4%	0.042	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150.4	-172.6	-57.8	176.9	0	0	0	111.4	Q93 N99 L100 G105 R107 K109	Q93-L95 HydrophobicContact CG-CD2 3.88Å; L95-N99 HydrophobicContact CD1-CB 4.41Å; L95-L100 CarbonylContact C-O 3.58Å; L95-L100 VanDerWaalsContact CA-O 3.27Å; L95-L100 WeakPolarHBondContact CA-O 3.45Å; L95-G105 CarbonylContact O-C 3.53Å; L95-G105 WeakPolarHBondContact O-CA 3.49Å; L95-R107 HydrophobicContact CB-CB 4.1Å; L95-R107 HydrophobicContact CB-CG 4.14Å; L95-R107 HydrophobicContact CD1-CG 4.37Å; L95-R107 PolarHBondContact N-O 2.87Å; L95-R107 PolarHBondContact O-N 2.98Å; L95-K109 HydrophobicContact CD1-CB 4.04Å
96	N	89.7	Confident	84.5	Confident	38 Å²	38	79.8 Å²	79.8	20%	0.203	44%	0.44	C	S	.	.			trans	-83.3	-176.4	166.2	81.4	-14.5	0	0	0	111.7	D98 N99 L100 D102	N96-D98 PolarHBondContact ND2-OD2 3.39Å; N96-D98 PolarHBondContact O-N 3.43Å; N96-D98 WeakPolarHBondContact OD1-CA 3.38Å; N96-D98 WeakPolarHBondContact OD1-CB 3.5Å; N96-D98 PolarHBondContact OD1-N 3.1Å; N96-N99 PolarHBondContact O-N 2.93Å; N96-N99 VanDerWaalsContact O-N 3.13Å; N96-N99 PolarHBondContact OD1-N 3.17Å; N96-L100 PolarHBondContact N-O 2.77Å; N96-L100 PolarHBondContact OD1-N 3.43Å; N96-L100 PolarHBondContact OD1-O 2.8Å; N96-D102 HydrophobicContact CB-CB 3.89Å
97	S	85.9	Confident	86	Confident	85 Å²	85	75 Å²	75	59%	0.594	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-29.3	176.7	-55.8	0	0	0	0	114.4	N99 R107	S97-N99 VanDerWaalsContact C-N 3.33Å; S97-R107 PolarHBondContact O-NH1 3.24Å; S97-R107 PolarHBondContact O-NH2 3.25Å
98	D	86.2	Confident	88	Confident	114 Å²	114	70.5 Å²	70.5	61%	0.61	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	2.9	-176.7	-44.1	-58.7	0	0	0	112.8	N96 L100	N96-D98 PolarHBondContact ND2-OD2 3.39Å; N96-D98 PolarHBondContact O-N 3.43Å; N96-D98 WeakPolarHBondContact OD1-CA 3.38Å; N96-D98 WeakPolarHBondContact OD1-CB 3.5Å; N96-D98 PolarHBondContact OD1-N 3.1Å; D98-L100 VanDerWaalsContact C-N 3.27Å; D98-L100 HydrophobicContact CB-CD1 4.44Å; D98-L100 HydrophobicContact CB-CG 4.31Å; D98-L100 PolarHBondContact O-N 2.94Å
99	N	84.8	Confident	89.4	Confident	91 Å²	91	71 Å²	71	49%	0.487	37%	0.373	S	S	.	.	S	Bend	trans	64.4	23.2	-171.5	-49.8	-69.4	0	0	0	114.7	L95 N96 S97 R107	L95-N99 HydrophobicContact CD1-CB 4.41Å; N96-N99 PolarHBondContact O-N 2.93Å; N96-N99 VanDerWaalsContact O-N 3.13Å; N96-N99 PolarHBondContact OD1-N 3.17Å; S97-N99 VanDerWaalsContact C-N 3.33Å; N99-R107 WeakPolarHBondContact OD1-CD 3.39Å; N99-R107 PolarHBondContact OD1-NH1 2.87Å
100	L	87.5	Confident	89.9	Confident	105 Å²	105	65.8 Å²	65.8	55%	0.55	35%	0.347	S	S	.	.			trans	-85.4	147.3	169.1	-62.6	175.2	0	0	0	110.5	L95 N96 D98 D102	L95-L100 CarbonylContact C-O 3.58Å; L95-L100 VanDerWaalsContact CA-O 3.27Å; L95-L100 WeakPolarHBondContact CA-O 3.45Å; N96-L100 PolarHBondContact N-O 2.77Å; N96-L100 PolarHBondContact OD1-N 3.43Å; N96-L100 PolarHBondContact OD1-O 2.8Å; D98-L100 VanDerWaalsContact C-N 3.27Å; D98-L100 HydrophobicContact CB-CD1 4.44Å; D98-L100 HydrophobicContact CB-CG 4.31Å; D98-L100 PolarHBondContact O-N 2.94Å; L100-D102 PolarHBondContact O-N 2.8Å
101	P	88.6	Confident	90.1	Very high	95 Å²	95	68.5 Å²	68.5	62%	0.617	36%	0.357	S	S	*	.	B	Isolated β-bridge	trans	-61.8	126.3	178	-22.2	34.1	0	0	0	112.5	K94	K94-P101 WeakPolarHBondContact O-CA 3.46Å
102	D	88.9	Confident	90.3	Very high	55 Å²	55	63.7 Å²	63.7	29%	0.294	33%	0.334	S	S	.	.			trans	-140.9	118.7	-175.5	176.5	-5.8	0	0	0	109.7	K94 N96 L100 D104 G105	K94-D102 CarbonylContact C-O 3.59Å; K94-D102 WeakPolarHBondContact CB-O 3.28Å; K94-D102 PolarHBondContact O-N 3.09Å; N96-D102 HydrophobicContact CB-CB 3.89Å; L100-D102 PolarHBondContact O-N 2.8Å; D102-D104 PolarHBondContact O-N 3.02Å; D102-D104 PolarHBondContact OD1-N 2.96Å; D102-G105 PolarHBondContact O-N 3.24Å; D102-G105 PolarHBondContact OD1-N 3.48Å
103	P	85.5	Confident	90.5	Very high	100 Å²	100	66.3 Å²	66.3	65%	0.649	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.5	-178.5	28.6	-36.2	0	0	0	114.2	K94	K94-P103 WeakPolarHBondContact CD-O 3.09Å; K94-P103 WeakPolarHBondContact CE-O 3.41Å; K94-P103 PolarHBondContact NZ-O 3.13Å
104	D	86	Confident	90.6	Very high	140 Å²	140	62.1 Å²	62.1	75%	0.749	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	4.2	175.4	-68.8	-47.4	0	0	0	112.6	D102 K106	D102-D104 PolarHBondContact O-N 3.02Å; D102-D104 PolarHBondContact OD1-N 2.96Å; D104-K106 PolarHBondContact O-N 2.84Å
105	G	88.3	Confident	90.6	Very high	5 Å²	5	64.9 Å²	64.9	5%	0.052	34%	0.335	C	S	.	.			trans	-55.8	128	179.4	0	0	0	0	0	114.2	L95 D102 W108	L95-G105 CarbonylContact O-C 3.53Å; L95-G105 WeakPolarHBondContact O-CA 3.49Å; D102-G105 PolarHBondContact O-N 3.24Å; D102-G105 PolarHBondContact OD1-N 3.48Å; G105-W108 PolarHBondContact O-NE1 2.88Å
106	K	91.2	Very high	90.4	Very high	140 Å²	140	64.7 Å²	64.7	61%	0.609	33%	0.334	S	S	*	.	S	Bend	trans	-82.2	-18.8	176.7	-66.3	-179.8	-176.8	173	0	113.3	E65 P66 V67 D104	E65-K106 HydrophobicContact CG-CB 4.39Å; P66-K106 WeakPolarHBondContact CA-O 3.49Å; P66-K106 HydrophobicContact CB-CB 4.2Å; P66-K106 HydrophobicContact CB-CD 4.49Å; V67-K106 PolarHBondContact N-O 2.78Å; D104-K106 PolarHBondContact O-N 2.84Å
107	R	95.2	Very high	90.4	Very high	28 Å²	28	67.5 Å²	67.5	11%	0.106	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122	173.9	-178.9	178.3	-59.4	166	10.9	108.8	I43 V63 A64 E65 L95 S97 N99	I43-R107 HydrophobicContact CD1-CG 4.13Å; V63-R107 HydrophobicContact CG1-CG 3.56Å; A64-R107 CarbonylContact O-C 3.48Å; A64-R107 WeakPolarHBondContact O-CA 3.38Å; E65-R107 HydrophobicContact CB-CB 4.03Å; E65-R107 HydrophobicContact CB-CG 4.27Å; E65-R107 HydrophobicContact CG-CB 4.05Å; E65-R107 IonicContact OE2-CZ 2.81Å; E65-R107 IonicContact OE2-NE 2.71Å; E65-R107 PolarHBondContact OE2-NE 2.6Å; E65-R107 IonicContact OE2-NH2 3.16Å; E65-R107 PolarHBondContact OE2-NH2 3.44Å; L95-R107 HydrophobicContact CB-CB 4.1Å; L95-R107 HydrophobicContact CB-CG 4.14Å; L95-R107 HydrophobicContact CD1-CG 4.37Å; L95-R107 PolarHBondContact N-O 2.87Å; L95-R107 PolarHBondContact O-N 2.98Å; S97-R107 PolarHBondContact O-NH1 3.24Å; S97-R107 PolarHBondContact O-NH2 3.25Å; N99-R107 WeakPolarHBondContact OD1-CD 3.39Å; N99-R107 PolarHBondContact OD1-NH1 2.87Å
108	W	95	Very high	90.6	Very high	20 Å²	20	65.3 Å²	65.3	8%	0.076	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	123	-177.7	-70.6	17.9	0	0	0	109.4	V63 A64 V67 S68 A70 Y81 I92 G105 L110	V63-W108 WeakPolarHBondContact CA-O 3.35Å; A64-W108 PolarHBondContact N-O 3.35Å; A64-W108 VanDerWaalsContact N-O 3.11Å; A64-W108 PolarHBondContact O-N 3.13Å; V67-W108 HydrophobicContact CB-CB 4.05Å; V67-W108 HydrophobicContact CB-CD2 3.81Å; V67-W108 HydrophobicContact CB-CE3 4.13Å; V67-W108 HydrophobicContact CB-CG 3.78Å; V67-W108 HydrophobicContact CG1-CB 4.32Å; V67-W108 HydrophobicContact CG1-CD2 3.69Å; V67-W108 HydrophobicContact CG1-CE3 3.46Å; V67-W108 VanDerWaalsContact CG1-CE3 3.46Å; V67-W108 HydrophobicContact CG1-CG 4.09Å; V67-W108 HydrophobicContact CG1-CZ3 4.03Å; V67-W108 HydrophobicContact CG2-CB 4.24Å; V67-W108 HydrophobicContact CG2-CG 4.47Å; S68-W108 WeakPolarHBondContact O-CH2 3.28Å; A70-W108 HydrophobicContact CB-CE3 3.95Å; A70-W108 HydrophobicContact CB-CZ3 4.16Å; Y81-W108 HydrophobicContact CD1-CH2 4.4Å; Y81-W108 AromaticContact CD1-CZ3 3.97Å; Y81-W108 HydrophobicContact CD1-CZ3 3.97Å; Y81-W108 HydrophobicContact CE1-CH2 4.34Å; Y81-W108 HydrophobicContact CE1-CZ3 4.23Å; I92-W108 HydrophobicContact CD1-CE3 3.66Å; I92-W108 HydrophobicContact CD1-CZ3 3.99Å; I92-W108 HydrophobicContact CG2-CB 4.02Å; I92-W108 HydrophobicContact CG2-CD2 3.98Å; I92-W108 HydrophobicContact CG2-CE3 3.86Å; I92-W108 HydrophobicContact CG2-CG 4.07Å; G105-W108 PolarHBondContact O-NE1 2.88Å; W108-L110 HydrophobicContact CB-CD1 4.12Å
109	K	94.7	Very high	90.8	Very high	47 Å²	47	60.8 Å²	60.8	20%	0.204	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	116.4	164.9	-178.9	177.5	-175.4	-174.4	0	108.8	E61 C62 V63 I92 Q93 L95	E61-K109 VanDerWaalsContact OE1-CE 3.22Å; E61-K109 WeakPolarHBondContact OE1-CE 3.36Å; E61-K109 IonicContact OE1-NZ 2.73Å; E61-K109 PolarHBondContact OE1-NZ 3.23Å; E61-K109 WeakPolarHBondContact OE2-CE 3.37Å; E61-K109 IonicContact OE2-NZ 3.57Å; E61-K109 PolarHBondContact OE2-NZ 2.71Å; C62-K109 CarbonylContact O-C 3.56Å; C62-K109 WeakPolarHBondContact O-CA 3.3Å; V63-K109 HydrophobicContact CG2-CB 4.02Å; V63-K109 HydrophobicContact CG2-CG 3.96Å; I92-K109 WeakPolarHBondContact CA-O 3.38Å; Q93-K109 HydrophobicContact CB-CB 4.37Å; Q93-K109 PolarHBondContact N-O 3.04Å; Q93-K109 PolarHBondContact O-N 3.44Å; L95-K109 HydrophobicContact CD1-CB 4.04Å
110	L	94.3	Very high	90.9	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	137.6	173.6	-72.2	61	0	0	0	108.6	E61 C62 A70 I72 L90 I92 W108 C130	E61-L110 WeakPolarHBondContact CA-O 3.48Å; C62-L110 HydrophobicContact CB-CB 4.25Å; C62-L110 PolarHBondContact N-O 3.05Å; C62-L110 PolarHBondContact O-N 3.32Å; A70-L110 HydrophobicContact CB-CD1 4.1Å; A70-L110 HydrophobicContact CB-CD2 3.99Å; A70-L110 HydrophobicContact CB-CG 4.08Å; I72-L110 HydrophobicContact CD1-CB 4.32Å; I72-L110 HydrophobicContact CG1-CD2 4.13Å; L90-L110 HydrophobicContact CD1-CB 4.12Å; L90-L110 HydrophobicContact CD1-CG 4.47Å; I92-L110 HydrophobicContact CD1-CD1 4.38Å; I92-L110 HydrophobicContact CD1-CG 4.17Å; I92-L110 HydrophobicContact CG1-CG 4.42Å; W108-L110 HydrophobicContact CB-CD1 4.12Å; L110-C130 HydrophobicContact CD2-CB 4.22Å
111	R	94.8	Very high	90.7	Very high	65 Å²	65	64.1 Å²	64.1	25%	0.245	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	129.3	176.4	-179.9	175.9	-175.5	-74.2	-8	110.8	T59 I60 E61 E91 E113	T59-R111 HydrophobicContact CG2-CG 3.72Å; I60-R111 WeakPolarHBondContact O-CA 3.33Å; E61-R111 HydrophobicContact CG-CG 4.35Å; E61-R111 IonicContact OE1-NE 3.3Å; E91-R111 HydrophobicContact CB-CB 4.19Å; E91-R111 PolarHBondContact N-O 3.07Å; E91-R111 PolarHBondContact O-N 2.96Å; E91-R111 IonicContact OE1-NH1 3.26Å; E91-R111 VanDerWaalsContact OE2-CD 3.28Å; E91-R111 WeakPolarHBondContact OE2-CD 3.08Å; E91-R111 IonicContact OE2-CZ 2.72Å; E91-R111 IonicContact OE2-NE 3.43Å; E91-R111 IonicContact OE2-NH1 2.78Å; E91-R111 PolarHBondContact OE2-NH1 3.2Å; R111-E113 IonicContact CZ-OE1 3.34Å; R111-E113 IonicContact NH1-OE1 3.12Å; R111-E113 PolarHBondContact NH1-OE1 3.37Å; R111-E113 IonicContact NH2-OE1 2.8Å; R111-E113 PolarHBondContact NH2-OE1 3.45Å
112	L	94.3	Very high	90.6	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.6	-179.7	172.3	67.6	0	0	0	110.1	T59 I60 I72 I79 I89 L90 V114	T59-L112 CarbonylContact C-O 3.51Å; T59-L112 WeakPolarHBondContact CA-O 3.39Å; I60-L112 HydrophobicContact CD1-CD2 4.48Å; I60-L112 PolarHBondContact N-O 3.16Å; I60-L112 PolarHBondContact O-N 3.17Å; I72-L112 HydrophobicContact CB-CD2 4.02Å; I72-L112 HydrophobicContact CD1-CB 3.83Å; I72-L112 HydrophobicContact CD1-CD2 4.32Å; I72-L112 HydrophobicContact CG2-CD2 3.83Å; I79-L112 HydrophobicContact CD1-CD1 4.21Å; I79-L112 HydrophobicContact CD1-CD2 3.65Å; I89-L112 HydrophobicContact CB-CD1 4.29Å; I89-L112 HydrophobicContact CD1-CD1 4.02Å; I89-L112 HydrophobicContact CG1-CD1 3.85Å; I89-L112 VanDerWaalsContact O-CD1 3.3Å; I89-L112 WeakPolarHBondContact O-CD1 3.31Å; L90-L112 HydrophobicContact CD1-CB 4.37Å; L112-V114 HydrophobicContact CD2-CG2 4.23Å; L112-V114 HydrophobicContact CG-CG2 4.24Å
113	E	93.7	Very high	90	Very high	86 Å²	86	70.6 Å²	70.6	40%	0.402	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.3	173.6	-67.9	-176.2	-171	0	0	111	P57 A58 T59 R111	P57-E113 HydrophobicContact CB-CB 4.14Å; P57-E113 HydrophobicContact CG-CB 4.26Å; P57-E113 HydrophobicContact CG-CG 4.42Å; A58-E113 WeakPolarHBondContact O-CA 3.18Å; T59-E113 HydrophobicContact CG2-CG 4.25Å; R111-E113 IonicContact CZ-OE1 3.34Å; R111-E113 IonicContact NH1-OE1 3.12Å; R111-E113 PolarHBondContact NH1-OE1 3.37Å; R111-E113 IonicContact NH2-OE1 2.8Å; R111-E113 PolarHBondContact NH2-OE1 3.45Å
114	V	93.1	Very high	89.8	Confident	4 Å²	4	71.2 Å²	71.2	2%	0.024	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.9	175.7	-176.6	0	0	0	0	108.8	P57 A58 I60 L112 D118 V119 Y126 I152	P57-V114 CarbonylContact C-O 3.59Å; P57-V114 WeakPolarHBondContact CA-O 3.14Å; P57-V114 WeakPolarHBondContact CB-O 3.46Å; A58-V114 PolarHBondContact N-O 3.08Å; A58-V114 PolarHBondContact O-N 2.69Å; I60-V114 HydrophobicContact CD1-CG2 4.44Å; L112-V114 HydrophobicContact CD2-CG2 4.23Å; L112-V114 HydrophobicContact CG-CG2 4.24Å; V114-D118 HydrophobicContact CG1-CB 4.05Å; V114-V119 HydrophobicContact CG1-CG2 4.04Å; V114-Y126 HydrophobicContact CG1-CE1 3.71Å; V114-Y126 HydrophobicContact CG2-CE1 4.27Å; V114-I152 HydrophobicContact CB-CD1 3.66Å; V114-I152 HydrophobicContact CG1-CD1 3.92Å; V114-I152 HydrophobicContact CG2-CD1 3.65Å
115	R	91.9	Very high	89.7	Confident	134 Å²	134	67.4 Å²	67.4	51%	0.506	31%	0.307	S	S	.	.			trans	-99	157.1	-174.8	-51.4	161.5	-65.2	-151.6	-1.5	110.5	P57 K117 D118 V119	P57-R115 HydrophobicContact CB-CG 4.3Å; R115-K117 VanDerWaalsContact C-N 3.32Å; R115-K117 HydrophobicContact CB-CG 4.35Å; R115-K117 PolarHBondContact O-N 2.99Å; R115-D118 VanDerWaalsContact CB-OD2 3.28Å; R115-D118 WeakPolarHBondContact CB-OD2 3.5Å; R115-D118 IonicContact CZ-OD1 3.71Å; R115-D118 IonicContact CZ-OD2 2.81Å; R115-D118 PolarHBondContact N-OD2 2.78Å; R115-D118 VanDerWaalsContact N-OD2 3.1Å; R115-D118 IonicContact NE-OD1 2.8Å; R115-D118 IonicContact NE-OD2 3.55Å; R115-D118 PolarHBondContact NE-OD2 3.46Å; R115-D118 IonicContact NH2-OD1 3.28Å; R115-D118 PolarHBondContact NH2-OD1 3.25Å; R115-D118 IonicContact NH2-OD2 3.14Å; R115-D118 PolarHBondContact NH2-OD2 2.53Å; R115-D118 VanDerWaalsContact NH2-OD2 3.16Å; R115-D118 WeakPolarHBondContact O-CB 3.39Å; R115-D118 PolarHBondContact O-N 3.46Å; R115-V119 PolarHBondContact O-N 2.9Å
116	A	89.5	Confident	89.8	Confident	4 Å²	4	68.3 Å²	68.3	3%	0.033	31%	0.309	C	S	.	.	H	α-helix	trans	-47.6	-51.3	178.3	0	0	0	0	0	112.9	T52 K54 D118 V119 E120 E154	T52-A116 HydrophobicContact CG2-CB 4.15Å; T52-A116 PolarHBondContact OG1-N 3.41Å; K54-A116 HydrophobicContact CG-CB 4.48Å; A116-D118 PolarHBondContact O-N 3.03Å; A116-D118 VanDerWaalsContact O-N 3.14Å; A116-V119 CarbonylContact O-C 3.6Å; A116-V119 WeakPolarHBondContact O-CA 3.48Å; A116-V119 WeakPolarHBondContact O-CB 3.17Å; A116-V119 PolarHBondContact O-N 3.39Å; A116-E120 PolarHBondContact O-N 3.22Å; A116-E154 HydrophobicContact CB-CG 4.25Å; A116-E154 WeakPolarHBondContact CB-OE1 3.23Å
117	K	88.9	Confident	89.9	Confident	98 Å²	98	64.5 Å²	64.5	43%	0.426	30%	0.297	S	S	.	.	H	α-helix	trans	-58.9	-27.2	177.7	66.8	164.3	-159.5	149	0	115.5	R115 E121	R115-K117 VanDerWaalsContact C-N 3.32Å; R115-K117 HydrophobicContact CB-CG 4.35Å; R115-K117 PolarHBondContact O-N 2.99Å; K117-E121 WeakPolarHBondContact O-CB 3.48Å; K117-E121 VanDerWaalsContact O-CG 3.27Å; K117-E121 WeakPolarHBondContact O-CG 3.41Å; K117-E121 PolarHBondContact O-N 2.88Å
118	D	90	Very high	89.9	Confident	39 Å²	39	63.2 Å²	63.2	21%	0.209	29%	0.292	C	S	.	.	H	α-helix	trans	-76.2	-20.2	178	-52.7	-55.1	0	0	0	110.9	V114 R115 A116 Y126	V114-D118 HydrophobicContact CG1-CB 4.05Å; R115-D118 VanDerWaalsContact CB-OD2 3.28Å; R115-D118 WeakPolarHBondContact CB-OD2 3.5Å; R115-D118 IonicContact CZ-OD1 3.71Å; R115-D118 IonicContact CZ-OD2 2.81Å; R115-D118 PolarHBondContact N-OD2 2.78Å; R115-D118 VanDerWaalsContact N-OD2 3.1Å; R115-D118 IonicContact NE-OD1 2.8Å; R115-D118 IonicContact NE-OD2 3.55Å; R115-D118 PolarHBondContact NE-OD2 3.46Å; R115-D118 IonicContact NH2-OD1 3.28Å; R115-D118 PolarHBondContact NH2-OD1 3.25Å; R115-D118 IonicContact NH2-OD2 3.14Å; R115-D118 PolarHBondContact NH2-OD2 2.53Å; R115-D118 VanDerWaalsContact NH2-OD2 3.16Å; R115-D118 WeakPolarHBondContact O-CB 3.39Å; R115-D118 PolarHBondContact O-N 3.46Å; A116-D118 PolarHBondContact O-N 3.03Å; A116-D118 VanDerWaalsContact O-N 3.14Å; D118-Y126 WeakPolarHBondContact O-CE2 3.27Å
119	V	90.5	Very high	89.9	Confident	19 Å²	19	63.6 Å²	63.6	12%	0.115	30%	0.295	C	S	.	.	H	α-helix	trans	-88.6	-42.6	171.4	-177.9	0	0	0	0	110.6	T52 V114 R115 A116 E121 W122 Y126 I152	T52-V119 HydrophobicContact CG2-CG2 4.02Å; V114-V119 HydrophobicContact CG1-CG2 4.04Å; R115-V119 PolarHBondContact O-N 2.9Å; A116-V119 CarbonylContact O-C 3.6Å; A116-V119 WeakPolarHBondContact O-CA 3.48Å; A116-V119 WeakPolarHBondContact O-CB 3.17Å; A116-V119 PolarHBondContact O-N 3.39Å; V119-E121 VanDerWaalsContact C-N 3.31Å; V119-E121 PolarHBondContact O-N 2.76Å; V119-W122 WeakPolarHBondContact O-CB 3.37Å; V119-W122 PolarHBondContact O-N 3.14Å; V119-Y126 HydrophobicContact CB-CD2 4.4Å; V119-Y126 HydrophobicContact CG1-CG 4.43Å; V119-Y126 HydrophobicContact CG2-CD1 4.28Å; V119-Y126 HydrophobicContact CG2-CD2 4.11Å; V119-Y126 HydrophobicContact CG2-CG 3.99Å; V119-I152 HydrophobicContact CG2-CB 4.27Å; V119-I152 HydrophobicContact CG2-CG2 3.92Å
120	E	86.1	Confident	90	Very high	129 Å²	129	61.4 Å²	61.4	60%	0.603	29%	0.285	S	S	*	.	H	α-helix	trans	-59.7	-36.2	176.2	-168.9	-176	-170.8	0	0	112.7	A116 W122	A116-E120 PolarHBondContact O-N 3.22Å; E120-W122 PolarHBondContact O-N 2.76Å
121	E	85.1	Confident	90	Very high	136 Å²	136	61.9 Å²	61.9	64%	0.636	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-2	174.4	-73.8	177.1	-148.9	0	0	113.6	K117 V119	K117-E121 WeakPolarHBondContact O-CB 3.48Å; K117-E121 VanDerWaalsContact O-CG 3.27Å; K117-E121 WeakPolarHBondContact O-CG 3.41Å; K117-E121 PolarHBondContact O-N 2.88Å; V119-E121 VanDerWaalsContact C-N 3.31Å; V119-E121 PolarHBondContact O-N 2.76Å
122	W	86.2	Confident	90	Very high	82 Å²	82	58.8 Å²	58.8	31%	0.311	28%	0.276	S	S	.	.			trans	-110.8	125.9	-175.7	-173.8	-108.7	0	0	0	112.3	A75 E76 V119 E120 D124 T125 Y126	A75-W122 HydrophobicContact CB-CD2 3.6Å; A75-W122 HydrophobicContact CB-CE3 3.84Å; A75-W122 HydrophobicContact CB-CG 4.13Å; A75-W122 HydrophobicContact CB-CH2 4.04Å; A75-W122 HydrophobicContact CB-CZ2 3.82Å; A75-W122 HydrophobicContact CB-CZ3 4.04Å; A75-W122 WeakPolarHBondContact O-CH2 3.4Å; E76-W122 HydrophobicContact CG-CH2 4.38Å; V119-W122 WeakPolarHBondContact O-CB 3.37Å; V119-W122 PolarHBondContact O-N 3.14Å; E120-W122 PolarHBondContact O-N 2.76Å; W122-D124 VanDerWaalsContact C-N 3.34Å; W122-D124 PolarHBondContact O-N 3.22Å; W122-T125 PolarHBondContact NE1-O 3.04Å; W122-Y126 HydrophobicContact CB-CD2 3.87Å; W122-Y126 HydrophobicContact CB-CE2 4.45Å; W122-Y126 AromaticContact CD1-CD2 3.86Å; W122-Y126 AromaticContact CG-CD2 3.88Å; W122-Y126 HydrophobicContact CG-CD2 3.88Å
123	F	76.2	Confident	89.9	Confident	205 Å²	205	60.8 Å²	60.8	90%	0.899	28%	0.283	S	S	*	.	S	Bend	trans	-84.5	6.1	-168.6	-68.7	-84.9	0	0	0	115.8
124	D	80.5	Confident	90	Very high	113 Å²	113	58 Å²	58	60%	0.604	27%	0.271	S	S	*	.	S	Bend	trans	-142.3	-176.1	-174.9	-158.6	-7.6	0	0	0	109.7	W122 Y126	W122-D124 VanDerWaalsContact C-N 3.34Å; W122-D124 PolarHBondContact O-N 3.22Å; D124-Y126 PolarHBondContact O-N 3.34Å
125	T	83.1	Confident	89.8	Confident	60 Å²	60	63 Å²	63	37%	0.368	29%	0.292	S	S	.	.			trans	-60.1	124.9	173.7	-56.4	0	0	0	0	110.5	W122 V127 E151	W122-T125 PolarHBondContact NE1-O 3.04Å; T125-V127 VanDerWaalsContact C-N 3.32Å; T125-V127 HydrophobicContact CG2-CG2 3.68Å; T125-V127 PolarHBondContact O-N 3.23Å; T125-E151 HydrophobicContact CG2-CB 4.46Å; T125-E151 HydrophobicContact CG2-CG 3.7Å
126	Y	90.9	Very high	89.7	Confident	24 Å²	24	56.6 Å²	56.6	9%	0.094	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	81.8	178.7	-163.1	-79.1	0	0	0	110.2	C74 A75 V114 D118 V119 W122 D124 I152	C74-Y126 HydrophobicContact CB-CE1 3.83Å; A75-Y126 HydrophobicContact CB-CD2 3.75Å; A75-Y126 HydrophobicContact CB-CE2 3.47Å; A75-Y126 VanDerWaalsContact CB-CE2 3.47Å; A75-Y126 HydrophobicContact CB-CG 4.39Å; V114-Y126 HydrophobicContact CG1-CE1 3.71Å; V114-Y126 HydrophobicContact CG2-CE1 4.27Å; D118-Y126 WeakPolarHBondContact O-CE2 3.27Å; V119-Y126 HydrophobicContact CB-CD2 4.4Å; V119-Y126 HydrophobicContact CG1-CG 4.43Å; V119-Y126 HydrophobicContact CG2-CD1 4.28Å; V119-Y126 HydrophobicContact CG2-CD2 4.11Å; V119-Y126 HydrophobicContact CG2-CG 3.99Å; W122-Y126 HydrophobicContact CB-CD2 3.87Å; W122-Y126 HydrophobicContact CB-CE2 4.45Å; W122-Y126 AromaticContact CD1-CD2 3.86Å; W122-Y126 AromaticContact CG-CD2 3.88Å; W122-Y126 HydrophobicContact CG-CD2 3.88Å; D124-Y126 PolarHBondContact O-N 3.34Å; Y126-I152 HydrophobicContact CD1-CB 3.96Å; Y126-I152 HydrophobicContact CD1-CD1 3.71Å; Y126-I152 HydrophobicContact CD1-CG1 3.92Å; Y126-I152 HydrophobicContact CE1-CD1 3.74Å; Y126-I152 HydrophobicContact CE1-CG1 4.44Å; Y126-I152 PolarHBondContact O-N 2.77Å
127	V	93.7	Very high	89.5	Confident	59 Å²	59	61 Å²	61	36%	0.358	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	137.6	179.3	-174.9	0	0	0	0	111	C74 A75 T125 T149 T150	C74-V127 WeakPolarHBondContact CA-O 3.27Å; A75-V127 PolarHBondContact N-O 3.38Å; T125-V127 VanDerWaalsContact C-N 3.32Å; T125-V127 HydrophobicContact CG2-CG2 3.68Å; T125-V127 PolarHBondContact O-N 3.23Å; V127-T149 HydrophobicContact CG1-CG2 3.84Å; V127-T150 CarbonylContact C-O 3.48Å; V127-T150 WeakPolarHBondContact CA-O 3.39Å
128	C	95.4	Very high	89.3	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	157.1	168.6	-58.1	0	0	0	0	112.9	I60 I72 K73 C74 T149 T150	I60-C128 HydrophobicContact CD1-CB 3.68Å; I60-C128 WeakPolarHBondContact CD1-SG 2.98Å; I72-C128 HydrophobicContact CG2-CB 4.27Å; K73-C128 CarbonylContact O-C 3.58Å; K73-C128 WeakPolarHBondContact O-CA 3.46Å; C74-C128 VanDerWaalsContact CA-SG 3.52Å; C74-C128 HydrophobicContact CB-CB 4.08Å; C74-C128 WeakPolarHBondContact CB-SG 3.44Å; C74-C128 WeakPolarHBondContact SG-CB 3.34Å; C74-C128 CovalentContact SG-SG 2.03Å; C74-C128 PolarHBondContact SG-SG 2.82Å; C128-T149 CarbonylContact O-C 3.54Å; C128-T149 WeakPolarHBondContact O-CA 3.3Å; C128-T150 HydrophobicContact CB-CG2 3.73Å; C128-T150 PolarHBondContact N-O 2.96Å; C128-T150 PolarHBondContact O-N 3.13Å
129	H	95.2	Very high	89	Confident	29 Å²	29	65.1 Å²	65.1	13%	0.134	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	152.5	163.2	64.1	-108.9	0	0	0	111.5	I72 K73 E131 I146 T149	I72-H129 CarbonylContact C-O 3.43Å; I72-H129 WeakPolarHBondContact CA-O 3.22Å; I72-H129 WeakPolarHBondContact CG2-O 3.34Å; K73-H129 PolarHBondContact N-O 3.02Å; K73-H129 PolarHBondContact O-N 2.84Å; H129-E131 IonicContact CD2-OE1 2.76Å; H129-E131 IonicContact CE1-OE1 3.73Å; H129-E131 IonicContact NE2-OE1 2.65Å; H129-E131 PolarHBondContact NE2-OE1 3.25Å; H129-I146 HydrophobicContact CB-CG2 4.19Å; H129-T149 HydrophobicContact CB-CG2 4.27Å
130	C	95.7	Very high	88.7	Confident	0 Å²	0	70 Å²	70	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	136.7	174.9	-66.2	0	0	0	0	110.4	F42 C62 I72 L110 I146 S147	F42-C130 HydrophobicContact CE1-CB 3.73Å; F42-C130 HydrophobicContact CZ-CB 3.92Å; C62-C130 HydrophobicContact CB-CB 3.77Å; C62-C130 WeakPolarHBondContact CB-SG 3.45Å; C62-C130 WeakPolarHBondContact SG-CB 3.45Å; C62-C130 CovalentContact SG-SG 2.04Å; C62-C130 PolarHBondContact SG-SG 2.87Å; I72-C130 VanDerWaalsContact CD1-SG 3.59Å; I72-C130 HydrophobicContact CG1-CB 4.42Å; L110-C130 HydrophobicContact CD2-CB 4.22Å; C130-I146 WeakPolarHBondContact O-CA 3.3Å; C130-S147 WeakPolarHBondContact CB-OG 3.13Å; C130-S147 PolarHBondContact N-OG 3.05Å; C130-S147 PolarHBondContact O-N 3.42Å
131	E	94.6	Very high	88.7	Confident	11 Å²	11	68.5 Å²	68.5	5%	0.051	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.5	173.9	-56	-163.2	172.5	0	0	108.9	A70 A71 H129 W133 K144 I146	A70-E131 WeakPolarHBondContact CA-O 3.28Å; A71-E131 PolarHBondContact N-O 3.42Å; A71-E131 PolarHBondContact O-N 2.9Å; H129-E131 IonicContact CD2-OE1 2.76Å; H129-E131 IonicContact CE1-OE1 3.73Å; H129-E131 IonicContact NE2-OE1 2.65Å; H129-E131 PolarHBondContact NE2-OE1 3.25Å; E131-W133 HydrophobicContact CB-CE3 4.26Å; E131-W133 HydrophobicContact CB-CH2 3.5Å; E131-W133 HydrophobicContact CB-CZ2 4.39Å; E131-W133 HydrophobicContact CB-CZ3 3.43Å; E131-W133 VanDerWaalsContact CB-CZ3 3.43Å; E131-W133 HydrophobicContact CG-CH2 4.42Å; E131-W133 VanDerWaalsContact O-CZ3 3.31Å; E131-W133 WeakPolarHBondContact O-CZ3 3.27Å; E131-W133 VanDerWaalsContact OE2-CH2 3.32Å; E131-W133 WeakPolarHBondContact OE2-CH2 3.48Å; E131-K144 HydrophobicContact CB-CD 4.21Å; E131-K144 HydrophobicContact CB-CG 4.47Å; E131-K144 VanDerWaalsContact CD-NZ 3.33Å; E131-K144 IonicContact OE1-NZ 2.69Å; E131-K144 PolarHBondContact OE1-NZ 2.97Å; E131-K144 WeakPolarHBondContact OE2-CD 3.17Å; E131-K144 WeakPolarHBondContact OE2-CE 3.5Å; E131-K144 IonicContact OE2-NZ 2.75Å; E131-K144 PolarHBondContact OE2-NZ 2.79Å; E131-I146 HydrophobicContact CG-CG1 4.23Å
132	A	94.6	Very high	88.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	132.9	-178.3	0	0	0	0	0	110.6	P40 F42 A64 V67 K144 V145	P40-A132 HydrophobicContact CB-CB 4.22Å; F42-A132 HydrophobicContact CE1-CB 4.42Å; F42-A132 HydrophobicContact CE2-CB 4.14Å; F42-A132 HydrophobicContact CZ-CB 3.76Å; A64-A132 HydrophobicContact CB-CB 4.04Å; V67-A132 HydrophobicContact CG2-CB 4.35Å; A132-K144 WeakPolarHBondContact O-CA 3.36Å; A132-V145 PolarHBondContact N-O 2.75Å; A132-V145 PolarHBondContact O-N 3.12Å
133	W	93.9	Very high	88.9	Confident	43 Å²	43	61 Å²	61	16%	0.163	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145.9	-178.8	-66.6	-109.6	0	0	0	111.8	S68 H69 A71 E131 K143 K144	S68-W133 PolarHBondContact N-O 2.76Å; S68-W133 PolarHBondContact OG-O 3.07Å; H69-W133 HydrophobicContact CB-CB 4.16Å; H69-W133 HydrophobicContact CB-CE3 4.46Å; H69-W133 PolarHBondContact N-O 2.99Å; H69-W133 PolarHBondContact O-N 3.12Å; A71-W133 HydrophobicContact CB-CH2 3.87Å; A71-W133 HydrophobicContact CB-CZ3 3.72Å; E131-W133 HydrophobicContact CB-CE3 4.26Å; E131-W133 HydrophobicContact CB-CH2 3.5Å; E131-W133 HydrophobicContact CB-CZ2 4.39Å; E131-W133 HydrophobicContact CB-CZ3 3.43Å; E131-W133 VanDerWaalsContact CB-CZ3 3.43Å; E131-W133 HydrophobicContact CG-CH2 4.42Å; E131-W133 VanDerWaalsContact O-CZ3 3.31Å; E131-W133 WeakPolarHBondContact O-CZ3 3.27Å; E131-W133 VanDerWaalsContact OE2-CH2 3.32Å; E131-W133 WeakPolarHBondContact OE2-CH2 3.48Å; W133-K143 VanDerWaalsContact CA-O 3.27Å; W133-K143 WeakPolarHBondContact CA-O 3.41Å; W133-K144 HydrophobicContact CD2-CB 4.42Å; W133-K144 HydrophobicContact CD2-CD 4.1Å; W133-K144 HydrophobicContact CD2-CG 3.94Å; W133-K144 HydrophobicContact CG-CB 4.22Å; W133-K144 HydrophobicContact CG-CG 4.24Å; W133-K144 HydrophobicContact CH2-CD 3.97Å; W133-K144 HydrophobicContact CZ2-CD 3.3Å; W133-K144 HydrophobicContact CZ2-CG 4.09Å
134	N	94	Very high	89.7	Confident	29 Å²	29	51.9 Å²	51.9	16%	0.155	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	160.8	161.3	-174.5	39.8	0	0	0	111.6	G38 P40 P66 V136 P142 K143	G38-N134 WeakPolarHBondContact O-CB 3.14Å; G38-N134 PolarHBondContact O-ND2 2.95Å; P40-N134 HydrophobicContact CG-CB 3.76Å; P66-N134 WeakPolarHBondContact O-CB 3.3Å; N134-V136 PolarHBondContact O-N 3.43Å; N134-P142 CarbonylContact O-C 3.58Å; N134-P142 WeakPolarHBondContact O-CA 3.28Å; N134-K143 PolarHBondContact N-O 2.82Å; N134-K143 VanDerWaalsContact N-O 3.1Å; N134-K143 PolarHBondContact O-N 3.36Å
135	K	90	Very high	90.2	Very high	108 Å²	108	48.1 Å²	48.1	47%	0.47	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	112.2	175.4	-170.6	-176	179	-171.8	0	110.4	V137 Q140	K135-V137 PolarHBondContact O-N 2.93Å; K135-Q140 WeakPolarHBondContact CE-O 3.22Å
136	V	88.9	Confident	90.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.237	C	C	.	.			trans	-81.9	117.5	179.6	177.9	0	0	0	0	109.4	L36 V39 N134 K138 L139 Q140 R141 K143	L36-V136 HydrophobicContact CB-CG1 3.76Å; L36-V136 HydrophobicContact CD1-CG1 4.13Å; V39-V136 HydrophobicContact CG2-CG1 4.44Å; V39-V136 HydrophobicContact CG2-CG2 3.66Å; N134-V136 PolarHBondContact O-N 3.43Å; V136-K138 VanDerWaalsContact C-N 3.32Å; V136-K138 PolarHBondContact O-N 3.26Å; V136-L139 HydrophobicContact CB-CB 4.22Å; V136-L139 HydrophobicContact CB-CD1 4.14Å; V136-L139 HydrophobicContact CB-CG 4.26Å; V136-L139 HydrophobicContact CG1-CB 4.23Å; V136-L139 HydrophobicContact CG1-CD1 3.96Å; V136-L139 HydrophobicContact CG1-CG 3.85Å; V136-L139 PolarHBondContact O-N 3.39Å; V136-Q140 PolarHBondContact O-N 3.22Å; V136-R141 PolarHBondContact N-O 2.99Å; V136-R141 VanDerWaalsContact N-O 3.17Å; V136-K143 HydrophobicContact CG2-CB 3.86Å; V136-K143 HydrophobicContact CG2-CG 4.15Å
137	V	86.1	Confident	90.9	Very high	97 Å²	97	47.6 Å²	47.6	59%	0.588	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-43	-170.1	-179.1	0	0	0	0	112	K135 L139 Q140	K135-V137 PolarHBondContact O-N 2.93Å; V137-L139 VanDerWaalsContact C-N 3.29Å; V137-L139 PolarHBondContact O-N 3.38Å; V137-Q140 PolarHBondContact O-N 3.43Å; V137-Q140 PolarHBondContact O-NE2 3.01Å; V137-Q140 VanDerWaalsContact O-NE2 3.1Å
138	K	84.4	Confident	90.8	Very high	167 Å²	167	49.6 Å²	49.6	73%	0.726	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-15.3	-179.6	179.7	163.9	152.8	-164.4	0	114.2	L36 V136	L36-K138 HydrophobicContact CD2-CB 4.44Å; L36-K138 HydrophobicContact CD2-CD 3.68Å; L36-K138 HydrophobicContact CD2-CG 4.25Å; V136-K138 VanDerWaalsContact C-N 3.32Å; V136-K138 PolarHBondContact O-N 3.26Å
139	L	84.2	Confident	90.7	Very high	55 Å²	55	53.7 Å²	53.7	29%	0.288	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-14.2	177.1	-58	178.2	0	0	0	113.5	E33 L36 V136 V137 R141 K143	E33-L139 HydrophobicContact CG-CD1 4.1Å; E33-L139 WeakPolarHBondContact OE1-CD1 3.41Å; L36-L139 HydrophobicContact CD1-CD1 3.75Å; L36-L139 HydrophobicContact CD1-CD2 3.93Å; L36-L139 HydrophobicContact CD1-CG 3.78Å; V136-L139 HydrophobicContact CB-CB 4.22Å; V136-L139 HydrophobicContact CB-CD1 4.14Å; V136-L139 HydrophobicContact CB-CG 4.26Å; V136-L139 HydrophobicContact CG1-CB 4.23Å; V136-L139 HydrophobicContact CG1-CD1 3.96Å; V136-L139 HydrophobicContact CG1-CG 3.85Å; V136-L139 PolarHBondContact O-N 3.39Å; V137-L139 VanDerWaalsContact C-N 3.29Å; V137-L139 PolarHBondContact O-N 3.38Å; L139-R141 HydrophobicContact CB-CG 4.01Å; L139-R141 PolarHBondContact O-N 2.99Å; L139-K143 HydrophobicContact CD1-CG 3.85Å
140	Q	84.1	Confident	90.6	Very high	122 Å²	122	52.4 Å²	52.4	57%	0.57	26%	0.262	S	S	*	.	S	Bend	trans	56.4	0.9	-174.9	-67.8	-64.3	-23	0	0	117	K135 V136 V137	K135-Q140 WeakPolarHBondContact CE-O 3.22Å; V136-Q140 PolarHBondContact O-N 3.22Å; V137-Q140 PolarHBondContact O-N 3.43Å; V137-Q140 PolarHBondContact O-NE2 3.01Å; V137-Q140 VanDerWaalsContact O-NE2 3.1Å
141	R	85.1	Confident	90.5	Very high	98 Å²	98	55.4 Å²	55.4	37%	0.37	28%	0.276	S	S	.	.	S	Bend	trans	-108.8	158	173.6	58.6	178.7	174.5	172.3	2.2	112	E33 V136 L139	E33-R141 IonicContact OE1-NH2 3.18Å; E33-R141 PolarHBondContact OE1-NH2 3.48Å; V136-R141 PolarHBondContact N-O 2.99Å; V136-R141 VanDerWaalsContact N-O 3.17Å; L139-R141 HydrophobicContact CB-CG 4.01Å; L139-R141 PolarHBondContact O-N 2.99Å
142	P	85.8	Confident	90.5	Very high	60 Å²	60	55 Å²	55	39%	0.39	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	152.6	161.1	28.8	-35.8	0	0	0	110.5	N134	N134-P142 CarbonylContact O-C 3.58Å; N134-P142 WeakPolarHBondContact O-CA 3.28Å
143	K	91.1	Very high	90.4	Very high	1 Å²	1	57.8 Å²	57.8	0%	0.004	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	146.5	168.3	-83	-62.3	-167.8	160	0	110.7	E26 D27 L28 V29 E33 W133 N134 V136 L139	E26-K143 PolarHBondContact O-NZ 3.24Å; D27-K143 CarbonylContact O-C 3.46Å; D27-K143 WeakPolarHBondContact O-CA 3.22Å; D27-K143 WeakPolarHBondContact O-CD 3.36Å; L28-K143 PolarHBondContact O-NZ 2.77Å; V29-K143 HydrophobicContact CG2-CB 3.77Å; V29-K143 HydrophobicContact CG2-CG 4.41Å; E33-K143 WeakPolarHBondContact OE1-CE 3.43Å; E33-K143 IonicContact OE1-NZ 2.74Å; E33-K143 PolarHBondContact OE1-NZ 3.23Å; E33-K143 VanDerWaalsContact OE1-NZ 3.14Å; E33-K143 WeakPolarHBondContact OE2-CE 3.38Å; E33-K143 IonicContact OE2-NZ 2.65Å; E33-K143 PolarHBondContact OE2-NZ 3.37Å; W133-K143 VanDerWaalsContact CA-O 3.27Å; W133-K143 WeakPolarHBondContact CA-O 3.41Å; N134-K143 PolarHBondContact N-O 2.82Å; N134-K143 VanDerWaalsContact N-O 3.1Å; N134-K143 PolarHBondContact O-N 3.36Å; V136-K143 HydrophobicContact CG2-CB 3.86Å; V136-K143 HydrophobicContact CG2-CG 4.15Å; L139-K143 HydrophobicContact CD1-CG 3.85Å
144	K	91.8	Very high	90.2	Very high	13 Å²	13	58.1 Å²	58.1	6%	0.057	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.9	-171.2	-169.1	175	85.5	169.6	0	111.5	D27 L28 V29 E131 A132 W133	D27-K144 HydrophobicContact CB-CB 4.34Å; D27-K144 WeakPolarHBondContact O-CB 3.42Å; D27-K144 PolarHBondContact O-N 3.44Å; L28-K144 HydrophobicContact CD2-CB 4.47Å; L28-K144 VanDerWaalsContact CD2-CE 3.44Å; V29-K144 PolarHBondContact N-O 3.11Å; E131-K144 HydrophobicContact CB-CD 4.21Å; E131-K144 HydrophobicContact CB-CG 4.47Å; E131-K144 VanDerWaalsContact CD-NZ 3.33Å; E131-K144 IonicContact OE1-NZ 2.69Å; E131-K144 PolarHBondContact OE1-NZ 2.97Å; E131-K144 WeakPolarHBondContact OE2-CD 3.17Å; E131-K144 WeakPolarHBondContact OE2-CE 3.5Å; E131-K144 IonicContact OE2-NZ 2.75Å; E131-K144 PolarHBondContact OE2-NZ 2.79Å; A132-K144 WeakPolarHBondContact O-CA 3.36Å; W133-K144 HydrophobicContact CD2-CB 4.42Å; W133-K144 HydrophobicContact CD2-CD 4.1Å; W133-K144 HydrophobicContact CD2-CG 3.94Å; W133-K144 HydrophobicContact CG-CB 4.22Å; W133-K144 HydrophobicContact CG-CG 4.24Å; W133-K144 HydrophobicContact CH2-CD 3.97Å; W133-K144 HydrophobicContact CZ2-CD 3.3Å; W133-K144 HydrophobicContact CZ2-CG 4.09Å
145	V	92.6	Very high	90	Very high	33 Å²	33	57.2 Å²	57.2	20%	0.2	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.1	166.5	-178.6	0	0	0	0	108.9	V29 V39 P40 F42 A132	V29-V145 HydrophobicContact CB-CG2 4.02Å; V29-V145 HydrophobicContact CG2-CG2 3.56Å; V39-V145 HydrophobicContact CG1-CG2 4.18Å; P40-V145 HydrophobicContact CB-CG2 4.41Å; P40-V145 VanDerWaalsContact O-CG2 3.28Å; P40-V145 WeakPolarHBondContact O-CG2 3.14Å; F42-V145 HydrophobicContact CD2-CG1 3.99Å; F42-V145 HydrophobicContact CE2-CB 4.35Å; F42-V145 HydrophobicContact CE2-CG1 4.02Å; A132-V145 PolarHBondContact N-O 2.75Å; A132-V145 PolarHBondContact O-N 3.12Å
146	I	93	Very high	89.9	Confident	67 Å²	67	56.6 Å²	56.6	34%	0.344	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	139.3	-179.6	-63.9	-177.2	0	0	0	108.6	L28 H129 C130 E131	L28-I146 HydrophobicContact CD2-CD1 3.76Å; L28-I146 HydrophobicContact CD2-CG1 4.08Å; H129-I146 HydrophobicContact CB-CG2 4.19Å; C130-I146 WeakPolarHBondContact O-CA 3.3Å; E131-I146 HydrophobicContact CG-CG1 4.23Å
147	S	94.7	Very high	90	Very high	7 Å²	7	57.1 Å²	57.1	5%	0.049	28%	0.284	C	S	.	.			trans	-77.3	166	174.8	75	0	0	0	0	112	C130	C130-S147 WeakPolarHBondContact CB-OG 3.13Å; C130-S147 PolarHBondContact N-OG 3.05Å; C130-S147 PolarHBondContact O-N 3.42Å
148	N	92.8	Very high	90.1	Very high	101 Å²	101	56.4 Å²	56.4	54%	0.54	28%	0.277	S	S	.	.			trans	-45.7	144.9	156.1	-60.1	4.9	0	0	0	110.8	H45 P46	H45-N148 HydrophobicContact CB-CB 4.32Å; H45-N148 PolarHBondContact ND1-N 3.4Å; P46-N148 VanDerWaalsContact CG-O 3.3Å; P46-N148 WeakPolarHBondContact CG-O 3.39Å
149	T	92	Very high	90.1	Very high	86 Å²	86	56.6 Å²	56.6	53%	0.528	28%	0.281	S	S	.	.			trans	-71.6	159.5	173.9	43.3	0	0	0	0	111.6	V127 C128 H129	V127-T149 HydrophobicContact CG1-CG2 3.84Å; C128-T149 CarbonylContact O-C 3.54Å; C128-T149 WeakPolarHBondContact O-CA 3.3Å; H129-T149 HydrophobicContact CB-CG2 4.27Å
150	T	93.4	Very high	90	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.012	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	136.5	173.4	-176.5	0	0	0	0	110.1	P46 K47 P48 Y50 I60 V127 C128	P46-T150 HydrophobicContact CB-CG2 4.02Å; P46-T150 HydrophobicContact CG-CG2 4.15Å; K47-T150 WeakPolarHBondContact O-CB 3.33Å; K47-T150 PolarHBondContact O-OG1 3.3Å; P48-T150 WeakPolarHBondContact O-CA 3.2Å; Y50-T150 WeakPolarHBondContact CD2-OG1 3.18Å; Y50-T150 HydrophobicContact CE2-CG2 4.46Å; Y50-T150 WeakPolarHBondContact CE2-OG1 3.47Å; I60-T150 HydrophobicContact CD1-CG2 4.14Å; I60-T150 HydrophobicContact CG1-CG2 4.3Å; I60-T150 HydrophobicContact CG2-CG2 4.46Å; V127-T150 CarbonylContact C-O 3.48Å; V127-T150 WeakPolarHBondContact CA-O 3.39Å; C128-T150 HydrophobicContact CB-CG2 3.73Å; C128-T150 PolarHBondContact N-O 2.96Å; C128-T150 PolarHBondContact O-N 3.13Å
151	E	94.1	Very high	90.2	Very high	64 Å²	64	56.8 Å²	56.8	30%	0.299	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	144.5	171.8	178.3	177.5	-172.3	0	0	110.3	P48 L49 Y50 T125 K153	P48-E151 PolarHBondContact O-N 3.25Å; L49-E151 CarbonylContact C-O 3.53Å; L49-E151 WeakPolarHBondContact CA-O 3.4Å; L49-E151 HydrophobicContact CD1-CB 3.82Å; L49-E151 HydrophobicContact CD1-CG 3.76Å; Y50-E151 PolarHBondContact N-O 2.87Å; T125-E151 HydrophobicContact CG2-CB 4.46Å; T125-E151 HydrophobicContact CG2-CG 3.7Å; E151-K153 HydrophobicContact CG-CG 4.22Å; E151-K153 WeakPolarHBondContact OE1-CE 3.42Å
152	I	93.7	Very high	90.4	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128	165.7	-44.6	-176.8	0	0	0	109.4	Y50 T52 A58 I60 V114 V119 Y126	Y50-I152 WeakPolarHBondContact O-CA 3.3Å; T52-I152 HydrophobicContact CG2-CG2 4Å; A58-I152 HydrophobicContact CB-CD1 4.32Å; A58-I152 HydrophobicContact CB-CG2 3.62Å; I60-I152 HydrophobicContact CD1-CD1 3.84Å; I60-I152 HydrophobicContact CG1-CD1 4.38Å; V114-I152 HydrophobicContact CB-CD1 3.66Å; V114-I152 HydrophobicContact CG1-CD1 3.92Å; V114-I152 HydrophobicContact CG2-CD1 3.65Å; V119-I152 HydrophobicContact CG2-CB 4.27Å; V119-I152 HydrophobicContact CG2-CG2 3.92Å; Y126-I152 HydrophobicContact CD1-CB 3.96Å; Y126-I152 HydrophobicContact CD1-CD1 3.71Å; Y126-I152 HydrophobicContact CD1-CG1 3.92Å; Y126-I152 HydrophobicContact CE1-CD1 3.74Å; Y126-I152 HydrophobicContact CE1-CG1 4.44Å; Y126-I152 PolarHBondContact O-N 2.77Å
153	K	92.3	Very high	90.4	Very high	58 Å²	58	55.5 Å²	55.5	25%	0.252	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	149.3	171	-67	-178.8	174.9	-175.8	0	111.1	L49 Y50 Y51 T52 E151 D186	L49-K153 HydrophobicContact CD1-CD 4.12Å; L49-K153 HydrophobicContact CD1-CG 4.01Å; Y50-K153 PolarHBondContact O-N 3.02Å; Y51-K153 WeakPolarHBondContact CA-O 3.28Å; Y51-K153 HydrophobicContact CD1-CB 3.85Å; Y51-K153 HydrophobicContact CE1-CB 3.94Å; Y51-K153 HydrophobicContact CE1-CD 3.91Å; T52-K153 WeakPolarHBondContact CG2-O 3.39Å; T52-K153 PolarHBondContact N-O 3.23Å; E151-K153 HydrophobicContact CG-CG 4.22Å; E151-K153 WeakPolarHBondContact OE1-CE 3.42Å; K153-D186 VanDerWaalsContact CD-OD2 3.25Å; K153-D186 WeakPolarHBondContact CD-OD2 3.43Å; K153-D186 WeakPolarHBondContact CE-OD2 3.46Å; K153-D186 IonicContact NZ-OD1 2.73Å; K153-D186 IonicContact NZ-OD2 3.34Å; K153-D186 PolarHBondContact NZ-OD2 3Å
154	E	89.9	Confident	90.3	Very high	51 Å²	51	60.6 Å²	60.6	24%	0.238	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	129.2	155.6	-178.7	165.2	-152	0	0	108.5	T52 K54 A116	T52-E154 WeakPolarHBondContact O-CA 3.43Å; K54-E154 WeakPolarHBondContact CE-OE1 3.13Å; K54-E154 WeakPolarHBondContact CG-OE1 3.37Å; A116-E154 HydrophobicContact CB-CG 4.25Å; A116-E154 WeakPolarHBondContact CB-OE1 3.23Å
155	A	90.4	Very high	90.2	Very high	9 Å²	9	60.3 Å²	60.3	7%	0.074	30%	0.295	C	S	.	.			trans	-84.5	136.8	175.7	0	0	0	0	0	111.3	Y51 T52 T53 D186 L236	Y51-A155 HydrophobicContact CD1-CB 3.83Å; Y51-A155 HydrophobicContact CG-CB 4.17Å; T52-A155 PolarHBondContact O-N 2.95Å; T53-A155 HydrophobicContact CG2-CB 4.14Å; A155-D186 WeakPolarHBondContact CA-O 2.99Å; A155-D186 VanDerWaalsContact CB-O 3.23Å; A155-D186 WeakPolarHBondContact CB-O 3.33Å; A155-L236 HydrophobicContact CB-CD1 3.57Å; A155-L236 HydrophobicContact CB-CG 4.42Å
156	Y	88.4	Confident	89.8	Confident	96 Å²	96	63.7 Å²	63.7	38%	0.376	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	166.4	-179.2	73.9	-85	0	0	0	111.8	E184 G185 D186 C235	Y156-E184 HydrophobicContact CE2-CG 4.46Å; Y156-E184 PolarHBondContact OH-OE1 3.05Å; Y156-G185 WeakPolarHBondContact O-CA 3.46Å; Y156-D186 HydrophobicContact CD1-CB 3.91Å; Y156-D186 HydrophobicContact CE1-CB 3.38Å; Y156-D186 PolarHBondContact N-O 2.83Å; Y156-D186 PolarHBondContact O-N 2.87Å; Y156-C235 PolarHBondContact O-SG 2.78Å
157	L	89.5	Confident	89.7	Confident	10 Å²	10	63.8 Å²	63.8	5%	0.052	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	127.5	172.1	-176.8	64.2	0	0	0	107.9	P183 E184 P189 C235 E239 R241	L157-P183 HydrophobicContact CD1-CB 3.9Å; L157-P183 HydrophobicContact CD1-CG 4.25Å; L157-P183 HydrophobicContact CG-CB 4.33Å; L157-E184 WeakPolarHBondContact CA-O 3.41Å; L157-P189 HydrophobicContact CD1-CB 3.82Å; L157-P189 HydrophobicContact CD1-CG 3.95Å; L157-C235 HydrophobicContact CB-CB 3.71Å; L157-C235 HydrophobicContact CD1-CB 4.22Å; L157-C235 HydrophobicContact CD2-CB 3.95Å; L157-C235 HydrophobicContact CG-CB 4.19Å; L157-E239 HydrophobicContact CB-CB 4.4Å; L157-E239 HydrophobicContact CD2-CB 4.25Å; L157-R241 HydrophobicContact CD2-CG 3.94Å; L157-R241 HydrophobicContact CG-CG 4.18Å; L157-R241 PolarHBondContact O-NH2 3.08Å
158	D	88.3	Confident	89	Confident	83 Å²	83	65.4 Å²	65.4	44%	0.444	33%	0.331	S	S	.	.			trans	-67.6	159	-175.6	-120.3	39.2	0	0	0	112.5	P183 E184 R241	D158-P183 HydrophobicContact CB-CB 3.9Å; D158-P183 WeakPolarHBondContact O-CB 3.5Å; D158-E184 HydrophobicContact CB-CB 4.45Å; D158-E184 PolarHBondContact N-O 3.29Å; D158-R241 WeakPolarHBondContact O-CD 3.3Å; D158-R241 WeakPolarHBondContact O-CG 3.37Å; D158-R241 PolarHBondContact O-NE 3.46Å
159	E	85.7	Confident	88.7	Confident	171 Å²	171	66.1 Å²	66.1	80%	0.799	34%	0.335	S	S	*	.	S	Bend	trans	-74	-31.4	-178.6	-66.4	-166.2	153	0	0	112.8
160	K	82.3	Confident	88.4	Confident	162 Å²	162	63.5 Å²	63.5	70%	0.704	32%	0.318	S	S	*	.	S	Bend	trans	-103.7	140.2	-174.6	-60.4	177.8	-175.7	174.9	0	110.5	P183	K160-P183 VanDerWaalsContact O-CA 3.24Å; K160-P183 WeakPolarHBondContact O-CA 2.98Å; K160-P183 WeakPolarHBondContact O-CB 3.35Å; K160-P183 WeakPolarHBondContact O-CG 3.18Å
161	F	88.2	Confident	87.8	Confident	19 Å²	19	64.2 Å²	64.2	8%	0.083	32%	0.324	C	S	.	.			trans	-63.7	151.1	160.9	-77.5	-105.6	0	0	0	109.7	E164 P183 C231 A233 R241 R242 A243	F161-E164 HydrophobicContact CB-CG 3.63Å; F161-E164 HydrophobicContact CD2-CG 4.21Å; F161-E164 HydrophobicContact CG-CG 4Å; F161-P183 HydrophobicContact CD2-CG 4.31Å; F161-P183 HydrophobicContact CG-CG 4.34Å; F161-C231 HydrophobicContact CE1-CB 4.47Å; F161-A233 HydrophobicContact CE1-CB 4.3Å; F161-A233 HydrophobicContact CZ-CB 4.37Å; F161-R241 HydrophobicContact CD2-CB 4.33Å; F161-R241 HydrophobicContact CE2-CB 3.58Å; F161-R241 HydrophobicContact CZ-CB 4.06Å; F161-R242 VanDerWaalsContact CE2-C 3.41Å; F161-A243 HydrophobicContact CD1-CB 4.31Å; F161-A243 HydrophobicContact CD2-CB 3.81Å; F161-A243 HydrophobicContact CE1-CB 4.21Å; F161-A243 HydrophobicContact CE2-CB 3.69Å; F161-A243 HydrophobicContact CG-CB 4.14Å; F161-A243 HydrophobicContact CZ-CB 3.91Å
162	Q	87.5	Confident	87.3	Confident	97 Å²	97	63 Å²	63	45%	0.453	32%	0.32	S	S	.	.	S	Bend	trans	-66.2	-56.3	165	-70.3	177.1	79.5	0	0	108.4	L181 P182 H716	Q162-L181 HydrophobicContact CB-CB 4.25Å; Q162-L181 PolarHBondContact N-O 2.79Å; Q162-P182 WeakPolarHBondContact CB-O 3.46Å; Q162-P182 WeakPolarHBondContact CG-O 3.25Å; Q162-P182 PolarHBondContact N-O 2.97Å; Q162-P182 PolarHBondContact NE2-O 2.84Å; Q162-H716 WeakPolarHBondContact CB-NE2 2.91Å; Q162-H716 PolarHBondContact O-NE2 3.11Å
163	L	86.4	Confident	86.8	Confident	33 Å²	33	66.7 Å²	66.7	17%	0.173	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-131.8	118.6	172.2	-179.8	61.8	0	0	0	111.9	T179 L181 H716 L718	L163-T179 HydrophobicContact CD2-CG2 3.57Å; L163-L181 HydrophobicContact CB-CB 4.06Å; L163-L181 HydrophobicContact CB-CD1 4.31Å; L163-L181 HydrophobicContact CD2-CD1 4.39Å; L163-L181 PolarHBondContact N-O 2.93Å; L163-L181 VanDerWaalsContact N-O 3.09Å; L163-L181 PolarHBondContact O-N 3.22Å; L163-H716 VanDerWaalsContact CB-CE1 3.41Å; L163-H716 WeakPolarHBondContact CB-CE1 3.02Å; L163-L718 HydrophobicContact CD2-CD2 3.64Å
164	E	89	Confident	86.4	Confident	108 Å²	108	69.6 Å²	69.6	51%	0.505	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-79.8	147.2	170.7	-64.2	-161.9	-175.8	0	0	111.7	F161 V166 A243	F161-E164 HydrophobicContact CB-CG 3.63Å; F161-E164 HydrophobicContact CD2-CG 4.21Å; F161-E164 HydrophobicContact CG-CG 4Å; E164-V166 PolarHBondContact O-N 2.94Å; E164-A243 HydrophobicContact CB-CB 3.87Å; E164-A243 HydrophobicContact CG-CB 3.55Å
165	P	90	Very high	86.4	Confident	8 Å²	8	71.4 Å²	71.4	5%	0.052	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-71.9	130.5	179.1	31.2	-36	0	0	0	112	L178 T179 W193 C231 A243 A245	P165-L178 HydrophobicContact CB-CB 4.43Å; P165-T179 VanDerWaalsContact CA-O 3.26Å; P165-T179 WeakPolarHBondContact CA-O 3.43Å; P165-T179 WeakPolarHBondContact CB-O 3.47Å; P165-W193 HydrophobicContact CB-CH2 3.7Å; P165-W193 HydrophobicContact CB-CZ3 4.14Å; P165-W193 HydrophobicContact CG-CH2 4.03Å; P165-W193 HydrophobicContact CG-CZ3 4.14Å; P165-C231 HydrophobicContact CG-CB 4.16Å; P165-A243 HydrophobicContact CG-CB 4.47Å; P165-A245 HydrophobicContact CB-CB 3.93Å; P165-A245 HydrophobicContact CG-CB 4.07Å
166	V	85.1	Confident	86.3	Confident	104 Å²	104	71.1 Å²	71.1	63%	0.63	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-73.9	143.9	-178.9	-175.3	0	0	0	0	110.7	E164 T168 A245	E164-V166 PolarHBondContact O-N 2.94Å; V166-T168 PolarHBondContact O-OG1 3.3Å; V166-A245 WeakPolarHBondContact O-CB 3.04Å
167	S	89.7	Confident	86.4	Confident	69 Å²	69	68.4 Å²	68.4	48%	0.483	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-80	135.2	173.6	-62.6	0	0	0	0	111	R246	S167-R246 CarbonylContact C-O 3.46Å; S167-R246 WeakPolarHBondContact CA-O 3.4Å; S167-R246 WeakPolarHBondContact CB-O 3.44Å; S167-R246 PolarHBondContact OG-N 3.06Å
168	T	81.4	Confident	86.5	Confident	40 Å²	40	68 Å²	68	25%	0.245	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124.4	-163.3	-56.4	0	0	0	0	112.2	V166 L170 L176 R246 V247 N248	V166-T168 PolarHBondContact O-OG1 3.3Å; T168-L170 HydrophobicContact CG2-CB 4.39Å; T168-L176 HydrophobicContact CG2-CD1 3.95Å; T168-R246 PolarHBondContact N-O 3.07Å; T168-V247 WeakPolarHBondContact O-CA 3.25Å; T168-N248 PolarHBondContact O-N 2.86Å
169	D	85.5	Confident	86.5	Confident	117 Å²	117	65.1 Å²	65.1	63%	0.626	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.4	169	-64.8	-45.9	0	0	0	109.7	N248	D169-N248 WeakPolarHBondContact OD1-CB 3.5Å; D169-N248 PolarHBondContact OD1-ND2 2.75Å
170	L	85.4	Confident	86.6	Confident	31 Å²	31	57 Å²	57	16%	0.162	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	147.2	-167.7	-168.4	57.3	0	0	0	113.4	T168 K174 R175 L176 T221 N248 I249 F250	T168-L170 HydrophobicContact CG2-CB 4.39Å; L170-K174 HydrophobicContact CD1-CB 3.66Å; L170-K174 HydrophobicContact CD1-CG 3.97Å; L170-K174 HydrophobicContact CD2-CB 3.98Å; L170-K174 HydrophobicContact CG-CB 3.75Å; L170-K174 HydrophobicContact CG-CG 4.36Å; L170-R175 WeakPolarHBondContact CD2-O 3.28Å; L170-L176 HydrophobicContact CD2-CB 3.89Å; L170-L176 HydrophobicContact CD2-CD1 4.02Å; L170-T221 HydrophobicContact CD2-CG2 3.86Å; L170-N248 PolarHBondContact N-O 2.73Å; L170-I249 HydrophobicContact CB-CG1 4.33Å; L170-I249 CarbonylContact O-C 3.59Å; L170-I249 WeakPolarHBondContact O-CA 3.35Å; L170-F250 WeakPolarHBondContact O-CD1 3.25Å; L170-F250 WeakPolarHBondContact O-CE1 3.39Å; L170-F250 PolarHBondContact O-N 2.9Å
171	A	80.1	Confident	87	Confident	16 Å²	16	51.4 Å²	51.4	13%	0.132	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	154.3	173.5	0	0	0	0	0	111.5	K174 T221 F250	A171-K174 HydrophobicContact CB-CG 4.03Å; A171-T221 PolarHBondContact O-OG1 2.87Å; A171-F250 HydrophobicContact CB-CD2 4.22Å; A171-F250 HydrophobicContact CB-CE2 3.62Å; A171-F250 HydrophobicContact CB-CZ 3.85Å
172	V	85.4	Confident	87.2	Confident	38 Å²	38	51.5 Å²	51.5	23%	0.23	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	147.2	164.3	166.3	0	0	0	0	110.9	T221 T223 I249 F250	V172-T221 WeakPolarHBondContact CA-O 3.2Å; V172-T223 HydrophobicContact CG2-CG2 3.72Å; V172-I249 HydrophobicContact CB-CG2 4.44Å; V172-I249 HydrophobicContact CG2-CG2 3.59Å; V172-F250 WeakPolarHBondContact CG2-O 3.12Å; V172-F250 PolarHBondContact N-O 2.89Å
173	S	82.7	Confident	87.3	Confident	81 Å²	81	46.9 Å²	46.9	57%	0.566	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	42.5	-176.8	-55.1	0	0	0	0	113.5	T221	S173-T221 PolarHBondContact N-O 2.82Å; S173-T221 PolarHBondContact N-OG1 3.21Å
174	K	84.1	Confident	87.4	Confident	118 Å²	118	50.9 Å²	50.9	51%	0.513	28%	0.276	S	S	.	.			trans	-118.1	164.7	166.4	-68.6	-67	-174.8	175.7	0	110.1	L170 A171 T221	L170-K174 HydrophobicContact CD1-CB 3.66Å; L170-K174 HydrophobicContact CD1-CG 3.97Å; L170-K174 HydrophobicContact CD2-CB 3.98Å; L170-K174 HydrophobicContact CG-CB 3.75Å; L170-K174 HydrophobicContact CG-CG 4.36Å; A171-K174 HydrophobicContact CB-CG 4.03Å; K174-T221 PolarHBondContact N-OG1 3.49Å; K174-T221 WeakPolarHBondContact O-CG2 3.4Å; K174-T221 PolarHBondContact O-N 3.08Å; K174-T221 PolarHBondContact O-OG1 2.98Å
175	R	88.3	Confident	87.4	Confident	90 Å²	90	46.2 Å²	46.2	34%	0.34	26%	0.257	S	S	.	.			trans	-83.8	133.9	171	-166.3	163.8	-164.1	-116.3	9.8	109.5	L170 V177 I218 E219 D721	L170-R175 WeakPolarHBondContact CD2-O 3.28Å; R175-V177 HydrophobicContact CG-CG2 4.5Å; R175-I218 CarbonylContact C-O 3.56Å; R175-I218 WeakPolarHBondContact CA-O 3.28Å; R175-E219 WeakPolarHBondContact CD-OE2 3.34Å; R175-E219 IonicContact CZ-OE1 2.72Å; R175-E219 VanDerWaalsContact CZ-OE1 3.27Å; R175-E219 IonicContact CZ-OE2 3.97Å; R175-E219 IonicContact NE-OE1 3.79Å; R175-E219 PolarHBondContact NE-OE1 3.18Å; R175-E219 IonicContact NE-OE2 3.24Å; R175-E219 PolarHBondContact NE-OE2 3.25Å; R175-E219 IonicContact NH2-OE1 3.84Å; R175-E219 PolarHBondContact NH2-OE1 3.26Å; R175-E219 IonicContact NH2-OE2 2.63Å; R175-D721 VanDerWaalsContact CD-OD2 3.27Å; R175-D721 WeakPolarHBondContact CD-OD2 3.45Å; R175-D721 IonicContact CZ-OD2 3.59Å; R175-D721 IonicContact NE-OD2 3.64Å; R175-D721 IonicContact NH1-OD1 2.87Å; R175-D721 PolarHBondContact NH1-OD1 3.04Å; R175-D721 IonicContact NH1-OD2 3.2Å; R175-D721 PolarHBondContact NH1-OD2 2.84Å
176	L	89	Confident	87.4	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.8	171.9	177.7	70.4	0	0	0	108.5	T168 L170 L178 I217 I218 T221 V247	T168-L176 HydrophobicContact CG2-CD1 3.95Å; L170-L176 HydrophobicContact CD2-CB 3.89Å; L170-L176 HydrophobicContact CD2-CD1 4.02Å; L176-L178 HydrophobicContact CD1-CD2 4.02Å; L176-L178 HydrophobicContact CD1-CG 4.43Å; L176-L178 HydrophobicContact CD2-CG 4.39Å; L176-L178 HydrophobicContact CG-CD2 4.44Å; L176-L178 HydrophobicContact CG-CG 4.3Å; L176-I217 CarbonylContact O-C 3.43Å; L176-I217 WeakPolarHBondContact O-CA 3.33Å; L176-I218 HydrophobicContact CB-CB 4.29Å; L176-I218 HydrophobicContact CD2-CD1 4.09Å; L176-I218 HydrophobicContact CD2-CG1 4.46Å; L176-I218 PolarHBondContact N-O 3.17Å; L176-I218 PolarHBondContact O-N 3.49Å; L176-T221 HydrophobicContact CB-CG2 3.78Å; L176-V247 HydrophobicContact CD2-CG1 3.86Å; L176-V247 HydrophobicContact CD2-CG2 4.12Å
177	V	90.8	Very high	87.6	Confident	39 Å²	39	44.2 Å²	44.2	24%	0.236	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.9	168.9	-177.8	0	0	0	0	107.6	R175 H215 L216 I217	R175-V177 HydrophobicContact CG-CG2 4.5Å; V177-H215 HydrophobicContact CG1-CB 4.49Å; V177-L216 CarbonylContact C-O 3.53Å; V177-L216 WeakPolarHBondContact CA-O 3.32Å; V177-I217 HydrophobicContact CG1-CG1 4.45Å; V177-I217 HydrophobicContact CG2-CG1 4.41Å; V177-I217 HydrophobicContact CG2-CG2 4.49Å
178	L	91	Very high	87.5	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	98.6	169.9	-60	-178.5	0	0	0	108.5	P165 L176 W193 H215 L216 Y229 A245 V247	P165-L178 HydrophobicContact CB-CB 4.43Å; L176-L178 HydrophobicContact CD1-CD2 4.02Å; L176-L178 HydrophobicContact CD1-CG 4.43Å; L176-L178 HydrophobicContact CD2-CG 4.39Å; L176-L178 HydrophobicContact CG-CD2 4.44Å; L176-L178 HydrophobicContact CG-CG 4.3Å; L178-W193 HydrophobicContact CB-CH2 3.54Å; L178-W193 HydrophobicContact CB-CZ2 4.26Å; L178-W193 HydrophobicContact CB-CZ3 4.06Å; L178-W193 HydrophobicContact CD1-CH2 4.36Å; L178-W193 HydrophobicContact CD1-CZ3 4.01Å; L178-W193 WeakPolarHBondContact O-CH2 3.2Å; L178-W193 VanDerWaalsContact O-CZ2 3.24Å; L178-W193 WeakPolarHBondContact O-CZ2 3.46Å; L178-H215 WeakPolarHBondContact O-CA 3.47Å; L178-L216 HydrophobicContact CB-CB 4.36Å; L178-L216 HydrophobicContact CD1-CD2 4.29Å; L178-L216 PolarHBondContact N-O 3.5Å; L178-L216 PolarHBondContact O-N 2.93Å; L178-Y229 VanDerWaalsContact CD1-CB 3.49Å; L178-Y229 HydrophobicContact CD1-CD1 3.92Å; L178-Y229 HydrophobicContact CD1-CD2 4.11Å; L178-Y229 HydrophobicContact CD1-CG 3.57Å; L178-A245 HydrophobicContact CD1-CB 4.29Å; L178-A245 HydrophobicContact CD2-CB 4.35Å; L178-V247 HydrophobicContact CD1-CG2 4.03Å; L178-V247 HydrophobicContact CD2-CG2 4.2Å
179	T	88.4	Confident	88	Confident	23 Å²	23	47.1 Å²	47.1	14%	0.141	25%	0.254	C	S	.	.			trans	-63.8	136.1	171.8	-44.4	0	0	0	0	109.8	L163 P165	L163-T179 HydrophobicContact CD2-CG2 3.57Å; P165-T179 VanDerWaalsContact CA-O 3.26Å; P165-T179 WeakPolarHBondContact CA-O 3.43Å; P165-T179 WeakPolarHBondContact CB-O 3.47Å
180	C	88.6	Confident	88.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.25	C	S	.	.			trans	-146	132.1	168.5	179.4	0	0	0	0	108.6	W193 C231	C180-W193 HydrophobicContact CB-CH2 3.91Å; C180-W193 HydrophobicContact CB-CZ2 3.48Å; C180-W193 VanDerWaalsContact CB-CZ2 3.48Å; C180-C231 HydrophobicContact CB-CB 3.75Å; C180-C231 WeakPolarHBondContact CB-SG 3.45Å; C180-C231 WeakPolarHBondContact SG-CB 3.33Å; C180-C231 CovalentContact SG-SG 2.03Å; C180-C231 PolarHBondContact SG-SG 2.93Å
181	L	90.9	Very high	88.5	Confident	45 Å²	45	46.5 Å²	46.5	24%	0.236	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-127.1	120.9	173.3	-67	164.5	0	0	0	107.9	Q162 L163 H716	Q162-L181 HydrophobicContact CB-CB 4.25Å; Q162-L181 PolarHBondContact N-O 2.79Å; L163-L181 HydrophobicContact CB-CB 4.06Å; L163-L181 HydrophobicContact CB-CD1 4.31Å; L163-L181 HydrophobicContact CD2-CD1 4.39Å; L163-L181 PolarHBondContact N-O 2.93Å; L163-L181 VanDerWaalsContact N-O 3.09Å; L163-L181 PolarHBondContact O-N 3.22Å; L181-H716 WeakPolarHBondContact CD1-CE1 3.09Å; L181-H716 VanDerWaalsContact CD1-ND1 3.32Å; L181-H716 WeakPolarHBondContact CD1-ND1 3.3Å
182	P	91.5	Very high	89.2	Confident	20 Å²	20	47 Å²	47	13%	0.13	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-67.6	168.7	-166.8	30.5	-38.2	0	0	0	112.6	Q162 P189 V191 A233	Q162-P182 WeakPolarHBondContact CB-O 3.46Å; Q162-P182 WeakPolarHBondContact CG-O 3.25Å; Q162-P182 PolarHBondContact N-O 2.97Å; Q162-P182 PolarHBondContact NE2-O 2.84Å; P182-P189 HydrophobicContact CB-CG 3.81Å; P182-P189 HydrophobicContact CG-CG 4.01Å; P182-V191 HydrophobicContact CB-CG2 3.73Å; P182-V191 HydrophobicContact CG-CG2 3.65Å; P182-A233 HydrophobicContact CB-CB 3.69Å
183	P	90.8	Very high	89.7	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-53.3	154.6	161.1	-17.6	28.9	0	0	0	111.7	L157 D158 K160 F161 A233 R241	L157-P183 HydrophobicContact CD1-CB 3.9Å; L157-P183 HydrophobicContact CD1-CG 4.25Å; L157-P183 HydrophobicContact CG-CB 4.33Å; D158-P183 HydrophobicContact CB-CB 3.9Å; D158-P183 WeakPolarHBondContact O-CB 3.5Å; K160-P183 VanDerWaalsContact O-CA 3.24Å; K160-P183 WeakPolarHBondContact O-CA 2.98Å; K160-P183 WeakPolarHBondContact O-CB 3.35Å; K160-P183 WeakPolarHBondContact O-CG 3.18Å; F161-P183 HydrophobicContact CD2-CG 4.31Å; F161-P183 HydrophobicContact CG-CG 4.34Å; P183-A233 HydrophobicContact CG-CB 4.35Å; P183-R241 HydrophobicContact CG-CB 3.83Å; P183-R241 HydrophobicContact CG-CG 3.61Å
184	E	88.3	Confident	90.3	Very high	116 Å²	116	42.3 Å²	42.3	54%	0.542	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-64	149.6	167.2	-166.9	172.9	154.1	0	0	110.4	Y156 L157 D158	Y156-E184 HydrophobicContact CE2-CG 4.46Å; Y156-E184 PolarHBondContact OH-OE1 3.05Å; L157-E184 WeakPolarHBondContact CA-O 3.41Å; D158-E184 HydrophobicContact CB-CB 4.45Å; D158-E184 PolarHBondContact N-O 3.29Å
185	G	88.7	Confident	90.8	Very high	11 Å²	11	37.2 Å²	37.2	11%	0.113	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	149.2	179.5	0	0	0	0	0	112.3	Y156 P187	Y156-G185 WeakPolarHBondContact O-CA 3.46Å; G185-P187 CarbonylContact C-O 3.6Å; G185-P187 CarbonylContact O-C 3.59Å
186	D	88.7	Confident	91.1	Very high	40 Å²	40	37.1 Å²	37.1	21%	0.214	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	115.1	175.9	-169.3	3.7	0	0	0	107.9	Y51 K153 A155 Y156	Y51-D186 WeakPolarHBondContact CE1-OD1 3.21Å; Y51-D186 PolarHBondContact OH-OD1 2.91Å; K153-D186 VanDerWaalsContact CD-OD2 3.25Å; K153-D186 WeakPolarHBondContact CD-OD2 3.43Å; K153-D186 WeakPolarHBondContact CE-OD2 3.46Å; K153-D186 IonicContact NZ-OD1 2.73Å; K153-D186 IonicContact NZ-OD2 3.34Å; K153-D186 PolarHBondContact NZ-OD2 3Å; A155-D186 WeakPolarHBondContact CA-O 2.99Å; A155-D186 VanDerWaalsContact CB-O 3.23Å; A155-D186 WeakPolarHBondContact CB-O 3.33Å; Y156-D186 HydrophobicContact CD1-CB 3.91Å; Y156-D186 HydrophobicContact CE1-CB 3.38Å; Y156-D186 PolarHBondContact N-O 2.83Å; Y156-D186 PolarHBondContact O-N 2.87Å
187	P	90.6	Very high	91.1	Very high	30 Å²	30	39.7 Å²	39.7	20%	0.195	22%	0.224	C	C	.	.	S	Bend	cis	-71.5	165.3	-1.5	33.2	-35.6	0	0	0	112.8	Y51 G185 L236	Y51-P187 HydrophobicContact CD2-CG 4.14Å; Y51-P187 HydrophobicContact CE1-CB 4.47Å; Y51-P187 HydrophobicContact CE1-CG 4.5Å; Y51-P187 HydrophobicContact CE2-CB 3.79Å; Y51-P187 HydrophobicContact CE2-CG 3.86Å; G185-P187 CarbonylContact C-O 3.6Å; G185-P187 CarbonylContact O-C 3.59Å; P187-L236 HydrophobicContact CG-CD2 3.92Å; P187-L236 HydrophobicContact CG-CG 4.34Å
188	D	87.7	Confident	91.2	Very high	152 Å²	152	42.9 Å²	42.9	81%	0.813	24%	0.235	S	C	*	.			trans	-45.8	126.6	174.3	-57.2	-63.8	0	0	0	111.7
189	P	91	Very high	91.3	Very high	18 Å²	18	47.4 Å²	47.4	12%	0.117	25%	0.252	C	S	.	.			trans	-73.5	139.5	-173.4	26.5	-33.7	0	0	0	113.3	L157 P182 V191 A233 A234	L157-P189 HydrophobicContact CD1-CB 3.82Å; L157-P189 HydrophobicContact CD1-CG 3.95Å; P182-P189 HydrophobicContact CB-CG 3.81Å; P182-P189 HydrophobicContact CG-CG 4.01Å; P189-V191 WeakPolarHBondContact O-CG2 2.98Å; P189-V191 PolarHBondContact O-N 2.89Å; P189-V191 VanDerWaalsContact O-N 3.17Å; P189-A233 HydrophobicContact CB-CB 4.22Å; P189-A233 HydrophobicContact CG-CB 4.49Å; P189-A234 CarbonylContact C-O 3.47Å; P189-A234 WeakPolarHBondContact CA-O 3.32Å
190	E	90.6	Very high	91.5	Very high	117 Å²	117	46.5 Å²	46.5	55%	0.547	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	113.9	170.1	-172.7	-161.1	146.2	0	0	109	R199 A233 A234	E190-R199 IonicContact OE1-NH2 3.8Å; E190-A233 CarbonylContact O-C 3.55Å; E190-A234 PolarHBondContact N-O 3.31Å; E190-A234 PolarHBondContact O-N 3.13Å
191	V	92.3	Very high	91.4	Very high	17 Å²	17	49.3 Å²	49.3	10%	0.103	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	136.2	178.4	-167.5	0	0	0	0	110.3	P182 P189 N214 V232	P182-V191 HydrophobicContact CB-CG2 3.73Å; P182-V191 HydrophobicContact CG-CG2 3.65Å; P189-V191 WeakPolarHBondContact O-CG2 2.98Å; P189-V191 PolarHBondContact O-N 2.89Å; P189-V191 VanDerWaalsContact O-N 3.17Å; V191-N214 HydrophobicContact CB-CB 3.81Å; V191-N214 HydrophobicContact CG1-CB 3.74Å; V191-N214 HydrophobicContact CG2-CB 4.38Å; V191-V232 CarbonylContact C-O 3.55Å; V191-V232 WeakPolarHBondContact CA-O 3.4Å
192	Y	93.5	Very high	90.8	Very high	28 Å²	28	52.9 Å²	52.9	11%	0.11	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.3	175.9	63.3	-95.4	0	0	0	114.6	L194 V232 A234 K240	Y192-L194 HydrophobicContact CD2-CD2 4.17Å; Y192-L194 HydrophobicContact CE2-CD2 4Å; Y192-V232 HydrophobicContact CD1-CB 4.37Å; Y192-V232 HydrophobicContact CD2-CB 3.89Å; Y192-V232 HydrophobicContact CD2-CG2 4.2Å; Y192-V232 HydrophobicContact CE1-CB 4.15Å; Y192-V232 HydrophobicContact CE1-CG1 3.89Å; Y192-V232 HydrophobicContact CE2-CB 3.65Å; Y192-V232 HydrophobicContact CE2-CG1 3.86Å; Y192-V232 HydrophobicContact CE2-CG2 3.87Å; Y192-V232 HydrophobicContact CG-CB 4.26Å; Y192-V232 PolarHBondContact N-O 3.15Å; Y192-V232 PolarHBondContact O-N 2.88Å; Y192-A234 HydrophobicContact CE1-CB 4.15Å; Y192-K240 PolarHBondContact OH-NZ 3.06Å
193	W	95.7	Very high	90.2	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	146.6	-177.8	-67.9	87	0	0	0	113.5	P165 L178 C180 V200 I210 N214 L216 T230 C231	P165-W193 HydrophobicContact CB-CH2 3.7Å; P165-W193 HydrophobicContact CB-CZ3 4.14Å; P165-W193 HydrophobicContact CG-CH2 4.03Å; P165-W193 HydrophobicContact CG-CZ3 4.14Å; L178-W193 HydrophobicContact CB-CH2 3.54Å; L178-W193 HydrophobicContact CB-CZ2 4.26Å; L178-W193 HydrophobicContact CB-CZ3 4.06Å; L178-W193 HydrophobicContact CD1-CH2 4.36Å; L178-W193 HydrophobicContact CD1-CZ3 4.01Å; L178-W193 WeakPolarHBondContact O-CH2 3.2Å; L178-W193 VanDerWaalsContact O-CZ2 3.24Å; L178-W193 WeakPolarHBondContact O-CZ2 3.46Å; C180-W193 HydrophobicContact CB-CH2 3.91Å; C180-W193 HydrophobicContact CB-CZ2 3.48Å; C180-W193 VanDerWaalsContact CB-CZ2 3.48Å; W193-V200 HydrophobicContact CB-CB 3.96Å; W193-V200 HydrophobicContact CB-CG2 3.75Å; W193-V200 PolarHBondContact O-N 2.89Å; W193-I210 HydrophobicContact CB-CD1 4.25Å; W193-I210 HydrophobicContact CG-CD1 4.36Å; W193-N214 PolarHBondContact NE1-O 3.43Å; W193-L216 HydrophobicContact CB-CD1 3.76Å; W193-L216 HydrophobicContact CD2-CB 3.79Å; W193-L216 HydrophobicContact CD2-CD1 3.72Å; W193-L216 HydrophobicContact CD2-CG 4.44Å; W193-L216 HydrophobicContact CE3-CB 4.26Å; W193-L216 HydrophobicContact CE3-CD1 3.92Å; W193-L216 HydrophobicContact CG-CB 4.12Å; W193-L216 HydrophobicContact CG-CD1 3.66Å; W193-L216 HydrophobicContact CH2-CB 4.3Å; W193-L216 HydrophobicContact CZ2-CB 3.88Å; W193-T230 CarbonylContact C-O 3.53Å; W193-T230 WeakPolarHBondContact CA-O 3.35Å; W193-C231 HydrophobicContact CD2-CB 4.32Å; W193-C231 HydrophobicContact CE3-CB 4.12Å; W193-C231 HydrophobicContact CH2-CB 3.96Å; W193-C231 HydrophobicContact CZ2-CB 4.11Å; W193-C231 HydrophobicContact CZ3-CB 3.94Å
194	L	96.1	Very high	89.9	Confident	19 Å²	19	62.5 Å²	62.5	10%	0.099	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.9	163.6	-47.3	175.5	0	0	0	108.9	Y192 K198 R199 Y229 T230 V232	Y192-L194 HydrophobicContact CD2-CD2 4.17Å; Y192-L194 HydrophobicContact CE2-CD2 4Å; L194-K198 CarbonylContact C-O 3.59Å; L194-K198 WeakPolarHBondContact CA-O 3.3Å; L194-R199 HydrophobicContact CD2-CB 4.28Å; L194-Y229 CarbonylContact O-C 3.57Å; L194-Y229 WeakPolarHBondContact O-CA 3.41Å; L194-T230 PolarHBondContact N-O 2.65Å; L194-T230 PolarHBondContact O-N 3.18Å; L194-V232 HydrophobicContact CD1-CG2 4.04Å; L194-V232 HydrophobicContact CG-CG2 4.08Å
195	K	95.1	Very high	90	Very high	12 Å²	12	58.5 Å²	58.5	5%	0.052	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.1	162.3	-173.4	-175.3	-169.8	-70.4	0	108.3	G197 K198 V200 F205 I208 S224 D225 S226 Y229	K195-G197 PolarHBondContact O-N 3.22Å; K195-G197 VanDerWaalsContact O-N 3.12Å; K195-K198 PolarHBondContact N-O 2.99Å; K195-K198 PolarHBondContact O-N 3.18Å; K195-V200 HydrophobicContact CB-CG2 4.24Å; K195-F205 HydrophobicContact CB-CE1 4.26Å; K195-F205 HydrophobicContact CB-CE2 4.24Å; K195-F205 HydrophobicContact CB-CZ 3.9Å; K195-F205 HydrophobicContact CD-CD1 4.26Å; K195-F205 HydrophobicContact CD-CE1 3.81Å; K195-F205 HydrophobicContact CD-CZ 4.31Å; K195-F205 HydrophobicContact CG-CE1 4.46Å; K195-F205 HydrophobicContact CG-CZ 4.48Å; K195-I208 HydrophobicContact CD-CD1 4.34Å; K195-S224 PolarHBondContact NZ-O 3.31Å; K195-D225 WeakPolarHBondContact CE-O 3.37Å; K195-S226 PolarHBondContact NZ-O 3.47Å; K195-Y229 HydrophobicContact CB-CD1 4.35Å; K195-Y229 HydrophobicContact CB-CE1 4.13Å; K195-Y229 HydrophobicContact CD-CE1 4.03Å; K195-Y229 HydrophobicContact CD-CE2 4.25Å; K195-Y229 WeakPolarHBondContact CD-OH 3.3Å; K195-Y229 WeakPolarHBondContact CE-OH 3.34Å; K195-Y229 HydrophobicContact CG-CD1 4.38Å; K195-Y229 HydrophobicContact CG-CE1 3.97Å; K195-Y229 HydrophobicContact CG-CE2 4.18Å
196	D	93	Very high	89.8	Confident	87 Å²	87	63 Å²	63	47%	0.465	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	37.6	180	-56.8	-55	0	0	0	112.9	K198 G227 N228	D196-K198 VanDerWaalsContact C-N 3.3Å; D196-K198 PolarHBondContact O-N 3.28Å; D196-G227 WeakPolarHBondContact OD1-CA 3.42Å; D196-N228 PolarHBondContact N-O 3.07Å; D196-N228 PolarHBondContact OD1-N 3.31Å
197	G	90	Very high	89.9	Confident	56 Å²	56	65 Å²	65	58%	0.577	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-17.3	-177.9	0	0	0	0	0	115.7	K195	K195-G197 PolarHBondContact O-N 3.22Å; K195-G197 VanDerWaalsContact O-N 3.12Å
198	K	93	Very high	89.9	Confident	106 Å²	106	64 Å²	64	46%	0.461	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	136.6	176.7	-171.7	-176.3	174.4	-159.1	0	110.8	L194 K195 D196 V200 S204 F205	L194-K198 CarbonylContact C-O 3.59Å; L194-K198 WeakPolarHBondContact CA-O 3.3Å; K195-K198 PolarHBondContact N-O 2.99Å; K195-K198 PolarHBondContact O-N 3.18Å; D196-K198 VanDerWaalsContact C-N 3.3Å; D196-K198 PolarHBondContact O-N 3.28Å; K198-V200 PolarHBondContact O-N 2.79Å; K198-S204 WeakPolarHBondContact CE-OG 3.48Å; K198-S204 VanDerWaalsContact NZ-CB 3.26Å; K198-S204 PolarHBondContact NZ-OG 3.01Å; K198-S204 VanDerWaalsContact NZ-OG 3.15Å; K198-F205 HydrophobicContact CB-CE2 4.15Å; K198-F205 HydrophobicContact CB-CZ 4.21Å; K198-F205 HydrophobicContact CD-CE2 3.8Å; K198-F205 HydrophobicContact CD-CZ 3.87Å; K198-F205 HydrophobicContact CG-CE2 4.02Å; K198-F205 HydrophobicContact CG-CZ 4.36Å
199	R	93	Very high	90	Very high	98 Å²	98	60.6 Å²	60.6	37%	0.37	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	132.6	175.8	-172.6	62.2	158.4	80.4	-6.5	110.5	E190 L194	E190-R199 IonicContact OE1-NH2 3.8Å; L194-R199 HydrophobicContact CD2-CB 4.28Å
200	V	92.1	Very high	89.8	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.018	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-76.7	122.5	168.3	-178.5	0	0	0	0	108	W193 K195 K198 F205 I208 I210 L216	W193-V200 HydrophobicContact CB-CB 3.96Å; W193-V200 HydrophobicContact CB-CG2 3.75Å; W193-V200 PolarHBondContact O-N 2.89Å; K195-V200 HydrophobicContact CB-CG2 4.24Å; K198-V200 PolarHBondContact O-N 2.79Å; V200-F205 HydrophobicContact CG2-CD2 4.39Å; V200-I208 HydrophobicContact CG1-CB 4.21Å; V200-I208 HydrophobicContact CG1-CG2 3.82Å; V200-I210 HydrophobicContact CB-CD1 4.3Å; V200-I210 HydrophobicContact CG1-CD1 4Å; V200-I210 HydrophobicContact CG1-CG1 4.47Å; V200-L216 HydrophobicContact CG2-CD1 4.2Å
201	D	86.1	Confident	89.5	Confident	60 Å²	60	59.3 Å²	59.3	32%	0.321	32%	0.317	S	S	.	.			trans	-155	162.5	175.9	73.5	65.8	0	0	0	109.3	K203 S204 F205	D201-K203 PolarHBondContact O-N 3.25Å; D201-K203 WeakPolarHBondContact OD1-CA 3.5Å; D201-K203 VanDerWaalsContact OD1-CB 3.3Å; D201-K203 WeakPolarHBondContact OD1-CB 3.16Å; D201-K203 PolarHBondContact OD1-N 2.93Å; D201-S204 VanDerWaalsContact CG-OG 3.28Å; D201-S204 PolarHBondContact O-N 3.09Å; D201-S204 VanDerWaalsContact O-N 3.11Å; D201-S204 WeakPolarHBondContact OD1-CB 3.41Å; D201-S204 PolarHBondContact OD1-N 2.89Å; D201-S204 PolarHBondContact OD1-OG 3.34Å; D201-S204 VanDerWaalsContact OD2-CB 3.29Å; D201-S204 WeakPolarHBondContact OD2-CB 3.31Å; D201-S204 PolarHBondContact OD2-OG 3.09Å; D201-F205 PolarHBondContact O-N 3.3Å
202	T	78.9	Confident	88.8	Confident	119 Å²	119	64.5 Å²	64.5	73%	0.73	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.1	-173.8	52.5	0	0	0	0	115.2
203	K	79.9	Confident	88.2	Confident	193 Å²	193	69.3 Å²	69.3	84%	0.839	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-30.4	173.2	-55.1	174	-178.4	174.7	0	111.1	D201	D201-K203 PolarHBondContact O-N 3.25Å; D201-K203 WeakPolarHBondContact OD1-CA 3.5Å; D201-K203 VanDerWaalsContact OD1-CB 3.3Å; D201-K203 WeakPolarHBondContact OD1-CB 3.16Å; D201-K203 PolarHBondContact OD1-N 2.93Å
204	S	83	Confident	87.6	Confident	30 Å²	30	71.8 Å²	71.8	21%	0.21	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-36.5	-175.2	-73.7	0	0	0	0	113.9	K198 D201	K198-S204 WeakPolarHBondContact CE-OG 3.48Å; K198-S204 VanDerWaalsContact NZ-CB 3.26Å; K198-S204 PolarHBondContact NZ-OG 3.01Å; K198-S204 VanDerWaalsContact NZ-OG 3.15Å; D201-S204 VanDerWaalsContact CG-OG 3.28Å; D201-S204 PolarHBondContact O-N 3.09Å; D201-S204 VanDerWaalsContact O-N 3.11Å; D201-S204 WeakPolarHBondContact OD1-CB 3.41Å; D201-S204 PolarHBondContact OD1-N 2.89Å; D201-S204 PolarHBondContact OD1-OG 3.34Å; D201-S204 VanDerWaalsContact OD2-CB 3.29Å; D201-S204 WeakPolarHBondContact OD2-CB 3.31Å; D201-S204 PolarHBondContact OD2-OG 3.09Å
205	F	90.4	Very high	87.2	Confident	33 Å²	33	71.6 Å²	71.6	15%	0.145	38%	0.375	C	S	.	.			trans	-148.6	73.2	-176.3	-59.2	-82.6	0	0	0	109.5	K195 K198 V200 D201 H207 I208	K195-F205 HydrophobicContact CB-CE1 4.26Å; K195-F205 HydrophobicContact CB-CE2 4.24Å; K195-F205 HydrophobicContact CB-CZ 3.9Å; K195-F205 HydrophobicContact CD-CD1 4.26Å; K195-F205 HydrophobicContact CD-CE1 3.81Å; K195-F205 HydrophobicContact CD-CZ 4.31Å; K195-F205 HydrophobicContact CG-CE1 4.46Å; K195-F205 HydrophobicContact CG-CZ 4.48Å; K198-F205 HydrophobicContact CB-CE2 4.15Å; K198-F205 HydrophobicContact CB-CZ 4.21Å; K198-F205 HydrophobicContact CD-CE2 3.8Å; K198-F205 HydrophobicContact CD-CZ 3.87Å; K198-F205 HydrophobicContact CG-CE2 4.02Å; K198-F205 HydrophobicContact CG-CZ 4.36Å; V200-F205 HydrophobicContact CG2-CD2 4.39Å; D201-F205 PolarHBondContact O-N 3.3Å; F205-H207 PolarHBondContact O-N 2.92Å; F205-H207 VanDerWaalsContact O-N 3.09Å; F205-I208 HydrophobicContact CB-CB 4.11Å; F205-I208 HydrophobicContact CB-CD1 3.75Å; F205-I208 HydrophobicContact CB-CG1 3.87Å; F205-I208 HydrophobicContact CD1-CD1 4.13Å; F205-I208 HydrophobicContact CG-CD1 4.08Å; F205-I208 PolarHBondContact O-N 3.27Å
206	P	86.2	Confident	87.1	Confident	104 Å²	104	71 Å²	71	68%	0.675	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.2	-165.6	27	-36.5	0	0	0	115.1
207	H	89.2	Confident	87	Confident	82 Å²	82	67.8 Å²	67.8	38%	0.38	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-0.1	178.5	64.3	-63.9	0	0	0	113.6	F205 D225	F205-H207 PolarHBondContact O-N 2.92Å; F205-H207 VanDerWaalsContact O-N 3.09Å; H207-D225 IonicContact CD2-OD1 3.67Å; H207-D225 IonicContact CE1-OD1 3.74Å; H207-D225 IonicContact NE2-OD1 3.63Å; H207-D225 PolarHBondContact NE2-OD1 2.63Å; H207-D225 IonicContact NE2-OD2 2.74Å
208	I	91.5	Very high	87.1	Confident	9 Å²	9	65.2 Å²	65.2	5%	0.046	33%	0.328	C	S	.	.			trans	-101.7	119.3	176	-55	-171.3	0	0	0	108.4	K195 V200 F205 L216 I218 Y229	K195-I208 HydrophobicContact CD-CD1 4.34Å; V200-I208 HydrophobicContact CG1-CB 4.21Å; V200-I208 HydrophobicContact CG1-CG2 3.82Å; F205-I208 HydrophobicContact CB-CB 4.11Å; F205-I208 HydrophobicContact CB-CD1 3.75Å; F205-I208 HydrophobicContact CB-CG1 3.87Å; F205-I208 HydrophobicContact CD1-CD1 4.13Å; F205-I208 HydrophobicContact CG-CD1 4.08Å; F205-I208 PolarHBondContact O-N 3.27Å; I208-L216 HydrophobicContact CG2-CD1 3.69Å; I208-L216 HydrophobicContact CG2-CD2 3.74Å; I208-L216 HydrophobicContact CG2-CG 3.5Å; I208-I218 HydrophobicContact CD1-CD1 3.9Å; I208-I218 HydrophobicContact CG1-CD1 3.86Å; I208-I218 HydrophobicContact CG1-CG1 4.03Å; I208-I218 HydrophobicContact CG2-CG1 4.28Å; I208-Y229 HydrophobicContact CD1-CE1 4.19Å
209	V	89.1	Confident	86.9	Confident	82 Å²	82	64.7 Å²	64.7	50%	0.497	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	145.8	178.8	-178.2	0	0	0	0	109.2	L216 I217	V209-L216 WeakPolarHBondContact O-CA 3.46Å; V209-I217 PolarHBondContact N-O 3.39Å; V209-I217 PolarHBondContact O-N 3.43Å
210	I	88.1	Confident	86.7	Confident	61 Å²	61	65.3 Å²	65.3	31%	0.313	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.3	166.8	-58	163.9	0	0	0	106	W193 V200 H215	W193-I210 HydrophobicContact CB-CD1 4.25Å; W193-I210 HydrophobicContact CG-CD1 4.36Å; V200-I210 HydrophobicContact CB-CD1 4.3Å; V200-I210 HydrophobicContact CG1-CD1 4Å; V200-I210 HydrophobicContact CG1-CG1 4.47Å; I210-H215 WeakPolarHBondContact CA-O 3.24Å
211	N	84.3	Confident	86.5	Confident	46 Å²	46	65.2 Å²	65.2	25%	0.246	34%	0.337	C	S	.	.			trans	-87.5	174.4	-179.9	74.8	-0.8	0	0	0	112.2	Y213 N214 H215 I217	N211-Y213 PolarHBondContact O-N 2.78Å; N211-Y213 VanDerWaalsContact O-N 3.14Å; N211-Y213 WeakPolarHBondContact OD1-CA 3.35Å; N211-Y213 PolarHBondContact OD1-N 2.8Å; N211-Y213 VanDerWaalsContact OD1-N 3.11Å; N211-N214 WeakPolarHBondContact O-CA 3.43Å; N211-N214 PolarHBondContact O-N 3.04Å; N211-N214 PolarHBondContact OD1-N 3.13Å; N211-N214 VanDerWaalsContact OD1-N 3.17Å; N211-H215 PolarHBondContact N-O 2.94Å; N211-H215 VanDerWaalsContact N-O 3.08Å; N211-H215 WeakPolarHBondContact OD1-CB 3.42Å; N211-H215 PolarHBondContact OD1-N 2.65Å; N211-I217 HydrophobicContact CB-CD1 4.27Å
212	D	76.8	Confident	86.7	Confident	127 Å²	127	64.9 Å²	64.9	68%	0.679	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.1	179.4	-64	-19.8	0	0	0	113.4	N214	D212-N214 VanDerWaalsContact C-N 3.28Å
213	Y	80.8	Confident	87.1	Confident	128 Å²	128	62.8 Å²	62.8	50%	0.502	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	9.1	172.8	-55.9	-76.8	0	0	0	113.1	N211 H215	N211-Y213 PolarHBondContact O-N 2.78Å; N211-Y213 VanDerWaalsContact O-N 3.14Å; N211-Y213 WeakPolarHBondContact OD1-CA 3.35Å; N211-Y213 PolarHBondContact OD1-N 2.8Å; N211-Y213 VanDerWaalsContact OD1-N 3.11Å; Y213-H215 PolarHBondContact O-CE1 2.67Å; Y213-H215 VanDerWaalsContact O-CE1 3.22Å; Y213-H215 PolarHBondContact O-N 2.75Å; Y213-H215 PolarHBondContact O-ND1 3.25Å
214	N	83.9	Confident	87.5	Confident	53 Å²	53	57.9 Å²	57.9	28%	0.283	32%	0.315	S	S	.	.			trans	62.5	17.8	-177.8	-51.2	-75.1	0	0	0	115.3	V191 W193 N211 D212	V191-N214 HydrophobicContact CB-CB 3.81Å; V191-N214 HydrophobicContact CG1-CB 3.74Å; V191-N214 HydrophobicContact CG2-CB 4.38Å; W193-N214 PolarHBondContact NE1-O 3.43Å; N211-N214 WeakPolarHBondContact O-CA 3.43Å; N211-N214 PolarHBondContact O-N 3.04Å; N211-N214 PolarHBondContact OD1-N 3.13Å; N211-N214 VanDerWaalsContact OD1-N 3.17Å; D212-N214 VanDerWaalsContact C-N 3.28Å
215	H	86.5	Confident	87.9	Confident	14 Å²	14	56.6 Å²	56.6	7%	0.065	31%	0.306	C	S	.	.			trans	-81.9	141.3	174.7	-52.7	0.4	0	0	0	110	V177 L178 I210 N211 Y213	V177-H215 HydrophobicContact CG1-CB 4.49Å; L178-H215 WeakPolarHBondContact O-CA 3.47Å; I210-H215 WeakPolarHBondContact CA-O 3.24Å; N211-H215 PolarHBondContact N-O 2.94Å; N211-H215 VanDerWaalsContact N-O 3.08Å; N211-H215 WeakPolarHBondContact OD1-CB 3.42Å; N211-H215 PolarHBondContact OD1-N 2.65Å; Y213-H215 PolarHBondContact O-CE1 2.67Å; Y213-H215 VanDerWaalsContact O-CE1 3.22Å; Y213-H215 PolarHBondContact O-N 2.75Å; Y213-H215 PolarHBondContact O-ND1 3.25Å
216	L	92.8	Very high	88	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	127.6	178.9	-179.3	152.5	0	0	0	110.3	V177 L178 W193 V200 I208 V209 I218 Y229	V177-L216 CarbonylContact C-O 3.53Å; V177-L216 WeakPolarHBondContact CA-O 3.32Å; L178-L216 HydrophobicContact CB-CB 4.36Å; L178-L216 HydrophobicContact CD1-CD2 4.29Å; L178-L216 PolarHBondContact N-O 3.5Å; L178-L216 PolarHBondContact O-N 2.93Å; W193-L216 HydrophobicContact CB-CD1 3.76Å; W193-L216 HydrophobicContact CD2-CB 3.79Å; W193-L216 HydrophobicContact CD2-CD1 3.72Å; W193-L216 HydrophobicContact CD2-CG 4.44Å; W193-L216 HydrophobicContact CE3-CB 4.26Å; W193-L216 HydrophobicContact CE3-CD1 3.92Å; W193-L216 HydrophobicContact CG-CB 4.12Å; W193-L216 HydrophobicContact CG-CD1 3.66Å; W193-L216 HydrophobicContact CH2-CB 4.3Å; W193-L216 HydrophobicContact CZ2-CB 3.88Å; V200-L216 HydrophobicContact CG2-CD1 4.2Å; I208-L216 HydrophobicContact CG2-CD1 3.69Å; I208-L216 HydrophobicContact CG2-CD2 3.74Å; I208-L216 HydrophobicContact CG2-CG 3.5Å; V209-L216 WeakPolarHBondContact O-CA 3.46Å; L216-I218 HydrophobicContact CD2-CD1 4.32Å; L216-I218 HydrophobicContact CD2-CG1 4.06Å; L216-Y229 HydrophobicContact CD1-CD1 3.68Å; L216-Y229 HydrophobicContact CD1-CE1 3.88Å; L216-Y229 HydrophobicContact CD2-CD1 4Å; L216-Y229 HydrophobicContact CD2-CE1 3.76Å
217	I	91.2	Very high	88.3	Confident	20 Å²	20	52.8 Å²	52.8	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.6	-173	-54.5	176.6	0	0	0	110	L176 V177 V209 N211 E219	L176-I217 CarbonylContact O-C 3.43Å; L176-I217 WeakPolarHBondContact O-CA 3.33Å; V177-I217 HydrophobicContact CG1-CG1 4.45Å; V177-I217 HydrophobicContact CG2-CG1 4.41Å; V177-I217 HydrophobicContact CG2-CG2 4.49Å; V209-I217 PolarHBondContact N-O 3.39Å; V209-I217 PolarHBondContact O-N 3.43Å; N211-I217 HydrophobicContact CB-CD1 4.27Å; I217-E219 WeakPolarHBondContact CG2-OE1 3.23Å
218	I	93.4	Very high	88.6	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	113.2	168.8	-47.6	-176	0	0	0	107.9	R175 L176 I208 L216 D225 Y229	R175-I218 CarbonylContact C-O 3.56Å; R175-I218 WeakPolarHBondContact CA-O 3.28Å; L176-I218 HydrophobicContact CB-CB 4.29Å; L176-I218 HydrophobicContact CD2-CD1 4.09Å; L176-I218 HydrophobicContact CD2-CG1 4.46Å; L176-I218 PolarHBondContact N-O 3.17Å; L176-I218 PolarHBondContact O-N 3.49Å; I208-I218 HydrophobicContact CD1-CD1 3.9Å; I208-I218 HydrophobicContact CG1-CD1 3.86Å; I208-I218 HydrophobicContact CG1-CG1 4.03Å; I208-I218 HydrophobicContact CG2-CG1 4.28Å; L216-I218 HydrophobicContact CD2-CD1 4.32Å; L216-I218 HydrophobicContact CD2-CG1 4.06Å; I218-D225 HydrophobicContact CD1-CB 4.15Å; I218-Y229 WeakPolarHBondContact CD1-OH 3.41Å
219	E	88.4	Confident	88.7	Confident	94 Å²	94	51.9 Å²	51.9	44%	0.439	29%	0.286	S	S	.	.	S	Bend	trans	-68.5	-37.2	-173.9	-67.9	-61.1	150.1	0	0	113.7	R175 I217	R175-E219 WeakPolarHBondContact CD-OE2 3.34Å; R175-E219 IonicContact CZ-OE1 2.72Å; R175-E219 VanDerWaalsContact CZ-OE1 3.27Å; R175-E219 IonicContact CZ-OE2 3.97Å; R175-E219 IonicContact NE-OE1 3.79Å; R175-E219 PolarHBondContact NE-OE1 3.18Å; R175-E219 IonicContact NE-OE2 3.24Å; R175-E219 PolarHBondContact NE-OE2 3.25Å; R175-E219 IonicContact NH2-OE1 3.84Å; R175-E219 PolarHBondContact NH2-OE1 3.26Å; R175-E219 IonicContact NH2-OE2 2.63Å; I217-E219 WeakPolarHBondContact CG2-OE1 3.23Å
220	N	87.3	Confident	89.1	Confident	111 Å²	111	48.8 Å²	48.8	59%	0.594	27%	0.267	S	S	*	.	S	Bend	trans	-135.6	101.7	178.7	-74	-76.2	0	0	0	109.9
221	T	89.1	Confident	89.4	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.006	25%	0.253	C	S	.	.			trans	-66.3	137.9	-179.4	45.5	0	0	0	0	114.1	L170 A171 V172 S173 K174 L176 I249	L170-T221 HydrophobicContact CD2-CG2 3.86Å; A171-T221 PolarHBondContact O-OG1 2.87Å; V172-T221 WeakPolarHBondContact CA-O 3.2Å; S173-T221 PolarHBondContact N-O 2.82Å; S173-T221 PolarHBondContact N-OG1 3.21Å; K174-T221 PolarHBondContact N-OG1 3.49Å; K174-T221 WeakPolarHBondContact O-CG2 3.4Å; K174-T221 PolarHBondContact O-N 3.08Å; K174-T221 PolarHBondContact O-OG1 2.98Å; L176-T221 HydrophobicContact CB-CG2 3.78Å; T221-I249 HydrophobicContact CG2-CD1 3.62Å; T221-I249 HydrophobicContact CG2-CG1 4.23Å
222	T	90.3	Very high	89.9	Confident	54 Å²	54	43.7 Å²	43.7	33%	0.331	24%	0.241	S	C	.	.			trans	-113.8	160.9	170.8	69.6	0	0	0	0	110.8	S224 D225 I249	T222-S224 PolarHBondContact O-N 3.4Å; T222-S224 PolarHBondContact OG1-OG 2.84Å; T222-D225 WeakPolarHBondContact CB-OD2 3.49Å; T222-D225 PolarHBondContact N-OD2 3.35Å; T222-D225 WeakPolarHBondContact O-CB 3.48Å; T222-D225 PolarHBondContact O-N 2.86Å; T222-D225 VanDerWaalsContact OG1-CG 3.29Å; T222-D225 PolarHBondContact OG1-OD2 2.82Å; T222-I249 VanDerWaalsContact O-CG2 3.29Å; T222-I249 WeakPolarHBondContact O-CG2 3.21Å
223	T	85.9	Confident	90.7	Very high	75 Å²	75	37.7 Å²	37.7	46%	0.46	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-59.6	-30.8	175.7	49.6	0	0	0	0	112.5	V172 D225 S226 P251	V172-T223 HydrophobicContact CG2-CG2 3.72Å; T223-D225 PolarHBondContact O-N 2.92Å; T223-S226 WeakPolarHBondContact O-CB 3.15Å; T223-S226 PolarHBondContact O-N 2.82Å; T223-S226 PolarHBondContact O-OG 2.77Å; T223-P251 HydrophobicContact CG2-CB 4.15Å; T223-P251 HydrophobicContact CG2-CG 4.48Å
224	S	89.4	Confident	91.1	Very high	89 Å²	89	31.8 Å²	31.8	62%	0.622	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-64.3	-16.8	172.5	23.3	0	0	0	0	115.1	K195 T222 S226	K195-S224 PolarHBondContact NZ-O 3.31Å; T222-S224 PolarHBondContact O-N 3.4Å; T222-S224 PolarHBondContact OG1-OG 2.84Å; S224-S226 VanDerWaalsContact C-N 3.29Å
225	D	92.2	Very high	91.1	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.021	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-81.6	-9.5	175	-61.2	-50.8	0	0	0	112.6	K195 H207 I218 T222 T223 G227 Y229 I249	K195-D225 WeakPolarHBondContact CE-O 3.37Å; H207-D225 IonicContact CD2-OD1 3.67Å; H207-D225 IonicContact CE1-OD1 3.74Å; H207-D225 IonicContact NE2-OD1 3.63Å; H207-D225 PolarHBondContact NE2-OD1 2.63Å; H207-D225 IonicContact NE2-OD2 2.74Å; I218-D225 HydrophobicContact CD1-CB 4.15Å; T222-D225 WeakPolarHBondContact CB-OD2 3.49Å; T222-D225 PolarHBondContact N-OD2 3.35Å; T222-D225 WeakPolarHBondContact O-CB 3.48Å; T222-D225 PolarHBondContact O-N 2.86Å; T222-D225 VanDerWaalsContact OG1-CG 3.29Å; T222-D225 PolarHBondContact OG1-OD2 2.82Å; T223-D225 PolarHBondContact O-N 2.92Å; D225-G227 PolarHBondContact O-N 2.96Å; D225-Y229 VanDerWaalsContact O-CE2 3.27Å; D225-Y229 WeakPolarHBondContact O-CE2 3.32Å; D225-Y229 PolarHBondContact O-OH 2.58Å; D225-Y229 VanDerWaalsContact O-OH 3.04Å; D225-I249 HydrophobicContact CB-CD1 3.55Å
226	S	91.7	Very high	90.7	Very high	41 Å²	41	32.3 Å²	32.3	29%	0.287	19%	0.189	S	C	.	.			trans	-57.1	139.9	169.2	-48.3	0	0	0	0	110.8	K195 T223 S224 V247 I249	K195-S226 PolarHBondContact NZ-O 3.47Å; T223-S226 WeakPolarHBondContact O-CB 3.15Å; T223-S226 PolarHBondContact O-N 2.82Å; T223-S226 PolarHBondContact O-OG 2.77Å; S224-S226 VanDerWaalsContact C-N 3.29Å; S226-V247 CarbonylContact C-O 3.55Å; S226-V247 VanDerWaalsContact CA-O 3.23Å; S226-V247 WeakPolarHBondContact CA-O 3.3Å; S226-I249 PolarHBondContact OG-N 2.88Å
227	G	92.4	Very high	89.5	Confident	16 Å²	16	40 Å²	40	17%	0.165	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.6	-174.7	-179.1	0	0	0	0	0	114.5	D196 D225 V247	D196-G227 WeakPolarHBondContact OD1-CA 3.42Å; D225-G227 PolarHBondContact O-N 2.96Å; G227-V247 PolarHBondContact N-O 3Å; G227-V247 PolarHBondContact O-N 2.92Å
228	N	94.5	Very high	88.4	Confident	72 Å²	72	41.7 Å²	41.7	39%	0.385	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	112.7	173.3	-59.4	-83.9	0	0	0	109.5	D196 V244	D196-N228 PolarHBondContact N-O 3.07Å; D196-N228 PolarHBondContact OD1-N 3.31Å; N228-V244 HydrophobicContact CB-CG1 4.25Å
229	Y	95.5	Very high	87.6	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120	175.4	-74.6	-97.7	0	0	0	109.3	L178 L194 K195 I208 L216 I218 D225 V244 A245 V247	L178-Y229 VanDerWaalsContact CD1-CB 3.49Å; L178-Y229 HydrophobicContact CD1-CD1 3.92Å; L178-Y229 HydrophobicContact CD1-CD2 4.11Å; L178-Y229 HydrophobicContact CD1-CG 3.57Å; L194-Y229 CarbonylContact O-C 3.57Å; L194-Y229 WeakPolarHBondContact O-CA 3.41Å; K195-Y229 HydrophobicContact CB-CD1 4.35Å; K195-Y229 HydrophobicContact CB-CE1 4.13Å; K195-Y229 HydrophobicContact CD-CE1 4.03Å; K195-Y229 HydrophobicContact CD-CE2 4.25Å; K195-Y229 WeakPolarHBondContact CD-OH 3.3Å; K195-Y229 WeakPolarHBondContact CE-OH 3.34Å; K195-Y229 HydrophobicContact CG-CD1 4.38Å; K195-Y229 HydrophobicContact CG-CE1 3.97Å; K195-Y229 HydrophobicContact CG-CE2 4.18Å; I208-Y229 HydrophobicContact CD1-CE1 4.19Å; L216-Y229 HydrophobicContact CD1-CD1 3.68Å; L216-Y229 HydrophobicContact CD1-CE1 3.88Å; L216-Y229 HydrophobicContact CD2-CD1 4Å; L216-Y229 HydrophobicContact CD2-CE1 3.76Å; I218-Y229 WeakPolarHBondContact CD1-OH 3.41Å; D225-Y229 VanDerWaalsContact O-CE2 3.27Å; D225-Y229 WeakPolarHBondContact O-CE2 3.32Å; D225-Y229 PolarHBondContact O-OH 2.58Å; D225-Y229 VanDerWaalsContact O-OH 3.04Å; Y229-V244 CarbonylContact O-C 3.51Å; Y229-V244 WeakPolarHBondContact O-CA 3.29Å; Y229-A245 PolarHBondContact N-O 2.88Å; Y229-A245 PolarHBondContact O-N 2.83Å; Y229-V247 HydrophobicContact CD2-CB 3.89Å; Y229-V247 HydrophobicContact CD2-CG2 3.53Å; Y229-V247 HydrophobicContact CE2-CB 3.85Å; Y229-V247 HydrophobicContact CE2-CG1 4.35Å; Y229-V247 HydrophobicContact CE2-CG2 3.85Å; Y229-V247 HydrophobicContact CG-CG2 4.41Å
230	T	96.2	Very high	87.7	Confident	17 Å²	17	45.6 Å²	45.6	10%	0.104	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.3	178.7	-50.2	0	0	0	0	110	W193 L194 V232 R242 A243 V244	W193-T230 CarbonylContact C-O 3.53Å; W193-T230 WeakPolarHBondContact CA-O 3.35Å; L194-T230 PolarHBondContact N-O 2.65Å; L194-T230 PolarHBondContact O-N 3.18Å; T230-V232 HydrophobicContact CG2-CG2 3.86Å; T230-R242 HydrophobicContact CG2-CB 4Å; T230-R242 HydrophobicContact CG2-CG 4.5Å; T230-A243 CarbonylContact C-O 3.56Å; T230-A243 VanDerWaalsContact CA-O 3.31Å; T230-A243 WeakPolarHBondContact CA-O 3.27Å; T230-V244 HydrophobicContact CG2-CG2 3.96Å
231	C	94.8	Very high	87.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	135.5	162.6	-173	0	0	0	0	108.8	F161 P165 C180 W193 R242 A243	F161-C231 HydrophobicContact CE1-CB 4.47Å; P165-C231 HydrophobicContact CG-CB 4.16Å; C180-C231 HydrophobicContact CB-CB 3.75Å; C180-C231 WeakPolarHBondContact CB-SG 3.45Å; C180-C231 WeakPolarHBondContact SG-CB 3.33Å; C180-C231 CovalentContact SG-SG 2.03Å; C180-C231 PolarHBondContact SG-SG 2.93Å; W193-C231 HydrophobicContact CD2-CB 4.32Å; W193-C231 HydrophobicContact CE3-CB 4.12Å; W193-C231 HydrophobicContact CH2-CB 3.96Å; W193-C231 HydrophobicContact CZ2-CB 4.11Å; W193-C231 HydrophobicContact CZ3-CB 3.94Å; C231-R242 WeakPolarHBondContact O-CA 3.44Å; C231-A243 PolarHBondContact N-O 2.8Å; C231-A243 PolarHBondContact O-N 3.13Å
232	V	94.4	Very high	88.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	121.8	-178.6	-173.4	0	0	0	0	108.6	V191 Y192 L194 T230 K240 R241 R242	V191-V232 CarbonylContact C-O 3.55Å; V191-V232 WeakPolarHBondContact CA-O 3.4Å; Y192-V232 HydrophobicContact CD1-CB 4.37Å; Y192-V232 HydrophobicContact CD2-CB 3.89Å; Y192-V232 HydrophobicContact CD2-CG2 4.2Å; Y192-V232 HydrophobicContact CE1-CB 4.15Å; Y192-V232 HydrophobicContact CE1-CG1 3.89Å; Y192-V232 HydrophobicContact CE2-CB 3.65Å; Y192-V232 HydrophobicContact CE2-CG1 3.86Å; Y192-V232 HydrophobicContact CE2-CG2 3.87Å; Y192-V232 HydrophobicContact CG-CB 4.26Å; Y192-V232 PolarHBondContact N-O 3.15Å; Y192-V232 PolarHBondContact O-N 2.88Å; L194-V232 HydrophobicContact CD1-CG2 4.04Å; L194-V232 HydrophobicContact CG-CG2 4.08Å; T230-V232 HydrophobicContact CG2-CG2 3.86Å; V232-K240 HydrophobicContact CG1-CB 4.43Å; V232-K240 HydrophobicContact CG1-CD 4.38Å; V232-R241 WeakPolarHBondContact CA-O 3.31Å; V232-R242 HydrophobicContact CG1-CG 4.2Å; V232-R242 HydrophobicContact CG2-CG 4.19Å
233	A	93.6	Very high	88.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.5	170.5	0	0	0	0	0	109.2	F161 P182 P183 P189 E190 K240 R241	F161-A233 HydrophobicContact CE1-CB 4.3Å; F161-A233 HydrophobicContact CZ-CB 4.37Å; P182-A233 HydrophobicContact CB-CB 3.69Å; P183-A233 HydrophobicContact CG-CB 4.35Å; P189-A233 HydrophobicContact CB-CB 4.22Å; P189-A233 HydrophobicContact CG-CB 4.49Å; E190-A233 CarbonylContact O-C 3.55Å; A233-K240 CarbonylContact O-C 3.59Å; A233-K240 WeakPolarHBondContact O-CA 3.32Å; A233-R241 PolarHBondContact N-O 2.84Å; A233-R241 PolarHBondContact O-N 2.82Å
234	A	89.7	Confident	88.6	Confident	4 Å²	4	47.7 Å²	47.7	3%	0.033	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	118.9	-177.2	0	0	0	0	0	112.9	P189 E190 Y192 E239 K240	P189-A234 CarbonylContact C-O 3.47Å; P189-A234 WeakPolarHBondContact CA-O 3.32Å; E190-A234 PolarHBondContact N-O 3.31Å; E190-A234 PolarHBondContact O-N 3.13Å; Y192-A234 HydrophobicContact CE1-CB 4.15Å; A234-E239 CarbonylContact C-O 3.55Å; A234-E239 WeakPolarHBondContact CA-O 3.17Å; A234-K240 HydrophobicContact CB-CD 3.95Å; A234-K240 HydrophobicContact CB-CG 3.82Å
235	C	84.8	Confident	88.7	Confident	6 Å²	6	43.5 Å²	43.5	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.7	171.6	177	0	0	0	0	109.6	Y156 L157 E239	Y156-C235 PolarHBondContact O-SG 2.78Å; L157-C235 HydrophobicContact CB-CB 3.71Å; L157-C235 HydrophobicContact CD1-CB 4.22Å; L157-C235 HydrophobicContact CD2-CB 3.95Å; L157-C235 HydrophobicContact CG-CB 4.19Å; C235-E239 PolarHBondContact N-O 2.99Å; C235-E239 PolarHBondContact O-N 2.76Å
236	L	78	Confident	88.7	Confident	72 Å²	72	51.2 Å²	51.2	38%	0.377	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	-164.9	-175.2	-55.9	175.1	0	0	0	112.3	T53 A155 P187 G238	T53-L236 HydrophobicContact CG2-CD1 3.86Å; A155-L236 HydrophobicContact CB-CD1 3.57Å; A155-L236 HydrophobicContact CB-CG 4.42Å; P187-L236 HydrophobicContact CG-CD2 3.92Å; P187-L236 HydrophobicContact CG-CG 4.34Å; L236-G238 PolarHBondContact O-N 3.16Å
237	N	66.4	Low	88.8	Confident	162 Å²	162	49.3 Å²	49.3	87%	0.866	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	21.6	179.8	-60	35.7	0	0	0	113.4
238	G	68.4	Low	88.7	Confident	56 Å²	56	52.8 Å²	52.8	58%	0.577	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.1	-83.6	-167.1	0	0	0	0	0	113.7	L236	L236-G238 PolarHBondContact O-N 3.16Å
239	E	76.4	Confident	88.4	Confident	91 Å²	91	49.8 Å²	49.8	43%	0.425	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	136.6	-167.9	-68	-133.1	-155.8	0	0	112.2	L157 A234 C235 R241	L157-E239 HydrophobicContact CB-CB 4.4Å; L157-E239 HydrophobicContact CD2-CB 4.25Å; A234-E239 CarbonylContact C-O 3.55Å; A234-E239 WeakPolarHBondContact CA-O 3.17Å; C235-E239 PolarHBondContact N-O 2.99Å; C235-E239 PolarHBondContact O-N 2.76Å; E239-R241 IonicContact OE2-CZ 3.68Å; E239-R241 VanDerWaalsContact OE2-CZ 3.26Å; E239-R241 IonicContact OE2-NH1 2.7Å; E239-R241 PolarHBondContact OE2-NH1 2.92Å; E239-R241 IonicContact OE2-NH2 3.59Å; E239-R241 PolarHBondContact OE2-NH2 3.29Å
240	K	89.8	Confident	87.8	Confident	87 Å²	87	55.2 Å²	55.2	38%	0.378	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.9	178.9	-55.2	-164.3	173.8	-159.3	0	111.2	Y192 V232 A233 A234	Y192-K240 PolarHBondContact OH-NZ 3.06Å; V232-K240 HydrophobicContact CG1-CB 4.43Å; V232-K240 HydrophobicContact CG1-CD 4.38Å; A233-K240 CarbonylContact O-C 3.59Å; A233-K240 WeakPolarHBondContact O-CA 3.32Å; A234-K240 HydrophobicContact CB-CD 3.95Å; A234-K240 HydrophobicContact CB-CG 3.82Å
241	R	92.2	Very high	86.6	Confident	54 Å²	54	57.9 Å²	57.9	20%	0.204	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	155.7	165.8	-50.5	-57.1	174.2	-118.6	-3.1	109.4	L157 D158 F161 P183 V232 A233 E239	L157-R241 HydrophobicContact CD2-CG 3.94Å; L157-R241 HydrophobicContact CG-CG 4.18Å; L157-R241 PolarHBondContact O-NH2 3.08Å; D158-R241 WeakPolarHBondContact O-CD 3.3Å; D158-R241 WeakPolarHBondContact O-CG 3.37Å; D158-R241 PolarHBondContact O-NE 3.46Å; F161-R241 HydrophobicContact CD2-CB 4.33Å; F161-R241 HydrophobicContact CE2-CB 3.58Å; F161-R241 HydrophobicContact CZ-CB 4.06Å; P183-R241 HydrophobicContact CG-CB 3.83Å; P183-R241 HydrophobicContact CG-CG 3.61Å; V232-R241 WeakPolarHBondContact CA-O 3.31Å; A233-R241 PolarHBondContact N-O 2.84Å; A233-R241 PolarHBondContact O-N 2.82Å; E239-R241 IonicContact OE2-CZ 3.68Å; E239-R241 VanDerWaalsContact OE2-CZ 3.26Å; E239-R241 IonicContact OE2-NH1 2.7Å; E239-R241 PolarHBondContact OE2-NH1 2.92Å; E239-R241 IonicContact OE2-NH2 3.59Å; E239-R241 PolarHBondContact OE2-NH2 3.29Å
242	R	94.3	Very high	84.6	Confident	153 Å²	153	66.8 Å²	66.8	58%	0.577	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	133.7	-176.9	-57.5	179.4	-178.1	-114	6.1	110.8	F161 T230 C231 V232	F161-R242 VanDerWaalsContact CE2-C 3.41Å; T230-R242 HydrophobicContact CG2-CB 4Å; T230-R242 HydrophobicContact CG2-CG 4.5Å; C231-R242 WeakPolarHBondContact O-CA 3.44Å; V232-R242 HydrophobicContact CG1-CG 4.2Å; V232-R242 HydrophobicContact CG2-CG 4.19Å
243	A	92.1	Very high	82.4	Confident	2 Å²	2	72 Å²	72	2%	0.017	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	142.2	173.4	0	0	0	0	0	109.9	F161 E164 P165 T230 C231	F161-A243 HydrophobicContact CD1-CB 4.31Å; F161-A243 HydrophobicContact CD2-CB 3.81Å; F161-A243 HydrophobicContact CE1-CB 4.21Å; F161-A243 HydrophobicContact CE2-CB 3.69Å; F161-A243 HydrophobicContact CG-CB 4.14Å; F161-A243 HydrophobicContact CZ-CB 3.91Å; E164-A243 HydrophobicContact CB-CB 3.87Å; E164-A243 HydrophobicContact CG-CB 3.55Å; P165-A243 HydrophobicContact CG-CB 4.47Å; T230-A243 CarbonylContact C-O 3.56Å; T230-A243 VanDerWaalsContact CA-O 3.31Å; T230-A243 WeakPolarHBondContact CA-O 3.27Å; C231-A243 PolarHBondContact N-O 2.8Å; C231-A243 PolarHBondContact O-N 3.13Å
244	V	93.2	Very high	79.9	Confident	76 Å²	76	77.2 Å²	77.2	46%	0.461	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	114.9	-164.8	-173.9	0	0	0	0	112.2	N228 Y229 T230	N228-V244 HydrophobicContact CB-CG1 4.25Å; Y229-V244 CarbonylContact O-C 3.51Å; Y229-V244 WeakPolarHBondContact O-CA 3.29Å; T230-V244 HydrophobicContact CG2-CG2 3.96Å
245	A	92	Very high	77.3	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	140.2	167	0	0	0	0	0	111.1	P165 V166 L178 Y229	P165-A245 HydrophobicContact CB-CB 3.93Å; P165-A245 HydrophobicContact CG-CB 4.07Å; V166-A245 WeakPolarHBondContact O-CB 3.04Å; L178-A245 HydrophobicContact CD1-CB 4.29Å; L178-A245 HydrophobicContact CD2-CB 4.35Å; Y229-A245 PolarHBondContact N-O 2.88Å; Y229-A245 PolarHBondContact O-N 2.83Å
246	R	92.7	Very high	74.9	Confident	167 Å²	167	87.4 Å²	87.4	63%	0.63	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	134.1	164.6	-64.4	-177.1	178.2	147.8	4.3	109.3	S167 T168	S167-R246 CarbonylContact C-O 3.46Å; S167-R246 WeakPolarHBondContact CA-O 3.4Å; S167-R246 WeakPolarHBondContact CB-O 3.44Å; S167-R246 PolarHBondContact OG-N 3.06Å; T168-R246 PolarHBondContact N-O 3.07Å
247	V	92.7	Very high	72.6	Confident	1 Å²	1	91.9 Å²	91.9	1%	0.006	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.4	176	175.9	0	0	0	0	108.6	T168 L176 L178 S226 G227 Y229 I249	T168-V247 WeakPolarHBondContact O-CA 3.25Å; L176-V247 HydrophobicContact CD2-CG1 3.86Å; L176-V247 HydrophobicContact CD2-CG2 4.12Å; L178-V247 HydrophobicContact CD1-CG2 4.03Å; L178-V247 HydrophobicContact CD2-CG2 4.2Å; S226-V247 CarbonylContact C-O 3.55Å; S226-V247 VanDerWaalsContact CA-O 3.23Å; S226-V247 WeakPolarHBondContact CA-O 3.3Å; G227-V247 PolarHBondContact N-O 3Å; G227-V247 PolarHBondContact O-N 2.92Å; Y229-V247 HydrophobicContact CD2-CB 3.89Å; Y229-V247 HydrophobicContact CD2-CG2 3.53Å; Y229-V247 HydrophobicContact CE2-CB 3.85Å; Y229-V247 HydrophobicContact CE2-CG1 4.35Å; Y229-V247 HydrophobicContact CE2-CG2 3.85Å; Y229-V247 HydrophobicContact CG-CG2 4.41Å; V247-I249 HydrophobicContact CG1-CD1 3.69Å; V247-I249 HydrophobicContact CG1-CG1 3.96Å
248	N	90.4	Very high	71	Confident	88 Å²	88	94 Å²	94	47%	0.471	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123.6	173.6	-51.1	-62	0	0	0	109.2	T168 D169 L170	T168-N248 PolarHBondContact O-N 2.86Å; D169-N248 WeakPolarHBondContact OD1-CB 3.5Å; D169-N248 PolarHBondContact OD1-ND2 2.75Å; L170-N248 PolarHBondContact N-O 2.73Å
249	I	89.4	Confident	69.1	Low	10 Å²	10	96.5 Å²	96.5	5%	0.051	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.5	-177.9	-70.3	153.4	0	0	0	111.1	L170 V172 T221 T222 D225 S226 V247	L170-I249 HydrophobicContact CB-CG1 4.33Å; L170-I249 CarbonylContact O-C 3.59Å; L170-I249 WeakPolarHBondContact O-CA 3.35Å; V172-I249 HydrophobicContact CB-CG2 4.44Å; V172-I249 HydrophobicContact CG2-CG2 3.59Å; T221-I249 HydrophobicContact CG2-CD1 3.62Å; T221-I249 HydrophobicContact CG2-CG1 4.23Å; T222-I249 VanDerWaalsContact O-CG2 3.29Å; T222-I249 WeakPolarHBondContact O-CG2 3.21Å; D225-I249 HydrophobicContact CB-CD1 3.55Å; S226-I249 PolarHBondContact OG-N 2.88Å; V247-I249 HydrophobicContact CG1-CD1 3.69Å; V247-I249 HydrophobicContact CG1-CG1 3.96Å
250	F	82.9	Confident	67.1	Low	114 Å²	114	98.1 Å²	98.1	50%	0.5	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136	-173.5	56.8	-95	0	0	0	113	L170 A171 V172	L170-F250 WeakPolarHBondContact O-CD1 3.25Å; L170-F250 WeakPolarHBondContact O-CE1 3.39Å; L170-F250 PolarHBondContact O-N 2.9Å; A171-F250 HydrophobicContact CB-CD2 4.22Å; A171-F250 HydrophobicContact CB-CE2 3.62Å; A171-F250 HydrophobicContact CB-CZ 3.85Å; V172-F250 WeakPolarHBondContact CG2-O 3.12Å; V172-F250 PolarHBondContact N-O 2.89Å
251	P	69.8	Low	64.6	Low	73 Å²	73	96.8 Å²	96.8	47%	0.474	50%	0.497	S	S	.	.			trans	-70.6	142.4	-177.7	29.1	-34.9	0	0	0	112.4	T223 N253	T223-P251 HydrophobicContact CG2-CB 4.15Å; T223-P251 HydrophobicContact CG2-CG 4.48Å; P251-N253 PolarHBondContact O-N 2.86Å
252	Y	52.7	Low	62.1	Low	186 Å²	186	95.4 Å²	95.4	73%	0.729	50%	0.5	S	S	*	.			trans	-74.3	91.4	179.2	-168.3	-88.2	0	0	0	111.4	S254	Y252-S254 PolarHBondContact O-N 2.75Å
253	N	48.8	Very low	59.9	Low	111 Å²	111	93.1 Å²	93.1	59%	0.594	50%	0.499	S	S	*	.			trans	-82.3	100.8	177	-84.4	-25	0	0	0	111.5	P251 A255 M256	P251-N253 PolarHBondContact O-N 2.86Å; N253-A255 PolarHBondContact O-N 3.26Å; N253-M256 PolarHBondContact O-N 2.74Å
254	S	41.7	Very low	58.1	Low	109 Å²	109	94.9 Å²	94.9	76%	0.762	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-1.7	173.3	-53.5	0	0	0	0	115.1	Y252	Y252-S254 PolarHBondContact O-N 2.75Å
255	A	35.6	Very low	57	Low	99 Å²	99	93.5 Å²	93.5	82%	0.818	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-7	169.4	0	0	0	0	0	113.7	N253 N257	N253-A255 PolarHBondContact O-N 3.26Å; A255-N257 PolarHBondContact O-N 2.98Å
256	M	32.7	Very low	56	Low	124 Å²	124	101.2 Å²	101.2	61%	0.611	54%	0.541	S	S	*	.			trans	-99.5	38.3	-176.3	-156.9	153.1	-178	0	0	113.5	N253 R258 V260	N253-M256 PolarHBondContact O-N 2.74Å; M256-R258 PolarHBondContact O-N 3.14Å; M256-V260 HydrophobicContact CE-CG2 3.76Å
257	N	31.2	Very low	55.3	Low	166 Å²	166	96.8 Å²	96.8	89%	0.888	53%	0.525	S	S	*	.			trans	-77.7	49.3	157.2	-129	12	0	0	0	110.9	A255	A255-N257 PolarHBondContact O-N 2.98Å
258	R	31.4	Very low	54.3	Low	207 Å²	207	98.4 Å²	98.4	78%	0.781	54%	0.542	S	S	*	.	S	Bend	trans	-117.5	126.5	146.4	-65.7	-172.6	-172.8	-154.5	1.6	105	M256 V260	M256-R258 PolarHBondContact O-N 3.14Å; R258-V260 PolarHBondContact O-N 2.87Å
259	P	28.9	Very low	53.5	Low	109 Å²	109	103.2 Å²	103.2	71%	0.708	56%	0.561	S	S	*	*			trans	-56.8	130.8	153	29.3	-32.5	0	0	0	106.4	S261	P259-S261 PolarHBondContact O-N 3.11Å
260	V	35.7	Very low	52.9	Low	125 Å²	125	105.9 Å²	105.9	76%	0.758	57%	0.571	S	S	*	*			trans	-61.1	105.5	140.7	173.8	0	0	0	0	102.2	M256 R258 G262	M256-V260 HydrophobicContact CE-CG2 3.76Å; R258-V260 PolarHBondContact O-N 2.87Å; V260-G262 PolarHBondContact O-N 2.66Å
261	S	35.7	Very low	52.3	Low	58 Å²	58	102.2 Å²	102.2	41%	0.406	57%	0.565	S	S	.	*			trans	-59.6	115.3	-170.2	36.9	0	0	0	0	108	P259 D263	P259-S261 PolarHBondContact O-N 3.11Å; S261-D263 VanDerWaalsContact CB-CG 3.41Å; S261-D263 VanDerWaalsContact CB-OD2 3.24Å; S261-D263 WeakPolarHBondContact CB-OD2 3.27Å; S261-D263 PolarHBondContact O-N 3.06Å; S261-D263 VanDerWaalsContact OG-CG 3.3Å; S261-D263 PolarHBondContact OG-OD2 3.48Å
262	G	39.9	Very low	52.3	Low	26 Å²	26	103.8 Å²	103.8	27%	0.268	57%	0.573	S	S	.	*			trans	-63.3	67	146.6	0	0	0	0	0	107	V260 L264	V260-G262 PolarHBondContact O-N 2.66Å; G262-L264 VanDerWaalsContact C-N 3.26Å; G262-L264 PolarHBondContact O-N 3.29Å
263	D	47.6	Very low	53.3	Low	104 Å²	104	95.4 Å²	95.4	56%	0.556	54%	0.542	S	S	*	.			trans	-63.2	97.4	177.2	-93	-41.8	0	0	0	105.4	S261 T265 A296	S261-D263 VanDerWaalsContact CB-CG 3.41Å; S261-D263 VanDerWaalsContact CB-OD2 3.24Å; S261-D263 WeakPolarHBondContact CB-OD2 3.27Å; S261-D263 PolarHBondContact O-N 3.06Å; S261-D263 VanDerWaalsContact OG-CG 3.3Å; S261-D263 PolarHBondContact OG-OD2 3.48Å; D263-T265 PolarHBondContact O-N 2.8Å; D263-A296 WeakPolarHBondContact O-CB 3.38Å; D263-A296 PolarHBondContact O-N 2.87Å
264	L	55.1	Low	54.2	Low	40 Å²	40	94.8 Å²	94.8	21%	0.209	53%	0.532	C	S	.	.	B	Isolated β-bridge	trans	-53.6	117.1	172.7	-69.7	148.4	0	0	0	106	G262 N266 R293 V294 P319 L322	G262-L264 VanDerWaalsContact C-N 3.26Å; G262-L264 PolarHBondContact O-N 3.29Å; L264-N266 PolarHBondContact O-N 3.03Å; L264-R293 VanDerWaalsContact CD1-CZ 3.49Å; L264-R293 VanDerWaalsContact CD1-NH1 3.33Å; L264-R293 HydrophobicContact CD2-CG 4.36Å; L264-V294 WeakPolarHBondContact CA-O 3.39Å; L264-P319 HydrophobicContact CD1-CB 3.72Å; L264-P319 HydrophobicContact CD1-CG 3.93Å; L264-P319 WeakPolarHBondContact CD2-O 3.45Å; L264-L322 HydrophobicContact CD2-CD2 3.75Å
265	T	70	Confident	55.3	Low	47 Å²	47	93.3 Å²	93.3	29%	0.288	51%	0.512	S	S	.	.			trans	-50.7	141.9	-176.9	57.4	0	0	0	0	109.2	D263 W267 R293 V294	D263-T265 PolarHBondContact O-N 2.8Å; T265-W267 PolarHBondContact O-N 3.34Å; T265-W267 VanDerWaalsContact O-N 3.15Å; T265-R293 VanDerWaalsContact O-CB 3.31Å; T265-R293 WeakPolarHBondContact O-CB 3.41Å; T265-V294 HydrophobicContact CG2-CG2 3.54Å; T265-V294 PolarHBondContact N-O 3.33Å; T265-V294 PolarHBondContact OG1-N 2.87Å; T265-V294 PolarHBondContact OG1-O 2.69Å
266	N	72.1	Confident	56.4	Low	161 Å²	161	92.1 Å²	92.1	86%	0.861	49%	0.491	S	S	*	.			trans	-41.8	127.6	173.9	-79.1	-40.7	0	0	0	110.3	L264 G268	L264-N266 PolarHBondContact O-N 3.03Å; N266-G268 PolarHBondContact O-N 3.1Å
267	W	76.8	Confident	57.4	Low	75 Å²	75	90.7 Å²	90.7	28%	0.284	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-46.7	128.2	-177.5	-78.8	106	0	0	0	111	T265 R291 R293 Q324	T265-W267 PolarHBondContact O-N 3.34Å; T265-W267 VanDerWaalsContact O-N 3.15Å; W267-R291 HydrophobicContact CD2-CG 4.48Å; W267-R291 HydrophobicContact CE3-CG 3.75Å; W267-R291 HydrophobicContact CZ3-CG 4.16Å; W267-R293 HydrophobicContact CD2-CB 4.46Å; W267-R293 HydrophobicContact CD2-CG 4.34Å; W267-R293 HydrophobicContact CE3-CB 4.06Å; W267-R293 HydrophobicContact CE3-CG 3.94Å; W267-R293 HydrophobicContact CH2-CG 4.07Å; W267-R293 HydrophobicContact CZ2-CG 4.47Å; W267-R293 VanDerWaalsContact CZ2-NE 3.34Å; W267-R293 HydrophobicContact CZ3-CB 4.36Å; W267-R293 HydrophobicContact CZ3-CG 3.79Å; W267-Q324 HydrophobicContact CH2-CB 3.65Å; W267-Q324 HydrophobicContact CZ2-CB 4.27Å; W267-Q324 HydrophobicContact CZ3-CB 3.81Å
268	G	72.5	Confident	58	Low	35 Å²	35	86.2 Å²	86.2	36%	0.361	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-58.4	163.5	170.7	0	0	0	0	0	111.9	N266 Y292	N266-G268 PolarHBondContact O-N 3.1Å; G268-Y292 PolarHBondContact N-O 2.87Å
269	E	72.5	Confident	58.2	Low	188 Å²	188	81 Å²	81	88%	0.879	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-58.6	155.1	175.1	-63	-161.5	142.1	0	0	111.6	G271	E269-G271 PolarHBondContact O-N 2.9Å
270	W	78	Confident	58.9	Low	67 Å²	67	78.2 Å²	78.2	25%	0.254	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-70.8	124.7	175	-72.8	96.9	0	0	0	110.4	Q289 R291 Q324 R326	W270-Q289 HydrophobicContact CE3-CG 3.92Å; W270-Q289 HydrophobicContact CZ3-CG 4.42Å; W270-R291 HydrophobicContact CD2-CB 4.19Å; W270-R291 HydrophobicContact CD2-CG 3.99Å; W270-R291 VanDerWaalsContact CE2-CD 3.47Å; W270-R291 HydrophobicContact CE3-CB 4.02Å; W270-R291 HydrophobicContact CE3-CG 3.84Å; W270-R291 HydrophobicContact CH2-CG 3.95Å; W270-R291 HydrophobicContact CZ2-CG 4.08Å; W270-R291 VanDerWaalsContact CZ2-NE 3.29Å; W270-R291 HydrophobicContact CZ3-CB 4.41Å; W270-R291 HydrophobicContact CZ3-CG 3.81Å; W270-Q324 HydrophobicContact CH2-CB 4.23Å; W270-Q324 HydrophobicContact CH2-CG 3.93Å; W270-Q324 VanDerWaalsContact CZ3-O 3.28Å; W270-Q324 WeakPolarHBondContact CZ3-O 3.43Å; W270-R326 VanDerWaalsContact CD1-NH2 3.3Å; W270-R326 HydrophobicContact CD2-CG 4.41Å; W270-R326 VanDerWaalsContact CE2-NE 3.26Å; W270-R326 HydrophobicContact CE3-CG 3.93Å; W270-R326 VanDerWaalsContact CG-NH2 3.28Å; W270-R326 HydrophobicContact CH2-CB 3.91Å; W270-R326 HydrophobicContact CH2-CG 3.62Å; W270-R326 HydrophobicContact CZ2-CG 4.13Å; W270-R326 HydrophobicContact CZ3-CB 4.08Å; W270-R326 HydrophobicContact CZ3-CG 3.52Å
271	G	70	Confident	59.2	Low	37 Å²	37	78 Å²	78	38%	0.381	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-63.9	172.3	174.6	0	0	0	0	0	113.3	E269 Q289 T290	E269-G271 PolarHBondContact O-N 2.9Å; G271-Q289 WeakPolarHBondContact O-CB 3.48Å; G271-T290 WeakPolarHBondContact CA-O 3.34Å; G271-T290 PolarHBondContact N-O 2.89Å
272	T	69.5	Low	59.9	Low	105 Å²	105	82.7 Å²	82.7	64%	0.644	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-60.6	140.4	-177.1	45.9	0	0	0	0	112.9	Y274	T272-Y274 PolarHBondContact O-N 3.29Å
273	C	74.5	Confident	60.1	Low	11 Å²	11	84.4 Å²	84.4	7%	0.074	49%	0.488	C	S	.	.			trans	-73.8	114	175.8	175.1	0	0	0	0	111.6	Q288 C328 Q332 C333 I334	C273-Q288 CarbonylContact C-O 3.54Å; C273-Q288 WeakPolarHBondContact CA-O 3.44Å; C273-C328 HydrophobicContact CB-CB 3.73Å; C273-C328 WeakPolarHBondContact CB-SG 3.38Å; C273-C328 WeakPolarHBondContact SG-CB 3.41Å; C273-C328 CovalentContact SG-SG 2.02Å; C273-C328 PolarHBondContact SG-SG 2.8Å; C273-Q332 HydrophobicContact CB-CB 4.2Å; C273-Q332 WeakPolarHBondContact CB-O 3.42Å; C273-C333 VanDerWaalsContact SG-CA 3.59Å; C273-I334 PolarHBondContact O-N 2.95Å; C273-I334 VanDerWaalsContact O-N 3.16Å
274	Y	66.1	Low	60.5	Low	97 Å²	97	90.1 Å²	90.1	38%	0.38	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	159.1	-179.7	64	-91.1	0	0	0	112.5	T272 L276 C287 Q288	T272-Y274 PolarHBondContact O-N 3.29Å; Y274-L276 HydrophobicContact CD2-CG 4.48Å; Y274-L276 HydrophobicContact CE2-CD2 4.01Å; Y274-L276 HydrophobicContact CE2-CG 4.1Å; Y274-C287 CarbonylContact O-C 3.58Å; Y274-C287 VanDerWaalsContact O-CA 3.29Å; Y274-C287 WeakPolarHBondContact O-CA 3.46Å; Y274-Q288 VanDerWaalsContact CD1-O 3.28Å; Y274-Q288 WeakPolarHBondContact CD1-O 3.42Å; Y274-Q288 PolarHBondContact N-O 2.63Å; Y274-Q288 PolarHBondContact O-N 2.89Å
275	K	65.6	Low	60.6	Low	79 Å²	79	92.1 Å²	92.1	34%	0.343	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.1	-173.2	-177.3	162.9	163.6	171.6	0	111.8	T277 T285 N335	K275-T277 HydrophobicContact CG-CG2 4.49Å; K275-T285 HydrophobicContact CD-CG2 3.83Å; K275-T285 HydrophobicContact CG-CG2 3.79Å; K275-N335 VanDerWaalsContact CD-OD1 3.31Å; K275-N335 WeakPolarHBondContact CD-OD1 3.48Å; K275-N335 PolarHBondContact NZ-OD1 2.81Å
276	L	58.9	Low	60.3	Low	73 Å²	73	92.7 Å²	92.7	38%	0.382	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.6	170.5	-71.5	169.1	0	0	0	110.1	Y274 V286 Q288	Y274-L276 HydrophobicContact CD2-CG 4.48Å; Y274-L276 HydrophobicContact CE2-CD2 4.01Å; Y274-L276 HydrophobicContact CE2-CG 4.1Å; L276-V286 PolarHBondContact N-O 3.08Å; L276-V286 PolarHBondContact O-N 3.03Å; L276-Q288 HydrophobicContact CD1-CB 4.24Å; L276-Q288 HydrophobicContact CD1-CG 4Å
277	T	52.6	Low	60.4	Low	94 Å²	94	85.5 Å²	85.5	58%	0.577	48%	0.481	S	S	*	.			trans	-116.5	103.7	170.9	49.9	0	0	0	0	108.8	K275	K275-T277 HydrophobicContact CG-CG2 4.49Å
278	A	44.1	Very low	60.3	Low	72 Å²	72	84.1 Å²	84.1	60%	0.595	48%	0.478	S	S	*	.			trans	-75.9	136.8	167.6	0	0	0	0	0	109.4	A283	A278-A283 WeakPolarHBondContact O-CB 3.45Å
279	E	35.7	Very low	60.6	Low	97 Å²	97	83.1 Å²	83.1	45%	0.453	46%	0.464	S	S	.	.			trans	-84.1	129.2	176.1	-65.3	-173.1	-170.6	0	0	110.1	S688 P689	E279-S688 WeakPolarHBondContact OE1-CB 3.28Å; E279-P689 WeakPolarHBondContact OE2-CD 3.36Å
280	G	43.1	Very low	60.7	Low	51 Å²	51	75.2 Å²	75.2	53%	0.526	43%	0.428	S	S	.	.	S	Bend	trans	154.9	154.7	-172.8	0	0	0	0	0	111.4	N282 A283	G280-N282 PolarHBondContact O-N 2.92Å; G280-N282 VanDerWaalsContact O-N 3.07Å; G280-A283 PolarHBondContact O-N 2.87Å
281	S	43.7	Very low	60.9	Low	121 Å²	121	74.3 Å²	74.3	85%	0.846	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-12	-169.5	50.9	0	0	0	0	115.9
282	N	48.8	Very low	61.3	Low	156 Å²	156	78.7 Å²	78.7	83%	0.834	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	36.3	-179.7	-73.8	-42.9	0	0	0	112.7	G280 R284	G280-N282 PolarHBondContact O-N 2.92Å; G280-N282 VanDerWaalsContact O-N 3.07Å; N282-R284 PolarHBondContact O-N 2.86Å
283	A	45.4	Very low	61.8	Low	62 Å²	62	75.8 Å²	75.8	51%	0.512	41%	0.408	S	S	.	.			trans	-62.7	91.7	-172.8	0	0	0	0	0	114.8	A278 G280 T285	A278-A283 WeakPolarHBondContact O-CB 3.45Å; G280-A283 PolarHBondContact O-N 2.87Å; A283-T285 PolarHBondContact O-N 3.38Å
284	R	56.4	Low	61.4	Low	224 Å²	224	77.4 Å²	77.4	85%	0.845	42%	0.417	S	S	*	.			trans	-66.5	127.8	163.1	-95.7	-177.1	171.6	169.7	-1.4	109.9	N282 V286	N282-R284 PolarHBondContact O-N 2.86Å; R284-V286 PolarHBondContact O-N 2.85Å
285	T	55.8	Low	61.4	Low	83 Å²	83	73 Å²	73	51%	0.509	40%	0.4	S	S	.	.			trans	-70.1	124.4	170	-66.1	0	0	0	0	109.8	K275 A283	K275-T285 HydrophobicContact CD-CG2 3.83Å; K275-T285 HydrophobicContact CG-CG2 3.79Å; A283-T285 PolarHBondContact O-N 3.38Å
286	V	65.2	Low	61.1	Low	59 Å²	59	71.3 Å²	71.3	36%	0.358	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	146.1	172.8	-177.2	0	0	0	0	108.8	L276 R284 Q288	L276-V286 PolarHBondContact N-O 3.08Å; L276-V286 PolarHBondContact O-N 3.03Å; R284-V286 PolarHBondContact O-N 2.85Å; V286-Q288 HydrophobicContact CG1-CG 4.42Å
287	C	73	Confident	60.7	Low	9 Å²	9	71.7 Å²	71.7	6%	0.061	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	130	-177.8	-61.4	0	0	0	0	109.2	Y274 N327 C328 C333	Y274-C287 CarbonylContact O-C 3.58Å; Y274-C287 VanDerWaalsContact O-CA 3.29Å; Y274-C287 WeakPolarHBondContact O-CA 3.46Å; C287-N327 CarbonylContact O-C 3.58Å; C287-N327 VanDerWaalsContact O-CA 3.23Å; C287-N327 WeakPolarHBondContact O-CA 3.03Å; C287-C328 VanDerWaalsContact CB-SG 3.57Å; C287-C328 PolarHBondContact O-N 2.91Å; C287-C328 PolarHBondContact O-SG 2.99Å; C287-C333 HydrophobicContact CB-CB 3.73Å; C287-C333 WeakPolarHBondContact CB-SG 3.4Å; C287-C333 WeakPolarHBondContact SG-CB 3.49Å; C287-C333 CovalentContact SG-SG 2.03Å; C287-C333 PolarHBondContact SG-SG 2.95Å
288	Q	74.4	Confident	60.5	Low	46 Å²	46	70.7 Å²	70.7	22%	0.215	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	159.1	-175.8	-75.6	-168.7	-13.9	0	0	113.4	C273 Y274 L276 V286 R326 N327 C328	C273-Q288 CarbonylContact C-O 3.54Å; C273-Q288 WeakPolarHBondContact CA-O 3.44Å; Y274-Q288 VanDerWaalsContact CD1-O 3.28Å; Y274-Q288 WeakPolarHBondContact CD1-O 3.42Å; Y274-Q288 PolarHBondContact N-O 2.63Å; Y274-Q288 PolarHBondContact O-N 2.89Å; L276-Q288 HydrophobicContact CD1-CB 4.24Å; L276-Q288 HydrophobicContact CD1-CG 4Å; V286-Q288 HydrophobicContact CG1-CG 4.42Å; Q288-R326 WeakPolarHBondContact CA-O 3.33Å; Q288-N327 VanDerWaalsContact CG-OD1 3.3Å; Q288-N327 WeakPolarHBondContact CG-OD1 3.48Å; Q288-N327 PolarHBondContact NE2-OD1 2.58Å; Q288-C328 PolarHBondContact N-SG 2.82Å; Q288-C328 VanDerWaalsContact N-SG 3.36Å
289	Q	79.5	Confident	60.5	Low	15 Å²	15	71.6 Å²	71.6	7%	0.07	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	148	178.5	57.3	-176.4	-58.7	0	0	109.1	W270 G271 T325 R326 C328	W270-Q289 HydrophobicContact CE3-CG 3.92Å; W270-Q289 HydrophobicContact CZ3-CG 4.42Å; G271-Q289 WeakPolarHBondContact O-CB 3.48Å; Q289-T325 CarbonylContact O-C 3.58Å; Q289-T325 WeakPolarHBondContact O-CA 3.48Å; Q289-R326 HydrophobicContact CG-CG 3.5Å; Q289-R326 WeakPolarHBondContact CG-O 3.47Å; Q289-R326 PolarHBondContact N-O 2.76Å; Q289-R326 PolarHBondContact O-N 2.72Å; Q289-R326 VanDerWaalsContact OE1-NE 3.16Å; Q289-C328 HydrophobicContact CG-CB 4.43Å
290	T	75.5	Confident	60.6	Low	21 Å²	21	73.8 Å²	73.8	13%	0.129	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	149.1	-172.2	-46.8	0	0	0	0	111	G271 Y292 Q324 T325	G271-T290 WeakPolarHBondContact CA-O 3.34Å; G271-T290 PolarHBondContact N-O 2.89Å; T290-Y292 HydrophobicContact CG2-CE1 4.42Å; T290-Y292 HydrophobicContact CG2-CE2 4.15Å; T290-Q324 CarbonylContact C-O 3.52Å; T290-Q324 WeakPolarHBondContact CA-O 3.19Å; T290-T325 HydrophobicContact CG2-CG2 4.09Å
291	R	81.6	Confident	60.2	Low	49 Å²	49	74.1 Å²	74.1	19%	0.185	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	164.5	169.2	65.7	173.3	-177.7	169.6	2.4	111.8	W267 W270 F323 Q324	W267-R291 HydrophobicContact CD2-CG 4.48Å; W267-R291 HydrophobicContact CE3-CG 3.75Å; W267-R291 HydrophobicContact CZ3-CG 4.16Å; W270-R291 HydrophobicContact CD2-CB 4.19Å; W270-R291 HydrophobicContact CD2-CG 3.99Å; W270-R291 VanDerWaalsContact CE2-CD 3.47Å; W270-R291 HydrophobicContact CE3-CB 4.02Å; W270-R291 HydrophobicContact CE3-CG 3.84Å; W270-R291 HydrophobicContact CH2-CG 3.95Å; W270-R291 HydrophobicContact CZ2-CG 4.08Å; W270-R291 VanDerWaalsContact CZ2-NE 3.29Å; W270-R291 HydrophobicContact CZ3-CB 4.41Å; W270-R291 HydrophobicContact CZ3-CG 3.81Å; R291-F323 CarbonylContact O-C 3.54Å; R291-F323 VanDerWaalsContact O-CA 3.24Å; R291-F323 WeakPolarHBondContact O-CA 3.41Å; R291-Q324 HydrophobicContact CG-CB 4.08Å; R291-Q324 VanDerWaalsContact CZ-OE1 3.31Å; R291-Q324 PolarHBondContact N-O 2.86Å; R291-Q324 PolarHBondContact O-N 2.89Å
292	Y	77.8	Confident	59.8	Low	128 Å²	128	78.2 Å²	78.2	50%	0.502	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	162.3	-172.1	-56.8	-90.6	0	0	0	112.1	G268 T290 L310 L322 F323	G268-Y292 PolarHBondContact N-O 2.87Å; T290-Y292 HydrophobicContact CG2-CE1 4.42Å; T290-Y292 HydrophobicContact CG2-CE2 4.15Å; Y292-L310 HydrophobicContact CD1-CD2 3.68Å; Y292-L310 HydrophobicContact CE1-CD2 3.96Å; Y292-L310 HydrophobicContact CG-CD2 4.5Å; Y292-L322 CarbonylContact C-O 3.53Å; Y292-L322 WeakPolarHBondContact CA-O 3.32Å; Y292-F323 HydrophobicContact CD1-CB 3.78Å; Y292-F323 HydrophobicContact CE1-CB 3.94Å
293	R	79.9	Confident	59.1	Low	45 Å²	45	76.6 Å²	76.6	17%	0.17	41%	0.406	C	S	.	.			trans	-149.8	153.7	168.3	60.2	-171.5	-175.4	158.1	4.5	109.5	L264 T265 W267 P319 P321 L322	L264-R293 VanDerWaalsContact CD1-CZ 3.49Å; L264-R293 VanDerWaalsContact CD1-NH1 3.33Å; L264-R293 HydrophobicContact CD2-CG 4.36Å; T265-R293 VanDerWaalsContact O-CB 3.31Å; T265-R293 WeakPolarHBondContact O-CB 3.41Å; W267-R293 HydrophobicContact CD2-CB 4.46Å; W267-R293 HydrophobicContact CD2-CG 4.34Å; W267-R293 HydrophobicContact CE3-CB 4.06Å; W267-R293 HydrophobicContact CE3-CG 3.94Å; W267-R293 HydrophobicContact CH2-CG 4.07Å; W267-R293 HydrophobicContact CZ2-CG 4.47Å; W267-R293 VanDerWaalsContact CZ2-NE 3.34Å; W267-R293 HydrophobicContact CZ3-CB 4.36Å; W267-R293 HydrophobicContact CZ3-CG 3.79Å; R293-P319 PolarHBondContact NH2-O 3.08Å; R293-P321 VanDerWaalsContact CZ-O 3.23Å; R293-P321 PolarHBondContact NE-O 2.89Å; R293-P321 PolarHBondContact NH2-O 2.78Å; R293-L322 PolarHBondContact N-O 3.42Å; R293-L322 WeakPolarHBondContact O-CD2 3.43Å
294	V	66.8	Low	58.4	Low	45 Å²	45	80.8 Å²	80.8	27%	0.273	42%	0.415	S	S	.	.			trans	-116.2	164.2	177.4	-60.6	0	0	0	0	111.4	L264 T265 I299	L264-V294 WeakPolarHBondContact CA-O 3.39Å; T265-V294 HydrophobicContact CG2-CG2 3.54Å; T265-V294 PolarHBondContact N-O 3.33Å; T265-V294 PolarHBondContact OG1-N 2.87Å; T265-V294 PolarHBondContact OG1-O 2.69Å; V294-I299 HydrophobicContact CG2-CD1 4.41Å
295	C	65.1	Low	57.1	Low	3 Å²	3	78.6 Å²	78.6	2%	0.02	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-86.3	117.9	179.4	-154.9	0	0	0	0	109.2	S297 Q298 C318	C295-S297 PolarHBondContact O-N 2.87Å; C295-S297 PolarHBondContact SG-OG 2.88Å; C295-S297 VanDerWaalsContact SG-OG 3.33Å; C295-Q298 PolarHBondContact O-N 2.81Å; C295-C318 HydrophobicContact CB-CB 3.84Å; C295-C318 WeakPolarHBondContact CB-SG 3.33Å; C295-C318 WeakPolarHBondContact SG-CB 3.35Å; C295-C318 CovalentContact SG-SG 2.04Å; C295-C318 PolarHBondContact SG-SG 3.18Å
296	A	58.9	Low	55.8	Low	45 Å²	45	83.8 Å²	83.8	37%	0.372	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-65	-13.2	-173.3	0	0	0	0	0	114.9	D263 Q298	D263-A296 WeakPolarHBondContact O-CB 3.38Å; D263-A296 PolarHBondContact O-N 2.87Å; A296-Q298 PolarHBondContact O-N 3.43Å
297	S	52.1	Low	54.2	Low	81 Å²	81	87 Å²	87	57%	0.566	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-68.8	-10.1	179.5	45.9	0	0	0	0	115.2	C295	C295-S297 PolarHBondContact O-N 2.87Å; C295-S297 PolarHBondContact SG-OG 2.88Å; C295-S297 VanDerWaalsContact SG-OG 3.33Å
298	Q	48.8	Very low	52.3	Low	72 Å²	72	92.3 Å²	92.3	34%	0.336	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-110.2	7.7	-174.8	-63.1	-170.7	-1.6	0	0	115.4	C295 A296 T300 T315	C295-Q298 PolarHBondContact O-N 2.81Å; A296-Q298 PolarHBondContact O-N 3.43Å; Q298-T300 PolarHBondContact O-N 2.85Å; Q298-T315 PolarHBondContact NE2-OG1 2.67Å
299	I	43	Very low	50.5	Low	91 Å²	91	95.5 Å²	95.5	47%	0.467	50%	0.498	S	S	.	.			trans	-98.9	84.7	-173.3	-50.6	179.6	0	0	0	111.9	V294	V294-I299 HydrophobicContact CG2-CD1 4.41Å
300	T	37.3	Very low	48.8	Very low	143 Å²	143	99.2 Å²	99.2	88%	0.877	52%	0.518	S	S	*	.			trans	-108.7	5	179.5	48.8	0	0	0	0	115.4	Q298	Q298-T300 PolarHBondContact O-N 2.85Å
301	S	36.3	Very low	47.1	Very low	58 Å²	58	100.8 Å²	100.8	41%	0.406	53%	0.53	S	S	.	.			trans	-140.6	161.1	162.7	104.9	0	0	0	0	111.3	T303	S301-T303 PolarHBondContact OG-OG1 2.99Å
302	K	34.2	Very low	45.3	Very low	208 Å²	208	106 Å²	106	90%	0.904	56%	0.556	S	S	*	*	S	Bend	trans	-108.6	13.5	-177.6	-104.5	-178.4	179.2	176.7	0	113.8
303	T	33.2	Very low	43.5	Very low	121 Å²	121	101.5 Å²	101.5	74%	0.742	54%	0.541	S	S	*	.	S	Bend	trans	-119.1	-14.7	-159.8	29.3	0	0	0	0	115.9	S301	S301-T303 PolarHBondContact OG-OG1 2.99Å
304	E	30.6	Very low	41.8	Very low	151 Å²	151	103.2 Å²	103.2	71%	0.706	56%	0.556	S	S	*	*			trans	-113.9	75.1	-172.4	-68	176.2	149.2	0	0	111.6
305	F	29.7	Very low	40.8	Very low	177 Å²	177	104 Å²	104	78%	0.776	56%	0.56	S	S	*	*			trans	-126.6	44.4	-179.3	-106.9	-79.4	0	0	0	113.2
306	K	29.7	Very low	40	Very low	192 Å²	192	112.1 Å²	112.1	84%	0.835	60%	0.604	S	S	*	*	S	Bend	trans	-142.1	131.3	164.3	-67.7	-173.1	-179.6	176	0	108.7
307	S	31.8	Very low	39.6	Very low	127 Å²	127	118.7 Å²	118.7	89%	0.888	63%	0.627	S	S	*	*	S	Bend	trans	47.2	83.4	-173.3	54.9	0	0	0	0	114.3
308	L	32.5	Very low	39.6	Very low	121 Å²	121	115.4 Å²	115.4	63%	0.634	60%	0.604	S	S	*	*			trans	-122.4	135.9	158.6	-142.1	77.5	0	0	0	107.5	L313	L308-L313 HydrophobicContact CD2-CD1 4.22Å
309	D	36.7	Very low	40.2	Very low	112 Å²	112	115.1 Å²	115.1	60%	0.599	61%	0.608	S	S	*	*			trans	-78.1	145.8	171.2	-173	25	0	0	0	110	S311	D309-S311 VanDerWaalsContact C-N 3.34Å; D309-S311 VanDerWaalsContact CG-OG 3.23Å; D309-S311 WeakPolarHBondContact OD2-CB 3.32Å; D309-S311 PolarHBondContact OD2-OG 2.7Å
310	L	42.6	Very low	41	Very low	93 Å²	93	116.8 Å²	116.8	49%	0.487	62%	0.617	S	S	.	*	S	Bend	trans	-80.5	-17.1	-173.1	-107.2	70.7	0	0	0	113.5	Y292 H312 L313	Y292-L310 HydrophobicContact CD1-CD2 3.68Å; Y292-L310 HydrophobicContact CE1-CD2 3.96Å; Y292-L310 HydrophobicContact CG-CD2 4.5Å; L310-H312 VanDerWaalsContact C-N 3.32Å; L310-H312 PolarHBondContact O-N 2.8Å; L310-L313 PolarHBondContact O-N 2.93Å
311	S	40.4	Very low	42.5	Very low	55 Å²	55	113 Å²	113	39%	0.385	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-49.7	-48	173.7	52.5	0	0	0	0	112.7	D309 L313 V314	D309-S311 VanDerWaalsContact C-N 3.34Å; D309-S311 VanDerWaalsContact CG-OG 3.23Å; D309-S311 WeakPolarHBondContact OD2-CB 3.32Å; D309-S311 PolarHBondContact OD2-OG 2.7Å; S311-L313 PolarHBondContact O-N 2.86Å; S311-L313 VanDerWaalsContact O-N 3.14Å; S311-V314 PolarHBondContact O-N 2.92Å
312	H	42.9	Very low	44.2	Very low	157 Å²	157	111.2 Å²	111.2	73%	0.727	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-72.9	-2.7	-175.1	-71.2	-79.7	0	0	0	115.5	L310	L310-H312 VanDerWaalsContact C-N 3.32Å; L310-H312 PolarHBondContact O-N 2.8Å
313	L	41.9	Very low	46.3	Very low	35 Å²	35	107.1 Å²	107.1	18%	0.183	56%	0.563	C	S	.	*	G	3₁₀ helix	trans	-99.3	3.3	179.1	-81.6	148.6	0	0	0	113.5	L308 L310 S311	L308-L313 HydrophobicContact CD2-CD1 4.22Å; L310-L313 PolarHBondContact O-N 2.93Å; S311-L313 PolarHBondContact O-N 2.86Å; S311-L313 VanDerWaalsContact O-N 3.14Å
314	V	42.6	Very low	48.4	Very low	81 Å²	81	104.8 Å²	104.8	49%	0.491	54%	0.544	S	S	.	.			trans	-106.9	76.2	-175.6	-164.2	0	0	0	0	111.3	S311 L320 L322	S311-V314 PolarHBondContact O-N 2.92Å; V314-L320 HydrophobicContact CG1-CD2 4.43Å; V314-L322 HydrophobicContact CB-CD1 4.43Å; V314-L322 HydrophobicContact CG1-CD1 4.26Å; V314-L322 HydrophobicContact CG2-CD1 3.91Å
315	T	46.5	Very low	50.6	Low	60 Å²	60	100.8 Å²	100.8	37%	0.368	53%	0.53	S	S	.	.			trans	-83.9	144.2	164.9	50.8	0	0	0	0	110.8	Q298 Q317 C318	Q298-T315 PolarHBondContact NE2-OG1 2.67Å; T315-Q317 PolarHBondContact O-N 2.87Å; T315-C318 PolarHBondContact O-N 3.3Å; T315-C318 VanDerWaalsContact O-N 3.13Å
316	D	48.9	Very low	53	Low	174 Å²	174	97.7 Å²	97.7	93%	0.93	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	2.3	-178.4	-57.8	-51	0	0	0	116.5
317	Q	50.1	Low	55.5	Low	183 Å²	183	93.6 Å²	93.6	86%	0.855	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	0.2	-175.9	-58.7	175.4	10.1	0	0	112.7	T315	T315-Q317 PolarHBondContact O-N 2.87Å
318	C	51.1	Low	57.6	Low	12 Å²	12	88.4 Å²	88.4	8%	0.081	46%	0.464	C	S	.	.	S	Bend	trans	-104	131.6	-178.2	-72.3	0	0	0	0	112	C295 T315 L320	C295-C318 HydrophobicContact CB-CB 3.84Å; C295-C318 WeakPolarHBondContact CB-SG 3.33Å; C295-C318 WeakPolarHBondContact SG-CB 3.35Å; C295-C318 CovalentContact SG-SG 2.04Å; C295-C318 PolarHBondContact SG-SG 3.18Å; T315-C318 PolarHBondContact O-N 3.3Å; T315-C318 VanDerWaalsContact O-N 3.13Å; C318-L320 PolarHBondContact O-N 3.34Å
319	P	61.4	Low	59.3	Low	67 Å²	67	85.3 Å²	85.3	44%	0.435	45%	0.452	S	S	.	.			trans	-71.2	106.6	-172.1	-15.9	29.1	0	0	0	113	L264 R293	L264-P319 HydrophobicContact CD1-CB 3.72Å; L264-P319 HydrophobicContact CD1-CG 3.93Å; L264-P319 WeakPolarHBondContact CD2-O 3.45Å; R293-P319 PolarHBondContact NH2-O 3.08Å
320	L	61.4	Low	60.3	Low	125 Å²	125	85 Å²	85	65%	0.654	46%	0.459	S	S	*	.	S	Bend	trans	-60.8	151.8	173.2	-68.9	174.9	0	0	0	111.6	V314 C318 L322	V314-L320 HydrophobicContact CG1-CD2 4.43Å; C318-L320 PolarHBondContact O-N 3.34Å; L320-L322 HydrophobicContact CD2-CD1 4.34Å; L320-L322 HydrophobicContact CD2-CG 4.24Å
321	P	68	Low	61.3	Low	65 Å²	65	85.6 Å²	85.6	42%	0.422	47%	0.471	S	S	.	.			cis	-88	149.1	1.2	36.4	-36.6	0	0	0	112.6	R293 F323	R293-P321 VanDerWaalsContact CZ-O 3.23Å; R293-P321 PolarHBondContact NE-O 2.89Å; R293-P321 PolarHBondContact NH2-O 2.78Å; P321-F323 WeakPolarHBondContact CB-O 3.39Å
322	L	72.1	Confident	62.1	Low	19 Å²	19	88.6 Å²	88.6	10%	0.099	48%	0.479	C	S	.	.	S	Bend	trans	-87.8	-14.1	173.9	-68.9	167.1	0	0	0	113	L264 Y292 R293 V314 L320	L264-L322 HydrophobicContact CD2-CD2 3.75Å; Y292-L322 CarbonylContact C-O 3.53Å; Y292-L322 WeakPolarHBondContact CA-O 3.32Å; R293-L322 PolarHBondContact N-O 3.42Å; R293-L322 WeakPolarHBondContact O-CD2 3.43Å; V314-L322 HydrophobicContact CB-CD1 4.43Å; V314-L322 HydrophobicContact CG1-CD1 4.26Å; V314-L322 HydrophobicContact CG2-CD1 3.91Å; L320-L322 HydrophobicContact CD2-CD1 4.34Å; L320-L322 HydrophobicContact CD2-CG 4.24Å
323	F	78.3	Confident	62.8	Low	122 Å²	122	82 Å²	82	54%	0.535	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	163.3	172.3	63.8	-90.8	0	0	0	111.4	R291 Y292 P321	R291-F323 CarbonylContact O-C 3.54Å; R291-F323 VanDerWaalsContact O-CA 3.24Å; R291-F323 WeakPolarHBondContact O-CA 3.41Å; Y292-F323 HydrophobicContact CD1-CB 3.78Å; Y292-F323 HydrophobicContact CE1-CB 3.94Å; P321-F323 WeakPolarHBondContact CB-O 3.39Å
324	Q	77.9	Confident	63.5	Low	73 Å²	73	84.5 Å²	84.5	34%	0.341	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	131.8	173	-168.2	-177.2	20.1	0	0	110.4	W267 W270 T290 R291	W267-Q324 HydrophobicContact CH2-CB 3.65Å; W267-Q324 HydrophobicContact CZ2-CB 4.27Å; W267-Q324 HydrophobicContact CZ3-CB 3.81Å; W270-Q324 HydrophobicContact CH2-CB 4.23Å; W270-Q324 HydrophobicContact CH2-CG 3.93Å; W270-Q324 VanDerWaalsContact CZ3-O 3.28Å; W270-Q324 WeakPolarHBondContact CZ3-O 3.43Å; T290-Q324 CarbonylContact C-O 3.52Å; T290-Q324 WeakPolarHBondContact CA-O 3.19Å; R291-Q324 HydrophobicContact CG-CB 4.08Å; R291-Q324 VanDerWaalsContact CZ-OE1 3.31Å; R291-Q324 PolarHBondContact N-O 2.86Å; R291-Q324 PolarHBondContact O-N 2.89Å
325	T	76.8	Confident	63.7	Low	66 Å²	66	85.8 Å²	85.8	41%	0.405	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	155.9	170.4	52.6	0	0	0	0	111	Q289 T290	Q289-T325 CarbonylContact O-C 3.58Å; Q289-T325 WeakPolarHBondContact O-CA 3.48Å; T290-T325 HydrophobicContact CG2-CG2 4.09Å
326	R	79.9	Confident	63.2	Low	113 Å²	113	87.3 Å²	87.3	43%	0.426	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	156.4	161.7	68.5	-177	172.1	161.2	7.2	110.5	W270 Q288 Q289	W270-R326 VanDerWaalsContact CD1-NH2 3.3Å; W270-R326 HydrophobicContact CD2-CG 4.41Å; W270-R326 VanDerWaalsContact CE2-NE 3.26Å; W270-R326 HydrophobicContact CE3-CG 3.93Å; W270-R326 VanDerWaalsContact CG-NH2 3.28Å; W270-R326 HydrophobicContact CH2-CB 3.91Å; W270-R326 HydrophobicContact CH2-CG 3.62Å; W270-R326 HydrophobicContact CZ2-CG 4.13Å; W270-R326 HydrophobicContact CZ3-CB 4.08Å; W270-R326 HydrophobicContact CZ3-CG 3.52Å; Q288-R326 WeakPolarHBondContact CA-O 3.33Å; Q289-R326 HydrophobicContact CG-CG 3.5Å; Q289-R326 WeakPolarHBondContact CG-O 3.47Å; Q289-R326 PolarHBondContact N-O 2.76Å; Q289-R326 PolarHBondContact O-N 2.72Å; Q289-R326 VanDerWaalsContact OE1-NE 3.16Å
327	N	81.8	Confident	62.4	Low	105 Å²	105	87.7 Å²	87.7	56%	0.561	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	144.6	168.7	-64.8	-13.2	0	0	0	110.2	C287 Q288	C287-N327 CarbonylContact O-C 3.58Å; C287-N327 VanDerWaalsContact O-CA 3.23Å; C287-N327 WeakPolarHBondContact O-CA 3.03Å; Q288-N327 VanDerWaalsContact CG-OD1 3.3Å; Q288-N327 WeakPolarHBondContact CG-OD1 3.48Å; Q288-N327 PolarHBondContact NE2-OD1 2.58Å
328	C	75.4	Confident	61.4	Low	18 Å²	18	85.1 Å²	85.1	12%	0.122	47%	0.471	C	S	.	.			trans	-109.5	164.5	172.1	33.8	0	0	0	0	111.7	C273 C287 Q288 Q289	C273-C328 HydrophobicContact CB-CB 3.73Å; C273-C328 WeakPolarHBondContact CB-SG 3.38Å; C273-C328 WeakPolarHBondContact SG-CB 3.41Å; C273-C328 CovalentContact SG-SG 2.02Å; C273-C328 PolarHBondContact SG-SG 2.8Å; C287-C328 VanDerWaalsContact CB-SG 3.57Å; C287-C328 PolarHBondContact O-N 2.91Å; C287-C328 PolarHBondContact O-SG 2.99Å; Q288-C328 PolarHBondContact N-SG 2.82Å; Q288-C328 VanDerWaalsContact N-SG 3.36Å; Q289-C328 HydrophobicContact CG-CB 4.43Å
329	S	68.1	Low	60.3	Low	56 Å²	56	91.9 Å²	91.9	39%	0.392	51%	0.506	S	S	.	.			trans	-59	140.8	170.5	-179.7	0	0	0	0	110.9	S331 Q332	S329-S331 PolarHBondContact O-N 3.23Å; S329-S331 VanDerWaalsContact O-N 3.14Å; S329-S331 PolarHBondContact OG-N 3.34Å; S329-S331 PolarHBondContact OG-OG 3.41Å; S329-Q332 PolarHBondContact O-N 3.46Å
330	S	58.8	Low	58.8	Low	107 Å²	107	94.2 Å²	94.2	75%	0.748	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-58.3	-23.7	171.1	51.3	0	0	0	0	112.9	Q332 C333	S330-Q332 VanDerWaalsContact C-N 3.29Å; S330-Q332 PolarHBondContact O-N 3.02Å; S330-C333 WeakPolarHBondContact O-CB 3.44Å
331	S	63.6	Low	57.2	Low	104 Å²	104	94.3 Å²	94.3	73%	0.727	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-73.6	-12.1	174.1	63.4	0	0	0	0	115.1	S329	S329-S331 PolarHBondContact O-N 3.23Å; S329-S331 VanDerWaalsContact O-N 3.14Å; S329-S331 PolarHBondContact OG-N 3.34Å; S329-S331 PolarHBondContact OG-OG 3.41Å
332	Q	57.2	Low	55.4	Low	119 Å²	119	98.3 Å²	98.3	56%	0.556	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-105.6	1.6	179.8	-67.3	175.5	-30.2	0	0	112.6	C273 S329 S330 I334	C273-Q332 HydrophobicContact CB-CB 4.2Å; C273-Q332 WeakPolarHBondContact CB-O 3.42Å; S329-Q332 PolarHBondContact O-N 3.46Å; S330-Q332 VanDerWaalsContact C-N 3.29Å; S330-Q332 PolarHBondContact O-N 3.02Å; Q332-I334 PolarHBondContact O-N 3.28Å
333	C	57.3	Low	53.3	Low	18 Å²	18	106.5 Å²	106.5	12%	0.122	58%	0.576	C	S	.	*			trans	-90.6	108.3	-161.9	-166.2	0	0	0	0	112.1	C273 C287 S330 N335	C273-C333 VanDerWaalsContact SG-CA 3.59Å; C287-C333 HydrophobicContact CB-CB 3.73Å; C287-C333 WeakPolarHBondContact CB-SG 3.4Å; C287-C333 WeakPolarHBondContact SG-CB 3.49Å; C287-C333 CovalentContact SG-SG 2.03Å; C287-C333 PolarHBondContact SG-SG 2.95Å; S330-C333 WeakPolarHBondContact O-CB 3.44Å; C333-N335 PolarHBondContact O-N 2.95Å
334	I	56.8	Low	50.8	Low	88 Å²	88	104.4 Å²	104.4	45%	0.451	59%	0.589	S	S	.	*	B	Isolated β-bridge	trans	-72	121.7	-175.7	-57	177.4	0	0	0	109.7	C273 Q332	C273-I334 PolarHBondContact O-N 2.95Å; C273-I334 VanDerWaalsContact O-N 3.16Å; Q332-I334 PolarHBondContact O-N 3.28Å
335	N	46.3	Very low	48.6	Very low	108 Å²	108	106 Å²	106	58%	0.578	62%	0.615	S	S	*	*			trans	-83.1	139.1	172.7	-72.4	-70	0	0	0	110.6	K275 C333	K275-N335 VanDerWaalsContact CD-OD1 3.31Å; K275-N335 WeakPolarHBondContact CD-OD1 3.48Å; K275-N335 PolarHBondContact NZ-OD1 2.81Å; C333-N335 PolarHBondContact O-N 2.95Å
336	S	36.5	Very low	46.2	Very low	92 Å²	92	110.7 Å²	110.7	64%	0.643	63%	0.632	S	S	*	*			trans	70.5	124	174.9	-161.1	0	0	0	0	116.4	N338	S336-N338 PolarHBondContact O-N 3.2Å
337	M	31.2	Very low	43.8	Very low	182 Å²	182	113.1 Å²	113.1	90%	0.897	65%	0.652	S	S	*	*			trans	-74.3	100.4	157.3	-87.7	-176.9	164.1	0	0	109
338	N	30.1	Very low	41.2	Very low	128 Å²	128	112.4 Å²	112.4	68%	0.684	66%	0.656	S	S	*	*	S	Bend	trans	-147.5	104.5	158.3	-96	-44.4	0	0	0	108.3	S336	S336-N338 PolarHBondContact O-N 3.2Å
339	N	27.9	Very low	38.9	Very low	155 Å²	155	118.6 Å²	118.6	83%	0.829	69%	0.687	S	S	*	*			trans	45.7	81.6	167.8	-60	-23.7	0	0	0	117.3
340	V	29.3	Very low	37	Very low	115 Å²	115	124.9 Å²	124.9	70%	0.697	71%	0.713	S	S	*	*			trans	-92.2	108.3	161	177.7	0	0	0	0	109.8	L342	V340-L342 HydrophobicContact CG1-CG 4.49Å
341	V	28.1	Very low	35.5	Very low	127 Å²	127	129.3 Å²	129.3	77%	0.77	72%	0.719	S	S	*	*			trans	-111.9	128.5	166.8	172.8	0	0	0	0	108.5
342	L	29.6	Very low	33.7	Very low	149 Å²	149	129.2 Å²	129.2	78%	0.78	72%	0.716	S	S	*	*			trans	-149.2	127	170.3	-71.4	177.2	0	0	0	107.4	V340	V340-L342 HydrophobicContact CG1-CG 4.49Å
343	K	28.3	Very low	32.5	Very low	191 Å²	191	129.1 Å²	129.1	83%	0.83	73%	0.725	S	S	*	*			cis	-131.4	152.2	-0.1	-60.2	168.8	-178.9	167.5	0	107.1
344	G	26.4	Very low	31	Very low	79 Å²	79	134.7 Å²	134.7	81%	0.814	76%	0.759	S	S	*	*				98	135.5	75.1	0	0	0	0	0	109.6
345	A	31.5	Very low	29.7	Very low	106 Å²	106	136.3 Å²	136.3	88%	0.876	77%	0.773	S	S	*	*			cis	-142.6	-173.7	32.6	0	0	0	0	0	114.7
346	H	26.7	Very low	28.7	Very low	165 Å²	165	137.2 Å²	137.2	76%	0.764	78%	0.783	S	S	*	*			trans	-53.6	141.5	177.8	-91	-116.5	0	0	0	114.5
347	L	28.1	Very low	28.4	Very low	163 Å²	163	141 Å²	141	85%	0.853	79%	0.794	S	S	*	*				-151.9	115.8	104.9	-145.8	72.6	0	0	0	111.7
348	S	27.1	Very low	28.3	Very low	91 Å²	91	140.3 Å²	140.3	64%	0.636	79%	0.787	S	S	*	*			trans	-99.2	84.4	173.5	54.4	0	0	0	0	109.4
349	D	27.1	Very low	28.2	Very low	147 Å²	147	140.9 Å²	140.9	79%	0.786	79%	0.788	S	S	*	*			trans	-171.3	130.5	157.7	-101.8	-32.3	0	0	0	111.2
350	M	28.7	Very low	28.2	Very low	188 Å²	188	139 Å²	139	93%	0.926	78%	0.784	S	S	*	*			trans	154.7	112.1	151.7	-87.2	-66.9	168	0	0	110.2
351	K	28	Very low	28.1	Very low	201 Å²	201	137.4 Å²	137.4	87%	0.874	78%	0.779	S	S	*	*			trans	-88.3	146.8	178.5	-166.9	167.8	179	177.8	0	109.3
352	P	26.1	Very low	28.2	Very low	102 Å²	102	136.8 Å²	136.8	66%	0.662	78%	0.78	S	S	*	*			trans	-81.7	153.1	-158.5	31.5	-37.6	0	0	0	114.6	T354	P352-T354 PolarHBondContact O-N 2.63Å
353	P	30.3	Very low	28.4	Very low	117 Å²	117	134.5 Å²	134.5	76%	0.76	77%	0.774	S	S	*	*			trans	-79.3	104.1	160.3	32.2	-30.2	0	0	0	110.2	T355	P353-T355 PolarHBondContact O-N 3.16Å
354	T	26.5	Very low	28.7	Very low	135 Å²	135	132.6 Å²	132.6	83%	0.828	77%	0.77	S	S	*	*			trans	-71	106.8	160.8	45.9	0	0	0	0	109.5	P352	P352-T354 PolarHBondContact O-N 2.63Å
355	T	30	Very low	29.1	Very low	121 Å²	121	137.8 Å²	137.8	74%	0.742	77%	0.77	S	S	*	*			trans	-126.3	108	171.5	-39.5	0	0	0	0	110.1	P353	P353-T355 PolarHBondContact O-N 3.16Å
356	T	25.7	Very low	29.7	Very low	127 Å²	127	140.3 Å²	140.3	78%	0.779	76%	0.757	S	S	*	*			trans	-75.4	136.7	174.3	48.3	0	0	0	0	110.5
357	L	29.4	Very low	30.7	Very low	171 Å²	171	137.8 Å²	137.8	90%	0.895	75%	0.754	S	S	*	*			trans	-141.7	142.7	158.3	-118.7	150.8	0	0	0	109
358	K	29.9	Very low	31.8	Very low	169 Å²	169	135.5 Å²	135.5	74%	0.735	74%	0.738	S	S	*	*			trans	-116.3	150.3	-161.9	-63.9	173.6	177.8	175.2	0	110.1
359	I	26.6	Very low	33	Very low	139 Å²	139	136 Å²	136	71%	0.713	73%	0.731	S	S	*	*			trans	50.3	128.4	134.3	-61.2	169.1	0	0	0	116.6
360	P	27.8	Very low	34.4	Very low	115 Å²	115	134.3 Å²	134.3	75%	0.747	72%	0.72	S	S	*	*			cis	-120.2	164.6	34	12.8	11.8	0	0	0	113.7
361	S	27.4	Very low	35.9	Very low	83 Å²	83	128.3 Å²	128.3	58%	0.58	70%	0.701	S	S	*	*			cis	76.8	81.2	19.7	87.7	0	0	0	0	117.4
362	S	30.1	Very low	37.8	Very low	113 Å²	113	123.9 Å²	123.9	79%	0.79	69%	0.685	S	S	*	*			trans	71	169.8	154.8	85.8	0	0	0	0	117.6
363	P	35	Very low	39.6	Very low	102 Å²	102	127.2 Å²	127.2	66%	0.662	69%	0.686	S	S	*	*			cis	-129.7	-174.3	-13.1	33.4	-13.5	0	0	0	113.7
364	M	33.4	Very low	41.5	Very low	151 Å²	151	125.4 Å²	125.4	74%	0.744	67%	0.673	S	S	*	*			trans	55.5	99.7	151.5	-70.9	156.8	60.2	0	0	119.3
365	F	34.8	Very low	43.8	Very low	188 Å²	188	120.7 Å²	120.7	83%	0.825	65%	0.651	S	S	*	*				-63.4	139.6	129	-88.8	-92.8	0	0	0	108.4
366	R	45.9	Very low	46	Very low	159 Å²	159	119.7 Å²	119.7	60%	0.6	64%	0.641	S	S	*	*			trans	-78.1	143.7	-170	-66	-169.3	-176.1	179.1	1.6	111.9	E368 E369	R366-E368 HydrophobicContact CB-CB 4.3Å; R366-E368 HydrophobicContact CB-CG 4.39Å; R366-E368 WeakPolarHBondContact CD-OE2 3.33Å; R366-E368 IonicContact CZ-OE2 3.79Å; R366-E368 IonicContact NE-OE2 2.76Å; R366-E368 IonicContact NH1-OE2 2.69Å; R366-E368 PolarHBondContact NH1-OE2 3.19Å; R366-E368 PolarHBondContact O-N 2.94Å; R366-E369 PolarHBondContact O-N 3.21Å
367	T	47	Very low	48.3	Very low	112 Å²	112	121.1 Å²	121.1	69%	0.687	64%	0.637	S	S	*	*	H	α-helix	trans	-59.3	-13.6	170.1	30	0	0	0	0	114.2	A371	T367-A371 PolarHBondContact O-N 3.48Å
368	E	51.5	Low	50.7	Low	114 Å²	114	118.1 Å²	118.1	53%	0.533	62%	0.621	S	S	.	*	H	α-helix	trans	-65.7	-37.5	175.6	-59.3	-179.1	121.3	0	0	112.5	R366 A371 I372	R366-E368 HydrophobicContact CB-CB 4.3Å; R366-E368 HydrophobicContact CB-CG 4.39Å; R366-E368 WeakPolarHBondContact CD-OE2 3.33Å; R366-E368 IonicContact CZ-OE2 3.79Å; R366-E368 IonicContact NE-OE2 2.76Å; R366-E368 IonicContact NH1-OE2 2.69Å; R366-E368 PolarHBondContact NH1-OE2 3.19Å; R366-E368 PolarHBondContact O-N 2.94Å; E368-A371 PolarHBondContact O-N 2.78Å; E368-I372 WeakPolarHBondContact O-CG1 2.99Å; E368-I372 PolarHBondContact O-N 3.4Å
369	E	51.9	Low	52.9	Low	102 Å²	102	113.2 Å²	113.2	48%	0.477	61%	0.608	S	S	.	*	H	α-helix	trans	-73.7	-37.8	179.9	-66.6	-179.5	153.5	0	0	111.7	R366 A371 I372 Y373	R366-E369 PolarHBondContact O-N 3.21Å; E369-A371 VanDerWaalsContact C-N 3.26Å; E369-A371 PolarHBondContact O-N 2.86Å; E369-I372 WeakPolarHBondContact O-CB 3.42Å; E369-I372 PolarHBondContact O-N 3.38Å; E369-I372 VanDerWaalsContact O-N 3.09Å; E369-Y373 VanDerWaalsContact O-CD2 3.31Å; E369-Y373 WeakPolarHBondContact O-CD2 3.39Å; E369-Y373 PolarHBondContact O-N 2.89Å
370	I	55.9	Low	55.4	Low	111 Å²	111	110.9 Å²	110.9	57%	0.569	60%	0.596	S	S	*	*	H	α-helix	trans	-61.4	-38.4	173.4	-58.1	176.1	0	0	0	110.3	I372 Y373 V374	I370-I372 VanDerWaalsContact C-N 3.32Å; I370-I372 PolarHBondContact O-N 3.39Å; I370-Y373 PolarHBondContact O-N 3.19Å; I370-V374 HydrophobicContact CG2-CG2 4.23Å; I370-V374 WeakPolarHBondContact O-CB 3.45Å; I370-V374 WeakPolarHBondContact O-CG2 3.39Å; I370-V374 PolarHBondContact O-N 3.27Å
371	A	61.9	Low	57.6	Low	62 Å²	62	107.6 Å²	107.6	51%	0.512	58%	0.579	S	S	.	*	H	α-helix	trans	-64.2	-34.3	174.9	0	0	0	0	0	112.8	T367 E368 E369 G375	T367-A371 PolarHBondContact O-N 3.48Å; E368-A371 PolarHBondContact O-N 2.78Å; E369-A371 VanDerWaalsContact C-N 3.26Å; E369-A371 PolarHBondContact O-N 2.86Å; A371-G375 PolarHBondContact O-N 3.14Å
372	I	67	Low	60.3	Low	108 Å²	108	108 Å²	108	55%	0.554	58%	0.578	S	S	*	*	H	α-helix	trans	-68.1	-45.8	173.6	-66.2	166.7	0	0	0	110.7	E368 E369 I370 G375 L376	E368-I372 WeakPolarHBondContact O-CG1 2.99Å; E368-I372 PolarHBondContact O-N 3.4Å; E369-I372 WeakPolarHBondContact O-CB 3.42Å; E369-I372 PolarHBondContact O-N 3.38Å; E369-I372 VanDerWaalsContact O-N 3.09Å; I370-I372 VanDerWaalsContact C-N 3.32Å; I370-I372 PolarHBondContact O-N 3.39Å; I372-G375 PolarHBondContact O-N 2.96Å; I372-L376 HydrophobicContact CG2-CD1 4.05Å; I372-L376 WeakPolarHBondContact O-CB 3.47Å; I372-L376 WeakPolarHBondContact O-CG 3.32Å; I372-L376 PolarHBondContact O-N 2.88Å
373	Y	62.8	Low	62.7	Low	173 Å²	173	107.8 Å²	107.8	68%	0.678	57%	0.567	S	S	*	*	H	α-helix	trans	-65.3	-42.5	177.5	-80.2	-72.1	0	0	0	112.9	E369 I370 L376 F377	E369-Y373 VanDerWaalsContact O-CD2 3.31Å; E369-Y373 WeakPolarHBondContact O-CD2 3.39Å; E369-Y373 PolarHBondContact O-N 2.89Å; I370-Y373 PolarHBondContact O-N 3.19Å; Y373-L376 PolarHBondContact O-N 3.35Å; Y373-F377 WeakPolarHBondContact O-CB 3.17Å; Y373-F377 PolarHBondContact O-N 3.05Å
374	V	70.6	Confident	64.7	Low	78 Å²	78	108 Å²	108	47%	0.473	56%	0.562	S	S	.	*	H	α-helix	trans	-65.5	-38.9	173.6	172.4	0	0	0	0	111	I370 F377 L378	I370-V374 HydrophobicContact CG2-CG2 4.23Å; I370-V374 WeakPolarHBondContact O-CB 3.45Å; I370-V374 WeakPolarHBondContact O-CG2 3.39Å; I370-V374 PolarHBondContact O-N 3.27Å; V374-F377 PolarHBondContact O-N 3.27Å; V374-L378 HydrophobicContact CG1-CD1 3.85Å; V374-L378 HydrophobicContact CG1-CG 4.27Å; V374-L378 WeakPolarHBondContact O-CB 3.27Å; V374-L378 VanDerWaalsContact O-CG 3.29Å; V374-L378 WeakPolarHBondContact O-CG 3.34Å; V374-L378 PolarHBondContact O-N 2.88Å
375	G	74.5	Confident	66.8	Low	37 Å²	37	103.2 Å²	103.2	38%	0.381	55%	0.547	S	S	.	.	H	α-helix	trans	-64.3	-38.5	174.3	0	0	0	0	0	113.4	A371 I372 S379	A371-G375 PolarHBondContact O-N 3.14Å; I372-G375 PolarHBondContact O-N 2.96Å; G375-S379 VanDerWaalsContact O-CB 3.25Å; G375-S379 WeakPolarHBondContact O-CB 3.47Å; G375-S379 PolarHBondContact O-N 2.83Å; G375-S379 PolarHBondContact O-OG 3.03Å
376	L	77.1	Confident	69	Low	100 Å²	100	97.4 Å²	97.4	52%	0.524	53%	0.526	S	S	.	.	H	α-helix	trans	-67.3	-43.3	172	-79.1	166.9	0	0	0	111.6	I372 Y373 S379 L380	I372-L376 HydrophobicContact CG2-CD1 4.05Å; I372-L376 WeakPolarHBondContact O-CB 3.47Å; I372-L376 WeakPolarHBondContact O-CG 3.32Å; I372-L376 PolarHBondContact O-N 2.88Å; Y373-L376 PolarHBondContact O-N 3.35Å; L376-S379 WeakPolarHBondContact CA-OG 3.31Å; L376-S379 PolarHBondContact O-N 3.03Å; L376-S379 PolarHBondContact O-OG 3.33Å; L376-S379 VanDerWaalsContact O-OG 3.06Å; L376-L380 VanDerWaalsContact O-CB 3.29Å; L376-L380 WeakPolarHBondContact O-CB 3.34Å; L376-L380 PolarHBondContact O-N 3.24Å
377	F	73.5	Confident	70.4	Confident	157 Å²	157	93.3 Å²	93.3	69%	0.689	52%	0.519	S	S	*	.	H	α-helix	trans	-67.1	-40.6	179	-156	-88.1	0	0	0	112.1	Y373 V374 A381	Y373-F377 WeakPolarHBondContact O-CB 3.17Å; Y373-F377 PolarHBondContact O-N 3.05Å; V374-F377 PolarHBondContact O-N 3.27Å; F377-A381 VanDerWaalsContact O-CB 3.3Å; F377-A381 WeakPolarHBondContact O-CB 3.34Å; F377-A381 PolarHBondContact O-N 3.34Å
378	L	80.1	Confident	71.6	Confident	108 Å²	108	90.3 Å²	90.3	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-67.9	-40.9	173.5	-72.3	173.5	0	0	0	112.1	V374 A381 V382	V374-L378 HydrophobicContact CG1-CD1 3.85Å; V374-L378 HydrophobicContact CG1-CG 4.27Å; V374-L378 WeakPolarHBondContact O-CB 3.27Å; V374-L378 VanDerWaalsContact O-CG 3.29Å; V374-L378 WeakPolarHBondContact O-CG 3.34Å; V374-L378 PolarHBondContact O-N 2.88Å; L378-A381 PolarHBondContact O-N 3.1Å; L378-V382 WeakPolarHBondContact O-CB 3.43Å; L378-V382 VanDerWaalsContact O-CG2 3.31Å; L378-V382 WeakPolarHBondContact O-CG2 3.23Å; L378-V382 PolarHBondContact O-N 3.06Å
379	S	77.1	Confident	72.7	Confident	66 Å²	66	89.8 Å²	89.8	46%	0.462	51%	0.506	S	S	.	.	H	α-helix	trans	-68.4	-35.4	176.7	65.7	0	0	0	0	111.9	G375 L376 V382 L383	G375-S379 VanDerWaalsContact O-CB 3.25Å; G375-S379 WeakPolarHBondContact O-CB 3.47Å; G375-S379 PolarHBondContact O-N 2.83Å; G375-S379 PolarHBondContact O-OG 3.03Å; L376-S379 WeakPolarHBondContact CA-OG 3.31Å; L376-S379 PolarHBondContact O-N 3.03Å; L376-S379 PolarHBondContact O-OG 3.33Å; L376-S379 VanDerWaalsContact O-OG 3.06Å; S379-V382 PolarHBondContact O-N 3.31Å; S379-L383 VanDerWaalsContact O-CB 3.28Å; S379-L383 WeakPolarHBondContact O-CB 3.22Å; S379-L383 PolarHBondContact O-N 2.84Å
380	L	78.8	Confident	73.7	Confident	90 Å²	90	88.9 Å²	88.9	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-67	-42.2	170.7	-176.8	62.4	0	0	0	112	L376 V382 L383 L384	L376-L380 VanDerWaalsContact O-CB 3.29Å; L376-L380 WeakPolarHBondContact O-CB 3.34Å; L376-L380 PolarHBondContact O-N 3.24Å; L380-V382 VanDerWaalsContact C-N 3.35Å; L380-V382 PolarHBondContact O-N 2.91Å; L380-L383 PolarHBondContact O-N 3.09Å; L380-L384 HydrophobicContact CD1-CD1 4.44Å; L380-L384 HydrophobicContact CD1-CG 4.36Å; L380-L384 HydrophobicContact CG-CD1 4.15Å; L380-L384 HydrophobicContact CG-CG 4.49Å; L380-L384 WeakPolarHBondContact O-CB 3.3Å; L380-L384 VanDerWaalsContact O-CG 3.3Å; L380-L384 WeakPolarHBondContact O-CG 3.5Å; L380-L384 PolarHBondContact O-N 3.14Å
381	A	74.5	Confident	74	Confident	46 Å²	46	87.5 Å²	87.5	38%	0.38	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-40	175.2	0	0	0	0	0	111.9	F377 L378 A385	F377-A381 VanDerWaalsContact O-CB 3.3Å; F377-A381 WeakPolarHBondContact O-CB 3.34Å; F377-A381 PolarHBondContact O-N 3.34Å; L378-A381 PolarHBondContact O-N 3.1Å; A381-A385 VanDerWaalsContact O-CB 3.31Å; A381-A385 WeakPolarHBondContact O-CB 3.24Å; A381-A385 PolarHBondContact O-N 3.12Å
382	V	82.1	Confident	73.9	Confident	92 Å²	92	93.2 Å²	93.2	56%	0.558	51%	0.508	S	S	*	.	H	α-helix	trans	-67	-40.5	171.9	170.1	0	0	0	0	111	L378 S379 L380 A385 V386	L378-V382 WeakPolarHBondContact O-CB 3.43Å; L378-V382 VanDerWaalsContact O-CG2 3.31Å; L378-V382 WeakPolarHBondContact O-CG2 3.23Å; L378-V382 PolarHBondContact O-N 3.06Å; S379-V382 PolarHBondContact O-N 3.31Å; L380-V382 VanDerWaalsContact C-N 3.35Å; L380-V382 PolarHBondContact O-N 2.91Å; V382-A385 PolarHBondContact O-N 3.49Å; V382-V386 HydrophobicContact CG1-CG2 4.29Å; V382-V386 WeakPolarHBondContact O-CB 3.3Å; V382-V386 VanDerWaalsContact O-CG2 3.26Å; V382-V386 WeakPolarHBondContact O-CG2 3.29Å; V382-V386 PolarHBondContact O-N 3.36Å
383	L	80.6	Confident	73.4	Confident	107 Å²	107	97.7 Å²	97.7	56%	0.56	52%	0.518	S	S	*	.	H	α-helix	trans	-62.9	-44.2	176	-165.6	79.1	0	0	0	111.1	S379 L380 V386 V387	S379-L383 VanDerWaalsContact O-CB 3.28Å; S379-L383 WeakPolarHBondContact O-CB 3.22Å; S379-L383 PolarHBondContact O-N 2.84Å; L380-L383 PolarHBondContact O-N 3.09Å; L383-V386 CarbonylContact O-C 3.57Å; L383-V386 PolarHBondContact O-N 2.83Å; L383-V387 WeakPolarHBondContact O-CB 3.42Å; L383-V387 VanDerWaalsContact O-CG2 3.27Å; L383-V387 WeakPolarHBondContact O-CG2 3.27Å; L383-V387 PolarHBondContact O-N 2.84Å
384	L	78.4	Confident	72.5	Confident	107 Å²	107	96.2 Å²	96.2	56%	0.56	52%	0.515	S	S	*	.	H	α-helix	trans	-65.8	-38.6	175.4	-71.4	171	0	0	0	111.9	L380 V387 A388	L380-L384 HydrophobicContact CD1-CD1 4.44Å; L380-L384 HydrophobicContact CD1-CG 4.36Å; L380-L384 HydrophobicContact CG-CD1 4.15Å; L380-L384 HydrophobicContact CG-CG 4.49Å; L380-L384 WeakPolarHBondContact O-CB 3.3Å; L380-L384 VanDerWaalsContact O-CG 3.3Å; L380-L384 WeakPolarHBondContact O-CG 3.5Å; L380-L384 PolarHBondContact O-N 3.14Å; L384-V387 PolarHBondContact O-N 3.07Å; L384-A388 VanDerWaalsContact O-CB 3.27Å; L384-A388 WeakPolarHBondContact O-CB 3.47Å; L384-A388 PolarHBondContact O-N 2.83Å
385	A	77.9	Confident	71.1	Confident	51 Å²	51	95.1 Å²	95.1	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-39.4	172.7	0	0	0	0	0	112.2	A381 V382 A388 L389	A381-A385 VanDerWaalsContact O-CB 3.31Å; A381-A385 WeakPolarHBondContact O-CB 3.24Å; A381-A385 PolarHBondContact O-N 3.12Å; V382-A385 PolarHBondContact O-N 3.49Å; A385-A388 PolarHBondContact O-N 2.84Å; A385-L389 WeakPolarHBondContact O-CB 3.28Å; A385-L389 VanDerWaalsContact O-CG 3.24Å; A385-L389 WeakPolarHBondContact O-CG 3.37Å; A385-L389 PolarHBondContact O-N 2.84Å
386	V	80	Confident	69.7	Low	65 Å²	65	99.6 Å²	99.6	39%	0.394	53%	0.526	S	S	.	.	H	α-helix	trans	-68.4	-40.9	174.7	166.8	0	0	0	0	110.9	V382 L383 L389 I390	V382-V386 HydrophobicContact CG1-CG2 4.29Å; V382-V386 WeakPolarHBondContact O-CB 3.3Å; V382-V386 VanDerWaalsContact O-CG2 3.26Å; V382-V386 WeakPolarHBondContact O-CG2 3.29Å; V382-V386 PolarHBondContact O-N 3.36Å; L383-V386 CarbonylContact O-C 3.57Å; L383-V386 PolarHBondContact O-N 2.83Å; V386-L389 CarbonylContact O-C 3.54Å; V386-L389 PolarHBondContact O-N 2.82Å; V386-I390 HydrophobicContact CG1-CD1 3.67Å; V386-I390 HydrophobicContact CG1-CG1 4.38Å; V386-I390 WeakPolarHBondContact O-CB 3.5Å; V386-I390 VanDerWaalsContact O-CG1 3.22Å; V386-I390 WeakPolarHBondContact O-CG1 3.33Å; V386-I390 PolarHBondContact O-N 3.04Å
387	V	76.2	Confident	67.8	Low	74 Å²	74	103.7 Å²	103.7	45%	0.448	54%	0.539	S	S	.	.	H	α-helix	trans	-62.1	-44.9	171.9	167.5	0	0	0	0	110.2	L383 L384 L389 I390 T391	L383-V387 WeakPolarHBondContact O-CB 3.42Å; L383-V387 VanDerWaalsContact O-CG2 3.27Å; L383-V387 WeakPolarHBondContact O-CG2 3.27Å; L383-V387 PolarHBondContact O-N 2.84Å; L384-V387 PolarHBondContact O-N 3.07Å; V387-L389 VanDerWaalsContact C-N 3.31Å; V387-L389 PolarHBondContact O-N 2.73Å; V387-I390 CarbonylContact O-C 3.58Å; V387-I390 PolarHBondContact O-N 2.84Å; V387-I390 VanDerWaalsContact O-N 3.1Å; V387-T391 HydrophobicContact CG1-CG2 4.28Å; V387-T391 WeakPolarHBondContact O-CG2 3.45Å; V387-T391 PolarHBondContact O-N 2.96Å; V387-T391 PolarHBondContact O-OG1 2.77Å; V387-T391 VanDerWaalsContact O-OG1 3.12Å
388	A	71.4	Confident	66	Low	48 Å²	48	104.8 Å²	104.8	40%	0.397	54%	0.544	S	S	.	.	H	α-helix	trans	-63.3	-34.3	175	0	0	0	0	0	112.9	L384 A385 T391 R392	L384-A388 VanDerWaalsContact O-CB 3.27Å; L384-A388 WeakPolarHBondContact O-CB 3.47Å; L384-A388 PolarHBondContact O-N 2.83Å; A385-A388 PolarHBondContact O-N 2.84Å; A388-T391 WeakPolarHBondContact CA-OG1 3.32Å; A388-T391 PolarHBondContact O-OG1 3.14Å; A388-R392 VanDerWaalsContact O-CB 3.24Å; A388-R392 WeakPolarHBondContact O-CB 3.49Å; A388-R392 VanDerWaalsContact O-CG 3.3Å; A388-R392 WeakPolarHBondContact O-CG 3.44Å; A388-R392 PolarHBondContact O-N 2.94Å
389	L	75	Confident	63.7	Low	104 Å²	104	103.7 Å²	103.7	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-73.6	-30	172.3	-74.2	168.1	0	0	0	112.5	A385 V386 V387 R393	A385-L389 WeakPolarHBondContact O-CB 3.28Å; A385-L389 VanDerWaalsContact O-CG 3.24Å; A385-L389 WeakPolarHBondContact O-CG 3.37Å; A385-L389 PolarHBondContact O-N 2.84Å; V386-L389 CarbonylContact O-C 3.54Å; V386-L389 PolarHBondContact O-N 2.82Å; V387-L389 VanDerWaalsContact C-N 3.31Å; V387-L389 PolarHBondContact O-N 2.73Å; L389-R393 VanDerWaalsContact O-CB 3.24Å; L389-R393 WeakPolarHBondContact O-CB 3.27Å; L389-R393 VanDerWaalsContact O-CG 3.3Å; L389-R393 WeakPolarHBondContact O-CG 3.36Å; L389-R393 PolarHBondContact O-N 3.29Å
390	I	72.7	Confident	61.6	Low	82 Å²	82	106 Å²	106	42%	0.421	56%	0.557	S	S	.	*	H	α-helix	trans	-79.6	-39.5	176.3	-72.3	168.4	0	0	0	111.2	V386 V387 R393 K394	V386-I390 HydrophobicContact CG1-CD1 3.67Å; V386-I390 HydrophobicContact CG1-CG1 4.38Å; V386-I390 WeakPolarHBondContact O-CB 3.5Å; V386-I390 VanDerWaalsContact O-CG1 3.22Å; V386-I390 WeakPolarHBondContact O-CG1 3.33Å; V386-I390 PolarHBondContact O-N 3.04Å; V387-I390 CarbonylContact O-C 3.58Å; V387-I390 PolarHBondContact O-N 2.84Å; V387-I390 VanDerWaalsContact O-N 3.1Å; I390-R393 CarbonylContact O-C 3.47Å; I390-R393 PolarHBondContact O-N 3.47Å; I390-K394 HydrophobicContact CG2-CD 4.36Å; I390-K394 HydrophobicContact CG2-CG 4.45Å; I390-K394 WeakPolarHBondContact O-CB 3.32Å; I390-K394 WeakPolarHBondContact O-CG 3.37Å; I390-K394 PolarHBondContact O-N 2.88Å
391	T	62.7	Low	59.3	Low	83 Å²	83	108 Å²	108	51%	0.509	57%	0.573	S	S	.	*	H	α-helix	trans	-67	-40.9	172.3	56	0	0	0	0	110.3	V387 A388 K394 S395	V387-T391 HydrophobicContact CG1-CG2 4.28Å; V387-T391 WeakPolarHBondContact O-CG2 3.45Å; V387-T391 PolarHBondContact O-N 2.96Å; V387-T391 PolarHBondContact O-OG1 2.77Å; V387-T391 VanDerWaalsContact O-OG1 3.12Å; A388-T391 WeakPolarHBondContact CA-OG1 3.32Å; A388-T391 PolarHBondContact O-OG1 3.14Å; T391-K394 PolarHBondContact O-N 2.96Å; T391-S395 WeakPolarHBondContact O-CB 3.27Å; T391-S395 PolarHBondContact O-N 3.09Å
392	R	59.6	Low	57.2	Low	182 Å²	182	115.8 Å²	115.8	69%	0.687	59%	0.592	S	S	*	*	H	α-helix	trans	-58.3	-48.7	166.2	-79.9	179.9	163.1	-179	-4.9	112	A388 K394 S395 L396	A388-R392 VanDerWaalsContact O-CB 3.24Å; A388-R392 WeakPolarHBondContact O-CB 3.49Å; A388-R392 VanDerWaalsContact O-CG 3.3Å; A388-R392 WeakPolarHBondContact O-CG 3.44Å; A388-R392 PolarHBondContact O-N 2.94Å; R392-K394 PolarHBondContact O-N 3.23Å; R392-S395 WeakPolarHBondContact O-CB 3.34Å; R392-S395 PolarHBondContact O-N 3.24Å; R392-L396 WeakPolarHBondContact O-CB 3.5Å; R392-L396 WeakPolarHBondContact O-CD1 3.39Å; R392-L396 PolarHBondContact O-N 2.94Å
393	R	56.7	Low	54.7	Low	201 Å²	201	114.6 Å²	114.6	76%	0.758	59%	0.593	S	S	*	*	H	α-helix	trans	-66.3	-30	179.1	-83.9	-179.9	166.3	-172.5	-3.3	114.5	L389 I390 K397	L389-R393 VanDerWaalsContact O-CB 3.24Å; L389-R393 WeakPolarHBondContact O-CB 3.27Å; L389-R393 VanDerWaalsContact O-CG 3.3Å; L389-R393 WeakPolarHBondContact O-CG 3.36Å; L389-R393 PolarHBondContact O-N 3.29Å; I390-R393 CarbonylContact O-C 3.47Å; I390-R393 PolarHBondContact O-N 3.47Å; R393-K397 PolarHBondContact O-N 3.3Å
394	K	42.6	Very low	52.3	Low	143 Å²	143	115.5 Å²	115.5	62%	0.622	60%	0.597	S	S	*	*	H	α-helix	trans	-75.5	-41.7	172.5	-73.7	-173.3	-179.8	-173.1	0	111	I390 T391 R392 L396 K397 F398	I390-K394 HydrophobicContact CG2-CD 4.36Å; I390-K394 HydrophobicContact CG2-CG 4.45Å; I390-K394 WeakPolarHBondContact O-CB 3.32Å; I390-K394 WeakPolarHBondContact O-CG 3.37Å; I390-K394 PolarHBondContact O-N 2.88Å; T391-K394 PolarHBondContact O-N 2.96Å; R392-K394 PolarHBondContact O-N 3.23Å; K394-L396 VanDerWaalsContact C-N 3.35Å; K394-L396 PolarHBondContact O-N 3.11Å; K394-K397 CarbonylContact O-C 3.56Å; K394-K397 PolarHBondContact O-N 2.84Å; K394-F398 PolarHBondContact O-N 2.89Å; K394-F398 VanDerWaalsContact O-N 3.14Å
395	S	42.7	Very low	49.9	Very low	55 Å²	55	118.6 Å²	118.6	39%	0.385	60%	0.601	S	S	.	*	H	α-helix	trans	-56.3	-46.5	170.2	175.6	0	0	0	0	111.5	T391 R392 K397 F398 S399	T391-S395 WeakPolarHBondContact O-CB 3.27Å; T391-S395 PolarHBondContact O-N 3.09Å; R392-S395 WeakPolarHBondContact O-CB 3.34Å; R392-S395 PolarHBondContact O-N 3.24Å; S395-K397 PolarHBondContact O-N 3.29Å; S395-K397 VanDerWaalsContact O-N 3.07Å; S395-F398 CarbonylContact O-C 3.56Å; S395-F398 PolarHBondContact O-N 2.72Å; S395-F398 VanDerWaalsContact O-N 3.11Å; S395-S399 WeakPolarHBondContact O-CA 3.47Å; S395-S399 WeakPolarHBondContact O-CB 3.45Å; S395-S399 PolarHBondContact O-N 2.93Å
396	L	44	Very low	47.7	Very low	130 Å²	130	126 Å²	126	68%	0.681	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-2.3	174.2	-90.5	99	0	0	0	115.4	R392 K394	R392-L396 WeakPolarHBondContact O-CB 3.5Å; R392-L396 WeakPolarHBondContact O-CD1 3.39Å; R392-L396 PolarHBondContact O-N 2.94Å; K394-L396 VanDerWaalsContact C-N 3.35Å; K394-L396 PolarHBondContact O-N 3.11Å
397	K	37.5	Very low	45.3	Very low	186 Å²	186	129 Å²	129	81%	0.809	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	3.5	171	-77.3	-162.4	172.2	-167.4	0	114.3	R393 K394 S395	R393-K397 PolarHBondContact O-N 3.3Å; K394-K397 CarbonylContact O-C 3.56Å; K394-K397 PolarHBondContact O-N 2.84Å; S395-K397 PolarHBondContact O-N 3.29Å; S395-K397 VanDerWaalsContact O-N 3.07Å
398	F	35	Very low	43	Very low	181 Å²	181	130.1 Å²	130.1	79%	0.794	66%	0.66	S	S	*	*	S	Bend	trans	-127.4	35.7	169.6	-137.9	-94.5	0	0	0	109.8	K394 S395 T400	K394-F398 PolarHBondContact O-N 2.89Å; K394-F398 VanDerWaalsContact O-N 3.14Å; S395-F398 CarbonylContact O-C 3.56Å; S395-F398 PolarHBondContact O-N 2.72Å; S395-F398 VanDerWaalsContact O-N 3.11Å; F398-T400 VanDerWaalsContact C-N 3.27Å; F398-T400 PolarHBondContact O-N 3.36Å
399	S	33.1	Very low	41	Very low	84 Å²	84	134.2 Å²	134.2	59%	0.587	69%	0.685	S	S	*	*			trans	-86.3	46.8	-158.5	-167.3	0	0	0	0	114.5	S395	S395-S399 WeakPolarHBondContact O-CA 3.47Å; S395-S399 WeakPolarHBondContact O-CB 3.45Å; S395-S399 PolarHBondContact O-N 2.93Å
400	T	31.5	Very low	38.9	Very low	115 Å²	115	136.7 Å²	136.7	71%	0.706	70%	0.698	S	S	*	*	S	Bend	trans	-136.8	118.3	169.5	46.8	0	0	0	0	109.4	F398	F398-T400 VanDerWaalsContact C-N 3.27Å; F398-T400 PolarHBondContact O-N 3.36Å
401	T	31.3	Very low	37	Very low	133 Å²	133	139.2 Å²	139.2	82%	0.816	71%	0.707	S	S	*	*	S	Bend	trans	75.1	142.8	-172.3	-21.4	0	0	0	0	114.4
402	R	30.3	Very low	35.5	Very low	208 Å²	208	141.1 Å²	141.1	79%	0.785	72%	0.724	S	S	*	*	S	Bend	trans	58	53.2	177.4	-71	-175.7	164.2	-156.5	-7.2	117.1
403	A	29.1	Very low	34.2	Very low	68 Å²	68	139.2 Å²	139.2	56%	0.562	72%	0.721	S	S	*	*	S	Bend	trans	-155.3	18.7	162.9	0	0	0	0	0	116.3
404	I	30	Very low	32.9	Very low	126 Å²	126	137.5 Å²	137.5	65%	0.646	71%	0.714	S	S	*	*			trans	-140.1	93.5	178.8	-52.3	177	0	0	0	109.9	Y18	Y18-I404 HydrophobicContact CE1-CD1 3.62Å
405	R	29.6	Very low	32.2	Very low	172 Å²	172	136.1 Å²	136.1	65%	0.649	72%	0.723	S	S	*	*			trans	-169.9	30.3	155.6	-114.4	-172.1	-151.9	173.2	4.9	117.2	E76	E76-R405 IonicContact OE1-NH1 3.81Å; E76-R405 WeakPolarHBondContact OE2-CD 3.43Å; E76-R405 IonicContact OE2-CZ 2.75Å; E76-R405 IonicContact OE2-NE 2.74Å; E76-R405 IonicContact OE2-NH1 2.76Å; E76-R405 PolarHBondContact OE2-NH1 2.9Å
406	Y	30.6	Very low	31.5	Very low	206 Å²	206	139.5 Å²	139.5	81%	0.808	75%	0.745	S	S	*	*	S	Bend	trans	-128.5	142.6	162.2	-84.2	-83.1	0	0	0	109.9
407	S	29.6	Very low	30.8	Very low	128 Å²	128	143.9 Å²	143.9	90%	0.895	75%	0.752	S	S	*	*	S	Bend	trans	68.9	44.9	-176.4	68.5	0	0	0	0	118.3
408	A	29	Very low	30.2	Very low	98 Å²	98	143.4 Å²	143.4	81%	0.81	75%	0.753	S	S	*	*			trans	-156	84.7	163.8	0	0	0	0	0	115.1
409	C	27.9	Very low	29.9	Very low	134 Å²	134	142.4 Å²	142.4	91%	0.905	75%	0.751	S	S	*	*			trans	-150.2	42	152.9	-155.6	0	0	0	0	111.9	H411	C409-H411 PolarHBondContact O-N 2.75Å
410	L	30.5	Very low	29.9	Very low	156 Å²	156	145.2 Å²	145.2	82%	0.817	76%	0.758	S	S	*	*			trans	-96.8	67	-175.7	-148.5	177.9	0	0	0	110.5
411	H	34	Very low	29.7	Very low	134 Å²	134	143.6 Å²	143.6	62%	0.62	76%	0.756	S	S	*	*			trans	-171.2	106.5	155.5	-90.4	-19	0	0	0	113.9	C409 K413	C409-H411 PolarHBondContact O-N 2.75Å; H411-K413 PolarHBondContact CD2-NZ 2.82Å; H411-K413 VanDerWaalsContact CD2-NZ 3.34Å; H411-K413 WeakPolarHBondContact CE1-CE 3.5Å; H411-K413 PolarHBondContact CE1-NZ 3.01Å; H411-K413 VanDerWaalsContact CE1-NZ 3.33Å; H411-K413 WeakPolarHBondContact NE2-CE 3.25Å; H411-K413 PolarHBondContact NE2-NZ 3.37Å
412	S	30.9	Very low	29.6	Very low	124 Å²	124	144.2 Å²	144.2	87%	0.867	76%	0.755	S	S	*	*				-110.2	140.3	125.1	-171	0	0	0	0	108.1
413	K	33	Very low	29.8	Very low	142 Å²	142	144.2 Å²	144.2	62%	0.617	76%	0.76	S	S	*	*			trans	-121.1	156.7	176.6	-72.3	162.9	154.6	148.8	0	105.7	H411	H411-K413 PolarHBondContact CD2-NZ 2.82Å; H411-K413 VanDerWaalsContact CD2-NZ 3.34Å; H411-K413 WeakPolarHBondContact CE1-CE 3.5Å; H411-K413 PolarHBondContact CE1-NZ 3.01Å; H411-K413 VanDerWaalsContact CE1-NZ 3.33Å; H411-K413 WeakPolarHBondContact NE2-CE 3.25Å; H411-K413 PolarHBondContact NE2-NZ 3.37Å
414	R	28.5	Very low	29.9	Very low	164 Å²	164	150.2 Å²	150.2	62%	0.619	77%	0.774	S	S	*	*			cis	-157.4	-179.4	42.9	-65.6	172.2	177.1	166.4	2.6	111.3	D967	R414-D967 IonicContact CZ-OD2 3.73Å; R414-D967 IonicContact NH1-OD2 2.68Å; R414-D967 PolarHBondContact NH1-OD2 2.86Å
415	S	29	Very low	29.9	Very low	114 Å²	114	147.4 Å²	147.4	80%	0.797	77%	0.77	S	S	*	*			trans	78.4	138	166.5	-140.3	0	0	0	0	115.7
416	C	27.9	Very low	29.9	Very low	126 Å²	126	147.4 Å²	147.4	85%	0.851	78%	0.777	S	S	*	*			cis	-132.4	-174.9	-8.2	-144.6	0	0	0	0	111.5
417	R	27.7	Very low	30.1	Very low	223 Å²	223	144.2 Å²	144.2	84%	0.842	77%	0.774	S	S	*	*			trans	-137.2	161.3	-170	-157.1	-175.4	-168.4	-164.1	5.5	111.2
418	Q	26	Very low	29.9	Very low	176 Å²	176	145 Å²	145	82%	0.822	77%	0.767	S	S	*	*			trans	82.6	144.2	-172.3	-56.6	166.3	-111.6	0	0	111.2
419	E	28.1	Very low	30	Very low	159 Å²	159	148.4 Å²	148.4	74%	0.743	77%	0.771	S	S	*	*			cis	-144.8	172.1	24.1	-135.3	173.2	-167.2	0	0	113.4
420	I	32.5	Very low	30.1	Very low	143 Å²	143	149.7 Å²	149.7	73%	0.733	77%	0.768	S	S	*	*			trans	47.3	115.1	160.3	-55.2	156.6	0	0	0	118.1
421	A	27.7	Very low	30.3	Very low	82 Å²	82	148.1 Å²	148.1	68%	0.678	77%	0.767	S	S	*	*			cis	91.2	123.7	24.5	0	0	0	0	0	118
422	N	29.3	Very low	30.2	Very low	146 Å²	146	145.1 Å²	145.1	78%	0.781	77%	0.772	S	S	*	*			trans	77.2	99.8	159.2	-65.8	-34.7	0	0	0	122.8
423	K	35	Very low	30.2	Very low	207 Å²	207	145.6 Å²	145.6	90%	0.9	77%	0.765	S	S	*	*				-172	116.9	124	-98.1	164.6	-175.7	178.9	0	106.1
424	K	30.3	Very low	30	Very low	194 Å²	194	146 Å²	146	84%	0.843	77%	0.771	S	S	*	*			cis	54.6	131.3	47	-79.2	-162.9	171.7	-173.5	0	113.9
425	A	29.8	Very low	30.1	Very low	68 Å²	68	144.2 Å²	144.2	56%	0.562	78%	0.778	S	S	*	*			cis	-170	169.1	-14.2	0	0	0	0	0	109.4
426	Q	31	Very low	30	Very low	172 Å²	172	146.7 Å²	146.7	80%	0.804	78%	0.777	S	S	*	*			trans	68.6	148.5	162.2	-68.7	154.3	-92.6	0	0	116.1
427	D	33.7	Very low	30	Very low	138 Å²	138	146.1 Å²	146.1	74%	0.738	77%	0.77	S	S	*	*			cis	-116.8	157.9	-5.4	-68.2	-64.1	0	0	0	109.8
428	L	26.9	Very low	29.7	Very low	144 Å²	144	141.4 Å²	141.4	75%	0.754	77%	0.766	S	S	*	*			cis	79.5	76.5	36.8	-121	179.4	0	0	0	115.7
429	L	31.3	Very low	29.8	Very low	171 Å²	171	140 Å²	140	90%	0.895	76%	0.763	S	S	*	*			trans	-163.9	169.3	130.8	-103	165.8	0	0	0	111.5
430	L	28.5	Very low	29.8	Very low	160 Å²	160	137.3 Å²	137.3	84%	0.838	76%	0.757	S	S	*	*			trans	-115.1	171.9	-159.6	-84.4	170.9	0	0	0	114
431	P	36.1	Very low	29.5	Very low	124 Å²	124	137 Å²	137	81%	0.805	76%	0.756	S	S	*	*			trans	-122	-177.2	-138.6	45.8	-37.7	0	0	0	116.4
432	G	30.8	Very low	29.5	Very low	70 Å²	70	142.3 Å²	142.3	72%	0.722	77%	0.769	S	S	*	*			trans	-175.2	156.5	158	0	0	0	0	0	109.6
433	D	30.6	Very low	29.6	Very low	134 Å²	134	142.1 Å²	142.1	72%	0.717	77%	0.768	S	S	*	*			cis	-161.9	173.3	-10.2	-152.1	-14.7	0	0	0	110
434	M	28.7	Very low	29.6	Very low	151 Å²	151	137.2 Å²	137.2	74%	0.744	76%	0.757	S	S	*	*			trans	26.9	144.8	149.6	-87.2	-174.5	-75.5	0	0	122.3
435	T	32.2	Very low	29.8	Very low	126 Å²	126	132.5 Å²	132.5	77%	0.773	75%	0.748	S	S	*	*			cis	-147.7	158.2	18.7	41.4	0	0	0	0	113.3
436	Q	25.7	Very low	29.9	Very low	166 Å²	166	136 Å²	136	78%	0.776	76%	0.763	S	S	*	*			trans	-95.8	172.7	157.9	-59.2	169.6	-46.6	0	0	110.6
437	T	28.5	Very low	30	Very low	114 Å²	114	131.8 Å²	131.8	70%	0.699	76%	0.757	S	S	*	*				167.2	141.2	109.1	43.5	0	0	0	0	113.2
438	T	21.3	Very low	30	Very low	124 Å²	124	131.8 Å²	131.8	76%	0.761	76%	0.757	S	S	*	*			trans	-111.5	139.6	160.6	-58.2	0	0	0	0	108.7
439	I	28	Very low	30.2	Very low	147 Å²	147	129.7 Å²	129.7	75%	0.754	75%	0.751	S	S	*	*			trans	-142.4	144.9	-171.2	-62.2	-179.5	0	0	0	111.1
440	T	27.8	Very low	30.3	Very low	102 Å²	102	130.7 Å²	130.7	63%	0.626	75%	0.751	S	S	*	*				178.8	118.3	-52	-91.3	0	0	0	0	110.5
441	I	27.3	Very low	30.4	Very low	136 Å²	136	129.4 Å²	129.4	70%	0.697	74%	0.744	S	S	*	*			trans	64	146.3	156.5	-65.5	169.6	0	0	0	119.5	N443	I441-N443 HydrophobicContact CG2-CB 4.08Å
442	M	27.7	Very low	30.1	Very low	194 Å²	194	130.2 Å²	130.2	96%	0.956	74%	0.738	S	S	*	*			trans	-127.8	151.6	139	-85.2	-163.6	-91.6	0	0	111.7
443	N	30.2	Very low	30	Very low	142 Å²	142	133.3 Å²	133.3	76%	0.759	73%	0.733	S	S	*	*			trans	-146.8	-159.4	-165.8	-146	5.1	0	0	0	106.8	I441	I441-N443 HydrophobicContact CG2-CB 4.08Å
444	P	35.8	Very low	29.7	Very low	104 Å²	104	133.9 Å²	133.9	68%	0.675	73%	0.734	S	S	*	*			cis	-110.9	-142.4	-12.6	36.3	-14.2	0	0	0	110.7
445	S	34.8	Very low	29.7	Very low	95 Å²	95	133.2 Å²	133.2	66%	0.664	73%	0.733	S	S	*	*			cis	-162.9	158.2	7.4	31.8	0	0	0	0	108.8
446	V	32.2	Very low	29.4	Very low	142 Å²	142	138 Å²	138	86%	0.861	74%	0.737	S	S	*	*			cis	75	130.4	39.4	177.7	0	0	0	0	112.1
447	A	32.9	Very low	29.5	Very low	83 Å²	83	138.6 Å²	138.6	69%	0.686	74%	0.742	S	S	*	*			cis	-136.4	-162.3	7.5	0	0	0	0	0	110.4
448	D	32.9	Very low	29.2	Very low	139 Å²	139	142.7 Å²	142.7	74%	0.743	75%	0.75	S	S	*	*			cis	-153.3	-153.5	-2.8	-148.5	-39	0	0	0	111.8
449	T	30.9	Very low	29.6	Very low	100 Å²	100	141.9 Å²	141.9	61%	0.613	75%	0.747	S	S	*	*			trans	-158.6	156.5	-159.7	53.1	0	0	0	0	114.5
450	Q	34.3	Very low	29.3	Very low	192 Å²	192	141.4 Å²	141.4	90%	0.897	75%	0.746	S	S	*	*			trans	168.9	165.1	149.3	-96.4	168	59.9	0	0	111.5
451	N	29.6	Very low	29.1	Very low	132 Å²	132	145.6 Å²	145.6	71%	0.706	75%	0.751	S	S	*	*				-160.7	159.8	-55.7	-149.7	10.8	0	0	0	112.6
452	Q	30.2	Very low	28.9	Very low	142 Å²	142	145.7 Å²	145.7	66%	0.664	75%	0.753	S	S	*	*			trans	61.3	112.9	156	-75.3	-179.8	-88.5	0	0	125.8
453	E	28.8	Very low	28.9	Very low	135 Å²	135	141.2 Å²	141.2	63%	0.631	74%	0.741	S	S	*	*				70.5	121	118.2	-66.9	-178.6	123	0	0	126.3
454	M	25	Very low	28.8	Very low	146 Å²	146	141.3 Å²	141.3	72%	0.719	74%	0.741	S	S	*	*			trans	87	118.2	133.6	-90.5	-169.2	-74.5	0	0	124.4
455	N	27.1	Very low	28.4	Very low	137 Å²	137	143 Å²	143	73%	0.733	75%	0.745	S	S	*	*			trans	89.2	127.7	135.8	-71.5	-37.6	0	0	0	123.1
456	R	26	Very low	28.1	Very low	225 Å²	225	144.4 Å²	144.4	85%	0.849	74%	0.744	S	S	*	*			trans	80.7	136.9	150.1	-76	179.5	172.2	171	-2.3	121.2
457	M	28	Very low	28.1	Very low	180 Å²	180	144.5 Å²	144.5	89%	0.887	74%	0.74	S	S	*	*			trans	79.2	137.5	154	-69.7	168.7	176.2	0	0	120.5
458	K	22.5	Very low	27.8	Very low	200 Å²	200	145.1 Å²	145.1	87%	0.87	74%	0.739	S	S	*	*			trans	-91	175.6	166.1	-65.9	180	178.2	-177.8	0	108.9
459	P	29.1	Very low	27.6	Very low	106 Å²	106	146.5 Å²	146.5	69%	0.688	74%	0.738	S	S	*	*			cis	-132.4	-169.5	-30.7	31.4	-10.9	0	0	0	112.9
460	N	22.8	Very low	27.6	Very low	137 Å²	137	147.9 Å²	147.9	73%	0.733	75%	0.747	S	S	*	*			trans	80.8	137.5	142.1	-92.7	10	0	0	0	122.7
461	Y	22.5	Very low	27.4	Very low	190 Å²	190	147.9 Å²	147.9	75%	0.745	74%	0.744	S	S	*	*			trans	71.6	127.1	154.2	-87.4	-102.5	0	0	0	122.3
462	N	24	Very low	27.4	Very low	138 Å²	138	144.5 Å²	144.5	74%	0.738	74%	0.74	S	S	*	*			trans	17.8	136.5	140	-55.9	-4.2	0	0	0	118.7
463	S	26.8	Very low	27.4	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	75%	0.747	S	S	*	*			cis	-170.8	168.5	44.2	45.7	0	0	0	0	113.4
464	N	27.8	Very low	27.6	Very low	144 Å²	144	144 Å²	144	77%	0.77	75%	0.751	S	S	*	*			trans	15.7	148.9	141.7	-43.8	-17.3	0	0	0	118.8
465	N	28.1	Very low	27.7	Very low	139 Å²	139	142.1 Å²	142.1	74%	0.743	75%	0.747	S	S	*	*			cis	-175.8	-175.1	39.4	-152.4	-8.5	0	0	0	113.2
466	I	29.2	Very low	28	Very low	125 Å²	125	143 Å²	143	64%	0.641	75%	0.751	S	S	*	*			trans	88.6	98.5	150	-72	157.5	0	0	0	119.1
467	N	30.9	Very low	28	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	75%	0.747	S	S	*	*			trans	70.9	154.6	133.5	-63.9	0.9	0	0	0	121.4
468	S	28.2	Very low	28.1	Very low	96 Å²	96	134.5 Å²	134.5	67%	0.671	75%	0.745	S	S	*	*			cis	173.4	156.5	-23.6	59.4	0	0	0	0	107.7
469	K	27.8	Very low	28.3	Very low	168 Å²	168	128.4 Å²	128.4	73%	0.73	74%	0.738	S	S	*	*			cis	-162	153.3	-8.5	-111.2	176	177.2	179	0	104.9
470	T	30.1	Very low	28.1	Very low	129 Å²	129	130.9 Å²	130.9	79%	0.791	74%	0.744	S	S	*	*			cis	83.4	96	16.9	-38.1	0	0	0	0	115.8
471	F	30.4	Very low	28.2	Very low	192 Å²	192	131.4 Å²	131.4	84%	0.842	75%	0.747	S	S	*	*			trans	-151	139.1	162	-96.9	-78.4	0	0	0	109.9
472	G	29.3	Very low	28.3	Very low	60 Å²	60	125.4 Å²	125.4	62%	0.619	74%	0.743	S	S	*	*			cis	141.9	98.9	-16.5	0	0	0	0	0	115.3
473	V	32.2	Very low	28.3	Very low	134 Å²	134	126.3 Å²	126.3	81%	0.812	75%	0.746	S	S	*	*			trans	-154.6	133.1	168.9	177.1	0	0	0	0	106.8
474	N	31.5	Very low	28.1	Very low	132 Å²	132	127.3 Å²	127.3	71%	0.706	74%	0.743	S	S	*	*			cis	-147.6	137.2	-19.1	-105	-9.4	0	0	0	107.4
475	V	26.6	Very low	28	Very low	108 Å²	108	130.3 Å²	130.3	66%	0.655	75%	0.75	S	S	*	*				53.6	111.3	96.6	-172.7	0	0	0	0	112.4
476	I	33.6	Very low	27.9	Very low	156 Å²	156	129 Å²	129	80%	0.8	74%	0.739	S	S	*	*				-148.7	127.4	79.2	-79	168.9	0	0	0	108.1
477	N	27.4	Very low	27.8	Very low	144 Å²	144	130.4 Å²	130.4	77%	0.77	74%	0.743	S	S	*	*				81.2	121.9	65	-90.3	-7.1	0	0	0	116.1
478	G	28.9	Very low	27.6	Very low	82 Å²	82	129.9 Å²	129.9	85%	0.845	74%	0.735	S	S	*	*			trans	82.7	141	166.5	0	0	0	0	0	116.1
479	G	26.3	Very low	27.5	Very low	71 Å²	71	134.3 Å²	134.3	73%	0.732	74%	0.739	S	S	*	*			cis	111.8	147	-10.8	0	0	0	0	0	115.6
480	I	26.9	Very low	27.2	Very low	158 Å²	158	132.6 Å²	132.6	81%	0.81	74%	0.738	S	S	*	*			trans	80.1	132.4	169.9	-53	170.8	0	0	0	115.8
481	N	24.4	Very low	27	Very low	149 Å²	149	132.1 Å²	132.1	80%	0.797	74%	0.735	S	S	*	*			trans	6.3	135.3	157.8	-44.5	-19	0	0	0	117.8
482	G	23.8	Very low	26.8	Very low	64 Å²	64	128.5 Å²	128.5	66%	0.66	73%	0.728	S	S	*	*			cis	119.9	-167.4	34.4	0	0	0	0	0	109
483	I	24.4	Very low	27	Very low	156 Å²	156	130.9 Å²	130.9	80%	0.8	73%	0.733	S	S	*	*			trans	64.9	89.8	176.1	-48.9	174.2	0	0	0	112.4
484	L	22.5	Very low	26.7	Very low	121 Å²	121	129.5 Å²	129.5	63%	0.634	73%	0.725	S	S	*	*				62	100.4	78.9	-171.7	120.6	0	0	0	113.7	Q486	L484-Q486 HydrophobicContact CD1-CG 4.24Å; L484-Q486 HydrophobicContact CG-CG 4.44Å
485	F	26.7	Very low	26.4	Very low	207 Å²	207	129.4 Å²	129.4	91%	0.908	72%	0.724	S	S	*	*			trans	-122.6	107.1	143.2	-102.7	-78.6	0	0	0	109.4
486	Q	25.7	Very low	26.4	Very low	112 Å²	112	130.3 Å²	130.3	52%	0.523	73%	0.725	S	S	.	*			trans	-74.3	133.1	163.5	-73	167.5	-104.4	0	0	109.1	L484	L484-Q486 HydrophobicContact CD1-CG 4.24Å; L484-Q486 HydrophobicContact CG-CG 4.44Å
487	H	26.5	Very low	26.3	Very low	154 Å²	154	129.8 Å²	129.8	71%	0.713	72%	0.723	S	S	*	*			trans	-162.4	114.2	132.3	-91.8	-60.5	0	0	0	105.2	Y489	H487-Y489 AromaticContact CE1-CE2 3.95Å; H487-Y489 AromaticContact ND1-CD2 3.96Å; H487-Y489 AromaticContact ND1-CE2 3.75Å
488	Q	26.9	Very low	26.6	Very low	134 Å²	134	127.5 Å²	127.5	63%	0.626	72%	0.716	S	S	*	*			cis	60.7	71.6	21.6	-155.1	-178.1	11	0	0	113.7
489	Y	25.2	Very low	26.5	Very low	189 Å²	189	130.9 Å²	130.9	74%	0.741	71%	0.714	S	S	*	*				-140.5	139.5	126.2	-81.2	-68.3	0	0	0	105.6	H487	H487-Y489 AromaticContact CE1-CE2 3.95Å; H487-Y489 AromaticContact ND1-CD2 3.96Å; H487-Y489 AromaticContact ND1-CE2 3.75Å
490	N	23.1	Very low	26.6	Very low	132 Å²	132	132.5 Å²	132.5	71%	0.706	71%	0.714	S	S	*	*				52.7	134	76.1	-65.7	-0.9	0	0	0	112.1
491	T	24.6	Very low	26.7	Very low	120 Å²	120	130 Å²	130	74%	0.736	71%	0.706	S	S	*	*			cis	-161.8	161	10.4	1.3	0	0	0	0	112.6
492	T	26.8	Very low	27	Very low	115 Å²	115	127.3 Å²	127.3	71%	0.706	71%	0.705	S	S	*	*			trans	-37.6	175.9	148	56.7	0	0	0	0	116
493	P	33.4	Very low	27.3	Very low	111 Å²	111	127.1 Å²	127.1	72%	0.721	70%	0.703	S	S	*	*			cis	-131.1	-122.2	-44.2	37.1	-17.9	0	0	0	109.5
494	V	25	Very low	27.6	Very low	105 Å²	105	128 Å²	128	64%	0.636	70%	0.704	S	S	*	*			trans	75.9	104.7	167.1	178.5	0	0	0	0	115.6
495	N	26	Very low	27.8	Very low	129 Å²	129	127 Å²	127	69%	0.69	70%	0.703	S	S	*	*				58.8	128.9	98.5	-40.9	-20.2	0	0	0	113.6
496	N	26.8	Very low	27.8	Very low	127 Å²	127	124.6 Å²	124.6	68%	0.679	70%	0.698	S	S	*	*			cis	-156.9	155.1	47	-83	-66.1	0	0	0	110.1
497	I	31.3	Very low	27.9	Very low	145 Å²	145	125 Å²	125	74%	0.744	71%	0.708	S	S	*	*				65.9	133.1	59.4	-79.9	170.1	0	0	0	112.5
498	P	33.2	Very low	27.9	Very low	96 Å²	96	126.4 Å²	126.4	62%	0.623	71%	0.712	S	S	*	*			cis	-147.4	-163.1	-21.4	42.9	-23	0	0	0	114.9
499	L	27	Very low	28.5	Very low	154 Å²	154	124.7 Å²	124.7	81%	0.806	71%	0.713	S	S	*	*			trans	67.2	166.8	155.5	-97.8	62.2	0	0	0	116.1
500	S	28.6	Very low	28.6	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	72%	0.718	S	S	*	*			cis	-158	167.2	3.1	119.1	0	0	0	0	108.5
501	T	29.3	Very low	29.1	Very low	106 Å²	106	120.5 Å²	120.5	65%	0.65	72%	0.721	S	S	*	*			cis	173.7	137.1	-19.2	-84.1	0	0	0	0	106.5
502	A	31.2	Very low	29.5	Very low	93 Å²	93	121.2 Å²	121.2	77%	0.769	73%	0.725	S	S	*	*			trans	62.7	165.6	168.8	0	0	0	0	0	117
503	G	29.4	Very low	29.9	Very low	60 Å²	60	120.9 Å²	120.9	62%	0.619	73%	0.728	S	S	*	*			cis	-136.5	155.3	0.3	0	0	0	0	0	113.5
504	Q	29.9	Very low	29.8	Very low	175 Å²	175	123.8 Å²	123.8	82%	0.818	74%	0.736	S	S	*	*				82.1	134.2	79.1	-71.1	-162.5	-10.2	0	0	112.1
505	T	28.1	Very low	30.2	Very low	100 Å²	100	121.3 Å²	121.3	61%	0.613	73%	0.732	S	S	*	*			cis	-170.1	146.2	-0.3	17.7	0	0	0	0	110.9
506	L	26.3	Very low	30.5	Very low	156 Å²	156	121.3 Å²	121.3	82%	0.817	74%	0.737	S	S	*	*			trans	56.1	160.7	133.9	-53.2	172.8	0	0	0	119.5
507	V	27.7	Very low	30.9	Very low	119 Å²	119	121 Å²	121	72%	0.721	74%	0.739	S	S	*	*			cis	-157.2	169	-6	111.4	0	0	0	0	112.4
508	F	27.4	Very low	30.9	Very low	184 Å²	184	120.1 Å²	120.1	81%	0.807	74%	0.741	S	S	*	*			trans	-66.4	-170.1	171.7	-66.4	-84.1	0	0	0	115.2
509	P	38.8	Very low	31	Very low	98 Å²	98	120.3 Å²	120.3	64%	0.636	75%	0.745	S	S	*	*				-136.3	-169.1	-52.6	38.8	-21.6	0	0	0	114.3
510	N	28	Very low	31.3	Very low	160 Å²	160	120.2 Å²	120.2	86%	0.856	74%	0.743	S	S	*	*			trans	77.3	135	151.3	-68.3	-11.1	0	0	0	121.8
511	G	33.1	Very low	31.6	Very low	74 Å²	74	122.8 Å²	122.8	76%	0.763	75%	0.748	S	S	*	*			trans	-170.9	138.6	163.4	0	0	0	0	0	109.9
512	T	31.9	Very low	32	Very low	134 Å²	134	122.2 Å²	122.2	82%	0.822	75%	0.754	S	S	*	*			trans	-135.1	179.3	-164.3	51.4	0	0	0	0	114.2
513	S	35.6	Very low	32	Very low	109 Å²	109	125.7 Å²	125.7	76%	0.762	76%	0.76	S	S	*	*			trans	93.5	146.3	166	86.7	0	0	0	0	117.2
514	L	31	Very low	32.6	Very low	172 Å²	172	130.7 Å²	130.7	90%	0.901	77%	0.772	S	S	*	*			cis	-164.3	163.8	-22.8	-134.7	117.6	0	0	0	111.4
515	G	34.4	Very low	33.4	Very low	53 Å²	53	127.8 Å²	127.8	55%	0.546	77%	0.768	S	S	.	*			trans	115.1	106.5	162.7	0	0	0	0	0	115.9
516	T	31.4	Very low	34.6	Very low	129 Å²	129	128.5 Å²	128.5	79%	0.791	77%	0.774	S	S	*	*				68.8	127.4	82.5	58.2	0	0	0	0	114.6
517	T	35.1	Very low	35.8	Very low	120 Å²	120	126.5 Å²	126.5	74%	0.736	77%	0.77	S	S	*	*			cis	-162.5	148.5	14.7	-1.4	0	0	0	0	113.2
518	T	31.9	Very low	37.1	Very low	127 Å²	127	126.8 Å²	126.8	78%	0.779	78%	0.775	S	S	*	*			trans	21.3	145.6	145.6	53.4	0	0	0	0	122.2
519	S	36.1	Very low	38.4	Very low	100 Å²	100	122.4 Å²	122.4	70%	0.699	77%	0.772	S	S	*	*			cis	-162.2	137.5	25.3	47.9	0	0	0	0	116.9
520	I	33.4	Very low	39.3	Very low	152 Å²	152	123.3 Å²	123.3	78%	0.779	78%	0.778	S	S	*	*			trans	49.6	110.5	131.1	-45.8	165.7	0	0	0	120.2
521	L	33.5	Very low	40.9	Very low	158 Å²	158	121.1 Å²	121.1	83%	0.827	77%	0.773	S	S	*	*				-168.7	151.1	98.3	-130.2	122.7	0	0	0	113.3
522	A	37.1	Very low	42.4	Very low	94 Å²	94	123 Å²	123	78%	0.777	77%	0.771	S	S	*	*			trans	45.7	89.9	167.2	0	0	0	0	0	119.5
523	N	32.7	Very low	43.7	Very low	166 Å²	166	122.1 Å²	122.1	89%	0.888	77%	0.768	S	S	*	*			trans	-106.9	134.3	167.6	-77.6	-44.3	0	0	0	112.3
524	L	41.3	Very low	44.9	Very low	165 Å²	165	122.4 Å²	122.4	86%	0.864	77%	0.767	S	S	*	*			trans	-111.1	140.9	151	-86.7	166.8	0	0	0	107.7
525	P	47.5	Very low	46.1	Very low	113 Å²	113	120.1 Å²	120.1	73%	0.734	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-71.2	140.1	-177.2	29.2	-34.1	0	0	0	111.3
526	P	52.1	Low	47	Very low	115 Å²	115	123.9 Å²	123.9	75%	0.747	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-66.2	149.6	172	29	-34.4	0	0	0	110.8
527	P	52.2	Low	48	Very low	114 Å²	114	123.1 Å²	123.1	74%	0.74	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-63.8	152.2	175.6	27.9	-34.7	0	0	0	111.3
528	P	54.2	Low	48.7	Very low	125 Å²	125	122.9 Å²	122.9	81%	0.812	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-63.4	142.3	179.6	27.4	-35	0	0	0	111.3
529	A	54.9	Low	49.6	Very low	92 Å²	92	122.2 Å²	122.2	76%	0.76	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-61.4	142.3	177.5	0	0	0	0	0	111.3
530	P	58.3	Low	50.2	Low	117 Å²	117	123.5 Å²	123.5	76%	0.76	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-63.7	146.1	174.8	28	-34.5	0	0	0	110.6
531	P	61.3	Low	50.6	Low	114 Å²	114	123.8 Å²	123.8	74%	0.74	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-64.2	150.1	176.5	28.3	-34.9	0	0	0	111
532	P	64.1	Low	50.9	Low	113 Å²	113	122.1 Å²	122.1	73%	0.734	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-62.1	148.9	176.1	27.5	-34.9	0	0	0	111
533	P	59.2	Low	50.8	Low	117 Å²	117	125.8 Å²	125.8	76%	0.76	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-61.4	145.9	174.9	27.2	-34.5	0	0	0	110.6
534	P	61.9	Low	50.9	Low	114 Å²	114	123.2 Å²	123.2	74%	0.74	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-63.6	148	177.7	27.8	-34.9	0	0	0	110.8	T536	P534-T536 PolarHBondContact O-N 3.07Å
535	P	55.1	Low	50.6	Low	125 Å²	125	123.3 Å²	123.3	81%	0.812	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-61.8	135.6	177.6	26.7	-34.4	0	0	0	110.5
536	T	53.5	Low	50.1	Low	132 Å²	132	123 Å²	123	81%	0.81	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-60.5	133.9	173.6	43.8	0	0	0	0	110.3	P534	P534-T536 PolarHBondContact O-N 3.07Å
537	P	53.1	Low	49.3	Very low	113 Å²	113	123.6 Å²	123.6	73%	0.734	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-63.8	149	177.3	27.8	-34.8	0	0	0	110.9
538	P	49.6	Very low	48.2	Very low	114 Å²	114	125.3 Å²	125.3	74%	0.74	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-64.8	154.4	176.1	28.8	-35.2	0	0	0	111.3
539	P	50.6	Low	47.3	Very low	113 Å²	113	125 Å²	125	73%	0.734	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-62.6	151.5	173.8	28.2	-35.2	0	0	0	111	L541	P539-L541 PolarHBondContact O-N 3.38Å
540	P	48.4	Very low	46	Very low	128 Å²	128	126.8 Å²	126.8	83%	0.831	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-60.3	132.4	178.5	-22.3	33.4	0	0	0	112
541	L	42.7	Very low	44.8	Very low	158 Å²	158	128.3 Å²	128.3	83%	0.827	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-64.7	139.7	169.1	-78.8	157.6	0	0	0	110	P539 L543	P539-L541 PolarHBondContact O-N 3.38Å; L541-L543 PolarHBondContact O-N 3.42Å
542	P	39	Very low	43.3	Very low	123 Å²	123	127.4 Å²	127.4	80%	0.799	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-63.2	121.7	172.6	-18.6	31.2	0	0	0	110.2	S544	P542-S544 PolarHBondContact O-N 2.88Å
543	L	36.3	Very low	41.6	Very low	170 Å²	170	129.2 Å²	129.2	89%	0.89	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70.9	128.7	174.5	-82.3	167.1	0	0	0	110.4	L541	L541-L543 PolarHBondContact O-N 3.42Å
544	S	32.9	Very low	40.2	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.2	130.4	-176.1	51.8	0	0	0	0	112.9	P542	P542-S544 PolarHBondContact O-N 2.88Å
545	L	35.4	Very low	38.6	Very low	167 Å²	167	133.5 Å²	133.5	87%	0.874	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64	139.9	171.8	-78.5	152	0	0	0	112
546	P	37.5	Very low	37.3	Very low	108 Å²	108	135.3 Å²	135.3	70%	0.701	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-73.2	156.2	166.6	32.2	-34.2	0	0	0	111.2
547	P	34.3	Very low	36.1	Very low	126 Å²	126	132 Å²	132	82%	0.818	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-78.1	144.6	-171.2	30.9	-35.9	0	0	0	114
548	I	30.5	Very low	34.9	Very low	150 Å²	150	131.5 Å²	131.5	77%	0.769	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-89.8	127.8	173.9	-61.7	168.8	0	0	0	109.8
549	P	34.1	Very low	34.1	Very low	120 Å²	120	135.4 Å²	135.4	78%	0.779	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-79.2	129.5	165.5	-7.3	24.9	0	0	0	110.8
550	T	27.6	Very low	33	Very low	128 Å²	128	133.5 Å²	133.5	79%	0.785	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-99.5	124.2	178.8	53.8	0	0	0	0	112.3
551	T	34.7	Very low	32.2	Very low	149 Å²	149	132.3 Å²	132.3	91%	0.914	79%	0.794	S	S	*	*			trans	-141	117.2	160.2	23.7	0	0	0	0	112.3
552	S	29.3	Very low	31.6	Very low	96 Å²	96	129.3 Å²	129.3	67%	0.671	79%	0.786	S	S	*	*			trans	-78.6	161.2	-176.7	53.5	0	0	0	0	116.1
553	I	29.1	Very low	31.1	Very low	151 Å²	151	129.9 Å²	129.9	77%	0.774	78%	0.783	S	S	*	*			trans	74.8	140	144.9	-72.7	160.8	0	0	0	115.3
554	N	28.7	Very low	30.8	Very low	142 Å²	142	128.5 Å²	128.5	76%	0.759	77%	0.774	S	S	*	*			cis	-147.5	-177.8	17.4	-144.1	-4.7	0	0	0	115.1
555	F	27.9	Very low	30.6	Very low	178 Å²	178	128.7 Å²	128.7	78%	0.781	78%	0.776	S	S	*	*			trans	-67.4	157	167.7	-73.1	-111.7	0	0	0	112.6
556	D	28	Very low	30.3	Very low	164 Å²	164	124 Å²	124	88%	0.877	77%	0.768	S	S	*	*				176.5	178.3	78.9	-117.3	-34.4	0	0	0	112.6
557	G	27.7	Very low	30	Very low	62 Å²	62	129.9 Å²	129.9	64%	0.639	78%	0.778	S	S	*	*			trans	114.8	53.5	138.8	0	0	0	0	0	124.7
558	S	29	Very low	29.8	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	78%	0.779	S	S	*	*			trans	37.4	139.1	132.8	68	0	0	0	0	126.8
559	H	31.7	Very low	29.8	Very low	196 Å²	196	126 Å²	126	91%	0.907	77%	0.771	S	S	*	*			trans	77.5	149.1	140.8	-69.6	-50.7	0	0	0	124.4
560	G	28.9	Very low	29.6	Very low	73 Å²	73	130.5 Å²	130.5	75%	0.753	78%	0.778	S	S	*	*			trans	106.9	121.2	172.3	0	0	0	0	0	113.5
561	A	30.1	Very low	29.6	Very low	102 Å²	102	129.1 Å²	129.1	84%	0.843	77%	0.774	S	S	*	*			cis	71.8	129.6	36.6	0	0	0	0	0	113.9
562	S	31.2	Very low	29.3	Very low	96 Å²	96	127.1 Å²	127.1	67%	0.671	77%	0.766	S	S	*	*			cis	-166.5	-179.2	-3.6	50.8	0	0	0	0	112.7
563	D	28.6	Very low	29.4	Very low	135 Å²	135	128.8 Å²	128.8	72%	0.722	77%	0.772	S	S	*	*			trans	93.4	147.1	135.8	-84.5	-50	0	0	0	126.6
564	I	29.3	Very low	29.4	Very low	140 Å²	140	129 Å²	129	72%	0.718	77%	0.774	S	S	*	*			trans	78.8	80.8	143.5	-71.1	162.8	0	0	0	121.6
565	S	29.7	Very low	29.7	Very low	117 Å²	117	126.6 Å²	126.6	82%	0.818	77%	0.766	S	S	*	*				39.3	140.1	117.7	71.3	0	0	0	0	124.5
566	G	28.3	Very low	29.7	Very low	69 Å²	69	124.3 Å²	124.3	71%	0.711	76%	0.762	S	S	*	*			trans	141.3	141.3	157.9	0	0	0	0	0	112.2
567	Y	31.3	Very low	29.8	Very low	231 Å²	231	122.1 Å²	122.1	91%	0.906	76%	0.755	S	S	*	*			cis	-146.3	171.8	0.5	-131	-95.3	0	0	0	110.7
568	T	31.3	Very low	29.8	Very low	136 Å²	136	126.2 Å²	126.2	83%	0.834	76%	0.757	S	S	*	*			trans	-105.6	165.5	-174.6	53.2	0	0	0	0	113.8
569	G	28.6	Very low	29.7	Very low	58 Å²	58	128.4 Å²	128.4	60%	0.598	76%	0.756	S	S	*	*			trans	166.8	106.7	162.3	0	0	0	0	0	118.7
570	F	30.7	Very low	29.5	Very low	214 Å²	214	127.9 Å²	127.9	94%	0.939	75%	0.752	S	S	*	*			trans	64.6	157.5	153.6	-57.2	-84.1	0	0	0	120.8
571	S	27.4	Very low	29.3	Very low	100 Å²	100	132.5 Å²	132.5	70%	0.699	76%	0.755	S	S	*	*				169.9	159.8	-60.7	180	0	0	0	0	109.8
572	S	29.6	Very low	29.2	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	75%	0.753	S	S	*	*			trans	70.2	139.8	170.8	75.2	0	0	0	0	117.1
573	T	31.5	Very low	29.3	Very low	132 Å²	132	135.3 Å²	135.3	81%	0.81	76%	0.755	S	S	*	*			cis	-151.3	149.5	-3.3	-5	0	0	0	0	114.1
574	L	29.2	Very low	29.2	Very low	156 Å²	156	134 Å²	134	82%	0.817	76%	0.762	S	S	*	*			trans	-36.7	175.4	160.8	-97.1	67.9	0	0	0	118.4
575	P	33.4	Very low	28.9	Very low	91 Å²	91	132 Å²	132	59%	0.591	76%	0.761	S	S	*	*			cis	-142.8	-178.2	-10.3	33.4	-11.9	0	0	0	117.1
576	N	28.7	Very low	28.6	Very low	130 Å²	130	132.6 Å²	132.6	70%	0.695	76%	0.764	S	S	*	*			trans	70.3	129.9	157	-56.9	-24.7	0	0	0	117.5
577	T	30.8	Very low	28.4	Very low	118 Å²	118	137.7 Å²	137.7	72%	0.724	77%	0.769	S	S	*	*			cis	-163.4	144.4	-7.3	9	0	0	0	0	106
578	Q	26.6	Very low	28.1	Very low	147 Å²	147	134.3 Å²	134.3	69%	0.687	77%	0.765	S	S	*	*			cis	70.2	122.8	20.4	-47.7	178.8	-88.9	0	0	113.4
579	H	27.9	Very low	27.7	Very low	149 Å²	149	133.2 Å²	133.2	69%	0.69	76%	0.763	S	S	*	*			cis	-128.1	179	8	-63.3	-110.5	0	0	0	109.7
580	F	26.8	Very low	27.5	Very low	186 Å²	186	133.8 Å²	133.8	82%	0.816	77%	0.769	S	S	*	*			cis	-144.1	156.5	12	-119.4	-64.7	0	0	0	111.6
581	M	25	Very low	27.2	Very low	169 Å²	169	134.8 Å²	134.8	83%	0.833	77%	0.768	S	S	*	*			trans	-165	-176.5	169.1	-134.2	-168.9	-167.1	0	0	107.8
582	N	27.2	Very low	27	Very low	148 Å²	148	138.2 Å²	138.2	79%	0.791	78%	0.777	S	S	*	*			trans	80.3	169.5	150.3	-111.4	8.3	0	0	0	118.6
583	P	32.7	Very low	26.8	Very low	109 Å²	109	140 Å²	140	71%	0.708	78%	0.784	S	S	*	*				-133.4	-170.9	-123.1	39.8	-18	0	0	0	114.6
584	A	26.8	Very low	26.4	Very low	107 Å²	107	138.2 Å²	138.2	88%	0.884	78%	0.777	S	S	*	*			trans	-117.3	97.9	171.1	0	0	0	0	0	111.5
585	S	24.3	Very low	26.2	Very low	99 Å²	99	137.7 Å²	137.7	69%	0.692	78%	0.775	S	S	*	*			trans	-94.5	128.1	171.4	56.1	0	0	0	0	111.4
586	C	22.9	Very low	26	Very low	130 Å²	130	138.4 Å²	138.4	88%	0.878	78%	0.78	S	S	*	*			trans	-96.2	105	157.4	-79.7	0	0	0	0	109
587	Q	23.5	Very low	25.8	Very low	175 Å²	175	142.9 Å²	142.9	82%	0.818	79%	0.788	S	S	*	*			trans	-73.1	132.2	161.3	-65.8	179.6	-72.3	0	0	108.8
588	I	25.4	Very low	25.5	Very low	161 Å²	161	145.1 Å²	145.1	83%	0.826	80%	0.795	S	S	*	*			trans	-127.2	115.8	154.9	-64.2	-177.6	0	0	0	106.3
589	S	23.3	Very low	25.3	Very low	112 Å²	112	145.7 Å²	145.7	78%	0.783	80%	0.798	S	S	*	*			trans	-67.2	137.8	174.6	-60.9	0	0	0	0	109.8
590	G	23.4	Very low	25.2	Very low	70 Å²	70	144.4 Å²	144.4	72%	0.722	80%	0.801	S	S	*	*			trans	-77.5	169.7	-172	0	0	0	0	0	114.7
591	Y	24.5	Very low	25.1	Very low	236 Å²	236	141.8 Å²	141.8	93%	0.925	80%	0.795	S	S	*	*			trans	-124.2	145.3	156	-99.2	-92	0	0	0	109.4
592	L	23.9	Very low	25.2	Very low	171 Å²	171	140.8 Å²	140.8	90%	0.895	79%	0.791	S	S	*	*			trans	-82.5	126.8	171.8	-70.4	139.3	0	0	0	109.6
593	T	24.3	Very low	25.1	Very low	145 Å²	145	140.6 Å²	140.6	89%	0.89	79%	0.786	S	S	*	*			trans	-140.4	149.8	143.7	49.8	0	0	0	0	109.6
594	S	23.4	Very low	24.8	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	79%	0.793	S	S	*	*			trans	-96.8	-171.8	-176.3	43.8	0	0	0	0	112.4
595	D	25.5	Very low	24.8	Very low	145 Å²	145	145 Å²	145	78%	0.775	78%	0.78	S	S	*	*			trans	89.9	152.5	152.9	-60.2	-51.6	0	0	0	119.1
596	P	29.4	Very low	25.2	Very low	106 Å²	106	147.5 Å²	147.5	69%	0.688	79%	0.786	S	S	*	*			trans	-119.9	-175.1	-132.3	44.5	-37.8	0	0	0	115.9
597	Y	24.4	Very low	25.4	Very low	225 Å²	225	149.1 Å²	149.1	88%	0.882	78%	0.78	S	S	*	*			trans	11.3	119.4	154.4	-81.9	-86.7	0	0	0	118.4
598	L	23.5	Very low	25.7	Very low	164 Å²	164	147.6 Å²	147.6	86%	0.859	78%	0.782	S	S	*	*			trans	-146.6	125	148.9	-119.6	161.7	0	0	0	111.1
599	Q	23.8	Very low	25.8	Very low	159 Å²	159	145 Å²	145	74%	0.743	77%	0.773	S	S	*	*			trans	-74.7	142	169.9	-67.5	161.3	-98.9	0	0	109.4
600	T	25.3	Very low	26	Very low	123 Å²	123	146.8 Å²	146.8	76%	0.755	78%	0.775	S	S	*	*			trans	-117.3	77.5	167.3	59.6	0	0	0	0	110.6
601	N	24.1	Very low	26.1	Very low	131 Å²	131	148.8 Å²	148.8	70%	0.701	78%	0.778	S	S	*	*			trans	-67.8	129.4	154.1	-76.7	1.5	0	0	0	107.4
602	I	27.1	Very low	26.3	Very low	147 Å²	147	140.9 Å²	140.9	75%	0.754	77%	0.768	S	S	*	*			trans	-101.9	93.7	170.2	-60.7	179	0	0	0	107.2	F604	I602-F604 HydrophobicContact CG2-CD2 4.44Å; I602-F604 HydrophobicContact CG2-CE2 4.48Å
603	E	25.3	Very low	26.5	Very low	144 Å²	144	139.6 Å²	139.6	67%	0.673	77%	0.767	S	S	*	*			trans	-78.6	116.8	171.9	-69	-172	165.5	0	0	110.5	N605	E603-N605 VanDerWaalsContact C-N 3.27Å; E603-N605 PolarHBondContact O-N 3.26Å; E603-N605 PolarHBondContact OE2-ND2 3.26Å
604	F	27.4	Very low	26.5	Very low	194 Å²	194	141.1 Å²	141.1	85%	0.851	76%	0.764	S	S	*	*			trans	-79.8	78.4	164.3	-99.8	-83.9	0	0	0	110	I602 N606	I602-F604 HydrophobicContact CG2-CD2 4.44Å; I602-F604 HydrophobicContact CG2-CE2 4.48Å; F604-N606 PolarHBondContact O-N 3.45Å
605	N	26.7	Very low	26.8	Very low	114 Å²	114	142.3 Å²	142.3	61%	0.61	77%	0.77	S	S	*	*			trans	-82.8	95.4	178.3	-120.7	-47.9	0	0	0	110.6	E603	E603-N605 VanDerWaalsContact C-N 3.27Å; E603-N605 PolarHBondContact O-N 3.26Å; E603-N605 PolarHBondContact OE2-ND2 3.26Å
606	N	31.2	Very low	26.8	Very low	153 Å²	153	140.8 Å²	140.8	82%	0.818	77%	0.766	S	S	*	*			trans	-105.7	92.1	170.4	-107.7	-7.7	0	0	0	109.6	F604	F604-N606 PolarHBondContact O-N 3.45Å
607	Q	27.1	Very low	26.6	Very low	164 Å²	164	146.5 Å²	146.5	77%	0.766	78%	0.775	S	S	*	*			trans	-77.2	123.9	171	-71.1	-174.7	-12.3	0	0	110.7
608	V	30.6	Very low	26.5	Very low	143 Å²	143	144.1 Å²	144.1	87%	0.867	77%	0.77	S	S	*	*			trans	-126.9	132.8	154.6	-179.6	0	0	0	0	107.5
609	V	26.8	Very low	26.5	Very low	105 Å²	105	144 Å²	144	64%	0.636	77%	0.765	S	S	*	*			trans	-105.5	127.4	-166.9	175.9	0	0	0	0	110
610	N	29	Very low	26.4	Very low	151 Å²	151	142.4 Å²	142.4	81%	0.807	77%	0.771	S	S	*	*				-179.1	147.4	123.5	-96.2	-53.6	0	0	0	115.3
611	S	25.5	Very low	26.4	Very low	112 Å²	112	145.3 Å²	145.3	78%	0.783	78%	0.776	S	S	*	*			trans	-32.9	148.9	168.3	54.4	0	0	0	0	119.9
612	G	27.1	Very low	26.3	Very low	70 Å²	70	145.9 Å²	145.9	72%	0.722	78%	0.784	S	S	*	*			trans	171.4	70.9	160.8	0	0	0	0	0	118.4
613	T	28.3	Very low	26.2	Very low	144 Å²	144	142.4 Å²	142.4	88%	0.883	79%	0.785	S	S	*	*			trans	23.3	131.7	152.4	52.2	0	0	0	0	123.3
614	E	25	Very low	26.2	Very low	176 Å²	176	143.6 Å²	143.6	82%	0.822	80%	0.795	S	S	*	*			trans	-43	168.4	151	-83.9	-173	146.7	0	0	115.9
615	P	30.6	Very low	26.1	Very low	118 Å²	118	140.6 Å²	140.6	77%	0.766	80%	0.798	S	S	*	*			cis	-144.5	-175.4	31.3	43	-22.3	0	0	0	119.3
616	T	23.9	Very low	25.9	Very low	114 Å²	114	145.6 Å²	145.6	70%	0.699	81%	0.808	S	S	*	*			trans	-58.2	156	174	55	0	0	0	0	116.6
617	Y	25.6	Very low	25.8	Very low	226 Å²	226	145.6 Å²	145.6	89%	0.886	81%	0.814	S	S	*	*			trans	-155.9	172.9	140.4	-113.3	-74.5	0	0	0	113.3
618	F	22.7	Very low	25.6	Very low	174 Å²	174	144.5 Å²	144.5	76%	0.763	81%	0.813	S	S	*	*			trans	-94.6	163.5	-165.7	-100.8	-120.7	0	0	0	115.7
619	E	23	Very low	25.5	Very low	162 Å²	162	144.1 Å²	144.1	76%	0.757	82%	0.815	S	S	*	*			trans	21.4	127.6	149.4	-63.7	174.2	153.3	0	0	121.4
620	S	23	Very low	25.6	Very low	126 Å²	126	142 Å²	142	88%	0.881	82%	0.815	S	S	*	*				176.3	167.9	116.7	-79.4	0	0	0	0	113.3
621	E	23.8	Very low	25.7	Very low	183 Å²	183	140.1 Å²	140.1	86%	0.855	81%	0.811	S	S	*	*			trans	-87.7	175.8	-174.8	-58.1	-176.3	113.3	0	0	115.6
622	V	23.4	Very low	26	Very low	143 Å²	143	143.9 Å²	143.9	87%	0.867	82%	0.815	S	S	*	*			trans	72.5	120.8	160.5	-167.7	0	0	0	0	118.2
623	G	24.7	Very low	26	Very low	74 Å²	74	149.3 Å²	149.3	76%	0.763	82%	0.82	S	S	*	*			trans	168.5	103.5	161.3	0	0	0	0	0	114.9
624	L	24.7	Very low	26	Very low	170 Å²	170	148 Å²	148	89%	0.89	82%	0.817	S	S	*	*			trans	-79.8	147	167.9	-68	91	0	0	0	111
625	S	24.3	Very low	26	Very low	131 Å²	131	145.9 Å²	145.9	92%	0.916	82%	0.816	S	S	*	*			trans	-164	154.3	134.5	-89.9	0	0	0	0	113.6
626	R	23.4	Very low	26.1	Very low	219 Å²	219	146 Å²	146	83%	0.826	82%	0.817	S	S	*	*			trans	-83.2	152.8	-176.7	-66.1	169	167.2	150.7	-8	112.6
627	V	28.5	Very low	26.3	Very low	153 Å²	153	149.2 Å²	149.2	93%	0.927	83%	0.829	S	S	*	*			trans	-126	141	138.2	-178.8	0	0	0	0	107.3
628	N	24.3	Very low	26.3	Very low	141 Å²	141	142.7 Å²	142.7	75%	0.754	82%	0.821	S	S	*	*			trans	-130.6	128.5	-162.7	-142.3	37	0	0	0	111.9
629	C	27.8	Very low	26.6	Very low	134 Å²	134	141.6 Å²	141.6	91%	0.905	83%	0.829	S	S	*	*			trans	-169.5	158.5	163	-134.9	0	0	0	0	108.3
630	G	27.7	Very low	26.9	Very low	62 Å²	62	138.1 Å²	138.1	64%	0.639	82%	0.822	S	S	*	*			cis	179.2	76.5	-4.3	0	0	0	0	0	110.5
631	P	32.7	Very low	27.2	Very low	111 Å²	111	138.9 Å²	138.9	72%	0.721	82%	0.816	S	S	*	*			trans	-93.2	148.2	-162.1	35.5	-34.8	0	0	0	114
632	H	31.6	Very low	27.6	Very low	190 Å²	190	138.7 Å²	138.7	88%	0.88	82%	0.82	S	S	*	*			trans	-142.9	149.7	161.2	-91.9	-78	0	0	0	113
633	F	26.5	Very low	27.8	Very low	184 Å²	184	135.8 Å²	135.8	81%	0.807	82%	0.819	S	S	*	*			trans	-80.5	165.5	-174.7	-75	-108.3	0	0	0	111.6
634	S	28.8	Very low	28	Very low	118 Å²	118	136 Å²	136	83%	0.825	82%	0.821	S	S	*	*				-172.5	171.7	73.4	-60.6	0	0	0	0	114.8
635	T	25.8	Very low	28.8	Very low	130 Å²	130	133.9 Å²	133.9	80%	0.798	82%	0.818	S	S	*	*			trans	-92.5	164.5	-166.2	43.9	0	0	0	0	116.2
636	P	32.6	Very low	29.1	Very low	122 Å²	122	135.1 Å²	135.1	79%	0.792	81%	0.812	S	S	*	*			trans	-94.9	166.9	-177	38.5	-37.3	0	0	0	115.1
637	L	27.7	Very low	29.3	Very low	181 Å²	181	132.6 Å²	132.6	95%	0.948	81%	0.81	S	S	*	*			trans	-158.6	167.1	158.4	-109.2	170.8	0	0	0	110.7
638	A	25.8	Very low	29.3	Very low	88 Å²	88	130.6 Å²	130.6	73%	0.727	80%	0.803	S	S	*	*			trans	-117.2	169	-167.7	0	0	0	0	0	114.7
639	V	29.1	Very low	29.6	Very low	152 Å²	152	128.5 Å²	128.5	92%	0.921	80%	0.799	S	S	*	*			trans	-177.6	173.8	147.5	142.1	0	0	0	0	110.2
640	S	29.1	Very low	29.7	Very low	88 Å²	88	126.8 Å²	126.8	62%	0.615	79%	0.789	S	S	*	*			trans	-134.2	160.6	-144.9	60.4	0	0	0	0	119
641	N	29.9	Very low	29.8	Very low	142 Å²	142	131.2 Å²	131.2	76%	0.759	80%	0.798	S	S	*	*			trans	84.4	155	143.6	-71.2	-13	0	0	0	123.5
642	L	30.3	Very low	30.2	Very low	180 Å²	180	131.3 Å²	131.3	94%	0.942	80%	0.798	S	S	*	*			trans	72.5	145.4	173.5	-54.3	117	0	0	0	116.1
643	G	29.3	Very low	30.1	Very low	82 Å²	82	127.6 Å²	127.6	85%	0.845	79%	0.794	S	S	*	*			cis	143.9	141.3	-3.4	0	0	0	0	0	111
644	G	28.6	Very low	30.3	Very low	77 Å²	77	125.4 Å²	125.4	79%	0.794	80%	0.796	S	S	*	*			cis	-165.5	-167.2	2.6	0	0	0	0	0	112.4
645	P	40.3	Very low	30.3	Very low	127 Å²	127	124 Å²	124	83%	0.825	79%	0.791	S	S	*	*			trans	-106.4	169	-164	40.2	-36.2	0	0	0	117
646	I	31.4	Very low	30.4	Very low	156 Å²	156	124.9 Å²	124.9	80%	0.8	79%	0.791	S	S	*	*			trans	-160	122.2	164.9	-103.8	147.1	0	0	0	113.7
647	E	27.6	Very low	30.2	Very low	166 Å²	166	124.9 Å²	124.9	78%	0.776	79%	0.789	S	S	*	*			trans	36	121.1	131.4	-50.9	-173.6	149.2	0	0	123
648	S	28.9	Very low	30.3	Very low	112 Å²	112	119.8 Å²	119.8	78%	0.783	78%	0.78	S	S	*	*				96.1	164.8	91.6	89.1	0	0	0	0	114.3
649	S	30.3	Very low	30.4	Very low	96 Å²	96	121.1 Å²	121.1	67%	0.671	78%	0.779	S	S	*	*			cis	-162.7	173	6.1	52.3	0	0	0	0	112.3
650	S	30.5	Very low	30.2	Very low	99 Å²	99	119.8 Å²	119.8	69%	0.692	77%	0.772	S	S	*	*			trans	65.4	151.5	154.8	69.1	0	0	0	0	120.7
651	D	30	Very low	30.3	Very low	155 Å²	155	121.5 Å²	121.5	83%	0.829	78%	0.778	S	S	*	*			cis	-159.8	168.9	-17.7	-106.9	-26.8	0	0	0	112.5
652	P	40.3	Very low	30.1	Very low	112 Å²	112	120.3 Å²	120.3	73%	0.727	78%	0.776	S	S	*	*			trans	-115.3	179.5	-169.3	43	-35.8	0	0	0	116.1
653	S	30.4	Very low	30	Very low	113 Å²	113	116 Å²	116	79%	0.79	77%	0.767	S	S	*	*			trans	-165.6	154.2	149.3	38.1	0	0	0	0	116.3
654	T	28.8	Very low	29.7	Very low	138 Å²	138	119.9 Å²	119.9	85%	0.847	77%	0.766	S	S	*	*			trans	-13.1	157.6	160.3	58.8	0	0	0	0	119.9
655	A	29.2	Very low	29.7	Very low	89 Å²	89	119.3 Å²	119.3	74%	0.736	76%	0.761	S	S	*	*			cis	-158.8	-171.2	22.6	0	0	0	0	0	110.6
656	N	28.9	Very low	29.1	Very low	148 Å²	148	118.6 Å²	118.6	79%	0.791	76%	0.759	S	S	*	*			cis	-155	-167.2	-2.3	-149.6	-1.6	0	0	0	112.4
657	T	27.4	Very low	29	Very low	121 Å²	121	116.8 Å²	116.8	74%	0.742	76%	0.758	S	S	*	*			trans	-94.1	160.4	-175.2	52.9	0	0	0	0	118.1
658	G	29.7	Very low	28.9	Very low	74 Å²	74	116.9 Å²	116.9	76%	0.763	76%	0.764	S	S	*	*			trans	-160.3	145.4	158.1	0	0	0	0	0	111.8
659	T	28.1	Very low	28.8	Very low	117 Å²	117	115.2 Å²	115.2	72%	0.718	77%	0.765	S	S	*	*			trans	-147.6	160	-156.2	52.5	0	0	0	0	117.6
660	T	26.3	Very low	28.7	Very low	124 Å²	124	114.3 Å²	114.3	76%	0.761	77%	0.77	S	S	*	*			trans	68.7	159.8	160.4	50.1	0	0	0	0	117
661	V	29.3	Very low	28.6	Very low	123 Å²	123	115.2 Å²	115.2	75%	0.745	78%	0.777	S	S	*	*			cis	-148.1	126.9	34.5	175	0	0	0	0	113.7
662	T	26	Very low	28.7	Very low	117 Å²	117	112.8 Å²	112.8	72%	0.718	77%	0.772	S	S	*	*				28	141.1	122	-31	0	0	0	0	124.7
663	A	27.7	Very low	28.1	Very low	91 Å²	91	114 Å²	114	75%	0.752	78%	0.778	S	S	*	*			trans	145.2	159.4	134.9	0	0	0	0	0	114.3
664	I	24.9	Very low	28	Very low	163 Å²	163	112.4 Å²	112.4	84%	0.836	78%	0.779	S	S	*	*			cis	-165.2	153.3	-38.3	-108.5	162.4	0	0	0	109.9
665	G	27.9	Very low	28	Very low	65 Å²	65	111.4 Å²	111.4	67%	0.67	78%	0.778	S	S	*	*			trans	100.6	128	167.8	0	0	0	0	0	115.3
666	S	27.5	Very low	28	Very low	112 Å²	112	114.1 Å²	114.1	78%	0.783	79%	0.785	S	S	*	*			cis	79.5	134.7	26.4	-147.6	0	0	0	0	113.8
667	C	28.2	Very low	27.8	Very low	117 Å²	117	110.1 Å²	110.1	79%	0.791	78%	0.778	S	S	*	*			cis	-147	-179.2	37.2	-54.4	0	0	0	0	115.5
668	N	26.9	Very low	27.9	Very low	168 Å²	168	112.6 Å²	112.6	90%	0.898	79%	0.786	S	S	*	*			trans	-88.4	169.8	-173.5	-45	-70.6	0	0	0	116.2
669	G	27.1	Very low	27.8	Very low	77 Å²	77	114.2 Å²	114.2	79%	0.794	78%	0.783	S	S	*	*			trans	169.2	113.8	150.1	0	0	0	0	0	118.8
670	G	27.6	Very low	27.6	Very low	77 Å²	77	115.4 Å²	115.4	79%	0.794	79%	0.785	S	S	*	*			trans	58.1	116.2	156.8	0	0	0	0	0	119
671	S	28.8	Very low	27.5	Very low	118 Å²	118	116.5 Å²	116.5	83%	0.825	79%	0.786	S	S	*	*			cis	69.3	106.3	35.4	-163.6	0	0	0	0	116.8
672	S	31.8	Very low	27.4	Very low	105 Å²	105	122.3 Å²	122.3	73%	0.734	79%	0.794	S	S	*	*				-172.3	112.5	123	25.8	0	0	0	0	114.6
673	T	27.7	Very low	27.5	Very low	137 Å²	137	122.4 Å²	122.4	84%	0.84	80%	0.799	S	S	*	*			trans	44.2	125.2	136.3	58.8	0	0	0	0	122.5
674	G	29.1	Very low	27.4	Very low	80 Å²	80	125 Å²	125	83%	0.825	80%	0.799	S	S	*	*			trans	-172.1	38.5	167.7	0	0	0	0	0	114.7
675	S	27	Very low	27.5	Very low	116 Å²	116	124.5 Å²	124.5	81%	0.811	80%	0.803	S	S	*	*			trans	-85.6	123.6	-159.4	-44.1	0	0	0	0	115.7
676	V	30.2	Very low	27.5	Very low	146 Å²	146	128.8 Å²	128.8	89%	0.885	81%	0.811	S	S	*	*			trans	-137.8	109.2	144.9	-176.7	0	0	0	0	108.7
677	G	24.6	Very low	27.5	Very low	64 Å²	64	133.5 Å²	133.5	66%	0.66	81%	0.812	S	S	*	*			trans	-146.6	135.7	172.8	0	0	0	0	0	109.7
678	L	28.7	Very low	27.5	Very low	174 Å²	174	132.3 Å²	132.3	91%	0.911	80%	0.804	S	S	*	*			trans	-129.7	110.9	-176.5	-77.5	173.1	0	0	0	110.8
679	P	27.4	Very low	28.1	Very low	107 Å²	107	128.4 Å²	128.4	70%	0.695	79%	0.788	S	S	*	*			trans	-104	-175.8	174.2	37.2	-30.2	0	0	0	113.1
680	L	24.7	Very low	28.4	Very low	143 Å²	143	131.1 Å²	131.1	75%	0.749	79%	0.785	S	S	*	*			trans	99.4	106.1	158	-59.9	158.5	0	0	0	120.5
681	N	24.8	Very low	28.3	Very low	146 Å²	146	133.7 Å²	133.7	78%	0.781	78%	0.78	S	S	*	*				49.1	119.5	121	-57	7.2	0	0	0	122.1
682	R	27.4	Very low	28.4	Very low	245 Å²	245	139.5 Å²	139.5	93%	0.925	79%	0.786	S	S	*	*			trans	-168.8	151.9	156	-103.5	177.6	170.9	-171.9	-3	108.9
683	C	26.9	Very low	28.1	Very low	120 Å²	120	140.1 Å²	140.1	81%	0.811	78%	0.781	S	S	*	*			cis	-164.6	158.3	-21.2	-128.9	0	0	0	0	110.3
684	L	25.5	Very low	28.2	Very low	146 Å²	146	139.6 Å²	139.6	76%	0.764	77%	0.771	S	S	*	*			trans	-65.5	155.8	177.5	-66.1	148.9	0	0	0	114.5
685	T	28.4	Very low	28	Very low	151 Å²	151	140.5 Å²	140.5	93%	0.926	76%	0.757	S	S	*	*				-172	156.7	120.6	17.4	0	0	0	0	114.4
686	N	26.7	Very low	28	Very low	155 Å²	155	144.3 Å²	144.3	83%	0.829	76%	0.76	S	S	*	*			trans	-113	155.6	-175.9	-99.9	-40.7	0	0	0	112.3
687	R	27.2	Very low	27.8	Very low	212 Å²	212	143.1 Å²	143.1	80%	0.8	75%	0.748	S	S	*	*				178.5	107.2	128.7	-101	172.8	179.7	-155.6	-3.8	116.1
688	S	29.5	Very low	27.8	Very low	91 Å²	91	144.8 Å²	144.8	64%	0.636	74%	0.742	S	S	*	*				63.4	159.6	109.7	-78.9	0	0	0	0	122.6	E279	E279-S688 WeakPolarHBondContact OE1-CB 3.28Å
689	P	39.1	Very low	27.8	Very low	86 Å²	86	143.7 Å²	143.7	56%	0.558	74%	0.742	S	S	*	*				-133.6	-157.5	-129	46.5	-30.9	0	0	0	114.3	E279	E279-P689 WeakPolarHBondContact OE2-CD 3.36Å
690	N	33.2	Very low	27.7	Very low	135 Å²	135	145.6 Å²	145.6	72%	0.722	74%	0.742	S	S	*	*			trans	-160.5	154.3	136.5	-107.4	-66.5	0	0	0	112.7
691	N	26.6	Very low	27.8	Very low	130 Å²	130	147 Å²	147	70%	0.695	75%	0.748	S	S	*	*			trans	-85.9	158.4	176.3	-72.6	-55.3	0	0	0	111.8
692	Y	30.5	Very low	27.9	Very low	240 Å²	240	147.4 Å²	147.4	94%	0.941	75%	0.75	S	S	*	*				-148.5	155.5	114.4	-92.3	-65.8	0	0	0	110
693	N	24.9	Very low	27.9	Very low	118 Å²	118	143.7 Å²	143.7	63%	0.631	74%	0.743	S	S	*	*			trans	-145.8	133	-164.3	178.3	14	0	0	0	110.4
694	I	29.9	Very low	28.1	Very low	126 Å²	126	144.3 Å²	144.3	65%	0.646	75%	0.747	S	S	*	*			trans	-138.2	122	170	-58	-176.9	0	0	0	108.8	S1135	I694-S1135 WeakPolarHBondContact CD1-OG 3.25Å
695	N	25.6	Very low	28.2	Very low	99 Å²	99	143.8 Å²	143.8	53%	0.529	75%	0.745	S	S	.	*			trans	-84.6	161.3	-173.2	-52.4	-57.7	0	0	0	113.1	L697	N695-L697 HydrophobicContact CB-CD1 4.25Å; N695-L697 HydrophobicContact CB-CG 4.26Å
696	F	25.7	Very low	28.3	Very low	197 Å²	197	145.9 Å²	145.9	86%	0.864	75%	0.745	S	S	*	*				176.3	88.9	124	-86.1	-60.5	0	0	0	107.6
697	L	25.8	Very low	28.4	Very low	121 Å²	121	147.9 Å²	147.9	63%	0.634	75%	0.746	S	S	*	*				62.4	130.5	82.2	-61.7	172.3	0	0	0	113.6	N695	N695-L697 HydrophobicContact CB-CD1 4.25Å; N695-L697 HydrophobicContact CB-CG 4.26Å
698	N	25.4	Very low	28.3	Very low	98 Å²	98	143.7 Å²	143.7	52%	0.524	75%	0.748	S	S	.	*			cis	-169	147.9	-8.6	-131.2	22	0	0	0	111.9	E700	N698-E700 WeakPolarHBondContact ND2-CG 3.43Å; N698-E700 PolarHBondContact ND2-OE1 3.47Å; N698-E700 PolarHBondContact ND2-OE2 3.41Å
699	V	29.4	Very low	28.2	Very low	151 Å²	151	148 Å²	148	92%	0.915	76%	0.758	S	S	*	*			trans	-150.8	135.7	136.2	-177.5	0	0	0	0	106.7
700	E	23.7	Very low	27.7	Very low	148 Å²	148	149.8 Å²	149.8	69%	0.692	77%	0.769	S	S	*	*			trans	-112.5	140.4	-163.7	-64	147	140.6	0	0	113.9	N698	N698-E700 WeakPolarHBondContact ND2-CG 3.43Å; N698-E700 PolarHBondContact ND2-OE1 3.47Å; N698-E700 PolarHBondContact ND2-OE2 3.41Å
701	I	28.3	Very low	27.4	Very low	171 Å²	171	151.8 Å²	151.8	88%	0.877	77%	0.774	S	S	*	*			trans	-141.7	139.5	146.8	-60.8	-173.4	0	0	0	106.7
702	D	27.2	Very low	27.5	Very low	155 Å²	155	151.3 Å²	151.3	83%	0.829	78%	0.781	S	S	*	*			trans	-73.7	138.7	-166.6	-62.9	-78.1	0	0	0	116.2
703	E	27.2	Very low	27.1	Very low	167 Å²	167	143.8 Å²	143.8	78%	0.78	78%	0.777	S	S	*	*			trans	-94	129.5	161.5	-73.8	-168.7	149.1	0	0	111.4	N705	E703-N705 PolarHBondContact OE2-ND2 2.93Å
704	C	30.7	Very low	27.2	Very low	133 Å²	133	145.8 Å²	145.8	90%	0.899	79%	0.787	S	S	*	*			trans	-109.3	99.6	162.8	-78.6	0	0	0	0	109.9
705	N	27.4	Very low	26.9	Very low	136 Å²	136	149 Å²	149	73%	0.727	79%	0.792	S	S	*	*			trans	-78.6	126.1	177.9	-91.1	-92.3	0	0	0	112	E703	E703-N705 PolarHBondContact OE2-ND2 2.93Å
706	E	31.5	Very low	27.1	Very low	194 Å²	194	148.2 Å²	148.2	91%	0.907	79%	0.785	S	S	*	*			trans	-147.1	157.4	148.9	-137.3	159.9	-143.9	0	0	110.5
707	K	27.8	Very low	27.3	Very low	197 Å²	197	144.7 Å²	144.7	86%	0.857	77%	0.771	S	S	*	*			trans	-100.1	141.3	-163.1	-66	-178	172.7	-167.1	0	113.5
708	C	26	Very low	27.4	Very low	124 Å²	124	145.5 Å²	145.5	84%	0.838	78%	0.775	S	S	*	*			trans	-127.5	143.6	159	-69	0	0	0	0	110.5
709	E	25.5	Very low	27.5	Very low	183 Å²	183	142.8 Å²	142.8	86%	0.855	76%	0.764	S	S	*	*			trans	-95	142.7	-179.7	-61	178.5	156.4	0	0	111.1
710	P	30.6	Very low	27.5	Very low	122 Å²	122	143.9 Å²	143.9	79%	0.792	76%	0.764	S	S	*	*			trans	-97.7	97.5	170.1	34.2	-28.6	0	0	0	111.5
711	E	26.3	Very low	27.6	Very low	178 Å²	178	139.8 Å²	139.8	83%	0.832	75%	0.747	S	S	*	*			trans	-72.7	135.1	161.7	-77	-158.1	136.2	0	0	110.6
712	S	27.4	Very low	27.8	Very low	119 Å²	119	138.8 Å²	138.8	83%	0.832	75%	0.749	S	S	*	*	S	Bend	trans	63.4	127.1	-178.9	73	0	0	0	0	115.8
713	G	23.8	Very low	27.8	Very low	83 Å²	83	137.8 Å²	137.8	86%	0.856	75%	0.748	S	S	*	*			trans	-90.2	126	-176.2	0	0	0	0	0	113.3
714	L	25.7	Very low	27.7	Very low	160 Å²	160	134.9 Å²	134.9	84%	0.838	75%	0.746	S	S	*	*			trans	-148.9	150	158.5	-100.9	162.7	0	0	0	107.7
715	Y	24.3	Very low	27.5	Very low	193 Å²	193	133.1 Å²	133.1	76%	0.757	74%	0.736	S	S	*	*			trans	-77.2	127.6	-177.3	-91	-108.6	0	0	0	111.1
716	H	29.9	Very low	27.4	Very low	83 Å²	83	134.2 Å²	134.2	38%	0.384	74%	0.741	S	S	.	*			trans	-149.3	136.3	163.2	-98.3	-56.1	0	0	0	114.7	Q162 L163 L181	Q162-H716 WeakPolarHBondContact CB-NE2 2.91Å; Q162-H716 PolarHBondContact O-NE2 3.11Å; L163-H716 VanDerWaalsContact CB-CE1 3.41Å; L163-H716 WeakPolarHBondContact CB-CE1 3.02Å; L181-H716 WeakPolarHBondContact CD1-CE1 3.09Å; L181-H716 VanDerWaalsContact CD1-ND1 3.32Å; L181-H716 WeakPolarHBondContact CD1-ND1 3.3Å
717	E	29.3	Very low	27.2	Very low	122 Å²	122	136.6 Å²	136.6	57%	0.57	74%	0.742	S	S	*	*			trans	-91.5	155.5	156.3	-69.6	-165.8	105.6	0	0	111
718	L	29.1	Very low	27.1	Very low	138 Å²	138	132.6 Å²	132.6	72%	0.723	74%	0.739	S	S	*	*			trans	-137.7	128.1	171.8	-76.6	170.4	0	0	0	109.9	L163	L163-L718 HydrophobicContact CD2-CD2 3.64Å
719	S	26.7	Very low	27.1	Very low	41 Å²	41	134.6 Å²	134.6	29%	0.287	74%	0.739	S	S	.	*			trans	-81.6	151.6	174.2	-41.1	0	0	0	0	112
720	L	29.1	Very low	27	Very low	174 Å²	174	130.1 Å²	130.1	91%	0.911	72%	0.721	S	S	*	*			trans	-155.4	153.6	156.3	-111.8	170.4	0	0	0	111.2
721	D	26.5	Very low	26.7	Very low	62 Å²	62	128.9 Å²	128.9	33%	0.332	71%	0.714	S	S	.	*			trans	-106	153.7	-166.4	-63.9	-30.9	0	0	0	113.6	R175	R175-D721 VanDerWaalsContact CD-OD2 3.27Å; R175-D721 WeakPolarHBondContact CD-OD2 3.45Å; R175-D721 IonicContact CZ-OD2 3.59Å; R175-D721 IonicContact NE-OD2 3.64Å; R175-D721 IonicContact NH1-OD1 2.87Å; R175-D721 PolarHBondContact NH1-OD1 3.04Å; R175-D721 IonicContact NH1-OD2 3.2Å; R175-D721 PolarHBondContact NH1-OD2 2.84Å
722	T	31.5	Very low	26.7	Very low	151 Å²	151	128.6 Å²	128.6	93%	0.926	71%	0.713	S	S	*	*			trans	-158.8	151	136.2	-2	0	0	0	0	115
723	V	27	Very low	26.8	Very low	134 Å²	134	129.4 Å²	129.4	81%	0.812	70%	0.702	S	S	*	*			trans	-91.6	133.2	-171	173.7	0	0	0	0	112.4
724	S	26.3	Very low	26.9	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	69%	0.685	S	S	*	*			trans	-167.1	127	138.3	-149.3	0	0	0	0	115.8
725	S	25.7	Very low	27.1	Very low	97 Å²	97	124.8 Å²	124.8	68%	0.678	66%	0.657	S	S	*	*			trans	28.4	119.9	152.5	53.3	0	0	0	0	123.6
726	D	25.4	Very low	27.5	Very low	159 Å²	159	120 Å²	120	85%	0.85	65%	0.65	S	S	*	*			trans	46.6	76.2	142.2	-76.9	-38	0	0	0	119.8
727	R	27.2	Very low	27.9	Very low	244 Å²	244	118.5 Å²	118.5	92%	0.921	64%	0.644	S	S	*	*	S	Bend	trans	-161.3	120.8	141.3	-106.6	154.9	-163.7	-147.1	4.5	112.3
728	S	25.9	Very low	28.8	Very low	112 Å²	112	116.5 Å²	116.5	78%	0.783	64%	0.635	S	S	*	*			trans	32	90	162.4	-165.6	0	0	0	0	117.7	L730	S728-L730 PolarHBondContact O-N 2.86Å
729	I	25	Very low	29.7	Very low	167 Å²	167	115.7 Å²	115.7	86%	0.856	63%	0.63	S	S	*	*			trans	-62.2	97	175.3	-54.2	167.4	0	0	0	110.7
730	L	24.8	Very low	31.5	Very low	88 Å²	88	117.1 Å²	117.1	46%	0.461	64%	0.635	S	S	.	*			trans	-161.9	29	172.9	-122.6	171.5	0	0	0	115.9	S728 R744 Y861	S728-L730 PolarHBondContact O-N 2.86Å; L730-R744 PolarHBondContact O-NH1 2.83Å; L730-Y861 HydrophobicContact CD1-CD2 4.35Å
731	C	24.3	Very low	33.9	Very low	97 Å²	97	109 Å²	109	66%	0.655	59%	0.593	S	S	*	*			trans	-139.6	107.9	169.6	-76.5	0	0	0	0	110.3
732	E	26.3	Very low	36.7	Very low	171 Å²	171	107.9 Å²	107.9	80%	0.799	59%	0.588	S	S	*	*			trans	-120.4	133.6	163.6	-72.2	-176.7	132.3	0	0	107.8
733	F	28.1	Very low	39.4	Very low	137 Å²	137	102.6 Å²	102.6	60%	0.601	56%	0.556	S	S	*	*			trans	46.8	84.4	173.7	-52.4	-73.5	0	0	0	117.2	D735	F733-D735 PolarHBondContact O-N 3.42Å
734	I	27.8	Very low	42.3	Very low	98 Å²	98	101.6 Å²	101.6	50%	0.503	54%	0.537	S	S	.	.			trans	-85	97.3	148.5	-53.9	176.6	0	0	0	106.5	E738 L739	I734-E738 HydrophobicContact CG2-CB 3.9Å; I734-L739 HydrophobicContact CG2-CB 4.33Å; I734-L739 HydrophobicContact CG2-CD1 3.89Å; I734-L739 HydrophobicContact CG2-CG 4.03Å
735	D	29.8	Very low	45.1	Very low	47 Å²	47	100.5 Å²	100.5	25%	0.251	52%	0.519	S	S	.	.			trans	-52.7	138.6	162.9	174.5	-10	0	0	0	108.5	F733 L737 E738	F733-D735 PolarHBondContact O-N 3.42Å; D735-L737 PolarHBondContact O-N 3.49Å; D735-L737 PolarHBondContact OD1-N 2.96Å; D735-L737 WeakPolarHBondContact OD2-CD1 3.24Å; D735-E738 HydrophobicContact CB-CG 4.42Å; D735-E738 WeakPolarHBondContact O-CB 3.16Å; D735-E738 PolarHBondContact O-N 3.28Å
736	P	31	Very low	48.1	Very low	93 Å²	93	100.1 Å²	100.1	60%	0.604	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-10.6	169.2	-29.2	36.9	0	0	0	116.2	Y1015	P736-Y1015 VanDerWaalsContact C-OH 3.22Å; P736-Y1015 PolarHBondContact O-OH 2.87Å
737	L	39.8	Very low	50.9	Low	51 Å²	51	92.6 Å²	92.6	27%	0.267	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-29.3	165.1	-80.2	139.6	0	0	0	114.9	D735 Y1015	D735-L737 PolarHBondContact O-N 3.49Å; D735-L737 PolarHBondContact OD1-N 2.96Å; D735-L737 WeakPolarHBondContact OD2-CD1 3.24Å; L737-Y1015 HydrophobicContact CD2-CD1 3.7Å; L737-Y1015 HydrophobicContact CD2-CE1 3.27Å; L737-Y1015 HydrophobicContact CG-CE1 3.63Å; L737-Y1015 PolarHBondContact N-OH 3.34Å
738	E	48.4	Very low	53.6	Low	81 Å²	81	82.5 Å²	82.5	38%	0.379	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-18.8	-173.9	-85.3	-93.9	106.1	0	0	114.2	I734 D735 N740 T741	I734-E738 HydrophobicContact CG2-CB 3.9Å; D735-E738 HydrophobicContact CB-CG 4.42Å; D735-E738 WeakPolarHBondContact O-CB 3.16Å; D735-E738 PolarHBondContact O-N 3.28Å; E738-N740 PolarHBondContact O-N 2.72Å; E738-T741 WeakPolarHBondContact CA-OG1 3.5Å; E738-T741 PolarHBondContact O-N 3.12Å; E738-T741 PolarHBondContact O-OG1 2.61Å; E738-T741 PolarHBondContact OE1-OG1 2.96Å
739	L	47.8	Very low	56.4	Low	120 Å²	120	78.7 Å²	78.7	63%	0.628	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19	-170.5	-125.3	127.7	0	0	0	114.6	I734	I734-L739 HydrophobicContact CG2-CB 4.33Å; I734-L739 HydrophobicContact CG2-CD1 3.89Å; I734-L739 HydrophobicContact CG2-CG 4.03Å
740	N	64	Low	59.2	Low	71 Å²	71	74.9 Å²	74.9	38%	0.38	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-1.2	175.8	-61.3	-5.8	0	0	0	113.8	E738 Q758	E738-N740 PolarHBondContact O-N 2.72Å; N740-Q758 VanDerWaalsContact CB-OE1 3.32Å; N740-Q758 PolarHBondContact ND2-NE2 3.35Å; N740-Q758 VanDerWaalsContact ND2-NE2 3.15Å; N740-Q758 PolarHBondContact ND2-OE1 2.89Å
741	T	79.3	Confident	61.9	Low	4 Å²	4	71.2 Å²	71.2	3%	0.025	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-21.1	179.1	60.6	0	0	0	0	112.9	E738 L756 A781 V782	E738-T741 WeakPolarHBondContact CA-OG1 3.5Å; E738-T741 PolarHBondContact O-N 3.12Å; E738-T741 PolarHBondContact O-OG1 2.61Å; E738-T741 PolarHBondContact OE1-OG1 2.96Å; T741-L756 VanDerWaalsContact O-CD1 3.23Å; T741-L756 WeakPolarHBondContact O-CD1 3.49Å; T741-A781 CarbonylContact O-C 3.54Å; T741-A781 VanDerWaalsContact O-CA 3.29Å; T741-A781 WeakPolarHBondContact O-CA 3.37Å; T741-V782 PolarHBondContact O-N 2.9Å
742	T	85.8	Confident	64.8	Low	38 Å²	38	68 Å²	68	23%	0.233	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137.4	-175.1	-64.9	0	0	0	0	112.1	R744 L780 A781	T742-R744 HydrophobicContact CG2-CG 4.47Å; T742-L780 WeakPolarHBondContact CA-O 3.39Å; T742-A781 HydrophobicContact CG2-CB 4.21Å; T742-A781 VanDerWaalsContact OG1-CB 3.3Å; T742-A781 WeakPolarHBondContact OG1-CB 3.46Å
743	V	87.4	Confident	67.6	Low	41 Å²	41	62.6 Å²	62.6	25%	0.248	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.9	173	63	0	0	0	0	110.1	L754 L756 Y779 L780	V743-L754 HydrophobicContact CG1-CB 4.05Å; V743-L754 HydrophobicContact CG1-CD2 4.22Å; V743-L754 HydrophobicContact CG1-CG 4.34Å; V743-L756 HydrophobicContact CB-CD2 3.83Å; V743-L756 HydrophobicContact CG1-CD2 3.71Å; V743-L756 HydrophobicContact CG1-CG 3.87Å; V743-Y779 CarbonylContact O-C 3.58Å; V743-Y779 VanDerWaalsContact O-CA 3.27Å; V743-Y779 WeakPolarHBondContact O-CA 3.18Å; V743-L780 HydrophobicContact CG1-CB 3.9Å; V743-L780 HydrophobicContact CG1-CD2 4.38Å; V743-L780 HydrophobicContact CG1-CG 4.49Å; V743-L780 PolarHBondContact N-O 3.36Å; V743-L780 PolarHBondContact O-N 2.76Å
744	R	87.9	Confident	70.6	Confident	112 Å²	112	56.2 Å²	56.2	42%	0.423	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	145.4	177.7	-48.3	-166.6	-172.9	169.7	3.7	110.4	L730 T742 E777 V778	L730-R744 PolarHBondContact O-NH1 2.83Å; T742-R744 HydrophobicContact CG2-CG 4.47Å; R744-E777 WeakPolarHBondContact CD-OE1 3.38Å; R744-V778 CarbonylContact C-O 3.49Å; R744-V778 WeakPolarHBondContact CA-O 3.28Å
745	K	86.2	Confident	73.5	Confident	82 Å²	82	53.1 Å²	53.1	36%	0.357	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	136.4	179.1	-154.3	-179.8	-163.6	-175.9	0	111.2	I747 D752 Q753 L754 V778	K745-I747 HydrophobicContact CB-CD1 4.49Å; K745-I747 HydrophobicContact CB-CG1 4.36Å; K745-I747 HydrophobicContact CD-CG1 4.46Å; K745-I747 HydrophobicContact CG-CG1 4.41Å; K745-D752 WeakPolarHBondContact CD-OD2 3.4Å; K745-D752 WeakPolarHBondContact CE-OD2 3.42Å; K745-D752 IonicContact NZ-OD1 3.8Å; K745-D752 PolarHBondContact NZ-OD1 2.86Å; K745-D752 IonicContact NZ-OD2 2.94Å; K745-D752 PolarHBondContact NZ-OD2 3.15Å; K745-Q753 PolarHBondContact NZ-O 2.91Å; K745-L754 HydrophobicContact CB-CD1 3.81Å; K745-L754 HydrophobicContact CB-CG 4.05Å; K745-L754 HydrophobicContact CD-CD1 4.28Å; K745-V778 PolarHBondContact N-O 2.89Å; K745-V778 PolarHBondContact O-N 2.85Å
746	T	87.4	Confident	76.3	Confident	90 Å²	90	51.3 Å²	51.3	55%	0.552	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	121.7	171.7	-50.7	0	0	0	0	109.8	L775 V776	T746-L775 HydrophobicContact CG2-CB 4.02Å; T746-V776 WeakPolarHBondContact CA-O 3.47Å
747	I	85	Confident	78.9	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.9	-172.1	-62.3	173.9	0	0	0	110.4	K745 D752 L754 I765 L770 L775 V776 V778	K745-I747 HydrophobicContact CB-CD1 4.49Å; K745-I747 HydrophobicContact CB-CG1 4.36Å; K745-I747 HydrophobicContact CD-CG1 4.46Å; K745-I747 HydrophobicContact CG-CG1 4.41Å; I747-D752 HydrophobicContact CB-CB 4.4Å; I747-D752 HydrophobicContact CD1-CB 3.72Å; I747-D752 HydrophobicContact CG1-CB 3.72Å; I747-D752 HydrophobicContact CG2-CB 3.83Å; I747-L754 HydrophobicContact CD1-CD1 3.39Å; I747-I765 HydrophobicContact CD1-CD1 3.9Å; I747-L770 HydrophobicContact CB-CD1 4.04Å; I747-L770 HydrophobicContact CG2-CD1 3.84Å; I747-L775 WeakPolarHBondContact O-CA 3.47Å; I747-V776 PolarHBondContact N-O 3.48Å; I747-V776 PolarHBondContact O-N 3.36Å; I747-V778 HydrophobicContact CD1-CB 4.39Å; I747-V778 HydrophobicContact CD1-CG2 4.43Å
748	S	84.8	Confident	80.9	Confident	31 Å²	31	51.8 Å²	51.8	22%	0.217	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	179	174	68.1	0	0	0	0	112.1	D750 G751	S748-D750 PolarHBondContact O-N 2.9Å; S748-D750 VanDerWaalsContact OG-CB 3.3Å; S748-D750 WeakPolarHBondContact OG-CB 3.47Å; S748-D750 PolarHBondContact OG-N 2.81Å; S748-D750 VanDerWaalsContact OG-N 3.13Å; S748-D750 PolarHBondContact OG-OD2 3.22Å; S748-G751 PolarHBondContact O-N 2.87Å; S748-G751 VanDerWaalsContact O-N 3.11Å
749	C	84.7	Confident	82.8	Confident	32 Å²	32	48 Å²	48	22%	0.216	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-9.3	168.4	58.9	0	0	0	0	114.6	G751 G768 L770	C749-G751 PolarHBondContact O-N 2.9Å; C749-G768 PolarHBondContact O-N 3.14Å; C749-L770 WeakPolarHBondContact CB-O 3.34Å
750	D	82.5	Confident	84.7	Confident	87 Å²	87	42.6 Å²	42.6	47%	0.465	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.3	173.9	-54.7	-66.9	0	0	0	112.8	S748 Q767	S748-D750 PolarHBondContact O-N 2.9Å; S748-D750 VanDerWaalsContact OG-CB 3.3Å; S748-D750 WeakPolarHBondContact OG-CB 3.47Å; S748-D750 PolarHBondContact OG-N 2.81Å; S748-D750 VanDerWaalsContact OG-N 3.13Å; S748-D750 PolarHBondContact OG-OD2 3.22Å; D750-Q767 VanDerWaalsContact O-CA 3.27Å; D750-Q767 WeakPolarHBondContact O-CA 3.35Å; D750-Q767 VanDerWaalsContact O-CB 3.22Å; D750-Q767 WeakPolarHBondContact O-CB 3.5Å
751	G	82.1	Confident	86.1	Confident	11 Å²	11	39.2 Å²	39.2	11%	0.113	22%	0.217	C	C	.	.			trans	75.3	164.8	-176.6	0	0	0	0	0	112.8	S748 C749 I765	S748-G751 PolarHBondContact O-N 2.87Å; S748-G751 VanDerWaalsContact O-N 3.11Å; C749-G751 PolarHBondContact O-N 2.9Å; G751-I765 CarbonylContact C-O 3.56Å; G751-I765 WeakPolarHBondContact CA-O 3.45Å
752	D	85.2	Confident	86.7	Confident	31 Å²	31	39.8 Å²	39.8	17%	0.166	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	-178.6	-175.6	-153	-22.1	0	0	0	110.8	K745 I747 I765 Y1145	K745-D752 WeakPolarHBondContact CD-OD2 3.4Å; K745-D752 WeakPolarHBondContact CE-OD2 3.42Å; K745-D752 IonicContact NZ-OD1 3.8Å; K745-D752 PolarHBondContact NZ-OD1 2.86Å; K745-D752 IonicContact NZ-OD2 2.94Å; K745-D752 PolarHBondContact NZ-OD2 3.15Å; I747-D752 HydrophobicContact CB-CB 4.4Å; I747-D752 HydrophobicContact CD1-CB 3.72Å; I747-D752 HydrophobicContact CG1-CB 3.72Å; I747-D752 HydrophobicContact CG2-CB 3.83Å; D752-I765 PolarHBondContact N-O 3.42Å; D752-I765 PolarHBondContact O-N 3.46Å; D752-Y1145 PolarHBondContact N-OH 3.33Å
753	Q	85.9	Confident	87	Confident	57 Å²	57	38 Å²	38	27%	0.266	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136	174.6	-169.3	168.6	105.3	0	0	112.3	K745 L763 T764	K745-Q753 PolarHBondContact NZ-O 2.91Å; Q753-L763 WeakPolarHBondContact CA-O 3.46Å; Q753-L763 WeakPolarHBondContact CG-O 3.29Å; Q753-T764 PolarHBondContact NE2-OG1 3.06Å
754	L	89.9	Confident	87.1	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	144.7	162.3	-78.4	67.4	0	0	0	108.4	V743 K745 I747 F762 L763 V778 L780	V743-L754 HydrophobicContact CG1-CB 4.05Å; V743-L754 HydrophobicContact CG1-CD2 4.22Å; V743-L754 HydrophobicContact CG1-CG 4.34Å; K745-L754 HydrophobicContact CB-CD1 3.81Å; K745-L754 HydrophobicContact CB-CG 4.05Å; K745-L754 HydrophobicContact CD-CD1 4.28Å; I747-L754 HydrophobicContact CD1-CD1 3.39Å; L754-F762 WeakPolarHBondContact O-CA 3.24Å; L754-L763 HydrophobicContact CB-CB 4.31Å; L754-L763 PolarHBondContact N-O 3.12Å; L754-L763 PolarHBondContact O-N 3.39Å; L754-V778 HydrophobicContact CD2-CG1 4.2Å; L754-L780 HydrophobicContact CB-CB 4.09Å; L754-L780 HydrophobicContact CB-CD2 3.98Å; L754-L780 HydrophobicContact CD2-CB 3.69Å
755	A	88.6	Confident	87.2	Confident	33 Å²	33	31.5 Å²	31.5	27%	0.273	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	140.4	179.8	0	0	0	0	0	110.8	P757 F762	A755-P757 HydrophobicContact CB-CG 4.22Å; A755-F762 HydrophobicContact CB-CD1 3.56Å; A755-F762 HydrophobicContact CB-CE1 3.89Å
756	L	88.6	Confident	87.1	Confident	8 Å²	8	28.3 Å²	28.3	4%	0.042	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	81.6	165.5	-67.6	171.1	0	0	0	106.9	T741 V743 Q758 S759 G760 V761 L780 V782	T741-L756 VanDerWaalsContact O-CD1 3.23Å; T741-L756 WeakPolarHBondContact O-CD1 3.49Å; V743-L756 HydrophobicContact CB-CD2 3.83Å; V743-L756 HydrophobicContact CG1-CD2 3.71Å; V743-L756 HydrophobicContact CG1-CG 3.87Å; L756-Q758 VanDerWaalsContact C-N 3.25Å; L756-Q758 PolarHBondContact O-N 3.07Å; L756-S759 PolarHBondContact O-N 3.47Å; L756-G760 PolarHBondContact O-N 3.05Å; L756-V761 HydrophobicContact CB-CB 4.37Å; L756-V761 PolarHBondContact N-O 2.97Å; L756-V761 PolarHBondContact O-N 3.36Å; L756-L780 HydrophobicContact CD1-CD2 4.43Å; L756-L780 HydrophobicContact CD1-CG 4.07Å; L756-L780 HydrophobicContact CG-CD2 4.4Å; L756-L780 HydrophobicContact CG-CG 4.49Å; L756-V782 HydrophobicContact CD1-CG2 3.85Å
757	P	85.7	Confident	86.8	Confident	80 Å²	80	27.7 Å²	27.7	52%	0.519	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-25.7	-165.9	-23.2	35.4	0	0	0	113.8	A755 K1007	A755-P757 HydrophobicContact CB-CG 4.22Å; P757-K1007 PolarHBondContact O-NZ 2.91Å
758	Q	82.8	Confident	86.6	Confident	75 Å²	75	28.8 Å²	28.8	35%	0.35	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-55.7	172.3	-70.7	173.2	16.8	0	0	110.1	N740 L756 G760 K1007 E1011	N740-Q758 VanDerWaalsContact CB-OE1 3.32Å; N740-Q758 PolarHBondContact ND2-NE2 3.35Å; N740-Q758 VanDerWaalsContact ND2-NE2 3.15Å; N740-Q758 PolarHBondContact ND2-OE1 2.89Å; L756-Q758 VanDerWaalsContact C-N 3.25Å; L756-Q758 PolarHBondContact O-N 3.07Å; Q758-G760 PolarHBondContact O-N 2.86Å; Q758-G760 VanDerWaalsContact O-N 3.16Å; Q758-K1007 WeakPolarHBondContact O-CD 3.36Å; Q758-K1007 WeakPolarHBondContact O-CE 3.36Å; Q758-K1007 WeakPolarHBondContact O-CG 3.4Å; Q758-E1011 HydrophobicContact CB-CG 4.08Å; Q758-E1011 WeakPolarHBondContact O-CG 3.39Å
759	S	87.4	Confident	86.6	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.4	176.9	-56.4	0	0	0	0	114.6	L756 V761 D1008	L756-S759 PolarHBondContact O-N 3.47Å; S759-V761 VanDerWaalsContact C-N 3.33Å; S759-D1008 VanDerWaalsContact CB-OD1 3.25Å; S759-D1008 WeakPolarHBondContact CB-OD1 3.17Å; S759-D1008 PolarHBondContact O-N 2.84Å; S759-D1008 PolarHBondContact OG-OD1 2.97Å
760	G	88	Confident	86.7	Confident	7 Å²	7	26 Å²	26	7%	0.072	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	23.6	-173.4	0	0	0	0	0	113.2	L756 Q758 F762	L756-G760 PolarHBondContact O-N 3.05Å; Q758-G760 PolarHBondContact O-N 2.86Å; Q758-G760 VanDerWaalsContact O-N 3.16Å; G760-F762 WeakPolarHBondContact O-CD2 3.4Å; G760-F762 WeakPolarHBondContact O-CE2 3.38Å
761	V	92.3	Very high	86.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134	-173.8	178	0	0	0	0	110	L756 S759 L780 V782 I803 S819 F820	L756-V761 HydrophobicContact CB-CB 4.37Å; L756-V761 PolarHBondContact N-O 2.97Å; L756-V761 PolarHBondContact O-N 3.36Å; S759-V761 VanDerWaalsContact C-N 3.33Å; V761-L780 HydrophobicContact CG1-CD1 4.06Å; V761-L780 HydrophobicContact CG1-CD2 4.24Å; V761-L780 HydrophobicContact CG1-CG 4.36Å; V761-V782 HydrophobicContact CB-CG2 4.16Å; V761-V782 HydrophobicContact CG1-CG2 4.36Å; V761-V782 HydrophobicContact CG2-CG2 3.81Å; V761-I803 HydrophobicContact CG1-CG1 4.07Å; V761-I803 HydrophobicContact CG1-CG2 3.64Å; V761-I803 HydrophobicContact CG2-CG1 4.27Å; V761-S819 CarbonylContact C-O 3.56Å; V761-S819 WeakPolarHBondContact CA-O 3.38Å; V761-F820 HydrophobicContact CG1-CB 4.3Å; V761-F820 HydrophobicContact CG2-CB 3.92Å
762	F	92.1	Very high	85.5	Confident	17 Å²	17	31.6 Å²	31.6	8%	0.075	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	145.6	-173.8	-51.4	-94.3	0	0	0	111	L754 A755 G760 L818 S819 F1128	L754-F762 WeakPolarHBondContact O-CA 3.24Å; A755-F762 HydrophobicContact CB-CD1 3.56Å; A755-F762 HydrophobicContact CB-CE1 3.89Å; G760-F762 WeakPolarHBondContact O-CD2 3.4Å; G760-F762 WeakPolarHBondContact O-CE2 3.38Å; F762-L818 CarbonylContact O-C 3.56Å; F762-L818 WeakPolarHBondContact O-CA 3.26Å; F762-S819 PolarHBondContact N-O 2.79Å; F762-S819 PolarHBondContact O-N 3.12Å; F762-F1128 HydrophobicContact CZ-CE1 4.45Å; F762-F1128 HydrophobicContact CZ-CZ 4.29Å
763	L	92.5	Very high	84.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.4	172.3	173	68.2	0	0	0	108.7	Q753 L754 I765 V778 L780 F805 V816 L818	Q753-L763 WeakPolarHBondContact CA-O 3.46Å; Q753-L763 WeakPolarHBondContact CG-O 3.29Å; L754-L763 HydrophobicContact CB-CB 4.31Å; L754-L763 PolarHBondContact N-O 3.12Å; L754-L763 PolarHBondContact O-N 3.39Å; L763-I765 HydrophobicContact CD1-CG1 4.5Å; L763-I765 HydrophobicContact CD2-CD1 4.04Å; L763-I765 HydrophobicContact CD2-CG1 4.26Å; L763-I765 HydrophobicContact CG-CD1 4.36Å; L763-I765 HydrophobicContact CG-CG1 4.02Å; L763-V778 HydrophobicContact CD2-CG1 3.9Å; L763-L780 HydrophobicContact CB-CD1 4.16Å; L763-L780 HydrophobicContact CB-CD2 3.87Å; L763-L780 HydrophobicContact CB-CG 4.44Å; L763-F805 HydrophobicContact CD1-CD1 4.48Å; L763-F805 HydrophobicContact CD1-CD2 4.25Å; L763-F805 HydrophobicContact CD1-CE2 4.45Å; L763-F805 HydrophobicContact CD1-CG 4.26Å; L763-F805 HydrophobicContact CD2-CB 3.8Å; L763-F805 HydrophobicContact CD2-CD2 3.89Å; L763-F805 HydrophobicContact CD2-CG 3.99Å; L763-V816 HydrophobicContact CD1-CB 3.96Å; L763-V816 HydrophobicContact CD1-CG2 3.73Å; L763-L818 HydrophobicContact CB-CD1 4.13Å; L763-L818 HydrophobicContact CD1-CB 4.44Å; L763-L818 HydrophobicContact CD1-CD1 4.04Å
764	T	90.4	Very high	83.6	Confident	16 Å²	16	37 Å²	37	10%	0.098	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	120.2	177.2	-45.4	0	0	0	0	108.9	Q753 P766 L817 Y1145 R1201	Q753-T764 PolarHBondContact NE2-OG1 3.06Å; T764-P766 WeakPolarHBondContact O-CD 3.28Å; T764-L817 PolarHBondContact N-O 3.05Å; T764-L817 PolarHBondContact O-N 3.12Å; T764-Y1145 HydrophobicContact CG2-CE1 4.14Å; T764-R1201 PolarHBondContact OG1-NH2 3.22Å; T764-R1201 VanDerWaalsContact OG1-NH2 3.09Å
765	I	88.4	Confident	83.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	98.7	-177.9	-59	-170.7	0	0	0	107.1	I747 G751 D752 L763 A769 L770 V778 V816 Y1145	I747-I765 HydrophobicContact CD1-CD1 3.9Å; G751-I765 CarbonylContact C-O 3.56Å; G751-I765 WeakPolarHBondContact CA-O 3.45Å; D752-I765 PolarHBondContact N-O 3.42Å; D752-I765 PolarHBondContact O-N 3.46Å; L763-I765 HydrophobicContact CD1-CG1 4.5Å; L763-I765 HydrophobicContact CD2-CD1 4.04Å; L763-I765 HydrophobicContact CD2-CG1 4.26Å; L763-I765 HydrophobicContact CG-CD1 4.36Å; L763-I765 HydrophobicContact CG-CG1 4.02Å; I765-A769 HydrophobicContact CG2-CB 3.85Å; I765-L770 HydrophobicContact CG2-CG 4.32Å; I765-V778 HydrophobicContact CD1-CB 4.3Å; I765-V778 HydrophobicContact CD1-CG1 3.88Å; I765-V778 HydrophobicContact CD1-CG2 3.97Å; I765-V816 HydrophobicContact CB-CG1 4.21Å; I765-V816 HydrophobicContact CG1-CB 4.38Å; I765-V816 HydrophobicContact CG1-CG1 3.87Å; I765-V816 HydrophobicContact CG2-CG1 4.08Å; I765-Y1145 PolarHBondContact O-OH 2.99Å
766	P	83.9	Confident	82.7	Confident	15 Å²	15	43.2 Å²	43.2	10%	0.097	25%	0.246	C	C	.	.			trans	-68.7	155.7	-170.4	27	-33.7	0	0	0	112.3	T764 G768 A769 P815	T764-P766 WeakPolarHBondContact O-CD 3.28Å; P766-G768 PolarHBondContact O-N 2.88Å; P766-A769 HydrophobicContact CG-CB 4.18Å; P766-A769 WeakPolarHBondContact O-CB 3.49Å; P766-A769 PolarHBondContact O-N 2.97Å; P766-P815 WeakPolarHBondContact CG-O 3.18Å
767	Q	82.2	Confident	82.6	Confident	78 Å²	78	47.4 Å²	47.4	36%	0.364	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	127.8	178.7	-175	167.1	50.2	0	0	112	D750 K814	D750-Q767 VanDerWaalsContact O-CA 3.27Å; D750-Q767 WeakPolarHBondContact O-CA 3.35Å; D750-Q767 VanDerWaalsContact O-CB 3.22Å; D750-Q767 WeakPolarHBondContact O-CB 3.5Å; Q767-K814 WeakPolarHBondContact O-CE 3.3Å; Q767-K814 PolarHBondContact O-NZ 3.45Å
768	G	81.1	Confident	82.7	Confident	24 Å²	24	43.6 Å²	43.6	25%	0.247	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	16.7	-175.7	0	0	0	0	0	115.3	C749 P766 S813	C749-G768 PolarHBondContact O-N 3.14Å; P766-G768 PolarHBondContact O-N 2.88Å; G768-S813 PolarHBondContact O-OG 2.91Å
769	A	85.3	Confident	83.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	-78.3	-24.5	166.4	0	0	0	0	0	113	I765 P766 L812 S813 K814 V816	I765-A769 HydrophobicContact CG2-CB 3.85Å; P766-A769 HydrophobicContact CG-CB 4.18Å; P766-A769 WeakPolarHBondContact O-CB 3.49Å; P766-A769 PolarHBondContact O-N 2.97Å; A769-L812 HydrophobicContact CB-CD2 4.45Å; A769-L812 CarbonylContact O-C 3.53Å; A769-L812 WeakPolarHBondContact O-CA 3.34Å; A769-S813 PolarHBondContact O-N 3.27Å; A769-S813 PolarHBondContact O-OG 2.73Å; A769-K814 HydrophobicContact CB-CB 4Å; A769-V816 HydrophobicContact CB-CG1 4.48Å
770	L	85.1	Confident	83.3	Confident	5 Å²	5	42.5 Å²	42.5	3%	0.026	23%	0.234	C	C	.	.	S	Bend	trans	-103	151.3	170	-62	178.4	0	0	0	110.3	I747 C749 I765 V776 L810 L812	I747-L770 HydrophobicContact CB-CD1 4.04Å; I747-L770 HydrophobicContact CG2-CD1 3.84Å; C749-L770 WeakPolarHBondContact CB-O 3.34Å; I765-L770 HydrophobicContact CG2-CG 4.32Å; L770-V776 HydrophobicContact CD1-CB 4.21Å; L770-V776 HydrophobicContact CD1-CG2 4.26Å; L770-V776 HydrophobicContact CD2-CG2 4.42Å; L770-L810 HydrophobicContact CD2-CD1 3.93Å; L770-L810 HydrophobicContact CD2-CG 4.45Å; L770-L812 HydrophobicContact CD2-CD2 3.98Å
771	Q	76.8	Confident	83.4	Confident	114 Å²	114	42.6 Å²	42.6	53%	0.533	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-66.2	142.7	-178.4	-64.9	-171.4	-14.4	0	0	112	N773 S774 N811	Q771-N773 PolarHBondContact O-N 3.4Å; Q771-S774 WeakPolarHBondContact O-CB 3.47Å; Q771-S774 PolarHBondContact O-N 3.31Å; Q771-S774 PolarHBondContact O-OG 2.99Å; Q771-N811 PolarHBondContact NE2-ND2 3.03Å
772	S	64.1	Low	83.3	Confident	101 Å²	101	42.7 Å²	42.7	71%	0.706	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	137.9	177.1	-51.4	0	0	0	0	111.9	S774	S772-S774 PolarHBondContact O-N 3.5Å
773	N	63.8	Low	83	Confident	168 Å²	168	42.6 Å²	42.6	90%	0.898	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	7.6	-175.3	-52.7	-14.7	0	0	0	116	Q771	Q771-N773 PolarHBondContact O-N 3.4Å
774	S	66	Low	82.5	Confident	34 Å²	34	44.2 Å²	44.2	24%	0.238	24%	0.242	C	C	.	.			trans	-87.8	138.1	167.6	69.8	0	0	0	0	111.6	Q771 S772	Q771-S774 WeakPolarHBondContact O-CB 3.47Å; Q771-S774 PolarHBondContact O-N 3.31Å; Q771-S774 PolarHBondContact O-OG 2.99Å; S772-S774 PolarHBondContact O-N 3.5Å
775	L	79.1	Confident	81.7	Confident	131 Å²	131	48.2 Å²	48.2	69%	0.686	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.1	160.5	-73.1	174.7	0	0	0	106.4	T746 I747	T746-L775 HydrophobicContact CG2-CB 4.02Å; I747-L775 WeakPolarHBondContact O-CA 3.47Å
776	V	82.1	Confident	81	Confident	35 Å²	35	51.3 Å²	51.3	21%	0.212	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.7	-175.2	-168.9	0	0	0	0	109.8	T746 I747 L770 V778 L810	T746-V776 WeakPolarHBondContact CA-O 3.47Å; I747-V776 PolarHBondContact N-O 3.48Å; I747-V776 PolarHBondContact O-N 3.36Å; L770-V776 HydrophobicContact CD1-CB 4.21Å; L770-V776 HydrophobicContact CD1-CG2 4.26Å; L770-V776 HydrophobicContact CD2-CG2 4.42Å; V776-V778 PolarHBondContact O-N 2.86Å; V776-L810 HydrophobicContact CB-CD1 4.47Å; V776-L810 HydrophobicContact CG1-CD1 3.63Å
777	E	86.3	Confident	80.4	Confident	96 Å²	96	57.5 Å²	57.5	45%	0.449	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	117.2	166.8	-173.1	-178.5	-177.9	0	0	108.6	R744 P807	R744-E777 WeakPolarHBondContact CD-OE1 3.38Å; E777-P807 VanDerWaalsContact O-CD 3.27Å; E777-P807 WeakPolarHBondContact O-CD 3.31Å
778	V	87.4	Confident	80.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.8	173.2	-178.5	0	0	0	0	108.3	R744 K745 I747 L754 L763 I765 V776 G806 L810	R744-V778 CarbonylContact C-O 3.49Å; R744-V778 WeakPolarHBondContact CA-O 3.28Å; K745-V778 PolarHBondContact N-O 2.89Å; K745-V778 PolarHBondContact O-N 2.85Å; I747-V778 HydrophobicContact CD1-CB 4.39Å; I747-V778 HydrophobicContact CD1-CG2 4.43Å; L754-V778 HydrophobicContact CD2-CG1 4.2Å; L763-V778 HydrophobicContact CD2-CG1 3.9Å; I765-V778 HydrophobicContact CD1-CB 4.3Å; I765-V778 HydrophobicContact CD1-CG1 3.88Å; I765-V778 HydrophobicContact CD1-CG2 3.97Å; V776-V778 PolarHBondContact O-N 2.86Å; V778-G806 WeakPolarHBondContact CA-O 3.27Å; V778-G806 WeakPolarHBondContact CG1-O 3.39Å; V778-L810 HydrophobicContact CG2-CD2 4.12Å
779	Y	90.2	Very high	80.4	Confident	52 Å²	52	56.6 Å²	56.6	20%	0.204	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.6	169.8	70.9	-97	0	0	0	112.4	V743 A781 Q804 F805 G806	V743-Y779 CarbonylContact O-C 3.58Å; V743-Y779 VanDerWaalsContact O-CA 3.27Å; V743-Y779 WeakPolarHBondContact O-CA 3.18Å; Y779-A781 HydrophobicContact CD2-CB 4.49Å; Y779-Q804 HydrophobicContact CE2-CG 4.09Å; Y779-Q804 PolarHBondContact OH-NE2 3.38Å; Y779-F805 WeakPolarHBondContact O-CA 3.33Å; Y779-F805 WeakPolarHBondContact O-CB 3.49Å; Y779-G806 PolarHBondContact N-O 3.39Å; Y779-G806 PolarHBondContact O-N 3.32Å
780	L	91.9	Very high	80.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.6	173.6	174.7	66.3	0	0	0	107.8	T742 V743 L754 L756 V761 L763 I803 Q804 F805 L818	T742-L780 WeakPolarHBondContact CA-O 3.39Å; V743-L780 HydrophobicContact CG1-CB 3.9Å; V743-L780 HydrophobicContact CG1-CD2 4.38Å; V743-L780 HydrophobicContact CG1-CG 4.49Å; V743-L780 PolarHBondContact N-O 3.36Å; V743-L780 PolarHBondContact O-N 2.76Å; L754-L780 HydrophobicContact CB-CB 4.09Å; L754-L780 HydrophobicContact CB-CD2 3.98Å; L754-L780 HydrophobicContact CD2-CB 3.69Å; L756-L780 HydrophobicContact CD1-CD2 4.43Å; L756-L780 HydrophobicContact CD1-CG 4.07Å; L756-L780 HydrophobicContact CG-CD2 4.4Å; L756-L780 HydrophobicContact CG-CG 4.49Å; V761-L780 HydrophobicContact CG1-CD1 4.06Å; V761-L780 HydrophobicContact CG1-CD2 4.24Å; V761-L780 HydrophobicContact CG1-CG 4.36Å; L763-L780 HydrophobicContact CB-CD1 4.16Å; L763-L780 HydrophobicContact CB-CD2 3.87Å; L763-L780 HydrophobicContact CB-CG 4.44Å; L780-I803 HydrophobicContact CD1-CG2 3.73Å; L780-Q804 CarbonylContact C-O 3.55Å; L780-Q804 WeakPolarHBondContact CA-O 3.4Å; L780-F805 HydrophobicContact CD1-CB 4.19Å; L780-L818 HydrophobicContact CD1-CD1 3.62Å
781	A	90.2	Very high	80.4	Confident	9 Å²	9	63.4 Å²	63.4	7%	0.074	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.2	-174.3	0	0	0	0	0	112.2	T741 T742 Y779 I803 Q804	T741-A781 CarbonylContact O-C 3.54Å; T741-A781 VanDerWaalsContact O-CA 3.29Å; T741-A781 WeakPolarHBondContact O-CA 3.37Å; T742-A781 HydrophobicContact CG2-CB 4.21Å; T742-A781 VanDerWaalsContact OG1-CB 3.3Å; T742-A781 WeakPolarHBondContact OG1-CB 3.46Å; Y779-A781 HydrophobicContact CD2-CB 4.49Å; A781-I803 WeakPolarHBondContact O-CA 3.37Å; A781-Q804 PolarHBondContact N-O 2.96Å; A781-Q804 PolarHBondContact O-N 2.9Å
782	V	90.2	Very high	80.8	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	110.3	169.6	179.1	0	0	0	0	110	T741 L756 V761 R784 P801	T741-V782 PolarHBondContact O-N 2.9Å; L756-V782 HydrophobicContact CD1-CG2 3.85Å; V761-V782 HydrophobicContact CB-CG2 4.16Å; V761-V782 HydrophobicContact CG1-CG2 4.36Å; V761-V782 HydrophobicContact CG2-CG2 3.81Å; V782-R784 HydrophobicContact CG1-CG 4.23Å; V782-R784 PolarHBondContact O-N 3.07Å; V782-R784 VanDerWaalsContact O-N 3.17Å; V782-P801 HydrophobicContact CG1-CB 3.81Å
783	C	86.8	Confident	81.5	Confident	15 Å²	15	56.2 Å²	56.2	10%	0.101	30%	0.296	C	S	.	.			trans	-80	93.4	-178.2	-61.4	0	0	0	0	110.3	H788 V802	C783-H788 HydrophobicContact CB-CB 3.78Å; C783-V802 HydrophobicContact CB-CB 4.12Å; C783-V802 HydrophobicContact CB-CG1 3.92Å; C783-V802 PolarHBondContact N-O 3.5Å
784	R	80.9	Confident	82	Confident	34 Å²	34	53.6 Å²	53.6	13%	0.128	28%	0.282	C	S	.	.			trans	-79.3	-25.7	-176.8	-67.9	-176.4	176.2	156.3	-4.3	114.7	V782 R789 D1008	V782-R784 HydrophobicContact CG1-CG 4.23Å; V782-R784 PolarHBondContact O-N 3.07Å; V782-R784 VanDerWaalsContact O-N 3.17Å; R784-R789 PolarHBondContact O-NH2 3.02Å; R784-D1008 IonicContact CZ-OD1 3.11Å; R784-D1008 IonicContact NE-OD1 3.38Å; R784-D1008 PolarHBondContact NE-OD1 2.65Å; R784-D1008 VanDerWaalsContact NE-OD1 3.12Å; R784-D1008 IonicContact NE-OD2 3.47Å; R784-D1008 PolarHBondContact NE-OD2 3.31Å; R784-D1008 IonicContact NH2-OD1 2.99Å; R784-D1008 PolarHBondContact NH2-OD1 3.44Å
785	E	73.9	Confident	82.8	Confident	99 Å²	99	56 Å²	56	46%	0.463	29%	0.289	S	S	.	.	S	Bend	trans	-65.2	142.5	-177	-65.6	-173.1	-98.1	0	0	114.1	K787 H788	E785-K787 HydrophobicContact CB-CG 4.11Å; E785-K787 PolarHBondContact O-N 3.19Å; E785-K787 WeakPolarHBondContact OE1-CE 3.24Å; E785-K787 IonicContact OE1-NZ 2.78Å; E785-K787 PolarHBondContact OE1-NZ 2.79Å; E785-K787 VanDerWaalsContact OE2-CD 3.3Å; E785-K787 WeakPolarHBondContact OE2-CD 3.39Å; E785-K787 WeakPolarHBondContact OE2-CE 3.34Å; E785-K787 IonicContact OE2-NZ 2.75Å; E785-K787 PolarHBondContact OE2-NZ 3.19Å; E785-H788 WeakPolarHBondContact O-CB 3.34Å; E785-H788 PolarHBondContact O-N 3.42Å
786	D	73.5	Confident	83.3	Confident	66 Å²	66	52.3 Å²	52.3	35%	0.353	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-65.5	-27.8	-178.4	-68.3	-2.2	0	0	0	112.3	H788 R789 M1073	D786-H788 PolarHBondContact O-N 3.45Å; D786-R789 PolarHBondContact O-N 2.99Å; D786-R789 WeakPolarHBondContact OD1-CD 3.18Å; D786-R789 IonicContact OD1-CZ 3.92Å; D786-R789 IonicContact OD1-NE 3.2Å; D786-R789 PolarHBondContact OD1-NE 3.38Å; D786-R789 IonicContact OD1-NH2 3.31Å; D786-M1073 PolarHBondContact OD2-N 3.34Å
787	K	72.6	Confident	83.8	Confident	144 Å²	144	50.7 Å²	50.7	63%	0.626	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-60.5	-7.6	170.9	86.4	-168	-177.4	-150.5	0	114.4	E785	E785-K787 HydrophobicContact CB-CG 4.11Å; E785-K787 PolarHBondContact O-N 3.19Å; E785-K787 WeakPolarHBondContact OE1-CE 3.24Å; E785-K787 IonicContact OE1-NZ 2.78Å; E785-K787 PolarHBondContact OE1-NZ 2.79Å; E785-K787 VanDerWaalsContact OE2-CD 3.3Å; E785-K787 WeakPolarHBondContact OE2-CD 3.39Å; E785-K787 WeakPolarHBondContact OE2-CE 3.34Å; E785-K787 IonicContact OE2-NZ 2.75Å; E785-K787 PolarHBondContact OE2-NZ 3.19Å
788	H	79.4	Confident	84	Confident	32 Å²	32	46.4 Å²	46.4	15%	0.148	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-110.6	-5	178.2	-65.8	-20.6	0	0	0	113.9	C783 E785 D786 W873 R906	C783-H788 HydrophobicContact CB-CB 3.78Å; E785-H788 WeakPolarHBondContact O-CB 3.34Å; E785-H788 PolarHBondContact O-N 3.42Å; D786-H788 PolarHBondContact O-N 3.45Å; H788-W873 WeakPolarHBondContact O-CZ2 3.2Å; H788-R906 PolarHBondContact ND1-NH1 3.49Å; H788-R906 VanDerWaalsContact ND1-NH1 3.17Å
789	R	83.9	Confident	84.3	Confident	52 Å²	52	46.5 Å²	46.5	20%	0.196	24%	0.239	C	C	.	.	S	Bend	trans	-79.1	157.8	179.3	-62	179.6	-169.1	-91.5	-18.4	112	R784 D786 L798 V802 W873 G1070	R784-R789 PolarHBondContact O-NH2 3.02Å; D786-R789 PolarHBondContact O-N 2.99Å; D786-R789 WeakPolarHBondContact OD1-CD 3.18Å; D786-R789 IonicContact OD1-CZ 3.92Å; D786-R789 IonicContact OD1-NE 3.2Å; D786-R789 PolarHBondContact OD1-NE 3.38Å; D786-R789 IonicContact OD1-NH2 3.31Å; R789-L798 HydrophobicContact CG-CD2 4.47Å; R789-V802 HydrophobicContact CG-CG2 4.35Å; R789-W873 PolarHBondContact O-NE1 2.99Å; R789-G1070 PolarHBondContact NH1-O 3.14Å; R789-G1070 VanDerWaalsContact NH1-O 3.15Å
790	P	86.5	Confident	84.5	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.026	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-73.3	150.7	166.1	31.5	-35.4	0	0	0	111.3	L792 L798 L836 W873 V910 T1071	P790-L792 HydrophobicContact CB-CD2 4.07Å; P790-L792 HydrophobicContact CG-CD1 4.47Å; P790-L792 HydrophobicContact CG-CD2 3.96Å; P790-L792 HydrophobicContact CG-CG 4.21Å; P790-L798 HydrophobicContact CG-CD1 4.04Å; P790-L836 HydrophobicContact CB-CD1 4.05Å; P790-L836 HydrophobicContact CG-CD1 4.41Å; P790-W873 VanDerWaalsContact CA-CD1 3.49Å; P790-W873 HydrophobicContact CB-CB 4.49Å; P790-W873 HydrophobicContact CB-CD2 4.2Å; P790-W873 HydrophobicContact CB-CG 3.93Å; P790-V910 HydrophobicContact CG-CG2 4.13Å; P790-T1071 VanDerWaalsContact O-CG2 3.3Å; P790-T1071 WeakPolarHBondContact O-CG2 3Å
791	T	83	Confident	84.4	Confident	144 Å²	144	44.9 Å²	44.9	88%	0.883	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-78.4	128.8	164.4	43	0	0	0	0	109.4
792	L	85.1	Confident	84.5	Confident	28 Å²	28	44.5 Å²	44.5	15%	0.147	23%	0.232	C	C	.	.			trans	-126.2	143.9	-172.2	-60.7	-175	0	0	0	111.2	P790 Q796 L798 V910 N1069 T1071	P790-L792 HydrophobicContact CB-CD2 4.07Å; P790-L792 HydrophobicContact CG-CD1 4.47Å; P790-L792 HydrophobicContact CG-CD2 3.96Å; P790-L792 HydrophobicContact CG-CG 4.21Å; L792-Q796 HydrophobicContact CB-CB 3.93Å; L792-Q796 HydrophobicContact CD2-CB 4.34Å; L792-L798 HydrophobicContact CD1-CB 4.08Å; L792-L798 VanDerWaalsContact CD1-N 3.26Å; L792-V910 HydrophobicContact CD1-CG1 4.29Å; L792-V910 HydrophobicContact CD1-CG2 4.38Å; L792-V910 HydrophobicContact CD2-CB 4.42Å; L792-V910 HydrophobicContact CD2-CG1 3.64Å; L792-V910 HydrophobicContact CD2-CG2 3.84Å; L792-N1069 PolarHBondContact O-ND2 3.46Å; L792-T1071 HydrophobicContact CB-CG2 4.12Å; L792-T1071 HydrophobicContact CD1-CG2 3.79Å; L792-T1071 HydrophobicContact CG-CG2 3.81Å
793	G	78.6	Confident	84.6	Confident	35 Å²	35	44.4 Å²	44.4	36%	0.361	23%	0.231	S	C	.	.			trans	-76.4	170.1	173.4	0	0	0	0	0	113.4	H795 Q796 N1069	G793-H795 PolarHBondContact O-N 2.91Å; G793-Q796 VanDerWaalsContact N-OE1 3.16Å; G793-Q796 PolarHBondContact O-N 3.33Å; G793-N1069 PolarHBondContact O-ND2 3.11Å
794	D	73.9	Confident	84.9	Confident	113 Å²	113	45.2 Å²	45.2	60%	0.604	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-21	-167.9	-51.9	-54.6	0	0	0	116.5	N1069	D794-N1069 PolarHBondContact O-OD1 3.39Å
795	H	84.1	Confident	85.4	Confident	86 Å²	86	43.6 Å²	43.6	40%	0.398	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	10.7	178.1	-65.8	-82.7	0	0	0	113.2	G793 D1035 W1068	G793-H795 PolarHBondContact O-N 2.91Å; H795-D1035 IonicContact CE1-OD1 3.28Å; H795-D1035 IonicContact CG-OD1 2.87Å; H795-D1035 IonicContact ND1-OD1 2.86Å; H795-D1035 PolarHBondContact ND1-OD1 3.23Å; H795-D1035 IonicContact ND1-OD2 3.66Å; H795-W1068 PolarHBondContact O-NE1 3.47Å
796	Q	89.3	Confident	86	Confident	53 Å²	53	38.9 Å²	38.9	25%	0.248	21%	0.205	C	C	.	.			trans	-104.9	122.4	177.4	-75	172.1	-12.9	0	0	110.5	L792 G793 V910 G911 E912 N1069	L792-Q796 HydrophobicContact CB-CB 3.93Å; L792-Q796 HydrophobicContact CD2-CB 4.34Å; G793-Q796 VanDerWaalsContact N-OE1 3.16Å; G793-Q796 PolarHBondContact O-N 3.33Å; Q796-V910 HydrophobicContact CB-CG1 4.26Å; Q796-G911 WeakPolarHBondContact CA-O 3.41Å; Q796-E912 HydrophobicContact CG-CB 3.97Å; Q796-E912 WeakPolarHBondContact CG-OE2 3.48Å; Q796-E912 PolarHBondContact NE2-OE2 2.89Å; Q796-N1069 WeakPolarHBondContact O-CA 3.11Å
797	T	91.5	Very high	86.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	139.4	177.2	175.4	0	0	0	0	111.3	L799 W831 V910 G911 K979 W1068	T797-L799 HydrophobicContact CG2-CD2 3.65Å; T797-L799 HydrophobicContact CG2-CG 4.05Å; T797-W831 HydrophobicContact CG2-CH2 3.5Å; T797-W831 VanDerWaalsContact CG2-CH2 3.5Å; T797-W831 HydrophobicContact CG2-CZ3 3.59Å; T797-V910 CarbonylContact O-C 3.53Å; T797-V910 WeakPolarHBondContact O-CA 3.42Å; T797-G911 WeakPolarHBondContact CG2-O 3.44Å; T797-G911 PolarHBondContact N-O 3.22Å; T797-G911 PolarHBondContact O-N 2.97Å; T797-K979 HydrophobicContact CG2-CD 4.24Å; T797-K979 VanDerWaalsContact OG1-CD 3.3Å; T797-K979 WeakPolarHBondContact OG1-CD 3.38Å; T797-K979 PolarHBondContact OG1-NZ 2.96Å; T797-W1068 WeakPolarHBondContact CA-O 3.41Å; T797-W1068 WeakPolarHBondContact CB-O 3.3Å; T797-W1068 HydrophobicContact CG2-CH2 4.35Å; T797-W1068 HydrophobicContact CG2-CZ2 3.73Å; T797-W1068 PolarHBondContact OG1-O 3.26Å
798	L	92.1	Very high	86.5	Confident	6 Å²	6	33.2 Å²	33.2	3%	0.031	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	129.5	158.6	-172.1	69	0	0	0	108.4	R789 P790 L792 S800 V802 C908 V910 N1069	R789-L798 HydrophobicContact CG-CD2 4.47Å; P790-L798 HydrophobicContact CG-CD1 4.04Å; L792-L798 HydrophobicContact CD1-CB 4.08Å; L792-L798 VanDerWaalsContact CD1-N 3.26Å; L798-S800 WeakPolarHBondContact CG-O 3.28Å; L798-V802 HydrophobicContact CD2-CG2 4.4Å; L798-C908 HydrophobicContact CD1-CB 3.87Å; L798-V910 HydrophobicContact CD1-CG2 4.37Å; L798-N1069 PolarHBondContact N-O 3.07Å
799	L	93.2	Very high	86.2	Confident	2 Å²	2	35 Å²	35	1%	0.01	21%	0.212	C	C	.	.			trans	-108.9	-19.3	-174.3	-74.1	179.2	0	0	0	114.3	T797 H822 C823 A824 W831 I833 L909	T797-L799 HydrophobicContact CG2-CD2 3.65Å; T797-L799 HydrophobicContact CG2-CG 4.05Å; L799-H822 CarbonylContact O-C 3.56Å; L799-H822 WeakPolarHBondContact O-CA 3.31Å; L799-H822 WeakPolarHBondContact O-CB 3.48Å; L799-C823 PolarHBondContact O-N 2.89Å; L799-C823 PolarHBondContact O-SG 2.88Å; L799-C823 VanDerWaalsContact O-SG 3.42Å; L799-A824 HydrophobicContact CD1-CB 4Å; L799-A824 HydrophobicContact CD2-CB 3.96Å; L799-W831 HydrophobicContact CD1-CE3 4.38Å; L799-W831 HydrophobicContact CD1-CZ3 4.3Å; L799-W831 HydrophobicContact CD2-CH2 3.76Å; L799-W831 HydrophobicContact CD2-CZ2 4.05Å; L799-W831 HydrophobicContact CD2-CZ3 4.23Å; L799-I833 HydrophobicContact CD1-CD1 4.09Å; L799-I833 HydrophobicContact CD1-CG1 4.13Å; L799-I833 HydrophobicContact CD1-CG2 4.08Å; L799-L909 HydrophobicContact CB-CB 4Å; L799-L909 PolarHBondContact N-O 2.98Å
800	S	93.3	Very high	86.1	Confident	6 Å²	6	33.4 Å²	33.4	4%	0.042	21%	0.207	C	C	.	.	S	Bend	trans	-127.4	169	179.7	69.1	0	0	0	0	111	L798 L909	L798-S800 WeakPolarHBondContact CG-O 3.28Å; S800-L909 PolarHBondContact OG-N 2.81Å
801	P	91.6	Very high	85.9	Confident	12 Å²	12	38.3 Å²	38.3	8%	0.078	23%	0.233	C	C	.	.			trans	-54.7	163.8	155.9	-20.7	33.6	0	0	0	111	V782 I803 P821 D1008	V782-P801 HydrophobicContact CG1-CB 3.81Å; P801-I803 HydrophobicContact CB-CD1 4.4Å; P801-I803 HydrophobicContact CB-CG1 4.43Å; P801-I803 WeakPolarHBondContact O-CD1 3.3Å; P801-P821 VanDerWaalsContact CD-O 3.27Å; P801-P821 WeakPolarHBondContact CD-O 3.17Å; P801-P821 HydrophobicContact CG-CG 4.11Å; P801-D1008 HydrophobicContact CG-CB 3.97Å
802	V	91.2	Very high	86	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.012	20%	0.196	C	C	.	.			trans	-91.1	113.9	168	178.9	0	0	0	0	107.6	C783 R789 L798 W873 R906 C908	C783-V802 HydrophobicContact CB-CB 4.12Å; C783-V802 HydrophobicContact CB-CG1 3.92Å; C783-V802 PolarHBondContact N-O 3.5Å; R789-V802 HydrophobicContact CG-CG2 4.35Å; L798-V802 HydrophobicContact CD2-CG2 4.4Å; V802-W873 HydrophobicContact CG1-CH2 3.99Å; V802-W873 HydrophobicContact CG1-CZ2 3.96Å; V802-R906 HydrophobicContact CG1-CG 3.55Å; V802-C908 HydrophobicContact CG2-CB 4.24Å
803	I	93	Very high	85.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	139.5	-174.2	-51	98.2	0	0	0	109.5	V761 L780 A781 P801 L818 F820 R906 Y907	V761-I803 HydrophobicContact CG1-CG1 4.07Å; V761-I803 HydrophobicContact CG1-CG2 3.64Å; V761-I803 HydrophobicContact CG2-CG1 4.27Å; L780-I803 HydrophobicContact CD1-CG2 3.73Å; A781-I803 WeakPolarHBondContact O-CA 3.37Å; P801-I803 HydrophobicContact CB-CD1 4.4Å; P801-I803 HydrophobicContact CB-CG1 4.43Å; P801-I803 WeakPolarHBondContact O-CD1 3.3Å; I803-L818 HydrophobicContact CB-CD2 4.38Å; I803-L818 HydrophobicContact CG2-CD1 4.01Å; I803-L818 HydrophobicContact CG2-CD2 4.1Å; I803-L818 HydrophobicContact CG2-CG 4.43Å; I803-F820 HydrophobicContact CD1-CB 3.75Å; I803-F820 HydrophobicContact CD1-CD1 3.95Å; I803-F820 HydrophobicContact CD1-CD2 3.51Å; I803-F820 HydrophobicContact CD1-CE1 4.4Å; I803-F820 HydrophobicContact CD1-CE2 4Å; I803-F820 HydrophobicContact CD1-CG 3.47Å; I803-F820 VanDerWaalsContact CD1-CG 3.47Å; I803-F820 HydrophobicContact CD1-CZ 4.43Å; I803-F820 HydrophobicContact CG1-CB 4.09Å; I803-F820 HydrophobicContact CG1-CG 4.27Å; I803-R906 CarbonylContact O-C 3.52Å; I803-R906 VanDerWaalsContact O-CA 3.3Å; I803-R906 WeakPolarHBondContact O-CA 3.01Å; I803-Y907 PolarHBondContact N-O 3.41Å; I803-Y907 PolarHBondContact O-N 2.94Å
804	Q	92.6	Very high	86.1	Confident	32 Å²	32	37.6 Å²	37.6	15%	0.15	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	134.4	173.3	-174.1	173.6	-48.4	0	0	110	Y779 L780 A781 R906	Y779-Q804 HydrophobicContact CE2-CG 4.09Å; Y779-Q804 PolarHBondContact OH-NE2 3.38Å; L780-Q804 CarbonylContact C-O 3.55Å; L780-Q804 WeakPolarHBondContact CA-O 3.4Å; A781-Q804 PolarHBondContact N-O 2.96Å; A781-Q804 PolarHBondContact O-N 2.9Å; Q804-R906 HydrophobicContact CB-CB 4.15Å; Q804-R906 HydrophobicContact CB-CG 4.21Å; Q804-R906 HydrophobicContact CG-CB 4.12Å; Q804-R906 VanDerWaalsContact OE1-CZ 3.24Å
805	F	91.8	Very high	86.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.5	162.7	77.7	-85.9	0	0	0	110.7	L763 Y779 L780 L812 V816 L818 T901 V903 A904 R905 Y907	L763-F805 HydrophobicContact CD1-CD1 4.48Å; L763-F805 HydrophobicContact CD1-CD2 4.25Å; L763-F805 HydrophobicContact CD1-CE2 4.45Å; L763-F805 HydrophobicContact CD1-CG 4.26Å; L763-F805 HydrophobicContact CD2-CB 3.8Å; L763-F805 HydrophobicContact CD2-CD2 3.89Å; L763-F805 HydrophobicContact CD2-CG 3.99Å; Y779-F805 WeakPolarHBondContact O-CA 3.33Å; Y779-F805 WeakPolarHBondContact O-CB 3.49Å; L780-F805 HydrophobicContact CD1-CB 4.19Å; F805-L812 HydrophobicContact CE2-CD1 4.31Å; F805-V816 HydrophobicContact CE1-CG2 4.33Å; F805-V816 HydrophobicContact CE2-CG2 3.61Å; F805-V816 HydrophobicContact CZ-CG2 3.45Å; F805-V816 VanDerWaalsContact CZ-CG2 3.45Å; F805-L818 HydrophobicContact CD1-CD1 4.14Å; F805-L818 HydrophobicContact CD1-CD2 4.17Å; F805-L818 HydrophobicContact CE1-CD2 4.41Å; F805-T901 HydrophobicContact CE1-CG2 3.98Å; F805-T901 HydrophobicContact CZ-CG2 3.94Å; F805-V903 VanDerWaalsContact CZ-O 3.27Å; F805-V903 WeakPolarHBondContact CZ-O 3.37Å; F805-A904 HydrophobicContact CD2-CB 3.86Å; F805-A904 VanDerWaalsContact CE2-CA 3.49Å; F805-A904 HydrophobicContact CE2-CB 3.59Å; F805-A904 HydrophobicContact CZ-CB 4.24Å; F805-R905 PolarHBondContact N-O 3.1Å; F805-R905 PolarHBondContact O-N 2.86Å; F805-Y907 HydrophobicContact CD1-CD2 4.49Å; F805-Y907 HydrophobicContact CD1-CE2 4.39Å; F805-Y907 HydrophobicContact CE1-CD2 4.21Å; F805-Y907 AromaticContact CE1-CE2 3.75Å; F805-Y907 HydrophobicContact CE1-CE2 3.75Å
806	G	85.9	Confident	86.9	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163	-177.8	-171.1	0	0	0	0	0	114	V778 Y779	V778-G806 WeakPolarHBondContact CA-O 3.27Å; V778-G806 WeakPolarHBondContact CG1-O 3.39Å; Y779-G806 PolarHBondContact N-O 3.39Å; Y779-G806 PolarHBondContact O-N 3.32Å
807	P	85	Confident	87	Confident	21 Å²	21	27.4 Å²	27.4	14%	0.136	17%	0.169	C	C	.	.	S	Bend	cis	-67.6	154.6	12.1	25.3	-35.3	0	0	0	115.5	E777 G809 L810 Y861 A904	E777-P807 VanDerWaalsContact O-CD 3.27Å; E777-P807 WeakPolarHBondContact O-CD 3.31Å; P807-G809 PolarHBondContact O-N 2.78Å; P807-L810 VanDerWaalsContact O-CB 3.27Å; P807-L810 WeakPolarHBondContact O-CB 3.28Å; P807-L810 PolarHBondContact O-N 2.75Å; P807-L810 VanDerWaalsContact O-N 3.12Å; P807-Y861 HydrophobicContact CB-CE1 3.99Å; P807-Y861 WeakPolarHBondContact CB-OH 3.47Å; P807-A904 VanDerWaalsContact O-CB 3.28Å; P807-A904 WeakPolarHBondContact O-CB 3.48Å
808	V	72.4	Confident	87	Confident	70 Å²	70	27.4 Å²	27.4	42%	0.424	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	128.3	171.5	179.8	0	0	0	0	108.5
809	G	71.8	Confident	87.1	Confident	69 Å²	69	27.1 Å²	27.1	71%	0.711	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.4	8.3	-172.7	0	0	0	0	0	114.9	P807 N811	P807-G809 PolarHBondContact O-N 2.78Å; G809-N811 PolarHBondContact O-N 3.25Å
810	L	82.6	Confident	87.1	Confident	18 Å²	18	27.1 Å²	27.1	9%	0.094	17%	0.167	C	C	.	.			trans	-51.4	119.2	165.9	-179.5	64.8	0	0	0	110.5	L770 V776 V778 P807 L812 A904	L770-L810 HydrophobicContact CD2-CD1 3.93Å; L770-L810 HydrophobicContact CD2-CG 4.45Å; V776-L810 HydrophobicContact CB-CD1 4.47Å; V776-L810 HydrophobicContact CG1-CD1 3.63Å; V778-L810 HydrophobicContact CG2-CD2 4.12Å; P807-L810 VanDerWaalsContact O-CB 3.27Å; P807-L810 WeakPolarHBondContact O-CB 3.28Å; P807-L810 PolarHBondContact O-N 2.75Å; P807-L810 VanDerWaalsContact O-N 3.12Å; L810-L812 HydrophobicContact CD2-CD1 4.45Å; L810-L812 HydrophobicContact CD2-CD2 3.97Å; L810-L812 HydrophobicContact CD2-CG 4.28Å; L810-L812 HydrophobicContact CG-CD2 4.08Å; L810-L812 HydrophobicContact CG-CG 4.13Å; L810-L812 PolarHBondContact O-N 2.85Å; L810-A904 HydrophobicContact CB-CB 3.81Å; L810-A904 HydrophobicContact CD2-CB 4.44Å
811	N	82.1	Confident	87.1	Confident	107 Å²	107	27.2 Å²	27.2	57%	0.572	17%	0.168	S	C	*	.			trans	-84.4	107	-176.8	-172.1	10.3	0	0	0	110.7	Q771 G809	Q771-N811 PolarHBondContact NE2-ND2 3.03Å; G809-N811 PolarHBondContact O-N 3.25Å
812	L	85.1	Confident	87.2	Confident	18 Å²	18	26.9 Å²	26.9	9%	0.094	17%	0.165	C	C	.	.			trans	-106.5	117.3	-174.3	-68	169.5	0	0	0	111.3	A769 L770 F805 L810 K814 V816	A769-L812 HydrophobicContact CB-CD2 4.45Å; A769-L812 CarbonylContact O-C 3.53Å; A769-L812 WeakPolarHBondContact O-CA 3.34Å; L770-L812 HydrophobicContact CD2-CD2 3.98Å; F805-L812 HydrophobicContact CE2-CD1 4.31Å; L810-L812 HydrophobicContact CD2-CD1 4.45Å; L810-L812 HydrophobicContact CD2-CD2 3.97Å; L810-L812 HydrophobicContact CD2-CG 4.28Å; L810-L812 HydrophobicContact CG-CD2 4.08Å; L810-L812 HydrophobicContact CG-CG 4.13Å; L810-L812 PolarHBondContact O-N 2.85Å; L812-K814 VanDerWaalsContact C-N 3.32Å; L812-V816 HydrophobicContact CD1-CG1 3.82Å; L812-V816 HydrophobicContact CD1-CG2 4.03Å; L812-V816 HydrophobicContact CD2-CG1 3.72Å; L812-V816 HydrophobicContact CG-CG1 4.38Å
813	S	84	Confident	87.3	Confident	74 Å²	74	26.8 Å²	26.8	52%	0.517	17%	0.165	S	C	.	.	S	Bend	trans	-82.1	-8.5	177	45.9	0	0	0	0	114.2	G768 A769	G768-S813 PolarHBondContact O-OG 2.91Å; A769-S813 PolarHBondContact O-N 3.27Å; A769-S813 PolarHBondContact O-OG 2.73Å
814	K	81.2	Confident	87.2	Confident	100 Å²	100	26.9 Å²	26.9	44%	0.435	17%	0.165	S	C	.	.	S	Bend	trans	-143.9	148.9	170.1	-61.4	179.4	-174.2	-179.7	0	107.9	Q767 A769 L812	Q767-K814 WeakPolarHBondContact O-CE 3.3Å; Q767-K814 PolarHBondContact O-NZ 3.45Å; A769-K814 HydrophobicContact CB-CB 4Å; L812-K814 VanDerWaalsContact C-N 3.32Å
815	P	85.8	Confident	87.2	Confident	29 Å²	29	27.5 Å²	27.5	19%	0.188	17%	0.168	C	C	.	.			trans	-65.8	146.3	177	30.3	-36.2	0	0	0	111.2	P766 M900 T901	P766-P815 WeakPolarHBondContact CG-O 3.18Å; P815-M900 HydrophobicContact CB-CG 3.71Å; P815-M900 HydrophobicContact CG-CE 4.37Å; P815-M900 HydrophobicContact CG-CG 3.89Å; P815-M900 HydrophobicContact CG-SD 4.04Å; P815-T901 CarbonylContact C-O 3.46Å; P815-T901 VanDerWaalsContact CA-O 3.25Å; P815-T901 WeakPolarHBondContact CA-O 3.44Å; P815-T901 WeakPolarHBondContact CB-O 3.48Å
816	V	89.8	Confident	86.9	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	156	174.9	-59.9	0	0	0	0	110	L763 I765 A769 F805 L812 M900 T901	L763-V816 HydrophobicContact CD1-CB 3.96Å; L763-V816 HydrophobicContact CD1-CG2 3.73Å; I765-V816 HydrophobicContact CB-CG1 4.21Å; I765-V816 HydrophobicContact CG1-CB 4.38Å; I765-V816 HydrophobicContact CG1-CG1 3.87Å; I765-V816 HydrophobicContact CG2-CG1 4.08Å; A769-V816 HydrophobicContact CB-CG1 4.48Å; F805-V816 HydrophobicContact CE1-CG2 4.33Å; F805-V816 HydrophobicContact CE2-CG2 3.61Å; F805-V816 HydrophobicContact CZ-CG2 3.45Å; F805-V816 VanDerWaalsContact CZ-CG2 3.45Å; L812-V816 HydrophobicContact CD1-CG1 3.82Å; L812-V816 HydrophobicContact CD1-CG2 4.03Å; L812-V816 HydrophobicContact CD2-CG1 3.72Å; L812-V816 HydrophobicContact CG-CG1 4.38Å; V816-M900 WeakPolarHBondContact O-CA 3.36Å; V816-T901 PolarHBondContact N-O 2.74Å; V816-T901 PolarHBondContact O-N 3.03Å
817	L	90.5	Very high	86.3	Confident	10 Å²	10	34.7 Å²	34.7	5%	0.052	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	105.4	-176.3	-174.1	55.6	0	0	0	111	T764 H898 M900 N1194 M1195 A1198	T764-L817 PolarHBondContact N-O 3.05Å; T764-L817 PolarHBondContact O-N 3.12Å; L817-H898 HydrophobicContact CD1-CB 4.17Å; L817-M900 HydrophobicContact CD1-CB 4.06Å; L817-N1194 WeakPolarHBondContact CD2-O 3.18Å; L817-M1195 HydrophobicContact CD1-CE 4.01Å; L817-M1195 HydrophobicContact CD1-SD 4.2Å; L817-M1195 HydrophobicContact CD2-SD 4.19Å; L817-A1198 HydrophobicContact CD2-CB 3.48Å; L817-A1198 VanDerWaalsContact CD2-CB 3.48Å; L817-A1198 HydrophobicContact CG-CB 4.27Å
818	L	92.8	Very high	85.3	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	113.8	178	-170.9	73.5	0	0	0	109.2	F762 L763 L780 I803 F805 F820 L899 Y907	F762-L818 CarbonylContact O-C 3.56Å; F762-L818 WeakPolarHBondContact O-CA 3.26Å; L763-L818 HydrophobicContact CB-CD1 4.13Å; L763-L818 HydrophobicContact CD1-CB 4.44Å; L763-L818 HydrophobicContact CD1-CD1 4.04Å; L780-L818 HydrophobicContact CD1-CD1 3.62Å; I803-L818 HydrophobicContact CB-CD2 4.38Å; I803-L818 HydrophobicContact CG2-CD1 4.01Å; I803-L818 HydrophobicContact CG2-CD2 4.1Å; I803-L818 HydrophobicContact CG2-CG 4.43Å; F805-L818 HydrophobicContact CD1-CD1 4.14Å; F805-L818 HydrophobicContact CD1-CD2 4.17Å; F805-L818 HydrophobicContact CE1-CD2 4.41Å; L818-F820 HydrophobicContact CD2-CD1 4.22Å; L818-F820 HydrophobicContact CD2-CE1 4.21Å; L818-F820 HydrophobicContact CG-CD1 4.06Å; L818-F820 HydrophobicContact CG-CE1 4.39Å; L818-L899 HydrophobicContact CB-CB 4.46Å; L818-L899 HydrophobicContact CD2-CD2 4.46Å; L818-L899 PolarHBondContact N-O 3.31Å; L818-L899 PolarHBondContact O-N 3.12Å; L818-Y907 HydrophobicContact CD2-CD2 4.34Å
819	S	92.8	Very high	85.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	130	-178.9	-48.5	0	0	0	0	110.3	V761 F762 A897 H898	V761-S819 CarbonylContact C-O 3.56Å; V761-S819 WeakPolarHBondContact CA-O 3.38Å; F762-S819 PolarHBondContact N-O 2.79Å; F762-S819 PolarHBondContact O-N 3.12Å; S819-A897 CarbonylContact C-O 3.54Å; S819-A897 VanDerWaalsContact CA-O 3.28Å; S819-A897 WeakPolarHBondContact CA-O 3.46Å; S819-H898 WeakPolarHBondContact CB-ND1 3.38Å; S819-H898 PolarHBondContact OG-ND1 3.16Å
820	F	94.1	Very high	85.6	Confident	1 Å²	1	36.5 Å²	36.5	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	154.8	-174.5	55.5	-90.7	0	0	0	112.4	V761 I803 L818 A897 L899 L909	V761-F820 HydrophobicContact CG1-CB 4.3Å; V761-F820 HydrophobicContact CG2-CB 3.92Å; I803-F820 HydrophobicContact CD1-CB 3.75Å; I803-F820 HydrophobicContact CD1-CD1 3.95Å; I803-F820 HydrophobicContact CD1-CD2 3.51Å; I803-F820 HydrophobicContact CD1-CE1 4.4Å; I803-F820 HydrophobicContact CD1-CE2 4Å; I803-F820 HydrophobicContact CD1-CG 3.47Å; I803-F820 VanDerWaalsContact CD1-CG 3.47Å; I803-F820 HydrophobicContact CD1-CZ 4.43Å; I803-F820 HydrophobicContact CG1-CB 4.09Å; I803-F820 HydrophobicContact CG1-CG 4.27Å; L818-F820 HydrophobicContact CD2-CD1 4.22Å; L818-F820 HydrophobicContact CD2-CE1 4.21Å; L818-F820 HydrophobicContact CG-CD1 4.06Å; L818-F820 HydrophobicContact CG-CE1 4.39Å; F820-A897 HydrophobicContact CD1-CB 4.48Å; F820-A897 HydrophobicContact CD2-CB 3.89Å; F820-A897 HydrophobicContact CE1-CB 4.14Å; F820-A897 HydrophobicContact CE2-CB 3.49Å; F820-A897 VanDerWaalsContact CE2-CB 3.49Å; F820-A897 HydrophobicContact CG-CB 4.38Å; F820-A897 HydrophobicContact CZ-CB 3.63Å; F820-A897 PolarHBondContact N-O 3.45Å; F820-A897 PolarHBondContact O-N 3.36Å; F820-L899 HydrophobicContact CE1-CB 3.86Å; F820-L899 HydrophobicContact CZ-CB 4.47Å; F820-L909 HydrophobicContact CE2-CD1 3.83Å; F820-L909 HydrophobicContact CE2-CG 3.85Å; F820-L909 HydrophobicContact CZ-CD1 4.25Å; F820-L909 HydrophobicContact CZ-CG 4.09Å
821	P	93.5	Very high	85.9	Confident	9 Å²	9	37 Å²	37	6%	0.058	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	155.6	-175.4	31.5	-36.4	0	0	0	113.3	P801 N895 M896 T1006	P801-P821 VanDerWaalsContact CD-O 3.27Å; P801-P821 WeakPolarHBondContact CD-O 3.17Å; P801-P821 HydrophobicContact CG-CG 4.11Å; P821-N895 VanDerWaalsContact CA-O 3.3Å; P821-N895 WeakPolarHBondContact CA-O 3.43Å; P821-M896 HydrophobicContact CB-SD 4.06Å; P821-T1006 HydrophobicContact CB-CG2 4.21Å; P821-T1006 HydrophobicContact CG-CG2 4.41Å
822	H	92.9	Very high	86.2	Confident	5 Å²	5	32.4 Å²	32.4	2%	0.023	17%	0.169	C	C	.	.			trans	-139.2	158.9	170.9	68.6	59.2	0	0	0	113.4	L799 D893 N895 M896 L909	L799-H822 CarbonylContact O-C 3.56Å; L799-H822 WeakPolarHBondContact O-CA 3.31Å; L799-H822 WeakPolarHBondContact O-CB 3.48Å; H822-D893 PolarHBondContact CE1-O 2.8Å; H822-D893 VanDerWaalsContact CE1-O 3.25Å; H822-D893 PolarHBondContact NE2-O 3.47Å; H822-D893 VanDerWaalsContact NE2-O 3.08Å; H822-N895 PolarHBondContact N-O 3.25Å; H822-M896 VanDerWaalsContact CD2-C 3.48Å; H822-M896 PolarHBondContact NE2-O 3.4Å; H822-L909 HydrophobicContact CB-CD1 4.42Å
823	C	92.9	Very high	86.5	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.			trans	-107.3	10.8	-179.2	66.7	0	0	0	0	115.7	L799 K979 I980 T1004 T1006	L799-C823 PolarHBondContact O-N 2.89Å; L799-C823 PolarHBondContact O-SG 2.88Å; L799-C823 VanDerWaalsContact O-SG 3.42Å; C823-K979 CarbonylContact O-C 3.45Å; C823-K979 WeakPolarHBondContact O-CA 3.46Å; C823-K979 WeakPolarHBondContact O-CB 3.44Å; C823-I980 WeakPolarHBondContact CB-O 3.24Å; C823-I980 PolarHBondContact O-N 2.71Å; C823-T1004 HydrophobicContact CB-CG2 4.48Å; C823-T1006 HydrophobicContact CB-CG2 4.29Å
824	A	92.4	Very high	86.8	Confident	1 Å²	1	30 Å²	30	1%	0.008	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-72	127.8	175.5	0	0	0	0	0	111.8	L799 L826 W831 I833	L799-A824 HydrophobicContact CD1-CB 4Å; L799-A824 HydrophobicContact CD2-CB 3.96Å; A824-L826 HydrophobicContact CB-CD2 3.79Å; A824-L826 PolarHBondContact O-N 3.17Å; A824-W831 HydrophobicContact CB-CD2 4.49Å; A824-W831 HydrophobicContact CB-CZ2 4.08Å; A824-I833 HydrophobicContact CB-CD1 4.29Å
825	E	91	Very high	87.4	Confident	45 Å²	45	25.3 Å²	25.3	21%	0.21	13%	0.127	C	C	.	.			trans	-80.7	103	165.4	176.8	52	-101.8	0	0	108.3	N827 S829 W831 T978 I980 L1032	E825-N827 VanDerWaalsContact C-N 3.33Å; E825-N827 VanDerWaalsContact OE1-CB 3.28Å; E825-N827 WeakPolarHBondContact OE1-CB 3.4Å; E825-N827 PolarHBondContact OE1-N 2.89Å; E825-N827 PolarHBondContact OE1-ND2 3.26Å; E825-S829 PolarHBondContact O-OG 3.19Å; E825-W831 PolarHBondContact O-NE1 3.15Å; E825-T978 HydrophobicContact CB-CG2 4.36Å; E825-T978 VanDerWaalsContact CB-O 3.31Å; E825-T978 WeakPolarHBondContact CB-O 3.25Å; E825-T978 PolarHBondContact N-O 3.32Å; E825-I980 HydrophobicContact CB-CD1 4.35Å; E825-I980 HydrophobicContact CB-CG1 3.99Å; E825-L1032 HydrophobicContact CB-CD2 4.2Å; E825-L1032 HydrophobicContact CG-CD2 4.2Å
826	L	85.5	Confident	87.7	Confident	57 Å²	57	25 Å²	25	30%	0.298	12%	0.123	S	C	.	.			trans	-78	-17.6	-174.1	-56.4	-178	0	0	0	113	A824 I833 L892 D893	A824-L826 HydrophobicContact CB-CD2 3.79Å; A824-L826 PolarHBondContact O-N 3.17Å; L826-I833 HydrophobicContact CD2-CD1 3.95Å; L826-L892 HydrophobicContact CD1-CB 3.71Å; L826-L892 HydrophobicContact CD1-CD1 4.45Å; L826-L892 HydrophobicContact CD2-CD1 4.16Å; L826-D893 WeakPolarHBondContact CD1-O 3.48Å
827	N	73.3	Confident	87.7	Confident	95 Å²	95	25 Å²	25	51%	0.508	12%	0.123	S	C	.	.	S	Bend	trans	-83.4	138	176.8	-55.3	-83.6	0	0	0	110.2	E825 S829	E825-N827 VanDerWaalsContact C-N 3.33Å; E825-N827 VanDerWaalsContact OE1-CB 3.28Å; E825-N827 WeakPolarHBondContact OE1-CB 3.4Å; E825-N827 PolarHBondContact OE1-N 2.89Å; E825-N827 PolarHBondContact OE1-ND2 3.26Å; N827-S829 PolarHBondContact O-N 3.5Å
828	Q	64	Low	87.5	Confident	152 Å²	152	26 Å²	26	71%	0.71	13%	0.129	S	C	*	.	S	Bend	trans	61.4	10.7	170.1	-45.9	178.1	11.3	0	0	116.7	Q975	Q828-Q975 WeakPolarHBondContact O-CB 3.04Å; Q828-Q975 WeakPolarHBondContact O-CG 3.36Å
829	S	69.7	Low	86.4	Confident	15 Å²	15	26 Å²	26	11%	0.105	13%	0.129	C	C	.	.	S	Bend	trans	-129.1	140.3	-179.8	85.8	0	0	0	0	113	E825 N827 W831 P976 T978	E825-S829 PolarHBondContact O-OG 3.19Å; N827-S829 PolarHBondContact O-N 3.5Å; S829-W831 PolarHBondContact O-N 3.15Å; S829-W831 VanDerWaalsContact O-N 3.11Å; S829-W831 PolarHBondContact OG-NE1 3.14Å; S829-W831 VanDerWaalsContact OG-NE1 3.08Å; S829-P976 WeakPolarHBondContact CB-O 3.31Å; S829-T978 PolarHBondContact OG-N 3.46Å
830	N	82.4	Confident	85	Confident	30 Å²	30	28.9 Å²	28.9	16%	0.16	15%	0.147	C	C	.	.			trans	-88.4	76.1	-172.4	-66.4	-76.2	0	0	0	111.3	Q914 I974 Q975	N830-Q914 HydrophobicContact CB-CB 4.38Å; N830-Q914 WeakPolarHBondContact O-CB 3.28Å; N830-Q914 PolarHBondContact O-N 2.89Å; N830-I974 HydrophobicContact CB-CG2 4.39Å; N830-Q975 WeakPolarHBondContact CB-O 2.98Å; N830-Q975 PolarHBondContact N-O 2.76Å; N830-Q975 PolarHBondContact ND2-N 2.88Å; N830-Q975 PolarHBondContact ND2-O 3.49Å
831	W	87.7	Confident	83.1	Confident	30 Å²	30	31 Å²	31	11%	0.114	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	137.4	176.9	-79.1	112.5	0	0	0	113.6	T797 L799 A824 E825 S829 I833 A977 T978 K979 W1068	T797-W831 HydrophobicContact CG2-CH2 3.5Å; T797-W831 VanDerWaalsContact CG2-CH2 3.5Å; T797-W831 HydrophobicContact CG2-CZ3 3.59Å; L799-W831 HydrophobicContact CD1-CE3 4.38Å; L799-W831 HydrophobicContact CD1-CZ3 4.3Å; L799-W831 HydrophobicContact CD2-CH2 3.76Å; L799-W831 HydrophobicContact CD2-CZ2 4.05Å; L799-W831 HydrophobicContact CD2-CZ3 4.23Å; A824-W831 HydrophobicContact CB-CD2 4.49Å; A824-W831 HydrophobicContact CB-CZ2 4.08Å; E825-W831 PolarHBondContact O-NE1 3.15Å; S829-W831 PolarHBondContact O-N 3.15Å; S829-W831 VanDerWaalsContact O-N 3.11Å; S829-W831 PolarHBondContact OG-NE1 3.14Å; S829-W831 VanDerWaalsContact OG-NE1 3.08Å; W831-I833 HydrophobicContact CB-CD1 3.98Å; W831-I833 HydrophobicContact CB-CG1 3.74Å; W831-I833 HydrophobicContact CG-CD1 4.15Å; W831-I833 HydrophobicContact CG-CG1 4.23Å; W831-A977 HydrophobicContact CD2-CB 3.74Å; W831-A977 HydrophobicContact CE3-CB 3.57Å; W831-A977 HydrophobicContact CG-CB 4.47Å; W831-A977 HydrophobicContact CH2-CB 3.78Å; W831-A977 HydrophobicContact CZ2-CB 4Å; W831-A977 HydrophobicContact CZ3-CB 3.57Å; W831-T978 VanDerWaalsContact CZ2-C 3.49Å; W831-T978 WeakPolarHBondContact CZ2-O 3.12Å; W831-T978 PolarHBondContact NE1-O 3.11Å; W831-K979 HydrophobicContact CH2-CB 4.23Å; W831-K979 HydrophobicContact CZ2-CB 4Å; W831-W1068 AromaticContact CH2-CH2 3.65Å; W831-W1068 HydrophobicContact CH2-CH2 3.65Å; W831-W1068 AromaticContact CH2-CZ2 3.8Å; W831-W1068 HydrophobicContact CH2-CZ2 3.8Å; W831-W1068 HydrophobicContact CZ2-CH2 4.39Å; W831-W1068 HydrophobicContact CZ3-CH2 4.32Å; W831-W1068 HydrophobicContact CZ3-CZ2 4.05Å
832	L	89	Confident	80.9	Confident	10 Å²	10	37.3 Å²	37.3	5%	0.052	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	104.8	157.7	-179.2	57.1	0	0	0	108	I878 Y881 G911 E912 Q914 I923	L832-I878 HydrophobicContact CD1-CG2 3.51Å; L832-Y881 HydrophobicContact CD1-CD2 4.42Å; L832-Y881 HydrophobicContact CD1-CE2 4.02Å; L832-G911 WeakPolarHBondContact O-CA 3.47Å; L832-E912 HydrophobicContact CB-CG 3.98Å; L832-E912 HydrophobicContact CD2-CG 4.19Å; L832-E912 HydrophobicContact CG-CG 4.29Å; L832-E912 PolarHBondContact N-O 2.79Å; L832-E912 PolarHBondContact O-N 3.33Å; L832-E912 VanDerWaalsContact O-N 3.07Å; L832-Q914 HydrophobicContact CB-CB 4.14Å; L832-Q914 HydrophobicContact CB-CG 4.45Å; L832-I923 HydrophobicContact CD2-CD1 4.06Å
833	I	91	Very high	78.4	Confident	9 Å²	9	44.3 Å²	44.3	5%	0.046	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.7	-173.8	-51.6	-176	0	0	0	110.5	L799 A824 L826 W831 I878 I879 L892 L909 V910	L799-I833 HydrophobicContact CD1-CD1 4.09Å; L799-I833 HydrophobicContact CD1-CG1 4.13Å; L799-I833 HydrophobicContact CD1-CG2 4.08Å; A824-I833 HydrophobicContact CB-CD1 4.29Å; L826-I833 HydrophobicContact CD2-CD1 3.95Å; W831-I833 HydrophobicContact CB-CD1 3.98Å; W831-I833 HydrophobicContact CB-CG1 3.74Å; W831-I833 HydrophobicContact CG-CD1 4.15Å; W831-I833 HydrophobicContact CG-CG1 4.23Å; I833-I878 WeakPolarHBondContact O-CA 3.43Å; I833-I878 WeakPolarHBondContact O-CG2 3.18Å; I833-I879 HydrophobicContact CB-CB 4.45Å; I833-I879 HydrophobicContact CB-CD1 4.37Å; I833-I879 HydrophobicContact CG2-CD1 3.88Å; I833-I879 PolarHBondContact O-N 3.27Å; I833-L892 HydrophobicContact CD1-CD1 3.57Å; I833-L909 HydrophobicContact CG2-CB 4.48Å; I833-L909 HydrophobicContact CG2-CD2 4.16Å; I833-V910 WeakPolarHBondContact CA-O 3.46Å
834	R	91.6	Very high	75.4	Confident	33 Å²	33	52.6 Å²	52.6	13%	0.125	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137	-179.1	-56	177.3	-173.9	-85.7	-2.7	110	L836 E875 G877 I878 V910 E912	R834-L836 HydrophobicContact CB-CD2 4.24Å; R834-E875 WeakPolarHBondContact CD-OE2 3.13Å; R834-E875 IonicContact CZ-OE2 2.73Å; R834-E875 IonicContact NE-OE2 2.67Å; R834-E875 IonicContact NH1-OE1 2.75Å; R834-E875 IonicContact NH1-OE2 3.96Å; R834-E875 PolarHBondContact NH1-OE2 3.49Å; R834-G877 CarbonylContact C-O 3.55Å; R834-G877 WeakPolarHBondContact CA-O 3.3Å; R834-I878 HydrophobicContact CG-CG1 4.37Å; R834-V910 PolarHBondContact N-O 3.46Å; R834-V910 PolarHBondContact O-N 2.87Å; R834-E912 IonicContact CZ-OE1 3.69Å; R834-E912 IonicContact NE-OE1 2.88Å; R834-E912 PolarHBondContact NE-OE1 3.44Å; R834-E912 IonicContact NH2-OE1 3.66Å; R834-E912 PolarHBondContact NH2-OE1 2.84Å
835	V	92.2	Very high	72.4	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	115.6	166.7	-172	0	0	0	0	107.2	V876 G877 I879 C890 L899 Y907 L909	V835-V876 HydrophobicContact CB-CG2 3.88Å; V835-V876 HydrophobicContact CG1-CG2 3.61Å; V835-V876 VanDerWaalsContact O-CG2 3.29Å; V835-V876 WeakPolarHBondContact O-CG2 3Å; V835-V876 PolarHBondContact O-N 3.31Å; V835-G877 PolarHBondContact N-O 2.85Å; V835-G877 PolarHBondContact O-N 2.89Å; V835-I879 HydrophobicContact CG2-CD1 4.11Å; V835-I879 HydrophobicContact CG2-CG1 4.06Å; V835-C890 HydrophobicContact CG2-CB 3.81Å; V835-L899 HydrophobicContact CG1-CD1 4.09Å; V835-L899 HydrophobicContact CG1-CD2 4.15Å; V835-Y907 HydrophobicContact CG1-CD1 4.28Å; V835-L909 HydrophobicContact CB-CD2 4.38Å; V835-L909 HydrophobicContact CG2-CD2 3.78Å
836	L	92.3	Very high	69.4	Low	21 Å²	21	59 Å²	59	11%	0.11	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	144.7	172.5	-53.7	-169.7	0	0	0	110.1	P790 R834 W873 Q874 E875 Y907 C908 V910	P790-L836 HydrophobicContact CB-CD1 4.05Å; P790-L836 HydrophobicContact CG-CD1 4.41Å; R834-L836 HydrophobicContact CB-CD2 4.24Å; L836-W873 HydrophobicContact CB-CE3 3.65Å; L836-W873 HydrophobicContact CB-CZ3 4.02Å; L836-Q874 CarbonylContact C-O 3.6Å; L836-Q874 WeakPolarHBondContact CA-O 3.46Å; L836-E875 HydrophobicContact CD2-CB 4.03Å; L836-Y907 WeakPolarHBondContact O-CA 3.07Å; L836-C908 PolarHBondContact N-O 3.32Å; L836-C908 PolarHBondContact O-N 3.08Å; L836-V910 HydrophobicContact CD1-CB 4.28Å; L836-V910 HydrophobicContact CD1-CG2 3.58Å; L836-V910 HydrophobicContact CG-CB 4.4Å; L836-V910 HydrophobicContact CG-CG2 3.99Å
837	A	90.9	Very high	66.8	Low	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.5	169.7	0	0	0	0	0	110.9	G839 W873 Q874 V876 R906 Y907	A837-G839 PolarHBondContact O-N 2.8Å; A837-W873 VanDerWaalsContact C-CE3 3.45Å; A837-Q874 PolarHBondContact N-O 2.81Å; A837-Q874 PolarHBondContact O-N 3.36Å; A837-V876 HydrophobicContact CB-CG1 3.56Å; A837-V876 HydrophobicContact CB-CG2 4.17Å; A837-R906 CarbonylContact C-O 3.57Å; A837-R906 VanDerWaalsContact CA-O 3.24Å; A837-R906 WeakPolarHBondContact CA-O 3.19Å; A837-Y907 HydrophobicContact CB-CD1 3.63Å; A837-Y907 HydrophobicContact CB-CE1 3.52Å; A837-Y907 HydrophobicContact CB-CG 4.45Å
838	L	86.1	Confident	64.8	Low	33 Å²	33	65.8 Å²	65.8	17%	0.173	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	124.4	173.4	-168.8	70.5	0	0	0	109.6	F871 W873 R905 R906	L838-F871 HydrophobicContact CD1-CB 4.09Å; L838-F871 HydrophobicContact CD2-CB 4.38Å; L838-F871 HydrophobicContact CG-CB 4.08Å; L838-F871 HydrophobicContact CG-CD1 4.4Å; L838-W873 HydrophobicContact CB-CE3 4.5Å; L838-W873 HydrophobicContact CD1-CD2 4.44Å; L838-W873 HydrophobicContact CD1-CG 4.43Å; L838-R905 WeakPolarHBondContact O-CD 3.46Å; L838-R906 HydrophobicContact CB-CB 3.98Å; L838-R906 PolarHBondContact N-O 3.47Å
839	G	69.1	Low	63.2	Low	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	159.9	-176.6	0	0	0	0	0	113.6	A837 F871 I872	A837-G839 PolarHBondContact O-N 2.8Å; G839-F871 WeakPolarHBondContact O-CA 3.4Å; G839-I872 PolarHBondContact N-O 3.4Å; G839-I872 PolarHBondContact O-N 3.22Å; G839-I872 VanDerWaalsContact O-O 3.14Å
840	P	63.7	Low	61	Low	59 Å²	59	71.4 Å²	71.4	38%	0.383	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	142.2	178.5	28.6	-35.1	0	0	0	110.9	L842 F871 Q874	P840-L842 PolarHBondContact O-N 2.81Å; P840-F871 HydrophobicContact CB-CE1 4.33Å; P840-Q874 PolarHBondContact O-NE2 3.05Å
841	N	53.4	Low	58.4	Low	46 Å²	46	76.4 Å²	76.4	25%	0.246	41%	0.409	C	S	.	.			trans	-75.4	87.5	-175.8	-172.2	-7.3	0	0	0	112.4	N843 R844 N870 I872	N841-N843 PolarHBondContact O-N 2.85Å; N841-N843 PolarHBondContact OD1-N 2.84Å; N841-R844 PolarHBondContact O-N 3.2Å; N841-N870 WeakPolarHBondContact CB-O 3.31Å; N841-N870 PolarHBondContact N-O 2.92Å; N841-I872 HydrophobicContact CB-CD1 4.1Å; N841-I872 HydrophobicContact CB-CG1 4.06Å; N841-I872 HydrophobicContact CB-CG2 4.36Å
842	L	47.7	Very low	55.5	Low	142 Å²	142	79.3 Å²	79.3	74%	0.743	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-10.6	179.6	-64.2	172.7	0	0	0	114.8	P840 R844	P840-L842 PolarHBondContact O-N 2.81Å; L842-R844 VanDerWaalsContact C-N 3.34Å
843	N	40.4	Very low	52.5	Low	152 Å²	152	85.6 Å²	85.6	81%	0.813	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	1.8	179.4	-67.7	-28.8	0	0	0	113.6	N841	N841-N843 PolarHBondContact O-N 2.85Å; N841-N843 PolarHBondContact OD1-N 2.84Å
844	R	30	Very low	49.5	Very low	174 Å²	174	92 Å²	92	66%	0.657	50%	0.501	S	S	*	.	S	Bend	trans	-97.8	134	161.5	-88.1	-174.9	165.4	-175.1	-5.1	109.9	N841 L842	N841-R844 PolarHBondContact O-N 3.2Å; L842-R844 VanDerWaalsContact C-N 3.34Å
845	S	29	Very low	46.3	Very low	85 Å²	85	98.2 Å²	98.2	59%	0.594	54%	0.536	S	S	*	.			trans	-54.7	136.5	171.6	174.2	0	0	0	0	110.7	N847	S845-N847 PolarHBondContact O-N 3.5Å; S845-N847 PolarHBondContact OG-OD1 2.82Å
846	P	28.8	Very low	43	Very low	94 Å²	94	101.1 Å²	101.1	61%	0.61	57%	0.566	S	S	*	*	S	Bend	trans	-70.7	0	-174.9	29.7	-36.6	0	0	0	114.6	N848 L849	P846-N848 PolarHBondContact O-N 3.42Å; P846-L849 PolarHBondContact O-N 3.3Å
847	N	30.8	Very low	39.8	Very low	133 Å²	133	110.8 Å²	110.8	71%	0.711	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	23.7	-168.4	-62.1	9.7	0	0	0	116.3	S845	S845-N847 PolarHBondContact O-N 3.5Å; S845-N847 PolarHBondContact OG-OD1 2.82Å
848	N	30.3	Very low	36.6	Very low	163 Å²	163	120 Å²	120	87%	0.872	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	6.8	168.5	-87.3	-47	0	0	0	113.2	P846	P846-N848 PolarHBondContact O-N 3.42Å
849	L	30.3	Very low	33.6	Very low	133 Å²	133	124.3 Å²	124.3	70%	0.696	67%	0.674	S	S	*	*	S	Bend	trans	-101.3	103	167.9	-78.2	158.7	0	0	0	108.1	P846 T851	P846-L849 PolarHBondContact O-N 3.3Å; L849-T851 HydrophobicContact CB-CG2 4.36Å; L849-T851 PolarHBondContact O-N 3.32Å
850	N	25.3	Very low	31.5	Very low	151 Å²	151	130.3 Å²	130.3	81%	0.807	71%	0.706	S	S	*	*			trans	-71.2	73.1	177	-82.3	-14.7	0	0	0	111.3	S852	N850-S852 PolarHBondContact O-N 2.73Å
851	T	27.5	Very low	29.8	Very low	136 Å²	136	133.3 Å²	133.3	83%	0.834	71%	0.711	S	S	*	*			trans	-76.1	52.5	174.5	57.4	0	0	0	0	111.4	L849	L849-T851 HydrophobicContact CB-CG2 4.36Å; L849-T851 PolarHBondContact O-N 3.32Å
852	S	25.4	Very low	28.6	Very low	91 Å²	91	136 Å²	136	64%	0.636	73%	0.734	S	S	*	*			trans	-149.6	48.5	-174.5	67.4	0	0	0	0	112.2	N850	N850-S852 PolarHBondContact O-N 2.73Å
853	N	26.3	Very low	27.7	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	73%	0.728	S	S	*	*			trans	-144.6	102.7	164.3	-103.8	-30.1	0	0	0	113.4
854	I	28.7	Very low	27.3	Very low	144 Å²	144	129.8 Å²	129.8	74%	0.738	71%	0.711	S	S	*	*			trans	60.3	96.2	136.5	-52.7	166.7	0	0	0	117.6
855	N	24.4	Very low	27.5	Very low	162 Å²	162	128.1 Å²	128.1	87%	0.866	71%	0.71	S	S	*	*			trans	7.7	109.5	133.6	-60.1	-17.8	0	0	0	118.4
856	G	22.8	Very low	27.7	Very low	62 Å²	62	128.6 Å²	128.6	64%	0.639	71%	0.71	S	S	*	*			trans	107.4	151.9	151	0	0	0	0	0	116.6
857	Y	24	Very low	27.8	Very low	224 Å²	224	128.3 Å²	128.3	88%	0.878	70%	0.703	S	S	*	*	S	Bend	trans	68.5	110	174.9	-56.7	-80.8	0	0	0	118
858	K	23.8	Very low	28.2	Very low	195 Å²	195	127.1 Å²	127.1	85%	0.848	70%	0.696	S	S	*	*			trans	32.5	92.7	148.7	-64.8	-176.7	174.5	-175.9	0	117.6
859	C	24.3	Very low	28.6	Very low	122 Å²	122	127.9 Å²	127.9	82%	0.824	69%	0.694	S	S	*	*			trans	-79.7	117.3	157.9	-58.5	0	0	0	0	110.1
860	N	24.2	Very low	29.4	Very low	126 Å²	126	124.3 Å²	124.3	67%	0.674	68%	0.676	S	S	*	*			trans	-71.9	151.9	167.4	-75.3	-11.5	0	0	0	110.4	S862	N860-S862 PolarHBondContact O-N 2.99Å; N860-S862 VanDerWaalsContact O-N 3.11Å
861	Y	27.7	Very low	31.2	Very low	122 Å²	122	120.7 Å²	120.7	48%	0.478	65%	0.653	S	S	.	*	G	3₁₀ helix	trans	-77.8	10.7	-171.2	-93.6	-94.1	0	0	0	116.1	L730 P807 A863 L864	L730-Y861 HydrophobicContact CD1-CD2 4.35Å; P807-Y861 HydrophobicContact CB-CE1 3.99Å; P807-Y861 WeakPolarHBondContact CB-OH 3.47Å; Y861-A863 PolarHBondContact O-N 3.15Å; Y861-A863 VanDerWaalsContact O-N 3.15Å; Y861-L864 HydrophobicContact CD1-CD1 4.11Å; Y861-L864 HydrophobicContact CE1-CD1 4.39Å
862	S	28.7	Very low	33.5	Very low	104 Å²	104	117.2 Å²	117.2	73%	0.727	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-71.9	-2	-177.5	49.3	0	0	0	0	115.4	N860	N860-S862 PolarHBondContact O-N 2.99Å; N860-S862 VanDerWaalsContact O-N 3.11Å
863	A	28.3	Very low	36.4	Very low	75 Å²	75	115.5 Å²	115.5	62%	0.62	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-90	2	-175	0	0	0	0	0	115.5	Y861	Y861-A863 PolarHBondContact O-N 3.15Å; Y861-A863 VanDerWaalsContact O-N 3.15Å
864	L	32.9	Very low	39.2	Very low	88 Å²	88	110.9 Å²	110.9	46%	0.461	58%	0.582	S	S	.	*	S	Bend	trans	-93.6	-18.4	-173.4	-89.9	166	0	0	0	115.7	Y861	Y861-L864 HydrophobicContact CD1-CD1 4.11Å; Y861-L864 HydrophobicContact CE1-CD1 4.39Å
865	H	34.7	Very low	41.9	Very low	139 Å²	139	107.7 Å²	107.7	64%	0.644	56%	0.564	S	S	*	*	S	Bend	trans	-82.9	-26.7	-178.8	-89.5	-96.7	0	0	0	114.2	N867	H865-N867 PolarHBondContact O-N 3.44Å
866	T	32.3	Very low	44.8	Very low	95 Å²	95	102.1 Å²	102.1	58%	0.583	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	12.8	-165.9	54.4	0	0	0	0	115.4
867	N	31.3	Very low	47.6	Very low	87 Å²	87	99.3 Å²	99.3	47%	0.465	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.5	29.1	-173.2	-109	-66.2	0	0	0	116.4	H865 H869 N870	H865-N867 PolarHBondContact O-N 3.44Å; N867-H869 PolarHBondContact O-N 3.04Å; N867-H869 VanDerWaalsContact O-N 3.1Å; N867-N870 PolarHBondContact O-N 3.28Å; N867-N870 PolarHBondContact OD1-ND2 3.25Å
868	L	38.9	Very low	50.4	Low	108 Å²	108	89.4 Å²	89.4	57%	0.565	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-51.3	-34.1	179.6	-88.4	150.9	0	0	0	114.4	N870 F871	L868-N870 PolarHBondContact O-N 2.82Å; L868-F871 PolarHBondContact O-N 2.82Å; L868-F871 VanDerWaalsContact O-N 3.11Å
869	H	38.4	Very low	53.2	Low	180 Å²	180	81.1 Å²	81.1	83%	0.833	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-59.5	-16.8	176.7	-75.1	-58.9	0	0	0	115.7	N867	N867-H869 PolarHBondContact O-N 3.04Å; N867-H869 VanDerWaalsContact O-N 3.1Å
870	N	48	Very low	55.6	Low	57 Å²	57	76.9 Å²	76.9	31%	0.305	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-92.9	-2.2	179	-75.6	-38	0	0	0	113.8	N841 N867 L868	N841-N870 WeakPolarHBondContact CB-O 3.31Å; N841-N870 PolarHBondContact N-O 2.92Å; N867-N870 PolarHBondContact O-N 3.28Å; N867-N870 PolarHBondContact OD1-ND2 3.25Å; L868-N870 PolarHBondContact O-N 2.82Å
871	F	62.9	Low	57.8	Low	76 Å²	76	75 Å²	75	33%	0.333	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136	175	-74	-94.1	0	0	0	111.2	L838 G839 P840 L868	L838-F871 HydrophobicContact CD1-CB 4.09Å; L838-F871 HydrophobicContact CD2-CB 4.38Å; L838-F871 HydrophobicContact CG-CB 4.08Å; L838-F871 HydrophobicContact CG-CD1 4.4Å; G839-F871 WeakPolarHBondContact O-CA 3.4Å; P840-F871 HydrophobicContact CB-CE1 4.33Å; L868-F871 PolarHBondContact O-N 2.82Å; L868-F871 VanDerWaalsContact O-N 3.11Å
872	I	76.4	Confident	59.7	Low	63 Å²	63	71.5 Å²	71.5	32%	0.323	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	151.2	177.8	55.8	169.5	0	0	0	110	G839 N841 Q874	G839-I872 PolarHBondContact N-O 3.4Å; G839-I872 PolarHBondContact O-N 3.22Å; G839-I872 VanDerWaalsContact O-O 3.14Å; N841-I872 HydrophobicContact CB-CD1 4.1Å; N841-I872 HydrophobicContact CB-CG1 4.06Å; N841-I872 HydrophobicContact CB-CG2 4.36Å; I872-Q874 HydrophobicContact CD1-CG 4.34Å; I872-Q874 HydrophobicContact CG1-CG 4.04Å; I872-Q874 PolarHBondContact O-N 2.86Å
873	W	85.8	Confident	61.3	Low	55 Å²	55	68.2 Å²	68.2	21%	0.208	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	126.9	167.9	-79	106.1	0	0	0	109.5	H788 R789 P790 V802 L836 A837 L838 R906 C908	H788-W873 WeakPolarHBondContact O-CZ2 3.2Å; R789-W873 PolarHBondContact O-NE1 2.99Å; P790-W873 VanDerWaalsContact CA-CD1 3.49Å; P790-W873 HydrophobicContact CB-CB 4.49Å; P790-W873 HydrophobicContact CB-CD2 4.2Å; P790-W873 HydrophobicContact CB-CG 3.93Å; V802-W873 HydrophobicContact CG1-CH2 3.99Å; V802-W873 HydrophobicContact CG1-CZ2 3.96Å; L836-W873 HydrophobicContact CB-CE3 3.65Å; L836-W873 HydrophobicContact CB-CZ3 4.02Å; A837-W873 VanDerWaalsContact C-CE3 3.45Å; L838-W873 HydrophobicContact CB-CE3 4.5Å; L838-W873 HydrophobicContact CD1-CD2 4.44Å; L838-W873 HydrophobicContact CD1-CG 4.43Å; W873-R906 HydrophobicContact CH2-CG 3.92Å; W873-R906 HydrophobicContact CZ2-CG 4.27Å; W873-C908 HydrophobicContact CH2-CB 4.2Å; W873-C908 VanDerWaalsContact CH2-SG 3.55Å
874	Q	84.9	Confident	62.8	Low	44 Å²	44	68.6 Å²	68.6	21%	0.206	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.3	-178.7	-68.3	170.9	-8.4	0	0	108.4	L836 A837 P840 I872 V876	L836-Q874 CarbonylContact C-O 3.6Å; L836-Q874 WeakPolarHBondContact CA-O 3.46Å; A837-Q874 PolarHBondContact N-O 2.81Å; A837-Q874 PolarHBondContact O-N 3.36Å; P840-Q874 PolarHBondContact O-NE2 3.05Å; I872-Q874 HydrophobicContact CD1-CG 4.34Å; I872-Q874 HydrophobicContact CG1-CG 4.04Å; I872-Q874 PolarHBondContact O-N 2.86Å; Q874-V876 PolarHBondContact O-N 2.95Å
875	E	86.1	Confident	64.2	Low	77 Å²	77	70.2 Å²	70.2	36%	0.36	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	117.3	164.2	-177.9	-178.8	111	0	0	108.4	R834 L836 I878 H926	R834-E875 WeakPolarHBondContact CD-OE2 3.13Å; R834-E875 IonicContact CZ-OE2 2.73Å; R834-E875 IonicContact NE-OE2 2.67Å; R834-E875 IonicContact NH1-OE1 2.75Å; R834-E875 IonicContact NH1-OE2 3.96Å; R834-E875 PolarHBondContact NH1-OE2 3.49Å; L836-E875 HydrophobicContact CD2-CB 4.03Å; E875-I878 HydrophobicContact CG-CG1 4.48Å; E875-I878 WeakPolarHBondContact OE1-CG1 2.93Å; E875-H926 IonicContact OE1-CE1 2.63Å; E875-H926 PolarHBondContact OE1-CE1 2.68Å; E875-H926 VanDerWaalsContact OE1-CE1 3.3Å; E875-H926 IonicContact OE1-ND1 3.35Å
876	V	84.7	Confident	65.5	Low	46 Å²	46	64.7 Å²	64.7	28%	0.279	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-25.5	167.5	-66.9	0	0	0	0	110.9	V835 A837 Q874 Y888 Y907	V835-V876 HydrophobicContact CB-CG2 3.88Å; V835-V876 HydrophobicContact CG1-CG2 3.61Å; V835-V876 VanDerWaalsContact O-CG2 3.29Å; V835-V876 WeakPolarHBondContact O-CG2 3Å; V835-V876 PolarHBondContact O-N 3.31Å; A837-V876 HydrophobicContact CB-CG1 3.56Å; A837-V876 HydrophobicContact CB-CG2 4.17Å; Q874-V876 PolarHBondContact O-N 2.95Å; V876-Y888 WeakPolarHBondContact O-CE1 3.32Å; V876-Y888 PolarHBondContact O-OH 2.9Å; V876-Y907 HydrophobicContact CG2-CE1 4.35Å
877	G	80.3	Confident	67.2	Low	3 Å²	3	66.6 Å²	66.6	3%	0.031	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	170.2	177.9	0	0	0	0	0	117.1	R834 V835 Y888	R834-G877 CarbonylContact C-O 3.55Å; R834-G877 WeakPolarHBondContact CA-O 3.3Å; V835-G877 PolarHBondContact N-O 2.85Å; V835-G877 PolarHBondContact O-N 2.89Å; G877-Y888 VanDerWaalsContact CA-CZ 3.41Å; G877-Y888 WeakPolarHBondContact CA-OH 2.96Å
878	I	83.8	Confident	69.3	Low	16 Å²	16	63.9 Å²	63.9	8%	0.082	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.7	173	-48.1	178	0	0	0	107.7	L832 I833 R834 E875 Y881	L832-I878 HydrophobicContact CD1-CG2 3.51Å; I833-I878 WeakPolarHBondContact O-CA 3.43Å; I833-I878 WeakPolarHBondContact O-CG2 3.18Å; R834-I878 HydrophobicContact CG-CG1 4.37Å; E875-I878 HydrophobicContact CG-CG1 4.48Å; E875-I878 WeakPolarHBondContact OE1-CG1 2.93Å; I878-Y881 HydrophobicContact CB-CD2 4.39Å; I878-Y881 HydrophobicContact CG2-CD2 3.69Å; I878-Y881 HydrophobicContact CG2-CE2 4.47Å; I878-Y881 HydrophobicContact CG2-CG 4.44Å; I878-Y881 PolarHBondContact O-N 3.23Å
879	I	83.5	Confident	71.3	Confident	21 Å²	21	58.8 Å²	58.8	11%	0.108	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	124.7	-175.2	-56.8	178.4	0	0	0	109	I833 V835 E882 C890 L892 L909	I833-I879 HydrophobicContact CB-CB 4.45Å; I833-I879 HydrophobicContact CB-CD1 4.37Å; I833-I879 HydrophobicContact CG2-CD1 3.88Å; I833-I879 PolarHBondContact O-N 3.27Å; V835-I879 HydrophobicContact CG2-CD1 4.11Å; V835-I879 HydrophobicContact CG2-CG1 4.06Å; I879-E882 WeakPolarHBondContact CA-OE1 3.36Å; I879-C890 HydrophobicContact CD1-CB 3.72Å; I879-C890 HydrophobicContact CG1-CB 4.03Å; I879-L892 HydrophobicContact CD1-CD1 3.82Å; I879-L892 HydrophobicContact CD1-CD2 3.94Å; I879-L892 HydrophobicContact CD1-CG 3.92Å; I879-L892 HydrophobicContact CG2-CD1 4.29Å; I879-L892 HydrophobicContact CG2-CG 4.5Å; I879-L909 HydrophobicContact CD1-CD2 3.96Å
880	G	73.9	Confident	73.7	Confident	33 Å²	33	50.2 Å²	50.2	34%	0.34	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	-0.6	-169.3	0	0	0	0	0	115.6	E882 R1177	G880-E882 VanDerWaalsContact C-OE2 3.25Å; G880-E882 WeakPolarHBondContact CA-OE2 3.31Å; G880-E882 VanDerWaalsContact N-CD 3.27Å; G880-E882 PolarHBondContact N-OE1 2.82Å; G880-E882 PolarHBondContact N-OE2 3.05Å; G880-R1177 VanDerWaalsContact CA-NH1 3.26Å
881	Y	70.2	Confident	75.5	Confident	86 Å²	86	48.1 Å²	48.1	34%	0.337	25%	0.246	S	C	.	.			trans	-128.4	28.9	174.7	-67.6	-89.2	0	0	0	111.8	L832 I878 Q914 L922	L832-Y881 HydrophobicContact CD1-CD2 4.42Å; L832-Y881 HydrophobicContact CD1-CE2 4.02Å; I878-Y881 HydrophobicContact CB-CD2 4.39Å; I878-Y881 HydrophobicContact CG2-CD2 3.69Å; I878-Y881 HydrophobicContact CG2-CE2 4.47Å; I878-Y881 HydrophobicContact CG2-CG 4.44Å; I878-Y881 PolarHBondContact O-N 3.23Å; Y881-Q914 PolarHBondContact OH-NE2 2.8Å; Y881-L922 HydrophobicContact CE1-CD2 3.99Å
882	E	68.6	Low	76.6	Confident	48 Å²	48	45.7 Å²	45.7	22%	0.224	24%	0.237	C	C	.	.			trans	-59.5	143.2	173.8	-58.7	82.7	177.7	0	0	110.7	I879 G880 Y1178	I879-E882 WeakPolarHBondContact CA-OE1 3.36Å; G880-E882 VanDerWaalsContact C-OE2 3.25Å; G880-E882 WeakPolarHBondContact CA-OE2 3.31Å; G880-E882 VanDerWaalsContact N-CD 3.27Å; G880-E882 PolarHBondContact N-OE1 2.82Å; G880-E882 PolarHBondContact N-OE2 3.05Å; E882-Y1178 HydrophobicContact CG-CD1 4.43Å; E882-Y1178 HydrophobicContact CG-CE1 4.27Å
883	S	62	Low	76.8	Confident	36 Å²	36	45 Å²	45	25%	0.252	23%	0.234	S	C	.	.			trans	-126.2	170.9	-176.2	82.8	0	0	0	0	111.6	V885 T886	S883-V885 PolarHBondContact O-N 3.37Å; S883-V885 PolarHBondContact OG-N 3.17Å; S883-T886 PolarHBondContact N-OG1 2.96Å; S883-T886 VanDerWaalsContact N-OG1 3.15Å; S883-T886 PolarHBondContact O-N 3Å; S883-T886 PolarHBondContact O-OG1 2.91Å
884	N	58.9	Low	76.4	Confident	82 Å²	82	46.7 Å²	46.7	44%	0.439	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-7.1	177.5	-69.3	-20.1	0	0	0	114.2	E933 F1180	N884-E933 PolarHBondContact ND2-OE1 3.31Å; N884-E933 PolarHBondContact ND2-OE2 3.17Å; N884-F1180 WeakPolarHBondContact OD1-CD2 3.42Å
885	V	61.9	Low	76.4	Confident	123 Å²	123	48.1 Å²	48.1	75%	0.745	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-6.5	-179.6	-162.5	0	0	0	0	112.6	S883 K887	S883-V885 PolarHBondContact O-N 3.37Å; S883-V885 PolarHBondContact OG-N 3.17Å; V885-K887 PolarHBondContact O-N 2.79Å
886	T	62.5	Low	76.6	Confident	22 Å²	22	46 Å²	46	14%	0.135	25%	0.254	C	S	.	.			trans	-72.7	119.5	-178.1	50.3	0	0	0	0	111.7	S883 Y888 Y1181	S883-T886 PolarHBondContact N-OG1 2.96Å; S883-T886 VanDerWaalsContact N-OG1 3.15Å; S883-T886 PolarHBondContact O-N 3Å; S883-T886 PolarHBondContact O-OG1 2.91Å; T886-Y888 HydrophobicContact CG2-CE1 3.99Å; T886-Y888 WeakPolarHBondContact CG2-OH 3.31Å; T886-Y1181 VanDerWaalsContact O-CD2 3.27Å; T886-Y1181 WeakPolarHBondContact O-CD2 3.37Å; T886-Y1181 VanDerWaalsContact O-CE2 3.27Å; T886-Y1181 WeakPolarHBondContact O-CE2 3.49Å
887	K	67.2	Low	76.9	Confident	135 Å²	135	43.9 Å²	43.9	59%	0.587	24%	0.24	S	C	*	.			trans	-77.2	-14.9	-177.3	-76	-174.8	144.7	-142.2	0	115.5	V885 D902 Y1181	V885-K887 PolarHBondContact O-N 2.79Å; K887-D902 IonicContact NZ-OD2 2.77Å; K887-D902 PolarHBondContact NZ-OD2 3.45Å; K887-Y1181 WeakPolarHBondContact O-CE2 3.31Å; K887-Y1181 PolarHBondContact O-OH 3.02Å
888	Y	75.6	Confident	77.4	Confident	30 Å²	30	43.9 Å²	43.9	12%	0.118	24%	0.24	C	C	.	.			trans	-108.7	157.4	-178.6	56.8	-85.7	0	0	0	111.2	V876 G877 T886 M900	V876-Y888 WeakPolarHBondContact O-CE1 3.32Å; V876-Y888 PolarHBondContact O-OH 2.9Å; G877-Y888 VanDerWaalsContact CA-CZ 3.41Å; G877-Y888 WeakPolarHBondContact CA-OH 2.96Å; T886-Y888 HydrophobicContact CG2-CE1 3.99Å; T886-Y888 WeakPolarHBondContact CG2-OH 3.31Å; Y888-M900 WeakPolarHBondContact CA-O 3.3Å; Y888-M900 VanDerWaalsContact CB-O 3.32Å; Y888-M900 WeakPolarHBondContact CB-O 3.5Å
889	I	81.5	Confident	77.8	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.3	156.2	-76.9	178.3	0	0	0	106.5	H891 L899 M900 Y1178 Y1181 M1195	I889-H891 HydrophobicContact CG2-CB 4.47Å; I889-L899 CarbonylContact O-C 3.57Å; I889-L899 WeakPolarHBondContact O-CA 3.43Å; I889-M900 HydrophobicContact CB-CB 4.42Å; I889-M900 HydrophobicContact CD1-CE 4.25Å; I889-M900 PolarHBondContact N-O 2.92Å; I889-M900 PolarHBondContact O-N 2.82Å; I889-Y1178 HydrophobicContact CB-CD1 4.49Å; I889-Y1178 HydrophobicContact CD1-CD1 4.13Å; I889-Y1178 HydrophobicContact CD1-CG 3.91Å; I889-Y1178 HydrophobicContact CG1-CD1 3.93Å; I889-Y1178 HydrophobicContact CG1-CG 4.24Å; I889-Y1178 HydrophobicContact CG2-CD1 3.99Å; I889-Y1178 HydrophobicContact CG2-CD2 4.4Å; I889-Y1178 HydrophobicContact CG2-CE1 3.92Å; I889-Y1178 HydrophobicContact CG2-CE2 4.36Å; I889-Y1178 HydrophobicContact CG2-CG 4.23Å; I889-Y1181 HydrophobicContact CD1-CD1 3.31Å; I889-Y1181 HydrophobicContact CD1-CD2 4.41Å; I889-Y1181 HydrophobicContact CD1-CE1 3.8Å; I889-Y1181 HydrophobicContact CD1-CG 3.66Å; I889-Y1181 HydrophobicContact CG1-CD1 3.76Å; I889-Y1181 HydrophobicContact CG1-CD2 3.98Å; I889-Y1181 HydrophobicContact CG1-CE1 4.05Å; I889-Y1181 HydrophobicContact CG1-CE2 4.25Å; I889-Y1181 HydrophobicContact CG1-CG 3.72Å; I889-M1195 HydrophobicContact CG2-CE 4.42Å
890	C	88	Confident	78.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	107	159.8	-164.6	0	0	0	0	108.2	V835 I879 H898 L899 Y1178	V835-C890 HydrophobicContact CG2-CB 3.81Å; I879-C890 HydrophobicContact CD1-CB 3.72Å; I879-C890 HydrophobicContact CG1-CB 4.03Å; C890-H898 WeakPolarHBondContact CA-O 3.48Å; C890-L899 HydrophobicContact CB-CD1 3.98Å; C890-Y1178 PolarHBondContact O-OH 3.3Å
891	H	86.6	Confident	78.8	Confident	13 Å²	13	41.2 Å²	41.2	6%	0.06	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	144	172.1	-168.8	47.9	0	0	0	109.5	I889 A897 H898 Y1178 M1195	I889-H891 HydrophobicContact CG2-CB 4.47Å; H891-A897 CarbonylContact O-C 3.51Å; H891-A897 WeakPolarHBondContact O-CA 3.45Å; H891-H898 HydrophobicContact CB-CB 4.4Å; H891-H898 PolarHBondContact N-O 3.47Å; H891-H898 PolarHBondContact O-N 3.44Å; H891-Y1178 WeakPolarHBondContact CA-OH 3.41Å; H891-Y1178 HydrophobicContact CB-CE2 4.34Å; H891-Y1178 AromaticContact ND1-CE2 3.59Å; H891-M1195 HydrophobicContact CB-CE 4.16Å; H891-M1195 HydrophobicContact CB-SD 4.45Å
892	L	86.5	Confident	79.5	Confident	26 Å²	26	39.2 Å²	39.2	14%	0.136	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	117.4	177.6	-55.9	179.2	0	0	0	109.1	L826 I833 I879 A897 L909	L826-L892 HydrophobicContact CD1-CB 3.71Å; L826-L892 HydrophobicContact CD1-CD1 4.45Å; L826-L892 HydrophobicContact CD2-CD1 4.16Å; I833-L892 HydrophobicContact CD1-CD1 3.57Å; I879-L892 HydrophobicContact CD1-CD1 3.82Å; I879-L892 HydrophobicContact CD1-CD2 3.94Å; I879-L892 HydrophobicContact CD1-CG 3.92Å; I879-L892 HydrophobicContact CG2-CD1 4.29Å; I879-L892 HydrophobicContact CG2-CG 4.5Å; L892-A897 HydrophobicContact CD2-CB 3.65Å; L892-L909 HydrophobicContact CD2-CD1 3.75Å
893	D	80.1	Confident	80.4	Confident	49 Å²	49	39.4 Å²	39.4	26%	0.262	22%	0.217	S	C	.	.			trans	-86.2	-170.5	166	-84.1	-56.5	0	0	0	110.1	H822 L826 N895 M896 H898 C1199	H822-D893 PolarHBondContact CE1-O 2.8Å; H822-D893 VanDerWaalsContact CE1-O 3.25Å; H822-D893 PolarHBondContact NE2-O 3.47Å; H822-D893 VanDerWaalsContact NE2-O 3.08Å; L826-D893 WeakPolarHBondContact CD1-O 3.48Å; D893-N895 PolarHBondContact O-N 2.65Å; D893-N895 VanDerWaalsContact O-N 3.17Å; D893-M896 HydrophobicContact CB-CB 4.44Å; D893-M896 PolarHBondContact N-O 3.42Å; D893-H898 IonicContact OD2-CD2 2.67Å; D893-H898 IonicContact OD2-NE2 2.71Å; D893-C1199 PolarHBondContact OD2-SG 3.21Å
894	S	77.1	Confident	81.7	Confident	89 Å²	89	37.7 Å²	37.7	62%	0.622	21%	0.206	S	C	*	.	S	Bend	trans	-65.4	-19.3	-177.5	49.1	0	0	0	0	114.9
895	N	85	Confident	83.1	Confident	75 Å²	75	36.8 Å²	36.8	40%	0.401	20%	0.196	S	C	.	.	S	Bend	trans	-151.2	0.8	-175.1	61.7	-22.5	0	0	0	114.2	P821 H822 D893	P821-N895 VanDerWaalsContact CA-O 3.3Å; P821-N895 WeakPolarHBondContact CA-O 3.43Å; H822-N895 PolarHBondContact N-O 3.25Å; D893-N895 PolarHBondContact O-N 2.65Å; D893-N895 VanDerWaalsContact O-N 3.17Å
896	M	89.8	Confident	84.4	Confident	33 Å²	33	32.5 Å²	32.5	16%	0.163	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	133	-172.6	-71.5	-64.2	-64.3	0	0	110.6	P821 H822 D893	P821-M896 HydrophobicContact CB-SD 4.06Å; H822-M896 VanDerWaalsContact CD2-C 3.48Å; H822-M896 PolarHBondContact NE2-O 3.4Å; D893-M896 HydrophobicContact CB-CB 4.44Å; D893-M896 PolarHBondContact N-O 3.42Å
897	A	92	Very high	85.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.5	169.1	0	0	0	0	0	110	S819 F820 H891 L892 L909	S819-A897 CarbonylContact C-O 3.54Å; S819-A897 VanDerWaalsContact CA-O 3.28Å; S819-A897 WeakPolarHBondContact CA-O 3.46Å; F820-A897 HydrophobicContact CD1-CB 4.48Å; F820-A897 HydrophobicContact CD2-CB 3.89Å; F820-A897 HydrophobicContact CE1-CB 4.14Å; F820-A897 HydrophobicContact CE2-CB 3.49Å; F820-A897 VanDerWaalsContact CE2-CB 3.49Å; F820-A897 HydrophobicContact CG-CB 4.38Å; F820-A897 HydrophobicContact CZ-CB 3.63Å; F820-A897 PolarHBondContact N-O 3.45Å; F820-A897 PolarHBondContact O-N 3.36Å; H891-A897 CarbonylContact O-C 3.51Å; H891-A897 WeakPolarHBondContact O-CA 3.45Å; L892-A897 HydrophobicContact CD2-CB 3.65Å; A897-L909 HydrophobicContact CB-CD1 3.61Å
898	H	91.5	Very high	87.2	Confident	3 Å²	3	25.3 Å²	25.3	1%	0.014	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	92.3	177.7	-62	-81.9	0	0	0	108.9	L817 S819 C890 H891 D893 M1195 A1198	L817-H898 HydrophobicContact CD1-CB 4.17Å; S819-H898 WeakPolarHBondContact CB-ND1 3.38Å; S819-H898 PolarHBondContact OG-ND1 3.16Å; C890-H898 WeakPolarHBondContact CA-O 3.48Å; H891-H898 HydrophobicContact CB-CB 4.4Å; H891-H898 PolarHBondContact N-O 3.47Å; H891-H898 PolarHBondContact O-N 3.44Å; D893-H898 IonicContact OD2-CD2 2.67Å; D893-H898 IonicContact OD2-NE2 2.71Å; H898-M1195 HydrophobicContact CB-CE 4.1Å; H898-M1195 HydrophobicContact CB-SD 3.41Å; H898-M1195 WeakPolarHBondContact CB-SD 3.11Å; H898-A1198 PolarHBondContact CE1-O 3.17Å; H898-A1198 VanDerWaalsContact CE1-O 3.28Å
899	L	91.7	Very high	88.1	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	114.9	179.6	177.4	65.7	0	0	0	110.2	L818 F820 V835 I889 C890 T901 Y907	L818-L899 HydrophobicContact CB-CB 4.46Å; L818-L899 HydrophobicContact CD2-CD2 4.46Å; L818-L899 PolarHBondContact N-O 3.31Å; L818-L899 PolarHBondContact O-N 3.12Å; F820-L899 HydrophobicContact CE1-CB 3.86Å; F820-L899 HydrophobicContact CZ-CB 4.47Å; V835-L899 HydrophobicContact CG1-CD1 4.09Å; V835-L899 HydrophobicContact CG1-CD2 4.15Å; I889-L899 CarbonylContact O-C 3.57Å; I889-L899 WeakPolarHBondContact O-CA 3.43Å; C890-L899 HydrophobicContact CB-CD1 3.98Å; L899-T901 HydrophobicContact CG-CG2 4.45Å; L899-Y907 HydrophobicContact CD2-CD1 3.55Å; L899-Y907 HydrophobicContact CD2-CD2 4.37Å; L899-Y907 HydrophobicContact CD2-CE1 3.9Å; L899-Y907 HydrophobicContact CD2-CG 3.81Å
900	M	88.9	Confident	88.6	Confident	7 Å²	7	24.1 Å²	24.1	3%	0.034	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.5	171	-167.2	165.6	69.7	0	0	109.9	P815 V816 L817 Y888 I889 Y1181 V1191	P815-M900 HydrophobicContact CB-CG 3.71Å; P815-M900 HydrophobicContact CG-CE 4.37Å; P815-M900 HydrophobicContact CG-CG 3.89Å; P815-M900 HydrophobicContact CG-SD 4.04Å; V816-M900 WeakPolarHBondContact O-CA 3.36Å; L817-M900 HydrophobicContact CD1-CB 4.06Å; Y888-M900 WeakPolarHBondContact CA-O 3.3Å; Y888-M900 VanDerWaalsContact CB-O 3.32Å; Y888-M900 WeakPolarHBondContact CB-O 3.5Å; I889-M900 HydrophobicContact CB-CB 4.42Å; I889-M900 HydrophobicContact CD1-CE 4.25Å; I889-M900 PolarHBondContact N-O 2.92Å; I889-M900 PolarHBondContact O-N 2.82Å; M900-Y1181 HydrophobicContact CE-CD1 4.37Å; M900-Y1181 HydrophobicContact CE-CE1 3.38Å; M900-V1191 HydrophobicContact CE-CG1 3.61Å; M900-V1191 HydrophobicContact CE-CG2 4.27Å; M900-V1191 HydrophobicContact SD-CG1 3.99Å; M900-V1191 HydrophobicContact SD-CG2 4.47Å
901	T	88.5	Confident	88.8	Confident	7 Å²	7	24.1 Å²	24.1	4%	0.043	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	148.8	-174.3	-175.8	0	0	0	0	113.1	F805 P815 V816 L899 V903 Y907	F805-T901 HydrophobicContact CE1-CG2 3.98Å; F805-T901 HydrophobicContact CZ-CG2 3.94Å; P815-T901 CarbonylContact C-O 3.46Å; P815-T901 VanDerWaalsContact CA-O 3.25Å; P815-T901 WeakPolarHBondContact CA-O 3.44Å; P815-T901 WeakPolarHBondContact CB-O 3.48Å; V816-T901 PolarHBondContact N-O 2.74Å; V816-T901 PolarHBondContact O-N 3.03Å; L899-T901 HydrophobicContact CG-CG2 4.45Å; T901-V903 PolarHBondContact OG1-N 2.77Å; T901-Y907 HydrophobicContact CG2-CE2 4.28Å; T901-Y907 PolarHBondContact OG1-OH 2.89Å; T901-Y907 VanDerWaalsContact OG1-OH 3.14Å
902	D	86.1	Confident	89	Confident	44 Å²	44	25.1 Å²	25.1	24%	0.235	13%	0.134	C	C	.	.	S	Bend	trans	-92	4.1	175.6	60.5	-25.5	0	0	0	113.9	K887	K887-D902 IonicContact NZ-OD2 2.77Å; K887-D902 PolarHBondContact NZ-OD2 3.45Å
903	V	86.9	Confident	89.1	Confident	51 Å²	51	24.9 Å²	24.9	31%	0.309	13%	0.134	S	C	.	.	S	Bend	trans	-127.8	126	-172.8	-159.2	0	0	0	0	112.6	F805 T901 R905 Y907	F805-V903 VanDerWaalsContact CZ-O 3.27Å; F805-V903 WeakPolarHBondContact CZ-O 3.37Å; T901-V903 PolarHBondContact OG1-N 2.77Å; V903-R905 HydrophobicContact CG1-CG 3.94Å; V903-R905 PolarHBondContact O-N 3.1Å; V903-Y907 PolarHBondContact O-OH 3.02Å
904	A	88.3	Confident	89.2	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.008	13%	0.134	C	C	.	.			trans	-78.3	113.3	172.9	0	0	0	0	0	111.9	F805 P807 L810	F805-A904 HydrophobicContact CD2-CB 3.86Å; F805-A904 VanDerWaalsContact CE2-CA 3.49Å; F805-A904 HydrophobicContact CE2-CB 3.59Å; F805-A904 HydrophobicContact CZ-CB 4.24Å; P807-A904 VanDerWaalsContact O-CB 3.28Å; P807-A904 WeakPolarHBondContact O-CB 3.48Å; L810-A904 HydrophobicContact CB-CB 3.81Å; L810-A904 HydrophobicContact CD2-CB 4.44Å
905	R	88.6	Confident	88.8	Confident	63 Å²	63	28.6 Å²	28.6	24%	0.238	14%	0.137	C	C	.	.			trans	-152	179	-177.4	-64	-175.3	173.6	-162.3	2.3	111.3	F805 L838 V903 Y907	F805-R905 PolarHBondContact N-O 3.1Å; F805-R905 PolarHBondContact O-N 2.86Å; L838-R905 WeakPolarHBondContact O-CD 3.46Å; V903-R905 HydrophobicContact CG1-CG 3.94Å; V903-R905 PolarHBondContact O-N 3.1Å; R905-Y907 HydrophobicContact CB-CD2 4.24Å; R905-Y907 HydrophobicContact CB-CE2 3.64Å; R905-Y907 WeakPolarHBondContact O-CD2 3.07Å
906	R	90.6	Very high	87.3	Confident	32 Å²	32	30.3 Å²	30.3	12%	0.121	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	135.9	161.8	-172.2	-175.6	-63	168.6	-3.1	109.9	H788 V802 I803 Q804 A837 L838 W873	H788-R906 PolarHBondContact ND1-NH1 3.49Å; H788-R906 VanDerWaalsContact ND1-NH1 3.17Å; V802-R906 HydrophobicContact CG1-CG 3.55Å; I803-R906 CarbonylContact O-C 3.52Å; I803-R906 VanDerWaalsContact O-CA 3.3Å; I803-R906 WeakPolarHBondContact O-CA 3.01Å; Q804-R906 HydrophobicContact CB-CB 4.15Å; Q804-R906 HydrophobicContact CB-CG 4.21Å; Q804-R906 HydrophobicContact CG-CB 4.12Å; Q804-R906 VanDerWaalsContact OE1-CZ 3.24Å; A837-R906 CarbonylContact C-O 3.57Å; A837-R906 VanDerWaalsContact CA-O 3.24Å; A837-R906 WeakPolarHBondContact CA-O 3.19Å; L838-R906 HydrophobicContact CB-CB 3.98Å; L838-R906 PolarHBondContact N-O 3.47Å; W873-R906 HydrophobicContact CH2-CG 3.92Å; W873-R906 HydrophobicContact CZ2-CG 4.27Å
907	Y	93.7	Very high	84.7	Confident	6 Å²	6	34.4 Å²	34.4	2%	0.024	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	152.4	-173.1	-70.2	-85.4	0	0	0	111.9	I803 F805 L818 V835 L836 A837 V876 L899 T901 V903 R905	I803-Y907 PolarHBondContact N-O 3.41Å; I803-Y907 PolarHBondContact O-N 2.94Å; F805-Y907 HydrophobicContact CD1-CD2 4.49Å; F805-Y907 HydrophobicContact CD1-CE2 4.39Å; F805-Y907 HydrophobicContact CE1-CD2 4.21Å; F805-Y907 AromaticContact CE1-CE2 3.75Å; F805-Y907 HydrophobicContact CE1-CE2 3.75Å; L818-Y907 HydrophobicContact CD2-CD2 4.34Å; V835-Y907 HydrophobicContact CG1-CD1 4.28Å; L836-Y907 WeakPolarHBondContact O-CA 3.07Å; A837-Y907 HydrophobicContact CB-CD1 3.63Å; A837-Y907 HydrophobicContact CB-CE1 3.52Å; A837-Y907 HydrophobicContact CB-CG 4.45Å; V876-Y907 HydrophobicContact CG2-CE1 4.35Å; L899-Y907 HydrophobicContact CD2-CD1 3.55Å; L899-Y907 HydrophobicContact CD2-CD2 4.37Å; L899-Y907 HydrophobicContact CD2-CE1 3.9Å; L899-Y907 HydrophobicContact CD2-CG 3.81Å; T901-Y907 HydrophobicContact CG2-CE2 4.28Å; T901-Y907 PolarHBondContact OG1-OH 2.89Å; T901-Y907 VanDerWaalsContact OG1-OH 3.14Å; V903-Y907 PolarHBondContact O-OH 3.02Å; R905-Y907 HydrophobicContact CB-CD2 4.24Å; R905-Y907 HydrophobicContact CB-CE2 3.64Å; R905-Y907 WeakPolarHBondContact O-CD2 3.07Å
908	C	93.9	Very high	81.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	164.2	164.2	63.5	0	0	0	0	111.7	L798 V802 L836 W873	L798-C908 HydrophobicContact CD1-CB 3.87Å; V802-C908 HydrophobicContact CG2-CB 4.24Å; L836-C908 PolarHBondContact N-O 3.32Å; L836-C908 PolarHBondContact O-N 3.08Å; W873-C908 HydrophobicContact CH2-CB 4.2Å; W873-C908 VanDerWaalsContact CH2-SG 3.55Å
909	L	94.6	Very high	78.6	Confident	1 Å²	1	41 Å²	41	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	137.5	168.8	-67.6	178.3	0	0	0	111.2	L799 S800 F820 H822 I833 V835 I879 L892 A897	L799-L909 HydrophobicContact CB-CB 4Å; L799-L909 PolarHBondContact N-O 2.98Å; S800-L909 PolarHBondContact OG-N 2.81Å; F820-L909 HydrophobicContact CE2-CD1 3.83Å; F820-L909 HydrophobicContact CE2-CG 3.85Å; F820-L909 HydrophobicContact CZ-CD1 4.25Å; F820-L909 HydrophobicContact CZ-CG 4.09Å; H822-L909 HydrophobicContact CB-CD1 4.42Å; I833-L909 HydrophobicContact CG2-CB 4.48Å; I833-L909 HydrophobicContact CG2-CD2 4.16Å; V835-L909 HydrophobicContact CB-CD2 4.38Å; V835-L909 HydrophobicContact CG2-CD2 3.78Å; I879-L909 HydrophobicContact CD1-CD2 3.96Å; L892-L909 HydrophobicContact CD2-CD1 3.75Å; A897-L909 HydrophobicContact CB-CD1 3.61Å
910	V	93.1	Very high	75.4	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.03	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140	174.7	173.4	0	0	0	0	108.8	P790 L792 Q796 T797 L798 I833 R834 L836	P790-V910 HydrophobicContact CG-CG2 4.13Å; L792-V910 HydrophobicContact CD1-CG1 4.29Å; L792-V910 HydrophobicContact CD1-CG2 4.38Å; L792-V910 HydrophobicContact CD2-CB 4.42Å; L792-V910 HydrophobicContact CD2-CG1 3.64Å; L792-V910 HydrophobicContact CD2-CG2 3.84Å; Q796-V910 HydrophobicContact CB-CG1 4.26Å; T797-V910 CarbonylContact O-C 3.53Å; T797-V910 WeakPolarHBondContact O-CA 3.42Å; L798-V910 HydrophobicContact CD1-CG2 4.37Å; I833-V910 WeakPolarHBondContact CA-O 3.46Å; R834-V910 PolarHBondContact N-O 3.46Å; R834-V910 PolarHBondContact O-N 2.87Å; L836-V910 HydrophobicContact CD1-CB 4.28Å; L836-V910 HydrophobicContact CD1-CG2 3.58Å; L836-V910 HydrophobicContact CG-CB 4.4Å; L836-V910 HydrophobicContact CG-CG2 3.99Å
911	G	91.5	Very high	72.4	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	150.1	180	0	0	0	0	0	113.5	Q796 T797 L832	Q796-G911 WeakPolarHBondContact CA-O 3.41Å; T797-G911 WeakPolarHBondContact CG2-O 3.44Å; T797-G911 PolarHBondContact N-O 3.22Å; T797-G911 PolarHBondContact O-N 2.97Å; L832-G911 WeakPolarHBondContact O-CA 3.47Å
912	E	90.3	Very high	69.6	Low	34 Å²	34	61.5 Å²	61.5	16%	0.159	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	159.6	173.1	62.4	-161.7	161.7	0	0	110.5	Q796 L832 R834 Q914	Q796-E912 HydrophobicContact CG-CB 3.97Å; Q796-E912 WeakPolarHBondContact CG-OE2 3.48Å; Q796-E912 PolarHBondContact NE2-OE2 2.89Å; L832-E912 HydrophobicContact CB-CG 3.98Å; L832-E912 HydrophobicContact CD2-CG 4.19Å; L832-E912 HydrophobicContact CG-CG 4.29Å; L832-E912 PolarHBondContact N-O 2.79Å; L832-E912 PolarHBondContact O-N 3.33Å; L832-E912 VanDerWaalsContact O-N 3.07Å; R834-E912 IonicContact CZ-OE1 3.69Å; R834-E912 IonicContact NE-OE1 2.88Å; R834-E912 PolarHBondContact NE-OE1 3.44Å; R834-E912 IonicContact NH2-OE1 3.66Å; R834-E912 PolarHBondContact NH2-OE1 2.84Å; E912-Q914 PolarHBondContact O-N 2.8Å
913	T	88.5	Confident	66.9	Low	21 Å²	21	63 Å²	63	13%	0.129	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	126.5	173.5	-63.1	0	0	0	0	110.8	K915 A977 D1035	T913-K915 PolarHBondContact O-N 3.4Å; T913-A977 WeakPolarHBondContact OG1-CB 3.23Å; T913-A977 PolarHBondContact OG1-N 3.46Å; T913-D1035 VanDerWaalsContact CB-OD2 3.24Å; T913-D1035 WeakPolarHBondContact CB-OD2 3.29Å; T913-D1035 WeakPolarHBondContact OG1-CB 3.48Å; T913-D1035 PolarHBondContact OG1-OD2 2.92Å
914	Q	81.9	Confident	64	Low	56 Å²	56	65.6 Å²	65.6	26%	0.262	36%	0.359	S	S	.	.			trans	-69.9	114.7	177.5	-167.1	-178.2	30.3	0	0	111	N830 L832 Y881 E912	N830-Q914 HydrophobicContact CB-CB 4.38Å; N830-Q914 WeakPolarHBondContact O-CB 3.28Å; N830-Q914 PolarHBondContact O-N 2.89Å; L832-Q914 HydrophobicContact CB-CB 4.14Å; L832-Q914 HydrophobicContact CB-CG 4.45Å; Y881-Q914 PolarHBondContact OH-NE2 2.8Å; E912-Q914 PolarHBondContact O-N 2.8Å
915	K	69.9	Low	61.2	Low	160 Å²	160	72.4 Å²	72.4	70%	0.696	40%	0.395	S	S	*	.			trans	-88.6	114.9	178.6	-61.4	175.9	-175.2	176.7	0	109.7	T913 L917	T913-K915 PolarHBondContact O-N 3.4Å; K915-L917 PolarHBondContact O-N 3.16Å
916	L	52.8	Low	58.5	Low	110 Å²	110	72.9 Å²	72.9	58%	0.576	40%	0.4	S	S	*	.			trans	-67.9	112.2	172.6	-90.5	99.1	0	0	0	110.7	I974	L916-I974 HydrophobicContact CB-CD1 4.03Å; L916-I974 HydrophobicContact CD1-CD1 3.69Å; L916-I974 HydrophobicContact CD1-CG1 4.02Å; L916-I974 HydrophobicContact CG-CD1 4.43Å
917	L	36.1	Very low	55.6	Low	120 Å²	120	81.2 Å²	81.2	63%	0.628	44%	0.437	S	S	*	.			trans	-90.4	121.7	163.3	-83.8	141.9	0	0	0	109	K915	K915-L917 PolarHBondContact O-N 3.16Å
918	G	28.1	Very low	52.5	Low	78 Å²	78	88.4 Å²	88.4	80%	0.804	48%	0.476	S	S	*	.			trans	-70.6	134.5	177.2	0	0	0	0	0	112.3
919	G	26.1	Very low	49.4	Very low	62 Å²	62	93.7 Å²	93.7	64%	0.639	50%	0.503	S	S	*	.	S	Bend	trans	75.7	91.8	166	0	0	0	0	0	116.1	R921	G919-R921 PolarHBondContact O-N 3.15Å
920	N	26.1	Very low	46.2	Very low	163 Å²	163	100.6 Å²	100.6	87%	0.872	54%	0.54	S	S	*	.	S	Bend	trans	55.3	18.9	157.8	-63.8	-2.8	0	0	0	118.3
921	R	25.9	Very low	43.2	Very low	188 Å²	188	107.8 Å²	107.8	71%	0.709	57%	0.573	S	S	*	*			trans	-122.5	87.2	167.7	-73.7	-171.1	175.4	-179.3	-0.1	111.6	G919	G919-R921 PolarHBondContact O-N 3.15Å
922	L	28.1	Very low	40.3	Very low	95 Å²	95	113.5 Å²	113.5	50%	0.497	61%	0.608	S	S	.	*			trans	-57.1	153.4	153.9	-77.1	167	0	0	0	109.4	Y881 S924	Y881-L922 HydrophobicContact CE1-CD2 3.99Å; L922-S924 PolarHBondContact O-N 3.03Å
923	I	30.9	Very low	37.4	Very low	77 Å²	77	117.1 Å²	117.1	40%	0.395	63%	0.625	S	S	.	*			trans	-56.9	103.5	-166	-61.6	168.9	0	0	0	111.3	L832 N925 H926	L832-I923 HydrophobicContact CD2-CD1 4.06Å; I923-N925 HydrophobicContact CG2-CB 4.48Å; I923-N925 PolarHBondContact O-N 2.64Å; I923-H926 PolarHBondContact O-CD2 3.15Å
924	S	25.7	Very low	34.6	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	44.7	-172.3	66.7	0	0	0	0	113.9	L922	L922-S924 PolarHBondContact O-N 3.03Å
925	N	28.5	Very low	32	Very low	144 Å²	144	129.2 Å²	129.2	77%	0.77	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-16.9	161.1	-77.1	-13.4	0	0	0	111.7	I923 K927	I923-N925 HydrophobicContact CG2-CB 4.48Å; I923-N925 PolarHBondContact O-N 2.64Å; N925-K927 PolarHBondContact O-N 2.84Å
926	H	33.3	Very low	29.9	Very low	73 Å²	73	127.7 Å²	127.7	34%	0.338	68%	0.677	S	S	.	*			trans	-81.4	93.4	177.7	-59.5	-75.8	0	0	0	111.4	E875 I923 N928 L929	E875-H926 IonicContact OE1-CE1 2.63Å; E875-H926 PolarHBondContact OE1-CE1 2.68Å; E875-H926 VanDerWaalsContact OE1-CE1 3.3Å; E875-H926 IonicContact OE1-ND1 3.35Å; I923-H926 PolarHBondContact O-CD2 3.15Å; H926-N928 PolarHBondContact O-N 2.84Å; H926-N928 VanDerWaalsContact O-N 3.08Å; H926-L929 HydrophobicContact CB-CD1 4.33Å
927	K	28.1	Very low	28.8	Very low	208 Å²	208	128.2 Å²	128.2	90%	0.904	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	1.6	-179.9	-80.8	-171.8	173.6	-178.6	0	116.3	N925	N925-K927 PolarHBondContact O-N 2.84Å
928	N	29	Very low	28.4	Very low	157 Å²	157	128.2 Å²	128.2	84%	0.84	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.5	22.8	-164.3	-86.4	-13.2	0	0	0	115.7	H926	H926-N928 PolarHBondContact O-N 2.84Å; H926-N928 VanDerWaalsContact O-N 3.08Å
929	L	30	Very low	28.4	Very low	110 Å²	110	130.5 Å²	130.5	58%	0.576	68%	0.676	S	S	*	*			trans	-116.5	118.3	175.9	-75.2	169	0	0	0	111.8	H926	H926-L929 HydrophobicContact CB-CD1 4.33Å
930	N	27.3	Very low	28.4	Very low	146 Å²	146	128.9 Å²	128.9	78%	0.781	66%	0.66	S	S	*	*			trans	-78.5	141.9	178.9	-79.4	-27.4	0	0	0	111.7	T932	N930-T932 VanDerWaalsContact C-N 3.27Å; N930-T932 PolarHBondContact O-N 2.71Å
931	H	28.5	Very low	28.6	Very low	156 Å²	156	125 Å²	125	72%	0.722	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	17.8	-158	-134.4	-70.4	0	0	0	115.7
932	T	30.9	Very low	28.7	Very low	121 Å²	121	119.2 Å²	119.2	74%	0.742	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	-8.5	-155.8	46.2	0	0	0	0	117.2	N930	N930-T932 VanDerWaalsContact C-N 3.27Å; N930-T932 PolarHBondContact O-N 2.71Å
933	E	30.4	Very low	28.8	Very low	110 Å²	110	117.8 Å²	117.8	51%	0.514	62%	0.622	S	S	.	*	S	Bend	trans	-98.7	-5.2	-172.9	-60.8	-169.2	127.7	0	0	115	N884 Q935	N884-E933 PolarHBondContact ND2-OE1 3.31Å; N884-E933 PolarHBondContact ND2-OE2 3.17Å; E933-Q935 VanDerWaalsContact C-N 3.3Å; E933-Q935 PolarHBondContact O-N 3.35Å
934	F	29.9	Very low	28.6	Very low	151 Å²	151	119.6 Å²	119.6	66%	0.662	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	17.9	-166.9	-88	-79.9	0	0	0	117.4
935	Q	26.8	Very low	28.6	Very low	180 Å²	180	117.1 Å²	117.1	84%	0.841	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-3.7	-170.3	-87.5	-168.8	-15.7	0	0	117.5	E933	E933-Q935 VanDerWaalsContact C-N 3.3Å; E933-Q935 PolarHBondContact O-N 3.35Å
936	N	26.5	Very low	28.7	Very low	128 Å²	128	116.6 Å²	116.6	68%	0.684	62%	0.62	S	S	*	*			trans	-141.1	89.8	-176.2	-71.8	-70.8	0	0	0	114.2
937	F	28.1	Very low	28.5	Very low	121 Å²	121	118.3 Å²	118.3	53%	0.531	63%	0.628	S	S	.	*			trans	-147.9	135.7	159.7	-93	-63	0	0	0	113.3	F1180	F937-F1180 HydrophobicContact CD2-CE2 4.3Å; F937-F1180 HydrophobicContact CE1-CE1 4.36Å; F937-F1180 HydrophobicContact CE1-CZ 4.39Å; F937-F1180 AromaticContact CE2-CD2 3.59Å; F937-F1180 HydrophobicContact CE2-CD2 3.59Å; F937-F1180 HydrophobicContact CE2-CE1 4.41Å; F937-F1180 AromaticContact CE2-CE2 3.29Å; F937-F1180 HydrophobicContact CE2-CE2 3.29Å; F937-F1180 HydrophobicContact CE2-CG 4.27Å; F937-F1180 AromaticContact CE2-CZ 3.74Å; F937-F1180 HydrophobicContact CE2-CZ 3.74Å; F937-F1180 AromaticContact CZ-CD1 3.86Å; F937-F1180 HydrophobicContact CZ-CD1 3.86Å; F937-F1180 AromaticContact CZ-CD2 3.49Å; F937-F1180 HydrophobicContact CZ-CD2 3.49Å; F937-F1180 VanDerWaalsContact CZ-CD2 3.49Å; F937-F1180 AromaticContact CZ-CE1 3.83Å; F937-F1180 HydrophobicContact CZ-CE1 3.83Å; F937-F1180 AromaticContact CZ-CE2 3.47Å; F937-F1180 HydrophobicContact CZ-CE2 3.47Å; F937-F1180 VanDerWaalsContact CZ-CE2 3.47Å; F937-F1180 AromaticContact CZ-CG 3.69Å; F937-F1180 HydrophobicContact CZ-CG 3.69Å; F937-F1180 AromaticContact CZ-CZ 3.64Å; F937-F1180 HydrophobicContact CZ-CZ 3.64Å
938	P	29.1	Very low	28.5	Very low	121 Å²	121	116.2 Å²	116.2	79%	0.786	63%	0.627	S	S	*	*			trans	-80.2	160.5	174.2	-11.5	29.1	0	0	0	113.8
939	N	27.7	Very low	28.4	Very low	126 Å²	126	113.4 Å²	113.4	67%	0.674	61%	0.611	S	S	*	*			trans	-69.6	127.8	178	-73.7	-59.3	0	0	0	113.4	Q947	N939-Q947 PolarHBondContact OD1-NE2 3.26Å
940	G	25.2	Very low	28.1	Very low	28 Å²	28	114.5 Å²	114.5	29%	0.289	62%	0.617	S	S	.	*			trans	-156.7	140.9	171.3	0	0	0	0	0	110.8	E1176	G940-E1176 VanDerWaalsContact CA-OE1 3.3Å; G940-E1176 WeakPolarHBondContact CA-OE1 3.49Å
941	I	31.3	Very low	28.2	Very low	81 Å²	81	112.9 Å²	112.9	42%	0.415	61%	0.607	S	S	.	*	S	Bend	trans	61	80.6	180	-45.3	165.5	0	0	0	114.9	T943 R1174	I941-T943 PolarHBondContact O-N 3.45Å; I941-T943 VanDerWaalsContact O-N 3.14Å; I941-R1174 HydrophobicContact CD1-CB 3.98Å; I941-R1174 VanDerWaalsContact CD1-O 3.3Å; I941-R1174 WeakPolarHBondContact CD1-O 3.29Å
942	S	27.4	Very low	28.2	Very low	67 Å²	67	110.4 Å²	110.4	47%	0.469	60%	0.603	S	S	.	*			trans	47.1	46.8	146.1	-167.2	0	0	0	0	119.4	N944	S942-N944 PolarHBondContact O-N 3.08Å; S942-N944 PolarHBondContact OG-ND2 2.99Å
943	T	30.1	Very low	28	Very low	65 Å²	65	111.7 Å²	111.7	40%	0.399	61%	0.606	S	S	.	*			trans	-74.7	64.4	161.7	45.5	0	0	0	0	111.6	I941 G945 L946	I941-T943 PolarHBondContact O-N 3.45Å; I941-T943 VanDerWaalsContact O-N 3.14Å; T943-G945 PolarHBondContact O-N 3.26Å; T943-L946 PolarHBondContact O-N 2.97Å
944	N	26.1	Very low	27.8	Very low	115 Å²	115	112.8 Å²	112.8	62%	0.615	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	72.3	179	-76	-6.9	0	0	0	111.3	S942	S942-N944 PolarHBondContact O-N 3.08Å; S942-N944 PolarHBondContact OG-ND2 2.99Å
945	G	27.2	Very low	27.7	Very low	52 Å²	52	111.6 Å²	111.6	54%	0.536	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-177.7	-18.6	-179.2	0	0	0	0	0	113.2	T943	T943-G945 PolarHBondContact O-N 3.26Å
946	L	30.9	Very low	27.7	Very low	133 Å²	133	111 Å²	111	70%	0.696	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	-3.5	-175.5	-81.1	167.9	0	0	0	116.4	T943	T943-L946 PolarHBondContact O-N 2.97Å
947	Q	28.7	Very low	27.8	Very low	108 Å²	108	109.7 Å²	109.7	51%	0.505	62%	0.623	S	S	.	*	S	Bend	trans	-94.2	-5.3	-178.5	-69.5	-174.5	8.3	0	0	115.6	N939	N939-Q947 PolarHBondContact OD1-NE2 3.26Å
948	N	27	Very low	27.8	Very low	165 Å²	165	111.6 Å²	111.6	88%	0.882	64%	0.638	S	S	*	*	S	Bend	trans	-111.1	3.7	-174.4	-89.3	-7.9	0	0	0	116
949	I	27.8	Very low	27.9	Very low	98 Å²	98	113.1 Å²	113.1	50%	0.503	64%	0.64	S	S	.	*			trans	-108.9	101.2	174.4	-40.1	-175.6	0	0	0	110.2	I951	I949-I951 VanDerWaalsContact C-N 3.27Å; I949-I951 HydrophobicContact CB-CG1 4.24Å; I949-I951 HydrophobicContact CG2-CD1 3.87Å; I949-I951 HydrophobicContact CG2-CG1 3.52Å; I949-I951 PolarHBondContact O-N 2.67Å
950	N	23.6	Very low	27.9	Very low	132 Å²	132	113.9 Å²	113.9	71%	0.706	64%	0.643	S	S	*	*			trans	-78.3	67.7	-177.3	-170.8	3	0	0	0	112	T952	N950-T952 PolarHBondContact O-N 2.69Å; N950-T952 WeakPolarHBondContact OD1-CG2 3.34Å; N950-T952 PolarHBondContact OD1-OG1 3.11Å
951	I	29.4	Very low	28	Very low	112 Å²	112	120.7 Å²	120.7	57%	0.574	67%	0.669	S	S	*	*			trans	-82.5	59	179.2	-41.9	-176.1	0	0	0	111.3	I949 N953 L954	I949-I951 VanDerWaalsContact C-N 3.27Å; I949-I951 HydrophobicContact CB-CG1 4.24Å; I949-I951 HydrophobicContact CG2-CD1 3.87Å; I949-I951 HydrophobicContact CG2-CG1 3.52Å; I949-I951 PolarHBondContact O-N 2.67Å; I951-N953 VanDerWaalsContact C-N 3.29Å; I951-L954 HydrophobicContact CG2-CB 3.87Å; I951-L954 HydrophobicContact CG2-CD1 3.9Å; I951-L954 HydrophobicContact CG2-CG 4.08Å
952	T	27.5	Very low	27.8	Very low	104 Å²	104	122.2 Å²	122.2	64%	0.638	68%	0.683	S	S	*	*			trans	-89	9.4	171.5	43	0	0	0	0	113.1	N950	N950-T952 PolarHBondContact O-N 2.69Å; N950-T952 WeakPolarHBondContact OD1-CG2 3.34Å; N950-T952 PolarHBondContact OD1-OG1 3.11Å
953	N	26.8	Very low	27.8	Very low	149 Å²	149	126.9 Å²	126.9	80%	0.797	70%	0.702	S	S	*	*	S	Bend	trans	-139.3	22	-166.3	-106.3	-22.5	0	0	0	115.8	I951	I951-N953 VanDerWaalsContact C-N 3.29Å
954	L	27.6	Very low	27.6	Very low	132 Å²	132	129 Å²	129	69%	0.691	72%	0.72	S	S	*	*			trans	-117.4	26.3	175.4	-74.3	178.4	0	0	0	114.6	I951 N956	I951-L954 HydrophobicContact CG2-CB 3.87Å; I951-L954 HydrophobicContact CG2-CD1 3.9Å; I951-L954 HydrophobicContact CG2-CG 4.08Å; L954-N956 PolarHBondContact O-N 3.07Å
955	T	27.3	Very low	27.8	Very low	127 Å²	127	128.5 Å²	128.5	78%	0.779	73%	0.731	S	S	*	*	S	Bend	trans	-94.3	64.7	169.2	55.1	0	0	0	0	111.6
956	N	26.3	Very low	27.8	Very low	167 Å²	167	133.2 Å²	133.2	89%	0.893	74%	0.739	S	S	*	*	S	Bend	trans	173.4	73.2	155.8	-92.4	-27.9	0	0	0	113.4	L954	L954-N956 PolarHBondContact O-N 3.07Å
957	S	29.8	Very low	27.6	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	74%	0.736	S	S	*	*			trans	-162.5	90.3	158.1	58.2	0	0	0	0	112.7	N959	S957-N959 PolarHBondContact O-N 2.85Å
958	N	26.9	Very low	27.7	Very low	160 Å²	160	132.9 Å²	132.9	86%	0.856	75%	0.751	S	S	*	*			trans	-69	117.6	155.2	-65.6	-34.5	0	0	0	107.4
959	N	31.8	Very low	27.7	Very low	154 Å²	154	129 Å²	129	82%	0.824	75%	0.749	S	S	*	*			trans	-173.5	124	149.5	-96.6	-27.2	0	0	0	114	S957	S957-N959 PolarHBondContact O-N 2.85Å
960	I	27.6	Very low	28	Very low	141 Å²	141	130.8 Å²	130.8	72%	0.723	76%	0.759	S	S	*	*			trans	-2.6	121.7	142.9	-52.9	160	0	0	0	116.8
961	M	26.8	Very low	28.5	Very low	171 Å²	171	132.1 Å²	132.1	84%	0.842	77%	0.766	S	S	*	*			trans	-173.1	111.6	136.4	-98.4	169	-129.1	0	0	106.7
962	T	28.4	Very low	28.7	Very low	114 Å²	114	131.4 Å²	131.4	70%	0.699	77%	0.771	S	S	*	*				61.3	130.8	83.5	63.8	0	0	0	0	114.8	S964	T962-S964 PolarHBondContact O-N 3.44Å
963	D	25.7	Very low	29.8	Very low	164 Å²	164	132.6 Å²	132.6	88%	0.877	77%	0.773	S	S	*	*	S	Bend	trans	-63.6	109.6	-173.9	-176.4	17.4	0	0	0	113.5
964	S	25.9	Very low	31.4	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	75%	0.754	S	S	*	*			trans	172.3	82	154.7	34.1	0	0	0	0	112.2	T962	T962-S964 PolarHBondContact O-N 3.44Å
965	A	30.3	Very low	33.6	Very low	103 Å²	103	127.1 Å²	127.1	85%	0.851	74%	0.741	S	S	*	*			trans	-133.3	71.2	177.3	0	0	0	0	0	112.9
966	Q	28.5	Very low	36.3	Very low	152 Å²	152	122.7 Å²	122.7	71%	0.71	71%	0.714	S	S	*	*			trans	-77.8	152.7	158.6	-72.8	-170.2	-11.4	0	0	110.2
967	D	26.3	Very low	39.3	Very low	117 Å²	117	114.7 Å²	114.7	63%	0.626	67%	0.672	S	S	*	*			trans	61.4	79	176.5	-67	-42.8	0	0	0	116	R414	R414-D967 IonicContact CZ-OD2 3.73Å; R414-D967 IonicContact NH1-OD2 2.68Å; R414-D967 PolarHBondContact NH1-OD2 2.86Å
968	S	30.8	Very low	42.3	Very low	117 Å²	117	110.2 Å²	110.2	82%	0.818	64%	0.64	S	S	*	*			trans	-149.6	100	152.3	-78.5	0	0	0	0	109.8	L970	S968-L970 PolarHBondContact O-N 2.77Å
969	G	27.4	Very low	45.3	Very low	82 Å²	82	102.6 Å²	102.6	85%	0.845	60%	0.599	S	S	*	*			trans	-78.2	76.6	-169.1	0	0	0	0	0	114.3
970	L	33.3	Very low	48.2	Very low	136 Å²	136	96.7 Å²	96.7	71%	0.712	57%	0.567	S	S	*	*			trans	-134.8	16	177.7	-144	81.9	0	0	0	114.2	S968	S968-L970 PolarHBondContact O-N 2.77Å
971	L	34.9	Very low	51.3	Low	160 Å²	160	90.1 Å²	90.1	84%	0.838	53%	0.533	S	S	*	.			trans	-127.8	12.9	-171.1	-126.7	82.7	0	0	0	114.9
972	S	33.4	Very low	54.5	Low	98 Å²	98	83.9 Å²	83.9	69%	0.685	50%	0.502	S	S	*	.			trans	-80.4	-14	-170.9	41.3	0	0	0	0	116
973	D	50.6	Low	57.6	Low	129 Å²	129	78.4 Å²	78.4	69%	0.69	47%	0.468	S	S	*	.			trans	-102.3	6.6	-152.2	-69.2	17.1	0	0	0	115.6	Q975	D973-Q975 PolarHBondContact O-N 2.9Å
974	I	60.6	Low	60.9	Low	78 Å²	78	70.6 Å²	70.6	40%	0.4	43%	0.427	S	S	.	.			trans	-74.6	97.6	176.6	-51.8	175.8	0	0	0	109.3	N830 L916	N830-I974 HydrophobicContact CB-CG2 4.39Å; L916-I974 HydrophobicContact CB-CD1 4.03Å; L916-I974 HydrophobicContact CD1-CD1 3.69Å; L916-I974 HydrophobicContact CD1-CG1 4.02Å; L916-I974 HydrophobicContact CG-CD1 4.43Å
975	Q	72.9	Confident	64.2	Low	88 Å²	88	65.3 Å²	65.3	41%	0.411	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-62.9	128.2	171	-68.8	-64.4	-38.3	0	0	110.7	Q828 N830 D973	Q828-Q975 WeakPolarHBondContact O-CB 3.04Å; Q828-Q975 WeakPolarHBondContact O-CG 3.36Å; N830-Q975 WeakPolarHBondContact CB-O 2.98Å; N830-Q975 PolarHBondContact N-O 2.76Å; N830-Q975 PolarHBondContact ND2-N 2.88Å; N830-Q975 PolarHBondContact ND2-O 3.49Å; D973-Q975 PolarHBondContact O-N 2.9Å
976	P	84.7	Confident	67.2	Low	33 Å²	33	60.6 Å²	60.6	21%	0.214	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-67.5	154.9	177.6	29.9	-36.3	0	0	0	111.1	S829 T978 K1034 D1035	S829-P976 WeakPolarHBondContact CB-O 3.31Å; P976-T978 PolarHBondContact O-N 2.84Å; P976-T978 PolarHBondContact O-OG1 3.44Å; P976-K1034 HydrophobicContact CG-CB 4.36Å; P976-K1034 HydrophobicContact CG-CD 4.14Å; P976-D1035 HydrophobicContact CB-CB 4.26Å; P976-D1035 WeakPolarHBondContact CB-O 3.4Å
977	A	89.5	Confident	70.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-54.1	141	173	0	0	0	0	0	110.9	W831 T913 D1035 W1068	W831-A977 HydrophobicContact CD2-CB 3.74Å; W831-A977 HydrophobicContact CE3-CB 3.57Å; W831-A977 HydrophobicContact CG-CB 4.47Å; W831-A977 HydrophobicContact CH2-CB 3.78Å; W831-A977 HydrophobicContact CZ2-CB 4Å; W831-A977 HydrophobicContact CZ3-CB 3.57Å; T913-A977 WeakPolarHBondContact OG1-CB 3.23Å; T913-A977 PolarHBondContact OG1-N 3.46Å; A977-D1035 HydrophobicContact CB-CB 4.35Å; A977-D1035 PolarHBondContact O-N 2.99Å; A977-W1068 HydrophobicContact CB-CH2 4.12Å; A977-W1068 HydrophobicContact CB-CZ2 4.21Å
978	T	91	Very high	72.9	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.037	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.4	-175.3	-56.7	0	0	0	0	109.3	E825 S829 W831 P976 L1032 F1033 K1034	E825-T978 HydrophobicContact CB-CG2 4.36Å; E825-T978 VanDerWaalsContact CB-O 3.31Å; E825-T978 WeakPolarHBondContact CB-O 3.25Å; E825-T978 PolarHBondContact N-O 3.32Å; S829-T978 PolarHBondContact OG-N 3.46Å; W831-T978 VanDerWaalsContact CZ2-C 3.49Å; W831-T978 WeakPolarHBondContact CZ2-O 3.12Å; W831-T978 PolarHBondContact NE1-O 3.11Å; P976-T978 PolarHBondContact O-N 2.84Å; P976-T978 PolarHBondContact O-OG1 3.44Å; T978-L1032 HydrophobicContact CG2-CB 3.86Å; T978-L1032 HydrophobicContact CG2-CD2 4.09Å; T978-L1032 HydrophobicContact CG2-CG 4.41Å; T978-F1033 CarbonylContact C-O 3.55Å; T978-F1033 WeakPolarHBondContact CA-O 3.3Å; T978-K1034 HydrophobicContact CG2-CG 4.02Å; T978-K1034 WeakPolarHBondContact OG1-CE 3.36Å
979	K	91.1	Very high	75.1	Confident	1 Å²	1	45.9 Å²	45.9	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	150.9	175.7	76.7	-179	-171.6	170.6	0	111.7	T797 C823 W831 L981 F1033 I1067 W1068	T797-K979 HydrophobicContact CG2-CD 4.24Å; T797-K979 VanDerWaalsContact OG1-CD 3.3Å; T797-K979 WeakPolarHBondContact OG1-CD 3.38Å; T797-K979 PolarHBondContact OG1-NZ 2.96Å; C823-K979 CarbonylContact O-C 3.45Å; C823-K979 WeakPolarHBondContact O-CA 3.46Å; C823-K979 WeakPolarHBondContact O-CB 3.44Å; W831-K979 HydrophobicContact CH2-CB 4.23Å; W831-K979 HydrophobicContact CZ2-CB 4Å; K979-L981 HydrophobicContact CG-CD2 4.48Å; K979-F1033 PolarHBondContact N-O 2.03Å; K979-F1033 PolarHBondContact O-N 2.03Å; K979-I1067 VanDerWaalsContact CE-O 3.32Å; K979-I1067 WeakPolarHBondContact CE-O 3.3Å; K979-I1067 PolarHBondContact NZ-O 3.43Å; K979-W1068 HydrophobicContact CB-CZ3 4.47Å; K979-W1068 HydrophobicContact CD-CE3 4.2Å; K979-W1068 HydrophobicContact CD-CZ3 4.09Å; K979-W1068 HydrophobicContact CG-CE3 4.36Å; K979-W1068 HydrophobicContact CG-CH2 4.47Å; K979-W1068 HydrophobicContact CG-CZ3 3.88Å; K979-W1068 PolarHBondContact NZ-O 3.31Å
980	I	92.3	Very high	77.2	Confident	29 Å²	29	44.6 Å²	44.6	15%	0.149	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	117.7	-178.4	-44.3	176.8	0	0	0	107.9	C823 E825 D1005 L1032	C823-I980 WeakPolarHBondContact CB-O 3.24Å; C823-I980 PolarHBondContact O-N 2.71Å; E825-I980 HydrophobicContact CB-CD1 4.35Å; E825-I980 HydrophobicContact CB-CG1 3.99Å; I980-D1005 HydrophobicContact CB-CB 3.87Å; I980-D1005 HydrophobicContact CG2-CB 3.58Å; I980-D1005 WeakPolarHBondContact O-CB 3.47Å; I980-D1005 PolarHBondContact O-N 3.26Å; I980-L1032 HydrophobicContact CG1-CD2 4.06Å
981	L	93.3	Very high	78.9	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	155.3	169.7	-58.3	177.1	0	0	0	109.7	K979 V1002 L1003 S1030 L1031 F1033 L1040 I1067	K979-L981 HydrophobicContact CG-CD2 4.48Å; L981-V1002 HydrophobicContact CD1-CG1 3.86Å; L981-V1002 HydrophobicContact CD2-CG1 4.48Å; L981-L1003 CarbonylContact C-O 3.59Å; L981-L1003 WeakPolarHBondContact CA-O 3.14Å; L981-L1003 WeakPolarHBondContact CB-O 3.34Å; L981-S1030 CarbonylContact O-C 3.52Å; L981-S1030 WeakPolarHBondContact O-CA 3.24Å; L981-L1031 HydrophobicContact CB-CB 4.49Å; L981-L1031 PolarHBondContact N-O 3.34Å; L981-L1031 PolarHBondContact O-N 2.92Å; L981-F1033 HydrophobicContact CD1-CB 3.5Å; L981-F1033 HydrophobicContact CD1-CD1 4.27Å; L981-F1033 HydrophobicContact CD1-CD2 3.86Å; L981-F1033 HydrophobicContact CD1-CG 3.64Å; L981-F1033 HydrophobicContact CG-CB 3.79Å; L981-F1033 HydrophobicContact CG-CG 4.36Å; L981-L1040 HydrophobicContact CD1-CD2 4.43Å; L981-I1067 HydrophobicContact CD1-CG2 3.56Å; L981-I1067 HydrophobicContact CD2-CG2 3.96Å; L981-I1067 HydrophobicContact CG-CG2 4.41Å
982	K	92.8	Very high	80.1	Confident	40 Å²	40	38.5 Å²	38.5	17%	0.174	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121.4	170.2	179.5	151.6	-80.2	158.5	0	109.8	L1003 D1005 L1010 P1028	K982-L1003 PolarHBondContact N-O 3.36Å; K982-L1003 WeakPolarHBondContact O-CB 3.33Å; K982-L1003 PolarHBondContact O-N 2.77Å; K982-D1005 HydrophobicContact CB-CB 4.17Å; K982-D1005 VanDerWaalsContact CE-OD1 3.28Å; K982-D1005 WeakPolarHBondContact CE-OD1 3.48Å; K982-D1005 VanDerWaalsContact CE-OD2 3.3Å; K982-D1005 WeakPolarHBondContact CE-OD2 3.06Å; K982-D1005 VanDerWaalsContact NZ-CG 3.29Å; K982-D1005 IonicContact NZ-OD1 3.88Å; K982-D1005 PolarHBondContact NZ-OD1 2.88Å; K982-D1005 IonicContact NZ-OD2 2.71Å; K982-D1005 PolarHBondContact NZ-OD2 2.74Å; K982-L1010 HydrophobicContact CD-CD2 4.31Å; K982-P1028 HydrophobicContact CD-CB 3.93Å; K982-P1028 HydrophobicContact CG-CB 3.84Å
983	L	94.9	Very high	81.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.7	178.8	-57.2	174.4	0	0	0	109.5	Y1001 V1002 P1028 K1029 L1031 L1040 V1098 Q1108 L1110	L983-Y1001 WeakPolarHBondContact CA-O 3.42Å; L983-V1002 HydrophobicContact CD2-CG2 4.21Å; L983-P1028 CarbonylContact O-C 3.56Å; L983-P1028 WeakPolarHBondContact O-CA 3.42Å; L983-K1029 PolarHBondContact N-O 2.83Å; L983-K1029 PolarHBondContact O-N 2.97Å; L983-L1031 HydrophobicContact CD1-CB 4.29Å; L983-L1031 HydrophobicContact CD1-CD2 4.3Å; L983-L1031 HydrophobicContact CG-CB 4.5Å; L983-L1040 HydrophobicContact CD2-CD2 4.3Å; L983-V1098 HydrophobicContact CD1-CB 3.83Å; L983-V1098 HydrophobicContact CD1-CG1 3.78Å; L983-V1098 HydrophobicContact CD1-CG2 4.1Å; L983-V1098 HydrophobicContact CD2-CG1 4.32Å; L983-Q1108 HydrophobicContact CD1-CB 4.03Å; L983-L1110 HydrophobicContact CB-CD1 4.38Å
984	A	94.3	Very high	81.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.9	178.2	0	0	0	0	0	110.6	F986 V1000 Y1001 L1010 L1024 P1028	A984-F986 HydrophobicContact CB-CD2 4.37Å; A984-F986 HydrophobicContact CB-CE2 3.65Å; A984-F986 HydrophobicContact CB-CZ 4.45Å; A984-V1000 CarbonylContact O-C 3.54Å; A984-V1000 WeakPolarHBondContact O-CA 3.41Å; A984-Y1001 PolarHBondContact N-O 2.92Å; A984-Y1001 PolarHBondContact O-N 2.89Å; A984-L1010 HydrophobicContact CB-CD1 4.39Å; A984-L1024 HydrophobicContact CB-CD1 4.29Å; A984-P1028 HydrophobicContact CB-CB 4.25Å; A984-P1028 HydrophobicContact CB-CG 4.45Å
985	A	94.8	Very high	82.5	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.6	-176.4	0	0	0	0	0	111.4	R999 V1000 L1024 L1025 L1110 I1112	A985-R999 CarbonylContact C-O 3.4Å; A985-R999 WeakPolarHBondContact CA-O 3.44Å; A985-V1000 HydrophobicContact CB-CG2 4.18Å; A985-L1024 WeakPolarHBondContact O-CA 3.28Å; A985-L1025 PolarHBondContact O-N 2.83Å; A985-L1110 HydrophobicContact CB-CD1 4.33Å; A985-I1112 HydrophobicContact CB-CD1 3.57Å
986	F	93.6	Very high	83	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.8	-178	-66.5	-94.9	0	0	0	111.5	A984 I998 R999 Y1001 V1013 L1014 E1017 R1023 L1024	A984-F986 HydrophobicContact CB-CD2 4.37Å; A984-F986 HydrophobicContact CB-CE2 3.65Å; A984-F986 HydrophobicContact CB-CZ 4.45Å; F986-I998 CarbonylContact O-C 3.57Å; F986-I998 WeakPolarHBondContact O-CA 3.14Å; F986-R999 PolarHBondContact N-O 2.95Å; F986-R999 PolarHBondContact O-N 2.88Å; F986-Y1001 AromaticContact CD2-CD2 3.84Å; F986-Y1001 HydrophobicContact CD2-CD2 3.84Å; F986-Y1001 HydrophobicContact CD2-CE2 4.1Å; F986-Y1001 HydrophobicContact CE2-CD2 4.31Å; F986-V1013 HydrophobicContact CD2-CG1 4.26Å; F986-V1013 HydrophobicContact CE2-CG1 3.6Å; F986-V1013 HydrophobicContact CZ-CG1 4.08Å; F986-L1014 HydrophobicContact CE1-CD2 3.93Å; F986-L1014 HydrophobicContact CZ-CD2 3.83Å; F986-E1017 VanDerWaalsContact CB-CD 3.48Å; F986-E1017 HydrophobicContact CB-CG 3.94Å; F986-E1017 WeakPolarHBondContact CB-OE1 3.49Å; F986-E1017 HydrophobicContact CD1-CB 3.74Å; F986-E1017 HydrophobicContact CD1-CG 3.7Å; F986-E1017 HydrophobicContact CD2-CG 3.93Å; F986-E1017 HydrophobicContact CE1-CB 3.95Å; F986-E1017 HydrophobicContact CE1-CG 4.12Å; F986-E1017 HydrophobicContact CE2-CG 4.32Å; F986-E1017 HydrophobicContact CG-CB 4.2Å; F986-E1017 HydrophobicContact CG-CG 3.6Å; F986-E1017 HydrophobicContact CZ-CG 4.41Å; F986-R1023 VanDerWaalsContact CA-O 3.27Å; F986-R1023 WeakPolarHBondContact CA-O 3.33Å; F986-L1024 HydrophobicContact CD1-CB 4.19Å; F986-L1024 HydrophobicContact CD1-CD1 4.45Å; F986-L1024 HydrophobicContact CD2-CD1 4.47Å; F986-L1024 HydrophobicContact CE1-CB 3.91Å; F986-L1024 HydrophobicContact CE1-CD1 3.99Å; F986-L1024 HydrophobicContact CE2-CD1 4.03Å; F986-L1024 HydrophobicContact CZ-CD1 3.76Å
987	S	90	Very high	83.2	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	155.1	163.3	-171.3	0	0	0	0	110.4	Y996 N997 G1022 R1023	S987-Y996 WeakPolarHBondContact CB-OH 3.45Å; S987-Y996 WeakPolarHBondContact OG-CE2 3.36Å; S987-N997 VanDerWaalsContact CB-O 3.31Å; S987-N997 WeakPolarHBondContact CB-O 3.24Å; S987-N997 PolarHBondContact OG-O 2.87Å; S987-G1022 WeakPolarHBondContact O-CA 3.48Å; S987-R1023 PolarHBondContact N-O 2.98Å; S987-R1023 PolarHBondContact O-N 3.41Å
988	G	84.2	Confident	83.3	Confident	17 Å²	17	34.5 Å²	34.5	18%	0.175	20%	0.201	C	C	.	.			trans	-70.7	-175.7	173.3	0	0	0	0	0	113.1	L990	G988-L990 PolarHBondContact O-N 2.84Å
989	P	77.6	Confident	83.3	Confident	57 Å²	57	36.5 Å²	36.5	37%	0.37	21%	0.207	S	C	.	.			trans	-60.4	137.4	171.6	26.5	-34.2	0	0	0	111.1	T991	P989-T991 PolarHBondContact O-N 3.31Å; P989-T991 VanDerWaalsContact O-N 3.15Å
990	L	72.1	Confident	83.5	Confident	55 Å²	55	36.5 Å²	36.5	29%	0.288	21%	0.207	S	C	.	.			trans	-70.4	109.2	174.4	176.5	64.1	0	0	0	110	G988 Y996 W1051 L1090 N1114	G988-L990 PolarHBondContact O-N 2.84Å; L990-Y996 HydrophobicContact CB-CD2 4.16Å; L990-Y996 HydrophobicContact CB-CE2 4.23Å; L990-Y996 HydrophobicContact CD1-CD2 3.6Å; L990-Y996 HydrophobicContact CD1-CE2 4.41Å; L990-Y996 HydrophobicContact CD1-CG 3.99Å; L990-Y996 HydrophobicContact CG-CD2 4.47Å; L990-W1051 HydrophobicContact CD1-CH2 3.76Å; L990-W1051 HydrophobicContact CD1-CZ2 4.29Å; L990-W1051 HydrophobicContact CD2-CZ2 4.38Å; L990-L1090 WeakPolarHBondContact CD2-O 3.22Å; L990-N1114 VanDerWaalsContact CD2-ND2 3.29Å; L990-N1114 WeakPolarHBondContact CD2-ND2 3.28Å
991	T	67.8	Low	83.6	Confident	52 Å²	52	35.3 Å²	35.3	32%	0.319	20%	0.201	S	C	.	.			trans	-100.2	142.3	172.4	59.7	0	0	0	0	110.5	P989 T993 I994	P989-T991 PolarHBondContact O-N 3.31Å; P989-T991 VanDerWaalsContact O-N 3.15Å; T991-T993 PolarHBondContact O-N 2.8Å; T991-T993 VanDerWaalsContact O-N 3.16Å; T991-I994 WeakPolarHBondContact OG1-CB 3.42Å; T991-I994 WeakPolarHBondContact OG1-CG1 3.24Å
992	P	59.5	Low	83.6	Confident	116 Å²	116	35.7 Å²	35.7	75%	0.753	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	9.1	-175.5	33.4	-37	0	0	0	114.1
993	T	58.6	Low	83.5	Confident	125 Å²	125	34.1 Å²	34.1	77%	0.767	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.9	-3.1	-172.7	49.2	0	0	0	0	113.6	T991	T991-T993 PolarHBondContact O-N 2.8Å; T991-T993 VanDerWaalsContact O-N 3.16Å
994	I	64.5	Low	83.3	Confident	109 Å²	109	36 Å²	36	56%	0.559	21%	0.208	S	C	*	.	S	Bend	trans	-134.2	150.7	-175.4	-47.8	179.3	0	0	0	108.2	T991	T991-I994 WeakPolarHBondContact OG1-CB 3.42Å; T991-I994 WeakPolarHBondContact OG1-CG1 3.24Å
995	D	72.4	Confident	83.2	Confident	40 Å²	40	37.5 Å²	37.5	21%	0.214	22%	0.216	C	C	.	.			trans	-61.1	139.9	173.2	-58.7	-70.4	0	0	0	111.7	N997 R1054 L1082	D995-N997 PolarHBondContact O-N 2.97Å; D995-N997 VanDerWaalsContact O-N 3.15Å; D995-N997 PolarHBondContact O-ND2 3.33Å; D995-R1054 IonicContact OD1-CZ 2.7Å; D995-R1054 IonicContact OD1-NE 3.3Å; D995-R1054 PolarHBondContact OD1-NE 2.77Å; D995-R1054 IonicContact OD1-NH1 3.88Å; D995-R1054 PolarHBondContact OD1-NH1 3.45Å; D995-R1054 IonicContact OD1-NH2 3.6Å; D995-R1054 PolarHBondContact OD1-NH2 2.65Å; D995-R1054 IonicContact OD2-CZ 3.22Å; D995-R1054 IonicContact OD2-NE 3.83Å; D995-R1054 IonicContact OD2-NH1 2.67Å; D995-R1054 PolarHBondContact OD2-NH1 3.4Å; D995-R1054 IonicContact OD2-NH2 2.87Å; D995-R1054 PolarHBondContact OD2-NH2 2.83Å; D995-L1082 CarbonylContact C-O 3.47Å; D995-L1082 WeakPolarHBondContact CA-O 3.36Å
996	Y	84	Confident	82.9	Confident	10 Å²	10	38 Å²	38	4%	0.039	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	102.1	176.6	-174.3	-111.9	0	0	0	109.6	S987 L990 I998 L1082 V1092	S987-Y996 WeakPolarHBondContact CB-OH 3.45Å; S987-Y996 WeakPolarHBondContact OG-CE2 3.36Å; L990-Y996 HydrophobicContact CB-CD2 4.16Å; L990-Y996 HydrophobicContact CB-CE2 4.23Å; L990-Y996 HydrophobicContact CD1-CD2 3.6Å; L990-Y996 HydrophobicContact CD1-CE2 4.41Å; L990-Y996 HydrophobicContact CD1-CG 3.99Å; L990-Y996 HydrophobicContact CG-CD2 4.47Å; Y996-I998 HydrophobicContact CD1-CD1 4.2Å; Y996-I998 HydrophobicContact CD1-CG1 4.02Å; Y996-I998 HydrophobicContact CE1-CD1 4.05Å; Y996-I998 HydrophobicContact CE1-CG1 3.74Å; Y996-L1082 HydrophobicContact CD1-CD1 4.39Å; Y996-L1082 PolarHBondContact N-O 2.81Å; Y996-L1082 PolarHBondContact O-N 3.45Å; Y996-V1092 HydrophobicContact CD1-CG1 3.66Å; Y996-V1092 HydrophobicContact CD1-CG2 4.37Å; Y996-V1092 HydrophobicContact CE1-CG1 3.57Å; Y996-V1092 HydrophobicContact CG-CG1 4.26Å
997	N	88	Confident	82.7	Confident	58 Å²	58	41.4 Å²	41.4	31%	0.31	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.4	-173.8	-69.4	-61.2	0	0	0	111.3	S987 D995 S1081	S987-N997 VanDerWaalsContact CB-O 3.31Å; S987-N997 WeakPolarHBondContact CB-O 3.24Å; S987-N997 PolarHBondContact OG-O 2.87Å; D995-N997 PolarHBondContact O-N 2.97Å; D995-N997 VanDerWaalsContact O-N 3.15Å; D995-N997 PolarHBondContact O-ND2 3.33Å; N997-S1081 WeakPolarHBondContact OD1-CA 3.38Å; N997-S1081 VanDerWaalsContact OD1-CB 3.25Å; N997-S1081 WeakPolarHBondContact OD1-CB 3.38Å; N997-S1081 PolarHBondContact OD1-OG 3.41Å
998	I	91.5	Very high	82.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.7	176.5	-58.7	153.5	0	0	0	108.8	F986 Y996 V1000 L1025 A1079 F1080 L1082 I1096 I1112	F986-I998 CarbonylContact O-C 3.57Å; F986-I998 WeakPolarHBondContact O-CA 3.14Å; Y996-I998 HydrophobicContact CD1-CD1 4.2Å; Y996-I998 HydrophobicContact CD1-CG1 4.02Å; Y996-I998 HydrophobicContact CE1-CD1 4.05Å; Y996-I998 HydrophobicContact CE1-CG1 3.74Å; I998-V1000 HydrophobicContact CG2-CG2 4.12Å; I998-L1025 HydrophobicContact CG1-CD1 4.19Å; I998-L1025 HydrophobicContact CG2-CD1 3.89Å; I998-A1079 CarbonylContact O-C 3.35Å; I998-A1079 WeakPolarHBondContact O-CA 3.4Å; I998-F1080 HydrophobicContact CB-CB 4.3Å; I998-F1080 PolarHBondContact N-O 2.86Å; I998-F1080 PolarHBondContact O-N 3.3Å; I998-L1082 HydrophobicContact CD1-CD1 3.79Å; I998-L1082 HydrophobicContact CD1-CG 4.26Å; I998-I1096 HydrophobicContact CG2-CD1 3.96Å; I998-I1112 HydrophobicContact CD1-CG2 3.87Å; I998-I1112 HydrophobicContact CG1-CG2 4.29Å; I998-I1112 HydrophobicContact CG2-CD1 4.46Å
999	R	92.3	Very high	82.8	Confident	48 Å²	48	41.8 Å²	41.8	18%	0.181	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.9	175.8	-66.5	179	-70.7	-99.2	3.6	109.5	A985 F986 Y1001 E1017	A985-R999 CarbonylContact C-O 3.4Å; A985-R999 WeakPolarHBondContact CA-O 3.44Å; F986-R999 PolarHBondContact N-O 2.95Å; F986-R999 PolarHBondContact O-N 2.88Å; R999-Y1001 HydrophobicContact CB-CD2 4.39Å; R999-Y1001 HydrophobicContact CB-CE2 3.73Å; R999-E1017 IonicContact CZ-OE1 2.97Å; R999-E1017 IonicContact CZ-OE2 2.63Å; R999-E1017 IonicContact NE-OE1 3.44Å; R999-E1017 PolarHBondContact NE-OE1 2.02Å; R999-E1017 IonicContact NE-OE2 3.63Å; R999-E1017 IonicContact NH2-OE1 2.65Å; R999-E1017 PolarHBondContact NH2-OE1 3.36Å; R999-E1017 IonicContact NH2-OE2 3.72Å; R999-E1017 PolarHBondContact NH2-OE2 2.84Å
1000	V	94.5	Very high	83.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	102.7	179.9	-175.1	0	0	0	0	109.2	A984 A985 I998 F1042 H1077 C1078 F1080 I1096 L1110	A984-V1000 CarbonylContact O-C 3.54Å; A984-V1000 WeakPolarHBondContact O-CA 3.41Å; A985-V1000 HydrophobicContact CB-CG2 4.18Å; I998-V1000 HydrophobicContact CG2-CG2 4.12Å; V1000-F1042 HydrophobicContact CB-CE1 4.48Å; V1000-F1042 HydrophobicContact CG1-CD1 4.32Å; V1000-F1042 HydrophobicContact CG1-CE1 3.9Å; V1000-H1077 CarbonylContact O-C 3.53Å; V1000-H1077 VanDerWaalsContact O-CA 3.24Å; V1000-H1077 WeakPolarHBondContact O-CA 3.16Å; V1000-H1077 WeakPolarHBondContact O-CB 3.03Å; V1000-C1078 PolarHBondContact N-O 2.89Å; V1000-C1078 PolarHBondContact O-N 3.49Å; V1000-F1080 HydrophobicContact CG2-CD2 4.35Å; V1000-F1080 HydrophobicContact CG2-CE2 4.48Å; V1000-I1096 HydrophobicContact CG2-CD1 3.68Å; V1000-L1110 HydrophobicContact CG1-CD1 3.55Å; V1000-L1110 HydrophobicContact CG2-CD1 4.49Å
1001	Y	94.2	Very high	84.2	Confident	5 Å²	5	40.8 Å²	40.8	2%	0.02	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	145.7	-177.7	-71.8	-99.4	0	0	0	112	L983 A984 F986 R999 L1003 V1013 E1017 T1075 L1076 H1077	L983-Y1001 WeakPolarHBondContact CA-O 3.42Å; A984-Y1001 PolarHBondContact N-O 2.92Å; A984-Y1001 PolarHBondContact O-N 2.89Å; F986-Y1001 AromaticContact CD2-CD2 3.84Å; F986-Y1001 HydrophobicContact CD2-CD2 3.84Å; F986-Y1001 HydrophobicContact CD2-CE2 4.1Å; F986-Y1001 HydrophobicContact CE2-CD2 4.31Å; R999-Y1001 HydrophobicContact CB-CD2 4.39Å; R999-Y1001 HydrophobicContact CB-CE2 3.73Å; Y1001-L1003 HydrophobicContact CD1-CD2 4.48Å; Y1001-V1013 HydrophobicContact CD1-CB 4.44Å; Y1001-V1013 HydrophobicContact CD1-CG1 3.8Å; Y1001-V1013 HydrophobicContact CD1-CG2 3.68Å; Y1001-V1013 HydrophobicContact CD2-CG1 3.84Å; Y1001-V1013 HydrophobicContact CE1-CG1 3.99Å; Y1001-V1013 HydrophobicContact CE1-CG2 4.07Å; Y1001-V1013 HydrophobicContact CE2-CG1 4.03Å; Y1001-V1013 HydrophobicContact CG-CG1 3.73Å; Y1001-V1013 HydrophobicContact CG-CG2 4.23Å; Y1001-E1017 HydrophobicContact CE2-CG 4.12Å; Y1001-E1017 VanDerWaalsContact CE2-OE1 3.28Å; Y1001-E1017 WeakPolarHBondContact CE2-OE1 3.33Å; Y1001-E1017 PolarHBondContact OH-OE1 3.42Å; Y1001-T1075 WeakPolarHBondContact CE1-O 3.35Å; Y1001-L1076 WeakPolarHBondContact CA-O 2.99Å; Y1001-H1077 HydrophobicContact CD1-CB 3.76Å; Y1001-H1077 HydrophobicContact CD2-CB 4.08Å; Y1001-H1077 HydrophobicContact CE1-CB 3.97Å; Y1001-H1077 AromaticContact CE1-ND1 3.88Å; Y1001-H1077 HydrophobicContact CE2-CB 4.26Å; Y1001-H1077 HydrophobicContact CG-CB 3.81Å
1002	V	93.1	Very high	85	Confident	10 Å²	10	39.3 Å²	39.3	6%	0.061	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	95.6	176.3	-173.7	0	0	0	0	108.6	L981 L983 L1040 F1042 I1062 I1067 L1076	L981-V1002 HydrophobicContact CD1-CG1 3.86Å; L981-V1002 HydrophobicContact CD2-CG1 4.48Å; L983-V1002 HydrophobicContact CD2-CG2 4.21Å; V1002-L1040 HydrophobicContact CG1-CD2 4.09Å; V1002-L1040 HydrophobicContact CG2-CD2 4.18Å; V1002-F1042 HydrophobicContact CG2-CE1 4.3Å; V1002-F1042 HydrophobicContact CG2-CE2 4.5Å; V1002-F1042 HydrophobicContact CG2-CZ 3.56Å; V1002-I1062 HydrophobicContact CG2-CD1 3.85Å; V1002-I1067 HydrophobicContact CG1-CG2 4.16Å; V1002-L1076 PolarHBondContact N-O 2.86Å
1003	L	91.3	Very high	86.4	Confident	8 Å²	8	33.8 Å²	33.8	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	156.6	-172.6	-52.8	176.9	0	0	0	110.6	L981 K982 Y1001 A1009 L1010 V1013	L981-L1003 CarbonylContact C-O 3.59Å; L981-L1003 WeakPolarHBondContact CA-O 3.14Å; L981-L1003 WeakPolarHBondContact CB-O 3.34Å; K982-L1003 PolarHBondContact N-O 3.36Å; K982-L1003 WeakPolarHBondContact O-CB 3.33Å; K982-L1003 PolarHBondContact O-N 2.77Å; Y1001-L1003 HydrophobicContact CD1-CD2 4.48Å; L1003-A1009 HydrophobicContact CB-CB 4.19Å; L1003-L1010 HydrophobicContact CD1-CD1 4.42Å; L1003-V1013 HydrophobicContact CD1-CB 4.07Å; L1003-V1013 HydrophobicContact CD1-CG2 3.76Å; L1003-V1013 HydrophobicContact CD2-CG2 3.6Å; L1003-V1013 HydrophobicContact CG-CG2 4.3Å
1004	T	90.4	Very high	87.8	Confident	38 Å²	38	31 Å²	31	23%	0.233	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	141.3	159	50.3	0	0	0	0	108.5	C823 T1006	C823-T1004 HydrophobicContact CB-CG2 4.48Å; T1004-T1006 PolarHBondContact O-N 3.47Å; T1004-T1006 PolarHBondContact OG1-OG1 2.87Å
1005	D	91.7	Very high	88.8	Confident	33 Å²	33	28.8 Å²	28.8	18%	0.176	14%	0.143	C	C	.	.	S	Bend	trans	-74.9	78.7	176.9	-157.7	-19.3	0	0	0	110.8	I980 K982 S1030	I980-D1005 HydrophobicContact CB-CB 3.87Å; I980-D1005 HydrophobicContact CG2-CB 3.58Å; I980-D1005 WeakPolarHBondContact O-CB 3.47Å; I980-D1005 PolarHBondContact O-N 3.26Å; K982-D1005 HydrophobicContact CB-CB 4.17Å; K982-D1005 VanDerWaalsContact CE-OD1 3.28Å; K982-D1005 WeakPolarHBondContact CE-OD1 3.48Å; K982-D1005 VanDerWaalsContact CE-OD2 3.3Å; K982-D1005 WeakPolarHBondContact CE-OD2 3.06Å; K982-D1005 VanDerWaalsContact NZ-CG 3.29Å; K982-D1005 IonicContact NZ-OD1 3.88Å; K982-D1005 PolarHBondContact NZ-OD1 2.88Å; K982-D1005 IonicContact NZ-OD2 2.71Å; K982-D1005 PolarHBondContact NZ-OD2 2.74Å; D1005-S1030 WeakPolarHBondContact OD2-CB 3.38Å; D1005-S1030 PolarHBondContact OD2-OG 2.98Å
1006	T	90.2	Very high	89.4	Confident	9 Å²	9	28.1 Å²	28.1	6%	0.055	14%	0.14	C	C	.	.	S	Bend	trans	-139	149.5	177.2	63.2	0	0	0	0	108.6	P821 C823 T1004 D1008 A1009	P821-T1006 HydrophobicContact CB-CG2 4.21Å; P821-T1006 HydrophobicContact CG-CG2 4.41Å; C823-T1006 HydrophobicContact CB-CG2 4.29Å; T1004-T1006 PolarHBondContact O-N 3.47Å; T1004-T1006 PolarHBondContact OG1-OG1 2.87Å; T1006-D1008 PolarHBondContact O-N 2.94Å; T1006-A1009 PolarHBondContact O-N 2.83Å; T1006-A1009 WeakPolarHBondContact OG1-CB 3.1Å
1007	K	87.6	Confident	89.6	Confident	76 Å²	76	27.7 Å²	27.7	33%	0.33	14%	0.139	S	C	.	.	H	α-helix	trans	-64.2	-42.5	-176.1	-158.3	-177	165.6	-174	0	111.9	P757 Q758 A1009 L1010 E1011	P757-K1007 PolarHBondContact O-NZ 2.91Å; Q758-K1007 WeakPolarHBondContact O-CD 3.36Å; Q758-K1007 WeakPolarHBondContact O-CE 3.36Å; Q758-K1007 WeakPolarHBondContact O-CG 3.4Å; K1007-A1009 PolarHBondContact O-N 3.32Å; K1007-L1010 PolarHBondContact O-N 2.9Å; K1007-E1011 VanDerWaalsContact CE-OE1 3.3Å; K1007-E1011 WeakPolarHBondContact CE-OE1 3.19Å; K1007-E1011 HydrophobicContact CG-CG 4.29Å; K1007-E1011 VanDerWaalsContact O-CG 3.31Å; K1007-E1011 WeakPolarHBondContact O-CG 3.43Å; K1007-E1011 PolarHBondContact O-N 3.47Å
1008	D	88.9	Confident	89.5	Confident	12 Å²	12	33.4 Å²	33.4	6%	0.064	16%	0.161	C	C	.	.	H	α-helix	trans	-54.7	-44	177	-170.6	66.1	0	0	0	114.2	S759 R784 P801 T1006 L1010 E1011 H1012	S759-D1008 VanDerWaalsContact CB-OD1 3.25Å; S759-D1008 WeakPolarHBondContact CB-OD1 3.17Å; S759-D1008 PolarHBondContact O-N 2.84Å; S759-D1008 PolarHBondContact OG-OD1 2.97Å; R784-D1008 IonicContact CZ-OD1 3.11Å; R784-D1008 IonicContact NE-OD1 3.38Å; R784-D1008 PolarHBondContact NE-OD1 2.65Å; R784-D1008 VanDerWaalsContact NE-OD1 3.12Å; R784-D1008 IonicContact NE-OD2 3.47Å; R784-D1008 PolarHBondContact NE-OD2 3.31Å; R784-D1008 IonicContact NH2-OD1 2.99Å; R784-D1008 PolarHBondContact NH2-OD1 3.44Å; P801-D1008 HydrophobicContact CG-CB 3.97Å; T1006-D1008 PolarHBondContact O-N 2.94Å; D1008-L1010 PolarHBondContact O-N 2.66Å; D1008-E1011 PolarHBondContact O-N 3.03Å; D1008-H1012 WeakPolarHBondContact O-CB 3.48Å; D1008-H1012 PolarHBondContact O-N 3.38Å
1009	A	89.4	Confident	89.1	Confident	16 Å²	16	40.9 Å²	40.9	13%	0.132	19%	0.189	C	C	.	.	H	α-helix	trans	-65.7	-38.5	-178.7	0	0	0	0	0	112.2	L1003 T1006 K1007 V1013	L1003-A1009 HydrophobicContact CB-CB 4.19Å; T1006-A1009 PolarHBondContact O-N 2.83Å; T1006-A1009 WeakPolarHBondContact OG1-CB 3.1Å; K1007-A1009 PolarHBondContact O-N 3.32Å; A1009-V1013 PolarHBondContact O-N 3.06Å
1010	L	89.7	Confident	88.7	Confident	38 Å²	38	42.9 Å²	42.9	20%	0.199	20%	0.202	C	C	.	.	H	α-helix	trans	-70.2	-45.4	176.7	-177	63.4	0	0	0	111.8	K982 A984 L1003 K1007 D1008 H1012 V1013 L1014 P1028	K982-L1010 HydrophobicContact CD-CD2 4.31Å; A984-L1010 HydrophobicContact CB-CD1 4.39Å; L1003-L1010 HydrophobicContact CD1-CD1 4.42Å; K1007-L1010 PolarHBondContact O-N 2.9Å; D1008-L1010 PolarHBondContact O-N 2.66Å; L1010-H1012 VanDerWaalsContact C-N 3.3Å; L1010-H1012 PolarHBondContact O-N 2.91Å; L1010-V1013 PolarHBondContact O-N 3.23Å; L1010-L1014 HydrophobicContact CD1-CD1 4.47Å; L1010-L1014 HydrophobicContact CD1-CG 4.46Å; L1010-L1014 HydrophobicContact CG-CD1 3.97Å; L1010-L1014 HydrophobicContact CG-CG 4.42Å; L1010-L1014 WeakPolarHBondContact O-CB 3.25Å; L1010-L1014 VanDerWaalsContact O-CG 3.31Å; L1010-L1014 WeakPolarHBondContact O-CG 3.36Å; L1010-L1014 PolarHBondContact O-N 2.77Å; L1010-P1028 HydrophobicContact CD1-CG 4.31Å
1011	E	87.7	Confident	88.1	Confident	53 Å²	53	49 Å²	49	25%	0.248	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-37.7	177.3	-64.7	-78.5	-170.4	0	0	111.7	Q758 K1007 D1008 L1014 Y1015	Q758-E1011 HydrophobicContact CB-CG 4.08Å; Q758-E1011 WeakPolarHBondContact O-CG 3.39Å; K1007-E1011 VanDerWaalsContact CE-OE1 3.3Å; K1007-E1011 WeakPolarHBondContact CE-OE1 3.19Å; K1007-E1011 HydrophobicContact CG-CG 4.29Å; K1007-E1011 VanDerWaalsContact O-CG 3.31Å; K1007-E1011 WeakPolarHBondContact O-CG 3.43Å; K1007-E1011 PolarHBondContact O-N 3.47Å; D1008-E1011 PolarHBondContact O-N 3.03Å; E1011-L1014 PolarHBondContact O-N 3.15Å; E1011-Y1015 WeakPolarHBondContact O-CB 3.38Å; E1011-Y1015 PolarHBondContact O-N 3.1Å
1012	H	85.3	Confident	87.7	Confident	21 Å²	21	49.5 Å²	49.5	10%	0.097	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-47.1	174.7	-178.5	55.8	0	0	0	112.1	D1008 L1010 Y1015 V1016 S1074	D1008-H1012 WeakPolarHBondContact O-CB 3.48Å; D1008-H1012 PolarHBondContact O-N 3.38Å; L1010-H1012 VanDerWaalsContact C-N 3.3Å; L1010-H1012 PolarHBondContact O-N 2.91Å; H1012-Y1015 PolarHBondContact O-N 2.78Å; H1012-V1016 WeakPolarHBondContact O-CG2 3.48Å; H1012-V1016 PolarHBondContact O-N 3.18Å; H1012-S1074 WeakPolarHBondContact NE2-CB 3.15Å; H1012-S1074 PolarHBondContact NE2-OG 2.84Å
1013	V	88.9	Confident	87.4	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-68.8	-37.6	176.7	171.7	0	0	0	0	112.2	F986 Y1001 L1003 A1009 L1010 Y1015 V1016 E1017	F986-V1013 HydrophobicContact CD2-CG1 4.26Å; F986-V1013 HydrophobicContact CE2-CG1 3.6Å; F986-V1013 HydrophobicContact CZ-CG1 4.08Å; Y1001-V1013 HydrophobicContact CD1-CB 4.44Å; Y1001-V1013 HydrophobicContact CD1-CG1 3.8Å; Y1001-V1013 HydrophobicContact CD1-CG2 3.68Å; Y1001-V1013 HydrophobicContact CD2-CG1 3.84Å; Y1001-V1013 HydrophobicContact CE1-CG1 3.99Å; Y1001-V1013 HydrophobicContact CE1-CG2 4.07Å; Y1001-V1013 HydrophobicContact CE2-CG1 4.03Å; Y1001-V1013 HydrophobicContact CG-CG1 3.73Å; Y1001-V1013 HydrophobicContact CG-CG2 4.23Å; L1003-V1013 HydrophobicContact CD1-CB 4.07Å; L1003-V1013 HydrophobicContact CD1-CG2 3.76Å; L1003-V1013 HydrophobicContact CD2-CG2 3.6Å; L1003-V1013 HydrophobicContact CG-CG2 4.3Å; A1009-V1013 PolarHBondContact O-N 3.06Å; L1010-V1013 PolarHBondContact O-N 3.23Å; V1013-Y1015 VanDerWaalsContact C-N 3.29Å; V1013-Y1015 PolarHBondContact O-N 3.34Å; V1013-V1016 PolarHBondContact O-N 3.01Å; V1013-E1017 HydrophobicContact CG1-CG 4.19Å; V1013-E1017 WeakPolarHBondContact O-CB 3.37Å; V1013-E1017 PolarHBondContact O-N 2.9Å
1014	L	89	Confident	87.4	Confident	67 Å²	67	57.6 Å²	57.6	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-59.7	-39.9	173.9	-74.4	168.2	0	0	0	111.7	F986 L1010 E1011 K1018	F986-L1014 HydrophobicContact CE1-CD2 3.93Å; F986-L1014 HydrophobicContact CZ-CD2 3.83Å; L1010-L1014 HydrophobicContact CD1-CD1 4.47Å; L1010-L1014 HydrophobicContact CD1-CG 4.46Å; L1010-L1014 HydrophobicContact CG-CD1 3.97Å; L1010-L1014 HydrophobicContact CG-CG 4.42Å; L1010-L1014 WeakPolarHBondContact O-CB 3.25Å; L1010-L1014 VanDerWaalsContact O-CG 3.31Å; L1010-L1014 WeakPolarHBondContact O-CG 3.36Å; L1010-L1014 PolarHBondContact O-N 2.77Å; E1011-L1014 PolarHBondContact O-N 3.15Å; L1014-K1018 VanDerWaalsContact O-CB 3.24Å; L1014-K1018 WeakPolarHBondContact O-CB 3.46Å; L1014-K1018 PolarHBondContact O-N 2.88Å
1015	Y	84	Confident	87.4	Confident	62 Å²	62	56.3 Å²	56.3	24%	0.243	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-46.2	173.5	-179.1	-75.2	0	0	0	112	P736 L737 E1011 H1012 V1013 K1018 R1019	P736-Y1015 VanDerWaalsContact C-OH 3.22Å; P736-Y1015 PolarHBondContact O-OH 2.87Å; L737-Y1015 HydrophobicContact CD2-CD1 3.7Å; L737-Y1015 HydrophobicContact CD2-CE1 3.27Å; L737-Y1015 HydrophobicContact CG-CE1 3.63Å; L737-Y1015 PolarHBondContact N-OH 3.34Å; E1011-Y1015 WeakPolarHBondContact O-CB 3.38Å; E1011-Y1015 PolarHBondContact O-N 3.1Å; H1012-Y1015 PolarHBondContact O-N 2.78Å; V1013-Y1015 VanDerWaalsContact C-N 3.29Å; V1013-Y1015 PolarHBondContact O-N 3.34Å; Y1015-K1018 PolarHBondContact O-N 2.99Å; Y1015-R1019 VanDerWaalsContact CE1-CD 3.42Å; Y1015-R1019 HydrophobicContact CE1-CG 4.31Å; Y1015-R1019 PolarHBondContact O-N 2.8Å
1016	V	85.6	Confident	87.4	Confident	27 Å²	27	55.4 Å²	55.4	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-61.4	-48.2	178.7	168.5	0	0	0	0	110.9	H1012 V1013 K1018 R1019 L1020 T1075	H1012-V1016 WeakPolarHBondContact O-CG2 3.48Å; H1012-V1016 PolarHBondContact O-N 3.18Å; V1013-V1016 PolarHBondContact O-N 3.01Å; V1016-K1018 VanDerWaalsContact C-N 3.34Å; V1016-K1018 PolarHBondContact O-N 3.16Å; V1016-R1019 WeakPolarHBondContact O-CB 3.09Å; V1016-R1019 PolarHBondContact O-N 3.48Å; V1016-R1019 VanDerWaalsContact O-N 3.08Å; V1016-L1020 HydrophobicContact CG1-CD1 4.23Å; V1016-L1020 PolarHBondContact O-N 2.74Å; V1016-T1075 HydrophobicContact CG1-CG2 4.48Å; V1016-T1075 HydrophobicContact CG2-CG2 4.3Å
1017	E	88.7	Confident	87.4	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-67.4	-33.1	179.4	-78.8	-75.1	-166.1	0	0	112.5	F986 R999 Y1001 V1013 R1019 L1020 E1021 G1022	F986-E1017 VanDerWaalsContact CB-CD 3.48Å; F986-E1017 HydrophobicContact CB-CG 3.94Å; F986-E1017 WeakPolarHBondContact CB-OE1 3.49Å; F986-E1017 HydrophobicContact CD1-CB 3.74Å; F986-E1017 HydrophobicContact CD1-CG 3.7Å; F986-E1017 HydrophobicContact CD2-CG 3.93Å; F986-E1017 HydrophobicContact CE1-CB 3.95Å; F986-E1017 HydrophobicContact CE1-CG 4.12Å; F986-E1017 HydrophobicContact CE2-CG 4.32Å; F986-E1017 HydrophobicContact CG-CB 4.2Å; F986-E1017 HydrophobicContact CG-CG 3.6Å; F986-E1017 HydrophobicContact CZ-CG 4.41Å; R999-E1017 IonicContact CZ-OE1 2.97Å; R999-E1017 IonicContact CZ-OE2 2.63Å; R999-E1017 IonicContact NE-OE1 3.44Å; R999-E1017 PolarHBondContact NE-OE1 2.02Å; R999-E1017 IonicContact NE-OE2 3.63Å; R999-E1017 IonicContact NH2-OE1 2.65Å; R999-E1017 PolarHBondContact NH2-OE1 3.36Å; R999-E1017 IonicContact NH2-OE2 3.72Å; R999-E1017 PolarHBondContact NH2-OE2 2.84Å; Y1001-E1017 HydrophobicContact CE2-CG 4.12Å; Y1001-E1017 VanDerWaalsContact CE2-OE1 3.28Å; Y1001-E1017 WeakPolarHBondContact CE2-OE1 3.33Å; Y1001-E1017 PolarHBondContact OH-OE1 3.42Å; V1013-E1017 HydrophobicContact CG1-CG 4.19Å; V1013-E1017 WeakPolarHBondContact O-CB 3.37Å; V1013-E1017 PolarHBondContact O-N 2.9Å; E1017-R1019 PolarHBondContact O-N 3.38Å; E1017-L1020 CarbonylContact O-C 3.54Å; E1017-L1020 WeakPolarHBondContact O-CA 3.48Å; E1017-L1020 PolarHBondContact O-N 2.86Å; E1017-E1021 PolarHBondContact O-N 2.98Å; E1017-G1022 WeakPolarHBondContact O-CA 3.42Å; E1017-G1022 PolarHBondContact O-N 3.21Å; E1017-G1022 WeakPolarHBondContact OE2-CA 3.37Å
1018	K	85.3	Confident	87.7	Confident	177 Å²	177	55.8 Å²	55.8	77%	0.77	26%	0.263	S	S	*	.	H	α-helix	trans	-58.9	-31.1	170.8	-174.6	178.6	178.8	-177.1	0	112.6	L1014 Y1015 V1016	L1014-K1018 VanDerWaalsContact O-CB 3.24Å; L1014-K1018 WeakPolarHBondContact O-CB 3.46Å; L1014-K1018 PolarHBondContact O-N 2.88Å; Y1015-K1018 PolarHBondContact O-N 2.99Å; V1016-K1018 VanDerWaalsContact C-N 3.34Å; V1016-K1018 PolarHBondContact O-N 3.16Å
1019	R	82.9	Confident	88	Confident	158 Å²	158	57.2 Å²	57.2	60%	0.596	27%	0.268	S	S	*	.	H	α-helix	trans	-79.5	-13.5	173	-69.9	177.1	66.4	158.6	-5.4	113.8	Y1015 V1016 E1017	Y1015-R1019 VanDerWaalsContact CE1-CD 3.42Å; Y1015-R1019 HydrophobicContact CE1-CG 4.31Å; Y1015-R1019 PolarHBondContact O-N 2.8Å; V1016-R1019 WeakPolarHBondContact O-CB 3.09Å; V1016-R1019 PolarHBondContact O-N 3.48Å; V1016-R1019 VanDerWaalsContact O-N 3.08Å; E1017-R1019 PolarHBondContact O-N 3.38Å
1020	L	83.8	Confident	88.1	Confident	89 Å²	89	58.9 Å²	58.9	47%	0.466	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	15.4	178.2	-60.3	175.5	0	0	0	113	V1016 E1017 G1022	V1016-L1020 HydrophobicContact CG1-CD1 4.23Å; V1016-L1020 PolarHBondContact O-N 2.74Å; E1017-L1020 CarbonylContact O-C 3.54Å; E1017-L1020 WeakPolarHBondContact O-CA 3.48Å; E1017-L1020 PolarHBondContact O-N 2.86Å; L1020-G1022 PolarHBondContact O-N 3.14Å
1021	E	83.1	Confident	88.2	Confident	130 Å²	130	57.2 Å²	57.2	61%	0.607	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	22.6	-166.9	-59.1	-152	153.3	0	0	114.8	E1017	E1017-E1021 PolarHBondContact O-N 2.98Å
1022	G	84.7	Confident	88.4	Confident	15 Å²	15	57.2 Å²	57.2	16%	0.155	27%	0.271	C	S	.	.			trans	-68.4	138.8	-177.3	0	0	0	0	0	112.9	S987 E1017 L1020	S987-G1022 WeakPolarHBondContact O-CA 3.48Å; E1017-G1022 WeakPolarHBondContact O-CA 3.42Å; E1017-G1022 PolarHBondContact O-N 3.21Å; E1017-G1022 WeakPolarHBondContact OE2-CA 3.37Å; L1020-G1022 PolarHBondContact O-N 3.14Å
1023	R	87.2	Confident	88.7	Confident	160 Å²	160	56.2 Å²	56.2	60%	0.604	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.9	177	-57	-177.6	-172.4	-169.9	0.7	108.9	F986 S987 L1025	F986-R1023 VanDerWaalsContact CA-O 3.27Å; F986-R1023 WeakPolarHBondContact CA-O 3.33Å; S987-R1023 PolarHBondContact N-O 2.98Å; S987-R1023 PolarHBondContact O-N 3.41Å; R1023-L1025 WeakPolarHBondContact O-CD2 3.31Å
1024	L	90.8	Very high	88.8	Confident	27 Å²	27	58 Å²	58	14%	0.141	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	136.1	172.2	-173.9	75.3	0	0	0	109.5	A984 A985 F986 D1026 P1028 F1117 L1119	A984-L1024 HydrophobicContact CB-CD1 4.29Å; A985-L1024 WeakPolarHBondContact O-CA 3.28Å; F986-L1024 HydrophobicContact CD1-CB 4.19Å; F986-L1024 HydrophobicContact CD1-CD1 4.45Å; F986-L1024 HydrophobicContact CD2-CD1 4.47Å; F986-L1024 HydrophobicContact CE1-CB 3.91Å; F986-L1024 HydrophobicContact CE1-CD1 3.99Å; F986-L1024 HydrophobicContact CE2-CD1 4.03Å; F986-L1024 HydrophobicContact CZ-CD1 3.76Å; L1024-D1026 VanDerWaalsContact CG-O 3.32Å; L1024-D1026 WeakPolarHBondContact CG-O 3.34Å; L1024-P1028 HydrophobicContact CD1-CG 4.27Å; L1024-P1028 HydrophobicContact CD2-CG 4.26Å; L1024-F1117 HydrophobicContact CD2-CD1 4.36Å; L1024-F1117 HydrophobicContact CD2-CE1 4.22Å; L1024-F1117 WeakPolarHBondContact O-CB 3.35Å; L1024-L1119 HydrophobicContact CD2-CD1 3.64Å
1025	L	90.9	Very high	88.8	Confident	12 Å²	12	55.7 Å²	55.7	6%	0.063	26%	0.263	C	S	.	.			trans	-107.7	-15.6	-170.8	-53.1	176.2	0	0	0	114	A985 I998 R1023 I1112	A985-L1025 PolarHBondContact O-N 2.83Å; I998-L1025 HydrophobicContact CG1-CD1 4.19Å; I998-L1025 HydrophobicContact CG2-CD1 3.89Å; R1023-L1025 WeakPolarHBondContact O-CD2 3.31Å; L1025-I1112 HydrophobicContact CB-CD1 4.16Å; L1025-I1112 HydrophobicContact CB-CG2 4.23Å; L1025-I1112 HydrophobicContact CD1-CD1 4.33Å; L1025-I1112 HydrophobicContact CD1-CG2 3.63Å; L1025-I1112 HydrophobicContact CG-CG2 4.48Å
1026	D	91.9	Very high	89	Confident	14 Å²	14	55.3 Å²	55.3	8%	0.075	27%	0.265	C	S	.	.	S	Bend	trans	-162	158.8	-178.3	-169.7	10.8	0	0	0	108.9	L1024 K1029 L1110 K1111	L1024-D1026 VanDerWaalsContact CG-O 3.32Å; L1024-D1026 WeakPolarHBondContact CG-O 3.34Å; D1026-K1029 IonicContact OD1-NZ 3.97Å; D1026-K1029 PolarHBondContact OD1-NZ 2.99Å; D1026-K1029 WeakPolarHBondContact OD2-CE 3.24Å; D1026-K1029 IonicContact OD2-NZ 2.71Å; D1026-K1029 PolarHBondContact OD2-NZ 2.77Å; D1026-L1110 VanDerWaalsContact OD2-CA 3.23Å; D1026-L1110 WeakPolarHBondContact OD2-CA 3.39Å; D1026-K1111 PolarHBondContact OD2-N 3.26Å
1027	D	91.2	Very high	88.9	Confident	59 Å²	59	56.2 Å²	56.2	32%	0.316	28%	0.28	S	S	.	.			trans	-62.6	137.4	178.5	-75	-49.3	0	0	0	110.9	K1029 F1117	D1027-K1029 VanDerWaalsContact O-CE 3.3Å; D1027-K1029 WeakPolarHBondContact O-CE 3.3Å; D1027-K1029 WeakPolarHBondContact O-CG 3.43Å; D1027-K1029 PolarHBondContact O-N 3.47Å; D1027-F1117 HydrophobicContact CB-CZ 4.31Å; D1027-F1117 WeakPolarHBondContact OD1-CZ 3.26Å
1028	P	93.3	Very high	88.9	Confident	34 Å²	34	56.2 Å²	56.2	22%	0.221	28%	0.28	C	S	.	.			trans	-66.6	130.1	-176.6	-21.4	34.5	0	0	0	112.6	K982 L983 A984 L1010 L1024	K982-P1028 HydrophobicContact CD-CB 3.93Å; K982-P1028 HydrophobicContact CG-CB 3.84Å; L983-P1028 CarbonylContact O-C 3.56Å; L983-P1028 WeakPolarHBondContact O-CA 3.42Å; A984-P1028 HydrophobicContact CB-CB 4.25Å; A984-P1028 HydrophobicContact CB-CG 4.45Å; L1010-P1028 HydrophobicContact CD1-CG 4.31Å; L1024-P1028 HydrophobicContact CD1-CG 4.27Å; L1024-P1028 HydrophobicContact CD2-CG 4.26Å
1029	K	94	Very high	89.1	Confident	41 Å²	41	47.9 Å²	47.9	18%	0.178	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.8	-167.3	-52.4	-165.3	-179.3	173.6	0	112.5	L983 D1026 D1027 V1109 L1110	L983-K1029 PolarHBondContact N-O 2.83Å; L983-K1029 PolarHBondContact O-N 2.97Å; D1026-K1029 IonicContact OD1-NZ 3.97Å; D1026-K1029 PolarHBondContact OD1-NZ 2.99Å; D1026-K1029 WeakPolarHBondContact OD2-CE 3.24Å; D1026-K1029 IonicContact OD2-NZ 2.71Å; D1026-K1029 PolarHBondContact OD2-NZ 2.77Å; D1027-K1029 VanDerWaalsContact O-CE 3.3Å; D1027-K1029 WeakPolarHBondContact O-CE 3.3Å; D1027-K1029 WeakPolarHBondContact O-CG 3.43Å; D1027-K1029 PolarHBondContact O-N 3.47Å; K1029-V1109 PolarHBondContact NZ-O 2.6Å; K1029-L1110 HydrophobicContact CD-CD2 4.06Å; K1029-L1110 HydrophobicContact CG-CD2 4.05Å
1030	S	92.4	Very high	89.6	Confident	51 Å²	51	40.4 Å²	40.4	36%	0.357	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	135.2	176.1	-52.9	0	0	0	0	111.1	L981 D1005 Q1108	L981-S1030 CarbonylContact O-C 3.52Å; L981-S1030 WeakPolarHBondContact O-CA 3.24Å; D1005-S1030 WeakPolarHBondContact OD2-CB 3.38Å; D1005-S1030 PolarHBondContact OD2-OG 2.98Å; S1030-Q1108 PolarHBondContact O-NE2 3.09Å
1031	L	92.5	Very high	90	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	134.3	-179.6	178.7	73.1	0	0	0	109.6	L981 L983 L1040 V1098 Q1106 Q1108	L981-L1031 HydrophobicContact CB-CB 4.49Å; L981-L1031 PolarHBondContact N-O 3.34Å; L981-L1031 PolarHBondContact O-N 2.92Å; L983-L1031 HydrophobicContact CD1-CB 4.29Å; L983-L1031 HydrophobicContact CD1-CD2 4.3Å; L983-L1031 HydrophobicContact CG-CB 4.5Å; L1031-L1040 HydrophobicContact CD2-CD1 3.42Å; L1031-L1040 VanDerWaalsContact CD2-CD1 3.42Å; L1031-L1040 HydrophobicContact CD2-CD2 4.2Å; L1031-L1040 HydrophobicContact CD2-CG 4.46Å; L1031-V1098 HydrophobicContact CD2-CG1 4.39Å; L1031-Q1106 WeakPolarHBondContact CD1-O 3.46Å; L1031-Q1108 HydrophobicContact CB-CG 4.26Å; L1031-Q1108 HydrophobicContact CD1-CB 4.36Å; L1031-Q1108 HydrophobicContact CD1-CG 3.77Å
1032	L	91.7	Very high	90.5	Very high	52 Å²	52	30.4 Å²	30.4	27%	0.272	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	121.7	172.7	-64.1	179.8	0	0	0	110.2	E825 T978 I980 V1105	E825-L1032 HydrophobicContact CB-CD2 4.2Å; E825-L1032 HydrophobicContact CG-CD2 4.2Å; T978-L1032 HydrophobicContact CG2-CB 3.86Å; T978-L1032 HydrophobicContact CG2-CD2 4.09Å; T978-L1032 HydrophobicContact CG2-CG 4.41Å; I980-L1032 HydrophobicContact CG1-CD2 4.06Å; L1032-V1105 HydrophobicContact CB-CG1 4.2Å; L1032-V1105 HydrophobicContact CD1-CG1 4.45Å
1033	F	92	Very high	90.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.2	-179.9	-169.5	-104.2	0	0	0	109.5	T978 K979 L981 L1040 F1064 I1067 W1068 Q1100	T978-F1033 CarbonylContact C-O 3.55Å; T978-F1033 WeakPolarHBondContact CA-O 3.3Å; K979-F1033 PolarHBondContact N-O 2.03Å; K979-F1033 PolarHBondContact O-N 2.03Å; L981-F1033 HydrophobicContact CD1-CB 3.5Å; L981-F1033 HydrophobicContact CD1-CD1 4.27Å; L981-F1033 HydrophobicContact CD1-CD2 3.86Å; L981-F1033 HydrophobicContact CD1-CG 3.64Å; L981-F1033 HydrophobicContact CG-CB 3.79Å; L981-F1033 HydrophobicContact CG-CG 4.36Å; F1033-L1040 HydrophobicContact CD2-CD1 4.24Å; F1033-L1040 HydrophobicContact CE2-CB 4.12Å; F1033-L1040 HydrophobicContact CE2-CD1 4.34Å; F1033-F1064 AromaticContact CE1-CD2 3.72Å; F1033-F1064 HydrophobicContact CE1-CD2 3.72Å; F1033-F1064 AromaticContact CE1-CE2 3.85Å; F1033-F1064 HydrophobicContact CE1-CE2 3.85Å; F1033-F1064 AromaticContact CZ-CD2 3.71Å; F1033-F1064 HydrophobicContact CZ-CD2 3.71Å; F1033-F1064 HydrophobicContact CZ-CE2 4.29Å; F1033-I1067 HydrophobicContact CD1-CG2 3.8Å; F1033-I1067 HydrophobicContact CD2-CG2 4.4Å; F1033-I1067 HydrophobicContact CE1-CB 3.79Å; F1033-I1067 HydrophobicContact CE1-CG2 3.52Å; F1033-I1067 HydrophobicContact CE2-CB 4.5Å; F1033-I1067 HydrophobicContact CE2-CD1 3.89Å; F1033-I1067 HydrophobicContact CE2-CG2 4.16Å; F1033-I1067 HydrophobicContact CG-CG2 4.24Å; F1033-I1067 HydrophobicContact CZ-CB 3.77Å; F1033-I1067 HydrophobicContact CZ-CD1 3.83Å; F1033-I1067 HydrophobicContact CZ-CG1 4.37Å; F1033-I1067 HydrophobicContact CZ-CG2 3.72Å; F1033-W1068 AromaticContact CD1-CE3 3.74Å; F1033-W1068 HydrophobicContact CD1-CE3 3.74Å; F1033-W1068 HydrophobicContact CD1-CZ3 4.15Å; F1033-W1068 HydrophobicContact CE1-CB 4.45Å; F1033-W1068 AromaticContact CE1-CE3 3.91Å; F1033-W1068 HydrophobicContact CE1-CE3 3.91Å; F1033-Q1100 HydrophobicContact CD2-CB 4.24Å; F1033-Q1100 VanDerWaalsContact CD2-CD 3.44Å; F1033-Q1100 HydrophobicContact CD2-CG 3.85Å; F1033-Q1100 HydrophobicContact CE2-CB 4.41Å; F1033-Q1100 HydrophobicContact CE2-CG 3.68Å
1034	K	90.9	Very high	91.1	Very high	37 Å²	37	24.5 Å²	24.5	16%	0.161	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	149.5	-170.5	-65.4	-160.2	155.4	-164.9	0	112.5	P976 T978 N1036 F1064 Q1100 V1105	P976-K1034 HydrophobicContact CG-CB 4.36Å; P976-K1034 HydrophobicContact CG-CD 4.14Å; T978-K1034 HydrophobicContact CG2-CG 4.02Å; T978-K1034 WeakPolarHBondContact OG1-CE 3.36Å; K1034-N1036 HydrophobicContact CB-CB 4.49Å; K1034-N1036 PolarHBondContact O-N 2.81Å; K1034-N1036 PolarHBondContact O-OD1 3.07Å; K1034-F1064 WeakPolarHBondContact O-CE2 3.22Å; K1034-Q1100 PolarHBondContact O-NE2 2.82Å; K1034-V1105 HydrophobicContact CD-CG2 4.2Å
1035	D	89.2	Confident	91.1	Very high	20 Å²	20	27.2 Å²	27.2	11%	0.107	16%	0.158	C	C	.	.	S	Bend	trans	-71.4	69.7	166.7	-170.4	13.4	0	0	0	110.8	H795 T913 P976 A977 F1064 W1068	H795-D1035 IonicContact CE1-OD1 3.28Å; H795-D1035 IonicContact CG-OD1 2.87Å; H795-D1035 IonicContact ND1-OD1 2.86Å; H795-D1035 PolarHBondContact ND1-OD1 3.23Å; H795-D1035 IonicContact ND1-OD2 3.66Å; T913-D1035 VanDerWaalsContact CB-OD2 3.24Å; T913-D1035 WeakPolarHBondContact CB-OD2 3.29Å; T913-D1035 WeakPolarHBondContact OG1-CB 3.48Å; T913-D1035 PolarHBondContact OG1-OD2 2.92Å; P976-D1035 HydrophobicContact CB-CB 4.26Å; P976-D1035 WeakPolarHBondContact CB-O 3.4Å; A977-D1035 HydrophobicContact CB-CB 4.35Å; A977-D1035 PolarHBondContact O-N 2.99Å; D1035-F1064 WeakPolarHBondContact OD1-CZ 3.33Å; D1035-W1068 HydrophobicContact CB-CH2 3.77Å; D1035-W1068 HydrophobicContact CB-CZ2 3.72Å; D1035-W1068 HydrophobicContact CB-CZ3 4.26Å
1036	N	86.4	Confident	91	Very high	54 Å²	54	31.6 Å²	31.6	29%	0.289	18%	0.182	S	C	.	.	S	Bend	trans	-119.9	2.1	178.5	78.3	-18.8	0	0	0	113.2	K1034 G1038 Q1100 E1101 N1102	K1034-N1036 HydrophobicContact CB-CB 4.49Å; K1034-N1036 PolarHBondContact O-N 2.81Å; K1034-N1036 PolarHBondContact O-OD1 3.07Å; N1036-G1038 PolarHBondContact O-N 2.04Å; N1036-G1038 WeakPolarHBondContact OD1-CA 3.32Å; N1036-G1038 PolarHBondContact OD1-N 3.11Å; N1036-Q1100 PolarHBondContact OD1-NE2 3.26Å; N1036-E1101 PolarHBondContact ND2-O 2.99Å; N1036-N1102 VanDerWaalsContact ND2-C 3.32Å; N1036-N1102 PolarHBondContact ND2-O 2.82Å; N1036-N1102 VanDerWaalsContact ND2-O 3.1Å
1037	G	85.1	Confident	90.9	Very high	46 Å²	46	33.6 Å²	33.6	47%	0.474	19%	0.191	S	C	.	.	S	Bend	trans	74.9	-3.8	-175.8	0	0	0	0	0	115.8	F1064	G1037-F1064 VanDerWaalsContact O-CB 3.32Å; G1037-F1064 WeakPolarHBondContact O-CB 3.46Å
1038	G	87.5	Confident	90.7	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.01	18%	0.182	C	C	.	.			trans	-81.4	131.1	179.8	0	0	0	0	0	112.6	N1036 Q1100	N1036-G1038 PolarHBondContact O-N 2.04Å; N1036-G1038 WeakPolarHBondContact OD1-CA 3.32Å; N1036-G1038 PolarHBondContact OD1-N 3.11Å; G1038-Q1100 WeakPolarHBondContact O-CG 3.43Å; G1038-Q1100 PolarHBondContact O-NE2 3.42Å
1039	G	89.8	Confident	90.3	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.021	20%	0.202	C	C	.	.			trans	-68.6	175.7	173.6	0	0	0	0	0	113.2	I1062 Q1100 E1101	G1039-I1062 WeakPolarHBondContact CA-O 3.42Å; G1039-Q1100 WeakPolarHBondContact O-CA 3.46Å; G1039-E1101 PolarHBondContact O-N 2.82Å
1040	L	92.5	Very high	89.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	114.7	179.1	-167	70.1	0	0	0	110.7	L981 L983 V1002 L1031 F1033 F1042 E1061 I1062 I1067 V1098 Y1099 Q1100	L981-L1040 HydrophobicContact CD1-CD2 4.43Å; L983-L1040 HydrophobicContact CD2-CD2 4.3Å; V1002-L1040 HydrophobicContact CG1-CD2 4.09Å; V1002-L1040 HydrophobicContact CG2-CD2 4.18Å; L1031-L1040 HydrophobicContact CD2-CD1 3.42Å; L1031-L1040 VanDerWaalsContact CD2-CD1 3.42Å; L1031-L1040 HydrophobicContact CD2-CD2 4.2Å; L1031-L1040 HydrophobicContact CD2-CG 4.46Å; F1033-L1040 HydrophobicContact CD2-CD1 4.24Å; F1033-L1040 HydrophobicContact CE2-CB 4.12Å; F1033-L1040 HydrophobicContact CE2-CD1 4.34Å; L1040-F1042 HydrophobicContact CB-CE2 4.19Å; L1040-F1042 HydrophobicContact CD2-CE2 3.98Å; L1040-F1042 HydrophobicContact CD2-CZ 3.64Å; L1040-F1042 HydrophobicContact CG-CE2 3.96Å; L1040-F1042 HydrophobicContact CG-CZ 4.1Å; L1040-F1042 WeakPolarHBondContact O-CD2 3.3Å; L1040-F1042 WeakPolarHBondContact O-CE2 3.31Å; L1040-E1061 WeakPolarHBondContact O-CA 3.3Å; L1040-I1062 PolarHBondContact N-O 3.01Å; L1040-I1062 PolarHBondContact O-N 2.81Å; L1040-I1067 HydrophobicContact CB-CD1 3.28Å; L1040-I1067 HydrophobicContact CD2-CD1 4.13Å; L1040-I1067 HydrophobicContact CG-CD1 4.33Å; L1040-V1098 HydrophobicContact CD1-CG1 3.95Å; L1040-V1098 HydrophobicContact CD2-CG1 3.83Å; L1040-V1098 HydrophobicContact CG-CG1 3.77Å; L1040-Y1099 WeakPolarHBondContact CD1-O 3.42Å; L1040-Q1100 HydrophobicContact CD1-CB 4.28Å
1041	C	93.1	Very high	89.4	Confident	9 Å²	9	31.8 Å²	31.8	6%	0.061	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	138	-177.7	-55.8	0	0	0	0	111.3	Q1060 V1098 Y1099	C1041-Q1060 CarbonylContact C-O 3.57Å; C1041-Q1060 WeakPolarHBondContact CA-O 3.4Å; C1041-V1098 WeakPolarHBondContact O-CA 3.41Å; C1041-Y1099 HydrophobicContact CB-CD1 4.29Å; C1041-Y1099 HydrophobicContact CB-CD2 4.16Å; C1041-Y1099 HydrophobicContact CB-CE1 3.79Å; C1041-Y1099 HydrophobicContact CB-CE2 3.62Å; C1041-Y1099 HydrophobicContact CB-CG 4.46Å; C1041-Y1099 VanDerWaalsContact CB-CZ 3.41Å; C1041-Y1099 PolarHBondContact N-O 2.9Å; C1041-Y1099 PolarHBondContact O-N 3.2Å; C1041-Y1099 VanDerWaalsContact O-N 3.08Å
1042	F	94	Very high	89.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	118.5	178	-59.6	-106.2	0	0	0	109.9	V1000 V1002 L1040 S1059 Q1060 I1062 C1078 F1080 I1096 K1097 V1098	V1000-F1042 HydrophobicContact CB-CE1 4.48Å; V1000-F1042 HydrophobicContact CG1-CD1 4.32Å; V1000-F1042 HydrophobicContact CG1-CE1 3.9Å; V1002-F1042 HydrophobicContact CG2-CE1 4.3Å; V1002-F1042 HydrophobicContact CG2-CE2 4.5Å; V1002-F1042 HydrophobicContact CG2-CZ 3.56Å; L1040-F1042 HydrophobicContact CB-CE2 4.19Å; L1040-F1042 HydrophobicContact CD2-CE2 3.98Å; L1040-F1042 HydrophobicContact CD2-CZ 3.64Å; L1040-F1042 HydrophobicContact CG-CE2 3.96Å; L1040-F1042 HydrophobicContact CG-CZ 4.1Å; L1040-F1042 WeakPolarHBondContact O-CD2 3.3Å; L1040-F1042 WeakPolarHBondContact O-CE2 3.31Å; F1042-S1059 CarbonylContact O-C 3.55Å; F1042-S1059 WeakPolarHBondContact O-CA 3.4Å; F1042-Q1060 PolarHBondContact N-O 2.9Å; F1042-Q1060 PolarHBondContact O-N 2.96Å; F1042-I1062 HydrophobicContact CE2-CB 4.4Å; F1042-I1062 HydrophobicContact CE2-CD1 3.84Å; F1042-I1062 HydrophobicContact CE2-CG1 3.94Å; F1042-I1062 HydrophobicContact CZ-CD1 4.07Å; F1042-C1078 HydrophobicContact CD1-CB 4.26Å; F1042-C1078 HydrophobicContact CD2-CB 4.26Å; F1042-C1078 HydrophobicContact CE1-CB 4.26Å; F1042-C1078 HydrophobicContact CE2-CB 4.27Å; F1042-C1078 HydrophobicContact CG-CB 4.28Å; F1042-C1078 HydrophobicContact CZ-CB 4.28Å; F1042-F1080 HydrophobicContact CB-CE2 4.16Å; F1042-F1080 HydrophobicContact CB-CZ 3.66Å; F1042-I1096 HydrophobicContact CD1-CG2 4.37Å; F1042-K1097 CarbonylContact C-O 3.48Å; F1042-K1097 WeakPolarHBondContact CA-O 3.32Å; F1042-V1098 HydrophobicContact CD1-CB 4.35Å; F1042-V1098 HydrophobicContact CD1-CG1 3.93Å; F1042-V1098 HydrophobicContact CD1-CG2 3.55Å; F1042-V1098 HydrophobicContact CE1-CB 4.47Å; F1042-V1098 HydrophobicContact CE1-CG1 3.7Å; F1042-V1098 HydrophobicContact CE1-CG2 3.86Å; F1042-V1098 HydrophobicContact CG-CG1 4.44Å; F1042-V1098 HydrophobicContact CG-CG2 4.41Å; F1042-V1098 HydrophobicContact CZ-CG1 4.04Å
1043	C	91.8	Very high	88.9	Confident	21 Å²	21	36.1 Å²	36.1	14%	0.142	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	136.6	177.1	-62	0	0	0	0	110	I1096 K1097	C1043-I1096 CarbonylContact O-C 3.6Å; C1043-I1096 WeakPolarHBondContact O-CA 3.27Å; C1043-K1097 HydrophobicContact CB-CB 4.4Å; C1043-K1097 PolarHBondContact N-O 2.76Å; C1043-K1097 PolarHBondContact O-N 2.91Å
1044	I	91.6	Very high	88.6	Confident	31 Å²	31	42.3 Å²	42.3	16%	0.159	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.9	173.5	-169.7	168.1	0	0	0	110.5	I1047 F1080 L1082 C1094 K1095 I1096	I1044-I1047 HydrophobicContact CD1-CD1 3.98Å; I1044-I1047 HydrophobicContact CD1-CG1 4.17Å; I1044-I1047 HydrophobicContact CG1-CD1 4.01Å; I1044-I1047 HydrophobicContact CG1-CG1 3.97Å; I1044-I1047 HydrophobicContact CG2-CD1 4.37Å; I1044-F1080 HydrophobicContact CB-CD1 4.01Å; I1044-F1080 HydrophobicContact CB-CE1 3.93Å; I1044-F1080 HydrophobicContact CD1-CD1 4.02Å; I1044-F1080 HydrophobicContact CG2-CD1 4.2Å; I1044-F1080 HydrophobicContact CG2-CE1 4.18Å; I1044-L1082 HydrophobicContact CD1-CD2 3.78Å; I1044-C1094 HydrophobicContact CD1-CB 4.22Å; I1044-C1094 HydrophobicContact CG1-CB 4.13Å; I1044-K1095 WeakPolarHBondContact CA-O 3.21Å; I1044-I1096 HydrophobicContact CG1-CG1 4.43Å
1045	E	90.7	Very high	88	Confident	83 Å²	83	43 Å²	43	39%	0.388	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	165.8	-172	-62.9	-179.4	165.7	0	0	110.1	I1047 K1095	E1045-I1047 VanDerWaalsContact C-N 3.25Å; E1045-I1047 PolarHBondContact O-N 3.47Å; E1045-I1047 VanDerWaalsContact O-N 3.07Å; E1045-K1095 HydrophobicContact CB-CB 4.34Å; E1045-K1095 PolarHBondContact N-O 2.81Å; E1045-K1095 PolarHBondContact O-N 2.87Å
1046	D	89.4	Confident	87.1	Confident	105 Å²	105	50.2 Å²	50.2	56%	0.561	27%	0.265	S	S	*	.			trans	47.1	39.4	174	-66.1	-5.1	0	0	0	115.8	S1048 K1095	D1046-S1048 PolarHBondContact O-N 2.75Å; D1046-K1095 HydrophobicContact CB-CD 4.11Å; D1046-K1095 HydrophobicContact CB-CG 4.27Å; D1046-K1095 WeakPolarHBondContact OD2-CD 3.42Å; D1046-K1095 WeakPolarHBondContact OD2-CE 3.36Å; D1046-K1095 IonicContact OD2-NZ 3.62Å; D1046-K1095 PolarHBondContact OD2-NZ 2.93Å
1047	I	89	Confident	86.6	Confident	55 Å²	55	51.7 Å²	51.7	28%	0.282	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-62.7	127.6	175.3	-55.5	177.1	0	0	0	109.5	I1044 E1045 W1051 L1082 S1093 C1094	I1044-I1047 HydrophobicContact CD1-CD1 3.98Å; I1044-I1047 HydrophobicContact CD1-CG1 4.17Å; I1044-I1047 HydrophobicContact CG1-CD1 4.01Å; I1044-I1047 HydrophobicContact CG1-CG1 3.97Å; I1044-I1047 HydrophobicContact CG2-CD1 4.37Å; E1045-I1047 VanDerWaalsContact C-N 3.25Å; E1045-I1047 PolarHBondContact O-N 3.47Å; E1045-I1047 VanDerWaalsContact O-N 3.07Å; I1047-W1051 HydrophobicContact CG2-CB 3.87Å; I1047-L1082 HydrophobicContact CD1-CD2 4.22Å; I1047-S1093 CarbonylContact C-O 3.59Å; I1047-S1093 WeakPolarHBondContact CA-O 3.43Å; I1047-C1094 HydrophobicContact CB-CB 4.49Å; I1047-C1094 HydrophobicContact CG1-CB 3.98Å
1048	S	88.2	Confident	86.2	Confident	16 Å²	16	58.9 Å²	58.9	11%	0.112	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-56.3	144.8	176.2	47.8	0	0	0	0	112.6	D1046 W1051 V1092 S1093	D1046-S1048 PolarHBondContact O-N 2.75Å; S1048-W1051 PolarHBondContact O-N 3.04Å; S1048-V1092 WeakPolarHBondContact OG-CA 3.43Å; S1048-S1093 PolarHBondContact N-O 2.78Å; S1048-S1093 PolarHBondContact OG-N 3.04Å; S1048-S1093 PolarHBondContact OG-O 2.84Å
1049	P	84.5	Confident	86.1	Confident	100 Å²	100	61 Å²	61	65%	0.649	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	154	170.9	-24.6	34.7	0	0	0	112.7	W1051 Q1089	P1049-W1051 VanDerWaalsContact C-N 3.26Å; P1049-W1051 PolarHBondContact O-N 2.87Å; P1049-Q1089 VanDerWaalsContact C-OE1 3.32Å; P1049-Q1089 PolarHBondContact O-OE1 3.33Å; P1049-Q1089 VanDerWaalsContact O-OE1 3.12Å
1050	G	82.4	Confident	86.1	Confident	14 Å²	14	63.4 Å²	63.4	14%	0.144	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	0.3	-174.3	0	0	0	0	0	115	H1084 L1085 D1086	G1050-H1084 PolarHBondContact O-CD2 2.84Å; G1050-L1085 WeakPolarHBondContact O-CA 3.36Å; G1050-L1085 PolarHBondContact O-N 3.3Å; G1050-D1086 PolarHBondContact O-N 2.71Å
1051	W	85.9	Confident	86	Confident	18 Å²	18	68.3 Å²	68.3	7%	0.068	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151.1	178.7	-66.8	88.2	0	0	0	112	L990 I1047 S1048 P1049 L1082 E1083 H1084 Q1089 N1091 V1092	L990-W1051 HydrophobicContact CD1-CH2 3.76Å; L990-W1051 HydrophobicContact CD1-CZ2 4.29Å; L990-W1051 HydrophobicContact CD2-CZ2 4.38Å; I1047-W1051 HydrophobicContact CG2-CB 3.87Å; S1048-W1051 PolarHBondContact O-N 3.04Å; P1049-W1051 VanDerWaalsContact C-N 3.26Å; P1049-W1051 PolarHBondContact O-N 2.87Å; W1051-L1082 HydrophobicContact CE3-CB 4Å; W1051-E1083 WeakPolarHBondContact CA-O 3.22Å; W1051-H1084 AromaticContact CD2-CD2 3.81Å; W1051-H1084 AromaticContact CE2-CD2 3.3Å; W1051-H1084 AromaticContact CE2-NE2 3.68Å; W1051-H1084 HydrophobicContact CE3-CB 4.18Å; W1051-H1084 HydrophobicContact CH2-CB 3.66Å; W1051-H1084 AromaticContact CH2-CD2 3.53Å; W1051-H1084 AromaticContact CH2-CG 3.57Å; W1051-H1084 HydrophobicContact CZ2-CB 4.26Å; W1051-H1084 AromaticContact CZ2-CD2 3.17Å; W1051-H1084 WeakPolarHBondContact CZ2-CD2 3.27Å; W1051-H1084 AromaticContact CZ2-CE1 3.99Å; W1051-H1084 AromaticContact CZ2-CG 3.7Å; W1051-H1084 AromaticContact CZ2-NE2 3.38Å; W1051-H1084 WeakPolarHBondContact CZ2-NE2 3.38Å; W1051-H1084 HydrophobicContact CZ3-CB 3.64Å; W1051-H1084 AromaticContact NE1-CD2 3.8Å; W1051-H1084 AromaticContact NE1-NE2 3.91Å; W1051-Q1089 PolarHBondContact NE1-O 3.45Å; W1051-N1091 PolarHBondContact NE1-O 2.84Å; W1051-N1091 VanDerWaalsContact NE1-O 3.15Å; W1051-V1092 HydrophobicContact CB-CG2 4.47Å; W1051-V1092 HydrophobicContact CD2-CB 4.01Å; W1051-V1092 HydrophobicContact CD2-CG2 3.82Å; W1051-V1092 HydrophobicContact CE3-CG2 4.34Å; W1051-V1092 HydrophobicContact CG-CB 4.23Å; W1051-V1092 HydrophobicContact CG-CG2 3.84Å; W1051-V1092 HydrophobicContact CZ2-CB 4.16Å
1052	R	86.8	Confident	85.8	Confident	123 Å²	123	68.6 Å²	68.6	46%	0.464	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	154.6	165.5	68.4	173.4	-176.6	-164.8	0.2	111.4	L1082 E1083 L1085	R1052-L1082 CarbonylContact O-C 3.56Å; R1052-L1082 VanDerWaalsContact O-CA 3.31Å; R1052-L1082 WeakPolarHBondContact O-CA 3.4Å; R1052-E1083 HydrophobicContact CG-CB 3.96Å; R1052-E1083 IonicContact CZ-OE1 2.94Å; R1052-E1083 IonicContact CZ-OE2 3.69Å; R1052-E1083 VanDerWaalsContact CZ-OE2 3.28Å; R1052-E1083 PolarHBondContact N-O 2.59Å; R1052-E1083 VanDerWaalsContact NE-CD 3.26Å; R1052-E1083 IonicContact NE-OE1 3.85Å; R1052-E1083 PolarHBondContact NE-OE1 3.2Å; R1052-E1083 IonicContact NE-OE2 3.83Å; R1052-E1083 PolarHBondContact NE-OE2 3.4Å; R1052-E1083 IonicContact NH2-OE1 3.75Å; R1052-E1083 PolarHBondContact NH2-OE1 3.12Å; R1052-E1083 IonicContact NH2-OE2 2.79Å; R1052-E1083 PolarHBondContact NH2-OE2 3.01Å; R1052-E1083 PolarHBondContact O-N 3.14Å; R1052-L1085 HydrophobicContact CB-CD1 3.91Å; R1052-L1085 HydrophobicContact CB-CG 4.42Å; R1052-L1085 HydrophobicContact CG-CD1 4.02Å; R1052-L1085 HydrophobicContact CG-CD2 4.12Å; R1052-L1085 HydrophobicContact CG-CG 4.1Å
1053	S	86.6	Confident	85.6	Confident	24 Å²	24	71 Å²	71	17%	0.168	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	146.8	163.4	-171.8	0	0	0	0	110.6	L1055	S1053-L1055 VanDerWaalsContact C-N 3.32Å; S1053-L1055 PolarHBondContact OG-N 3.32Å
1054	R	84.5	Confident	85.6	Confident	129 Å²	129	71 Å²	71	49%	0.487	36%	0.356	S	S	.	.			trans	-84.3	-1.8	170.8	-72.3	-168.8	169.3	170.7	6.6	114.2	D995 Q1056 S1081 E1083	D995-R1054 IonicContact OD1-CZ 2.7Å; D995-R1054 IonicContact OD1-NE 3.3Å; D995-R1054 PolarHBondContact OD1-NE 2.77Å; D995-R1054 IonicContact OD1-NH1 3.88Å; D995-R1054 PolarHBondContact OD1-NH1 3.45Å; D995-R1054 IonicContact OD1-NH2 3.6Å; D995-R1054 PolarHBondContact OD1-NH2 2.65Å; D995-R1054 IonicContact OD2-CZ 3.22Å; D995-R1054 IonicContact OD2-NE 3.83Å; D995-R1054 IonicContact OD2-NH1 2.67Å; D995-R1054 PolarHBondContact OD2-NH1 3.4Å; D995-R1054 IonicContact OD2-NH2 2.87Å; D995-R1054 PolarHBondContact OD2-NH2 2.83Å; R1054-Q1056 PolarHBondContact O-N 3.39Å; R1054-S1081 PolarHBondContact N-O 2.81Å; R1054-S1081 VanDerWaalsContact N-O 3.08Å; R1054-E1083 HydrophobicContact CG-CB 4.09Å; R1054-E1083 IonicContact CZ-OE2 2.81Å; R1054-E1083 IonicContact NE-OE2 2.74Å; R1054-E1083 PolarHBondContact NE-OE2 2.74Å; R1054-E1083 IonicContact NH2-OE2 3.27Å
1055	L	78.1	Confident	85.3	Confident	52 Å²	52	75.4 Å²	75.4	27%	0.272	37%	0.371	S	S	.	.			trans	-67	126.7	177.1	-79.9	157.1	0	0	0	111.7	S1053 Q1060 F1080	S1053-L1055 VanDerWaalsContact C-N 3.32Å; S1053-L1055 PolarHBondContact OG-N 3.32Å; L1055-Q1060 HydrophobicContact CD1-CG 4.14Å; L1055-Q1060 HydrophobicContact CD2-CG 3.59Å; L1055-F1080 HydrophobicContact CD1-CD1 3.31Å; L1055-F1080 HydrophobicContact CD1-CE1 3.43Å; L1055-F1080 VanDerWaalsContact CD1-CE1 3.43Å; L1055-F1080 HydrophobicContact CD1-CG 4.3Å
1056	Q	70.7	Confident	85.1	Confident	172 Å²	172	75.1 Å²	75.1	80%	0.804	37%	0.369	S	S	*	.	S	Bend	trans	-79.6	-22.7	174.4	-57.9	-176.1	17.2	0	0	112	R1054	R1054-Q1056 PolarHBondContact O-N 3.39Å
1057	T	77.4	Confident	85.1	Confident	85 Å²	85	70.4 Å²	70.4	52%	0.521	34%	0.344	S	S	.	.	S	Bend	trans	-94.2	154.1	174.1	54.5	0	0	0	0	110.9	S1059	T1057-S1059 VanDerWaalsContact CB-O 3.24Å; T1057-S1059 WeakPolarHBondContact CB-O 3.42Å; T1057-S1059 PolarHBondContact O-N 3.02Å; T1057-S1059 PolarHBondContact OG1-O 2.89Å
1058	K	76.6	Confident	85.1	Confident	196 Å²	196	67.8 Å²	67.8	85%	0.852	33%	0.331	S	S	*	.	S	Bend	trans	-72.2	-20.1	173.3	-67.2	-172	175.3	-172.7	0	113.3
1059	S	84.7	Confident	84.8	Confident	47 Å²	47	67.7 Å²	67.7	33%	0.329	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	154.3	-176.6	55.1	0	0	0	0	110.7	F1042 T1057	F1042-S1059 CarbonylContact O-C 3.55Å; F1042-S1059 WeakPolarHBondContact O-CA 3.4Å; T1057-S1059 VanDerWaalsContact CB-O 3.24Å; T1057-S1059 WeakPolarHBondContact CB-O 3.42Å; T1057-S1059 PolarHBondContact O-N 3.02Å; T1057-S1059 PolarHBondContact OG1-O 2.89Å
1060	Q	89.3	Confident	83.9	Confident	51 Å²	51	63.9 Å²	63.9	24%	0.238	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	160.4	160.2	-64	-171.1	78.9	0	0	108.9	C1041 F1042 L1055 C1078 A1079	C1041-Q1060 CarbonylContact C-O 3.57Å; C1041-Q1060 WeakPolarHBondContact CA-O 3.4Å; F1042-Q1060 PolarHBondContact N-O 2.9Å; F1042-Q1060 PolarHBondContact O-N 2.96Å; L1055-Q1060 HydrophobicContact CD1-CG 4.14Å; L1055-Q1060 HydrophobicContact CD2-CG 3.59Å; Q1060-C1078 VanDerWaalsContact CB-SG 3.58Å; Q1060-C1078 PolarHBondContact NE2-SG 3.21Å; Q1060-A1079 PolarHBondContact NE2-O 2.8Å
1061	E	90.3	Very high	82.7	Confident	103 Å²	103	64.7 Å²	64.7	48%	0.481	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	138.9	175	-167.1	-167.1	140.9	0	0	109.6	L1040	L1040-E1061 WeakPolarHBondContact O-CA 3.3Å
1062	I	89.9	Confident	81.1	Confident	15 Å²	15	68.7 Å²	68.7	8%	0.077	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.9	163.9	-61.4	176.6	0	0	0	107.5	V1002 G1039 L1040 F1042 H1066 I1067 L1076 C1078	V1002-I1062 HydrophobicContact CG2-CD1 3.85Å; G1039-I1062 WeakPolarHBondContact CA-O 3.42Å; L1040-I1062 PolarHBondContact N-O 3.01Å; L1040-I1062 PolarHBondContact O-N 2.81Å; F1042-I1062 HydrophobicContact CE2-CB 4.4Å; F1042-I1062 HydrophobicContact CE2-CD1 3.84Å; F1042-I1062 HydrophobicContact CE2-CG1 3.94Å; F1042-I1062 HydrophobicContact CZ-CD1 4.07Å; I1062-H1066 HydrophobicContact CG2-CB 4.31Å; I1062-I1067 HydrophobicContact CB-CD1 3.99Å; I1062-I1067 HydrophobicContact CB-CG1 4.28Å; I1062-I1067 HydrophobicContact CG2-CD1 3.86Å; I1062-I1067 HydrophobicContact CG2-CG1 3.58Å; I1062-I1067 WeakPolarHBondContact O-CD1 3.27Å; I1062-L1076 HydrophobicContact CD1-CD1 4.46Å; I1062-L1076 HydrophobicContact CD1-CG 4.5Å; I1062-L1076 HydrophobicContact CG2-CD1 4.14Å; I1062-L1076 HydrophobicContact CG2-CD2 4.23Å; I1062-L1076 HydrophobicContact CG2-CG 4.5Å; I1062-C1078 HydrophobicContact CD1-CB 4.1Å
1063	P	89.8	Confident	79.7	Confident	51 Å²	51	68.3 Å²	68.3	33%	0.331	33%	0.334	S	S	.	.			trans	-58.4	146.6	-175.9	-28.1	35.2	0	0	0	114.4	R1065 H1066	P1063-R1065 VanDerWaalsContact C-N 3.35Å; P1063-R1065 PolarHBondContact O-N 2.79Å; P1063-H1066 PolarHBondContact O-N 3.32Å; P1063-H1066 VanDerWaalsContact O-N 3.15Å
1064	F	90.6	Very high	78.4	Confident	20 Å²	20	69 Å²	69	9%	0.088	34%	0.339	C	S	.	.	H	α-helix	trans	-47.1	-50.9	-176.7	173.4	-99.1	0	0	0	113.6	F1033 K1034 D1035 G1037 H1066 I1067 W1068	F1033-F1064 AromaticContact CE1-CD2 3.72Å; F1033-F1064 HydrophobicContact CE1-CD2 3.72Å; F1033-F1064 AromaticContact CE1-CE2 3.85Å; F1033-F1064 HydrophobicContact CE1-CE2 3.85Å; F1033-F1064 AromaticContact CZ-CD2 3.71Å; F1033-F1064 HydrophobicContact CZ-CD2 3.71Å; F1033-F1064 HydrophobicContact CZ-CE2 4.29Å; K1034-F1064 WeakPolarHBondContact O-CE2 3.22Å; D1035-F1064 WeakPolarHBondContact OD1-CZ 3.33Å; G1037-F1064 VanDerWaalsContact O-CB 3.32Å; G1037-F1064 WeakPolarHBondContact O-CB 3.46Å; F1064-H1066 VanDerWaalsContact C-N 3.29Å; F1064-H1066 PolarHBondContact O-N 2.79Å; F1064-I1067 PolarHBondContact O-N 3.1Å; F1064-I1067 VanDerWaalsContact O-N 3.14Å; F1064-W1068 HydrophobicContact CD1-CB 4.19Å; F1064-W1068 HydrophobicContact CD2-CB 4.34Å; F1064-W1068 HydrophobicContact CE1-CB 3.73Å; F1064-W1068 AromaticContact CE1-CG 3.85Å; F1064-W1068 HydrophobicContact CE1-CG 3.85Å; F1064-W1068 HydrophobicContact CE2-CB 3.88Å; F1064-W1068 AromaticContact CE2-CD2 3.96Å; F1064-W1068 HydrophobicContact CE2-CD2 3.96Å; F1064-W1068 AromaticContact CE2-CE3 3.84Å; F1064-W1068 HydrophobicContact CE2-CE3 3.84Å; F1064-W1068 AromaticContact CE2-CG 3.97Å; F1064-W1068 HydrophobicContact CE2-CG 3.97Å; F1064-W1068 HydrophobicContact CG-CB 4.48Å; F1064-W1068 HydrophobicContact CZ-CB 3.56Å; F1064-W1068 AromaticContact CZ-CD1 3.92Å; F1064-W1068 AromaticContact CZ-CD2 3.62Å; F1064-W1068 HydrophobicContact CZ-CD2 3.62Å; F1064-W1068 AromaticContact CZ-CE3 3.99Å; F1064-W1068 HydrophobicContact CZ-CE3 3.99Å; F1064-W1068 AromaticContact CZ-CG 3.39Å; F1064-W1068 HydrophobicContact CZ-CG 3.39Å; F1064-W1068 WeakPolarHBondContact O-CB 3.35Å; F1064-W1068 PolarHBondContact O-N 2.77Å
1065	R	86.7	Confident	77.9	Confident	124 Å²	124	64 Å²	64	47%	0.468	32%	0.322	S	S	.	.	H	α-helix	trans	-58.5	-35.8	-175.1	71.1	-177.1	-175.2	-172.8	0.4	114	P1063 N1069	P1063-R1065 VanDerWaalsContact C-N 3.35Å; P1063-R1065 PolarHBondContact O-N 2.79Å; R1065-N1069 PolarHBondContact O-N 2.85Å; R1065-N1069 VanDerWaalsContact O-N 3.14Å; R1065-N1069 PolarHBondContact O-OD1 3.26Å
1066	H	85.8	Confident	78.3	Confident	77 Å²	77	62.9 Å²	62.9	36%	0.356	32%	0.317	S	S	.	.	H	α-helix	trans	-70.4	-37.4	-178.8	-58.2	147.4	0	0	0	111	I1062 P1063 F1064 Q1072	I1062-H1066 HydrophobicContact CG2-CB 4.31Å; P1063-H1066 PolarHBondContact O-N 3.32Å; P1063-H1066 VanDerWaalsContact O-N 3.15Å; F1064-H1066 VanDerWaalsContact C-N 3.29Å; F1064-H1066 PolarHBondContact O-N 2.79Å; H1066-Q1072 PolarHBondContact CD2-OE1 3.41Å
1067	I	89	Confident	79.2	Confident	7 Å²	7	58 Å²	58	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-78.5	-43.8	176.8	-53.4	176.4	0	0	0	111	K979 L981 V1002 F1033 L1040 I1062 F1064 L1076	K979-I1067 VanDerWaalsContact CE-O 3.32Å; K979-I1067 WeakPolarHBondContact CE-O 3.3Å; K979-I1067 PolarHBondContact NZ-O 3.43Å; L981-I1067 HydrophobicContact CD1-CG2 3.56Å; L981-I1067 HydrophobicContact CD2-CG2 3.96Å; L981-I1067 HydrophobicContact CG-CG2 4.41Å; V1002-I1067 HydrophobicContact CG1-CG2 4.16Å; F1033-I1067 HydrophobicContact CD1-CG2 3.8Å; F1033-I1067 HydrophobicContact CD2-CG2 4.4Å; F1033-I1067 HydrophobicContact CE1-CB 3.79Å; F1033-I1067 HydrophobicContact CE1-CG2 3.52Å; F1033-I1067 HydrophobicContact CE2-CB 4.5Å; F1033-I1067 HydrophobicContact CE2-CD1 3.89Å; F1033-I1067 HydrophobicContact CE2-CG2 4.16Å; F1033-I1067 HydrophobicContact CG-CG2 4.24Å; F1033-I1067 HydrophobicContact CZ-CB 3.77Å; F1033-I1067 HydrophobicContact CZ-CD1 3.83Å; F1033-I1067 HydrophobicContact CZ-CG1 4.37Å; F1033-I1067 HydrophobicContact CZ-CG2 3.72Å; L1040-I1067 HydrophobicContact CB-CD1 3.28Å; L1040-I1067 HydrophobicContact CD2-CD1 4.13Å; L1040-I1067 HydrophobicContact CG-CD1 4.33Å; I1062-I1067 HydrophobicContact CB-CD1 3.99Å; I1062-I1067 HydrophobicContact CB-CG1 4.28Å; I1062-I1067 HydrophobicContact CG2-CD1 3.86Å; I1062-I1067 HydrophobicContact CG2-CG1 3.58Å; I1062-I1067 WeakPolarHBondContact O-CD1 3.27Å; F1064-I1067 PolarHBondContact O-N 3.1Å; F1064-I1067 VanDerWaalsContact O-N 3.14Å; I1067-L1076 HydrophobicContact CG1-CD2 4.31Å
1068	W	89.8	Confident	79.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68.5	-53.1	-173	-167.5	-105.2	0	0	0	111.4	H795 T797 W831 A977 K979 F1033 D1035 F1064 G1070	H795-W1068 PolarHBondContact O-NE1 3.47Å; T797-W1068 WeakPolarHBondContact CA-O 3.41Å; T797-W1068 WeakPolarHBondContact CB-O 3.3Å; T797-W1068 HydrophobicContact CG2-CH2 4.35Å; T797-W1068 HydrophobicContact CG2-CZ2 3.73Å; T797-W1068 PolarHBondContact OG1-O 3.26Å; W831-W1068 AromaticContact CH2-CH2 3.65Å; W831-W1068 HydrophobicContact CH2-CH2 3.65Å; W831-W1068 AromaticContact CH2-CZ2 3.8Å; W831-W1068 HydrophobicContact CH2-CZ2 3.8Å; W831-W1068 HydrophobicContact CZ2-CH2 4.39Å; W831-W1068 HydrophobicContact CZ3-CH2 4.32Å; W831-W1068 HydrophobicContact CZ3-CZ2 4.05Å; A977-W1068 HydrophobicContact CB-CH2 4.12Å; A977-W1068 HydrophobicContact CB-CZ2 4.21Å; K979-W1068 HydrophobicContact CB-CZ3 4.47Å; K979-W1068 HydrophobicContact CD-CE3 4.2Å; K979-W1068 HydrophobicContact CD-CZ3 4.09Å; K979-W1068 HydrophobicContact CG-CE3 4.36Å; K979-W1068 HydrophobicContact CG-CH2 4.47Å; K979-W1068 HydrophobicContact CG-CZ3 3.88Å; K979-W1068 PolarHBondContact NZ-O 3.31Å; F1033-W1068 AromaticContact CD1-CE3 3.74Å; F1033-W1068 HydrophobicContact CD1-CE3 3.74Å; F1033-W1068 HydrophobicContact CD1-CZ3 4.15Å; F1033-W1068 HydrophobicContact CE1-CB 4.45Å; F1033-W1068 AromaticContact CE1-CE3 3.91Å; F1033-W1068 HydrophobicContact CE1-CE3 3.91Å; D1035-W1068 HydrophobicContact CB-CH2 3.77Å; D1035-W1068 HydrophobicContact CB-CZ2 3.72Å; D1035-W1068 HydrophobicContact CB-CZ3 4.26Å; F1064-W1068 HydrophobicContact CD1-CB 4.19Å; F1064-W1068 HydrophobicContact CD2-CB 4.34Å; F1064-W1068 HydrophobicContact CE1-CB 3.73Å; F1064-W1068 AromaticContact CE1-CG 3.85Å; F1064-W1068 HydrophobicContact CE1-CG 3.85Å; F1064-W1068 HydrophobicContact CE2-CB 3.88Å; F1064-W1068 AromaticContact CE2-CD2 3.96Å; F1064-W1068 HydrophobicContact CE2-CD2 3.96Å; F1064-W1068 AromaticContact CE2-CE3 3.84Å; F1064-W1068 HydrophobicContact CE2-CE3 3.84Å; F1064-W1068 AromaticContact CE2-CG 3.97Å; F1064-W1068 HydrophobicContact CE2-CG 3.97Å; F1064-W1068 HydrophobicContact CG-CB 4.48Å; F1064-W1068 HydrophobicContact CZ-CB 3.56Å; F1064-W1068 AromaticContact CZ-CD1 3.92Å; F1064-W1068 AromaticContact CZ-CD2 3.62Å; F1064-W1068 HydrophobicContact CZ-CD2 3.62Å; F1064-W1068 AromaticContact CZ-CE3 3.99Å; F1064-W1068 HydrophobicContact CZ-CE3 3.99Å; F1064-W1068 AromaticContact CZ-CG 3.39Å; F1064-W1068 HydrophobicContact CZ-CG 3.39Å; F1064-W1068 WeakPolarHBondContact O-CB 3.35Å; F1064-W1068 PolarHBondContact O-N 2.77Å; W1068-G1070 PolarHBondContact O-N 2.84Å
1069	N	82.1	Confident	80.4	Confident	14 Å²	14	47 Å²	47	8%	0.075	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-38.5	-172.2	-64.2	26.4	0	0	0	111.9	L792 G793 D794 Q796 L798 R1065 T1071	L792-N1069 PolarHBondContact O-ND2 3.46Å; G793-N1069 PolarHBondContact O-ND2 3.11Å; D794-N1069 PolarHBondContact O-OD1 3.39Å; Q796-N1069 WeakPolarHBondContact O-CA 3.11Å; L798-N1069 PolarHBondContact N-O 3.07Å; R1065-N1069 PolarHBondContact O-N 2.85Å; R1065-N1069 VanDerWaalsContact O-N 3.14Å; R1065-N1069 PolarHBondContact O-OD1 3.26Å; N1069-T1071 HydrophobicContact CB-CG2 4.38Å; N1069-T1071 PolarHBondContact O-N 3.02Å
1070	G	65.4	Low	80.7	Confident	19 Å²	19	44.8 Å²	44.8	20%	0.196	23%	0.232	C	C	.	.			trans	68.5	20.2	-179.7	0	0	0	0	0	113.9	R789 W1068	R789-G1070 PolarHBondContact NH1-O 3.14Å; R789-G1070 VanDerWaalsContact NH1-O 3.15Å; W1068-G1070 PolarHBondContact O-N 2.84Å
1071	T	56.2	Low	80.6	Confident	31 Å²	31	44.3 Å²	44.3	19%	0.19	23%	0.234	C	C	.	.			trans	-103.2	3.2	-176	52.4	0	0	0	0	113.7	P790 L792 N1069	P790-T1071 VanDerWaalsContact O-CG2 3.3Å; P790-T1071 WeakPolarHBondContact O-CG2 3Å; L792-T1071 HydrophobicContact CB-CG2 4.12Å; L792-T1071 HydrophobicContact CD1-CG2 3.79Å; L792-T1071 HydrophobicContact CG-CG2 3.81Å; N1069-T1071 HydrophobicContact CB-CG2 4.38Å; N1069-T1071 PolarHBondContact O-N 3.02Å
1072	Q	52.9	Low	80.5	Confident	103 Å²	103	39.4 Å²	39.4	48%	0.481	21%	0.212	S	C	.	.	S	Bend	trans	-136.3	121.7	-178.1	-68.1	175.7	-17	0	0	109	H1066	H1066-Q1072 PolarHBondContact CD2-OE1 3.41Å
1073	M	56.9	Low	80.3	Confident	114 Å²	114	40.3 Å²	40.3	56%	0.562	22%	0.216	S	C	*	.			trans	63.7	102.5	173.9	-53	176.4	75.3	0	0	115.2	D786 T1075 L1076	D786-M1073 PolarHBondContact OD2-N 3.34Å; M1073-T1075 PolarHBondContact O-N 2.86Å; M1073-L1076 PolarHBondContact O-N 3.35Å
1074	S	58.7	Low	79.9	Confident	38 Å²	38	40.4 Å²	40.4	27%	0.266	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-6.4	167.4	62.4	0	0	0	0	114.8	H1012	H1012-S1074 WeakPolarHBondContact NE2-CB 3.15Å; H1012-S1074 PolarHBondContact NE2-OG 2.84Å
1075	T	74.8	Confident	79.4	Confident	24 Å²	24	44 Å²	44	15%	0.147	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.6	22.6	-174.4	52.3	0	0	0	0	113	Y1001 V1016 M1073 H1077	Y1001-T1075 WeakPolarHBondContact CE1-O 3.35Å; V1016-T1075 HydrophobicContact CG1-CG2 4.48Å; V1016-T1075 HydrophobicContact CG2-CG2 4.3Å; M1073-T1075 PolarHBondContact O-N 2.86Å; T1075-H1077 PolarHBondContact O-N 2.86Å; T1075-H1077 PolarHBondContact O-ND1 3.49Å
1076	L	86.6	Confident	78.9	Confident	29 Å²	29	40.3 Å²	40.3	15%	0.152	22%	0.221	C	C	.	.			trans	-51.9	119.1	178.9	-178.7	62.9	0	0	0	112.1	Y1001 V1002 I1062 I1067 M1073	Y1001-L1076 WeakPolarHBondContact CA-O 2.99Å; V1002-L1076 PolarHBondContact N-O 2.86Å; I1062-L1076 HydrophobicContact CD1-CD1 4.46Å; I1062-L1076 HydrophobicContact CD1-CG 4.5Å; I1062-L1076 HydrophobicContact CG2-CD1 4.14Å; I1062-L1076 HydrophobicContact CG2-CD2 4.23Å; I1062-L1076 HydrophobicContact CG2-CG 4.5Å; I1067-L1076 HydrophobicContact CG1-CD2 4.31Å; M1073-L1076 PolarHBondContact O-N 3.35Å
1077	H	89.5	Confident	78.1	Confident	69 Å²	69	41.5 Å²	41.5	32%	0.319	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	160.7	-177.5	68.3	-83.2	0	0	0	113.1	V1000 Y1001 T1075	V1000-H1077 CarbonylContact O-C 3.53Å; V1000-H1077 VanDerWaalsContact O-CA 3.24Å; V1000-H1077 WeakPolarHBondContact O-CA 3.16Å; V1000-H1077 WeakPolarHBondContact O-CB 3.03Å; Y1001-H1077 HydrophobicContact CD1-CB 3.76Å; Y1001-H1077 HydrophobicContact CD2-CB 4.08Å; Y1001-H1077 HydrophobicContact CE1-CB 3.97Å; Y1001-H1077 AromaticContact CE1-ND1 3.88Å; Y1001-H1077 HydrophobicContact CE2-CB 4.26Å; Y1001-H1077 HydrophobicContact CG-CB 3.81Å; T1075-H1077 PolarHBondContact O-N 2.86Å; T1075-H1077 PolarHBondContact O-ND1 3.49Å
1078	C	89.4	Confident	77.3	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.034	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.1	170.2	-173.7	0	0	0	0	109.3	V1000 F1042 Q1060 I1062 F1080	V1000-C1078 PolarHBondContact N-O 2.89Å; V1000-C1078 PolarHBondContact O-N 3.49Å; F1042-C1078 HydrophobicContact CD1-CB 4.26Å; F1042-C1078 HydrophobicContact CD2-CB 4.26Å; F1042-C1078 HydrophobicContact CE1-CB 4.26Å; F1042-C1078 HydrophobicContact CE2-CB 4.27Å; F1042-C1078 HydrophobicContact CG-CB 4.28Å; F1042-C1078 HydrophobicContact CZ-CB 4.28Å; Q1060-C1078 VanDerWaalsContact CB-SG 3.58Å; Q1060-C1078 PolarHBondContact NE2-SG 3.21Å; I1062-C1078 HydrophobicContact CD1-CB 4.1Å; C1078-F1080 HydrophobicContact CB-CE2 4.23Å; C1078-F1080 WeakPolarHBondContact SG-CE2 3.42Å
1079	A	90.3	Very high	76.4	Confident	46 Å²	46	55.1 Å²	55.1	38%	0.38	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.8	-175.9	0	0	0	0	0	112.3	I998 Q1060	I998-A1079 CarbonylContact O-C 3.35Å; I998-A1079 WeakPolarHBondContact O-CA 3.4Å; Q1060-A1079 PolarHBondContact NE2-O 2.8Å
1080	F	90.5	Very high	75.8	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	108.3	-179.7	-70.8	-96.7	0	0	0	110.5	I998 V1000 F1042 I1044 L1055 C1078 I1096	I998-F1080 HydrophobicContact CB-CB 4.3Å; I998-F1080 PolarHBondContact N-O 2.86Å; I998-F1080 PolarHBondContact O-N 3.3Å; V1000-F1080 HydrophobicContact CG2-CD2 4.35Å; V1000-F1080 HydrophobicContact CG2-CE2 4.48Å; F1042-F1080 HydrophobicContact CB-CE2 4.16Å; F1042-F1080 HydrophobicContact CB-CZ 3.66Å; I1044-F1080 HydrophobicContact CB-CD1 4.01Å; I1044-F1080 HydrophobicContact CB-CE1 3.93Å; I1044-F1080 HydrophobicContact CD1-CD1 4.02Å; I1044-F1080 HydrophobicContact CG2-CD1 4.2Å; I1044-F1080 HydrophobicContact CG2-CE1 4.18Å; L1055-F1080 HydrophobicContact CD1-CD1 3.31Å; L1055-F1080 HydrophobicContact CD1-CE1 3.43Å; L1055-F1080 VanDerWaalsContact CD1-CE1 3.43Å; L1055-F1080 HydrophobicContact CD1-CG 4.3Å; C1078-F1080 HydrophobicContact CB-CE2 4.23Å; C1078-F1080 WeakPolarHBondContact SG-CE2 3.42Å; F1080-I1096 HydrophobicContact CD2-CD1 3.98Å; F1080-I1096 HydrophobicContact CE2-CD1 4.32Å; F1080-I1096 HydrophobicContact CE2-CG2 4.2Å; F1080-I1096 HydrophobicContact CG-CD1 4.27Å; F1080-I1096 HydrophobicContact CZ-CG2 4.27Å
1081	S	88.2	Confident	76.5	Confident	40 Å²	40	63.6 Å²	63.6	28%	0.28	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	122.8	172.8	-51.7	0	0	0	0	111.1	N997 R1054	N997-S1081 WeakPolarHBondContact OD1-CA 3.38Å; N997-S1081 VanDerWaalsContact OD1-CB 3.25Å; N997-S1081 WeakPolarHBondContact OD1-CB 3.38Å; N997-S1081 PolarHBondContact OD1-OG 3.41Å; R1054-S1081 PolarHBondContact N-O 2.81Å; R1054-S1081 VanDerWaalsContact N-O 3.08Å
1082	L	87.9	Confident	77.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.6	171.4	-61.8	-174.3	0	0	0	110.8	D995 Y996 I998 I1044 I1047 W1051 R1052 V1092	D995-L1082 CarbonylContact C-O 3.47Å; D995-L1082 WeakPolarHBondContact CA-O 3.36Å; Y996-L1082 HydrophobicContact CD1-CD1 4.39Å; Y996-L1082 PolarHBondContact N-O 2.81Å; Y996-L1082 PolarHBondContact O-N 3.45Å; I998-L1082 HydrophobicContact CD1-CD1 3.79Å; I998-L1082 HydrophobicContact CD1-CG 4.26Å; I1044-L1082 HydrophobicContact CD1-CD2 3.78Å; I1047-L1082 HydrophobicContact CD1-CD2 4.22Å; W1051-L1082 HydrophobicContact CE3-CB 4Å; R1052-L1082 CarbonylContact O-C 3.56Å; R1052-L1082 VanDerWaalsContact O-CA 3.31Å; R1052-L1082 WeakPolarHBondContact O-CA 3.4Å; L1082-V1092 HydrophobicContact CD1-CG2 3.63Å
1083	E	84.3	Confident	79.6	Confident	35 Å²	35	59.7 Å²	59.7	16%	0.164	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	137	-179	-178.7	-176.9	159.3	0	0	110.6	W1051 R1052 R1054	W1051-E1083 WeakPolarHBondContact CA-O 3.22Å; R1052-E1083 HydrophobicContact CG-CB 3.96Å; R1052-E1083 IonicContact CZ-OE1 2.94Å; R1052-E1083 IonicContact CZ-OE2 3.69Å; R1052-E1083 VanDerWaalsContact CZ-OE2 3.28Å; R1052-E1083 PolarHBondContact N-O 2.59Å; R1052-E1083 VanDerWaalsContact NE-CD 3.26Å; R1052-E1083 IonicContact NE-OE1 3.85Å; R1052-E1083 PolarHBondContact NE-OE1 3.2Å; R1052-E1083 IonicContact NE-OE2 3.83Å; R1052-E1083 PolarHBondContact NE-OE2 3.4Å; R1052-E1083 IonicContact NH2-OE1 3.75Å; R1052-E1083 PolarHBondContact NH2-OE1 3.12Å; R1052-E1083 IonicContact NH2-OE2 2.79Å; R1052-E1083 PolarHBondContact NH2-OE2 3.01Å; R1052-E1083 PolarHBondContact O-N 3.14Å; R1054-E1083 HydrophobicContact CG-CB 4.09Å; R1054-E1083 IonicContact CZ-OE2 2.81Å; R1054-E1083 IonicContact NE-OE2 2.74Å; R1054-E1083 PolarHBondContact NE-OE2 2.74Å; R1054-E1083 IonicContact NH2-OE2 3.27Å
1084	H	81.4	Confident	81.3	Confident	53 Å²	53	54.5 Å²	54.5	25%	0.245	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.1	-177.4	-157.9	-163.9	0	0	0	111.2	G1050 W1051 D1086 Q1089	G1050-H1084 PolarHBondContact O-CD2 2.84Å; W1051-H1084 AromaticContact CD2-CD2 3.81Å; W1051-H1084 AromaticContact CE2-CD2 3.3Å; W1051-H1084 AromaticContact CE2-NE2 3.68Å; W1051-H1084 HydrophobicContact CE3-CB 4.18Å; W1051-H1084 HydrophobicContact CH2-CB 3.66Å; W1051-H1084 AromaticContact CH2-CD2 3.53Å; W1051-H1084 AromaticContact CH2-CG 3.57Å; W1051-H1084 HydrophobicContact CZ2-CB 4.26Å; W1051-H1084 AromaticContact CZ2-CD2 3.17Å; W1051-H1084 WeakPolarHBondContact CZ2-CD2 3.27Å; W1051-H1084 AromaticContact CZ2-CE1 3.99Å; W1051-H1084 AromaticContact CZ2-CG 3.7Å; W1051-H1084 AromaticContact CZ2-NE2 3.38Å; W1051-H1084 WeakPolarHBondContact CZ2-NE2 3.38Å; W1051-H1084 HydrophobicContact CZ3-CB 3.64Å; W1051-H1084 AromaticContact NE1-CD2 3.8Å; W1051-H1084 AromaticContact NE1-NE2 3.91Å; H1084-D1086 PolarHBondContact CE1-O 3.32Å; H1084-D1086 PolarHBondContact NE2-O 3.01Å; H1084-Q1089 PolarHBondContact NE2-O 2.91Å
1085	L	81.4	Confident	82.9	Confident	96 Å²	96	56.5 Å²	56.5	50%	0.503	29%	0.294	S	S	.	.	S	Bend	trans	-102.6	-26.3	-179.4	-62.7	-179	0	0	0	113.6	G1050 R1052	G1050-L1085 WeakPolarHBondContact O-CA 3.36Å; G1050-L1085 PolarHBondContact O-N 3.3Å; R1052-L1085 HydrophobicContact CB-CD1 3.91Å; R1052-L1085 HydrophobicContact CB-CG 4.42Å; R1052-L1085 HydrophobicContact CG-CD1 4.02Å; R1052-L1085 HydrophobicContact CG-CD2 4.12Å; R1052-L1085 HydrophobicContact CG-CG 4.1Å
1086	D	76.2	Confident	83.9	Confident	46 Å²	46	55.4 Å²	55.4	25%	0.246	29%	0.287	C	S	.	.			trans	-130.7	103.5	176.5	-178.9	3.3	0	0	0	110.9	G1050 H1084 R1088 Q1089	G1050-D1086 PolarHBondContact O-N 2.71Å; H1084-D1086 PolarHBondContact CE1-O 3.32Å; H1084-D1086 PolarHBondContact NE2-O 3.01Å; D1086-R1088 PolarHBondContact O-N 3.39Å; D1086-R1088 VanDerWaalsContact OD1-CB 3.26Å; D1086-R1088 WeakPolarHBondContact OD1-CB 3Å; D1086-R1088 WeakPolarHBondContact OD1-CG 3.13Å; D1086-R1088 PolarHBondContact OD1-N 3.04Å; D1086-Q1089 HydrophobicContact CB-CB 4.49Å; D1086-Q1089 HydrophobicContact CB-CG 4.31Å; D1086-Q1089 PolarHBondContact O-N 2.91Å; D1086-Q1089 PolarHBondContact OD2-NE2 3.44Å
1087	P	68.8	Low	84.2	Confident	102 Å²	102	56 Å²	56	66%	0.662	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-12.9	177	-29.8	37.2	0	0	0	116
1088	R	71.4	Confident	84.4	Confident	222 Å²	222	52.7 Å²	52.7	84%	0.838	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.1	174.9	-58.1	170.2	177	177	0.3	113.1	D1086 L1090	D1086-R1088 PolarHBondContact O-N 3.39Å; D1086-R1088 VanDerWaalsContact OD1-CB 3.26Å; D1086-R1088 WeakPolarHBondContact OD1-CB 3Å; D1086-R1088 WeakPolarHBondContact OD1-CG 3.13Å; D1086-R1088 PolarHBondContact OD1-N 3.04Å; R1088-L1090 PolarHBondContact O-N 3.04Å
1089	Q	72.1	Confident	84.6	Confident	71 Å²	71	56.3 Å²	56.3	33%	0.332	29%	0.286	S	S	.	.			trans	-103.7	79.6	-172.9	-64.9	-173.8	71.3	0	0	110.2	P1049 W1051 H1084 D1086 N1091	P1049-Q1089 VanDerWaalsContact C-OE1 3.32Å; P1049-Q1089 PolarHBondContact O-OE1 3.33Å; P1049-Q1089 VanDerWaalsContact O-OE1 3.12Å; W1051-Q1089 PolarHBondContact NE1-O 3.45Å; H1084-Q1089 PolarHBondContact NE2-O 2.91Å; D1086-Q1089 HydrophobicContact CB-CB 4.49Å; D1086-Q1089 HydrophobicContact CB-CG 4.31Å; D1086-Q1089 PolarHBondContact O-N 2.91Å; D1086-Q1089 PolarHBondContact OD2-NE2 3.44Å; Q1089-N1091 VanDerWaalsContact C-N 3.32Å; Q1089-N1091 PolarHBondContact O-N 3.22Å
1090	L	70	Confident	84.7	Confident	111 Å²	111	54.4 Å²	54.4	58%	0.581	27%	0.269	S	S	*	.			trans	-76	-14.6	-176.3	-61.7	175	0	0	0	114.3	L990 R1088 N1114	L990-L1090 WeakPolarHBondContact CD2-O 3.22Å; R1088-L1090 PolarHBondContact O-N 3.04Å; L1090-N1114 PolarHBondContact O-ND2 2.83Å
1091	N	79.1	Confident	84.6	Confident	99 Å²	99	58.5 Å²	58.5	53%	0.529	29%	0.289	S	S	.	.			trans	-86.3	134.6	172.2	-68.5	-8.6	0	0	0	108.8	W1051 Q1089 N1114	W1051-N1091 PolarHBondContact NE1-O 2.84Å; W1051-N1091 VanDerWaalsContact NE1-O 3.15Å; Q1089-N1091 VanDerWaalsContact C-N 3.32Å; Q1089-N1091 PolarHBondContact O-N 3.22Å; N1091-N1114 WeakPolarHBondContact CA-OD1 3.45Å
1092	V	84.3	Confident	84	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.012	31%	0.307	C	S	.	.			trans	-122.5	133.6	168.7	60	0	0	0	0	109.2	Y996 S1048 W1051 L1082 S1113 N1114	Y996-V1092 HydrophobicContact CD1-CG1 3.66Å; Y996-V1092 HydrophobicContact CD1-CG2 4.37Å; Y996-V1092 HydrophobicContact CE1-CG1 3.57Å; Y996-V1092 HydrophobicContact CG-CG1 4.26Å; S1048-V1092 WeakPolarHBondContact OG-CA 3.43Å; W1051-V1092 HydrophobicContact CB-CG2 4.47Å; W1051-V1092 HydrophobicContact CD2-CB 4.01Å; W1051-V1092 HydrophobicContact CD2-CG2 3.82Å; W1051-V1092 HydrophobicContact CE3-CG2 4.34Å; W1051-V1092 HydrophobicContact CG-CB 4.23Å; W1051-V1092 HydrophobicContact CG-CG2 3.84Å; W1051-V1092 HydrophobicContact CZ2-CB 4.16Å; L1082-V1092 HydrophobicContact CD1-CG2 3.63Å; V1092-S1113 WeakPolarHBondContact O-CA 3.42Å; V1092-N1114 HydrophobicContact CG1-CB 3.65Å; V1092-N1114 PolarHBondContact N-OD1 2.88Å; V1092-N1114 PolarHBondContact O-N 3.17Å; V1092-N1114 VanDerWaalsContact O-N 3.11Å; V1092-N1114 PolarHBondContact O-OD1 3.11Å
1093	S	90.1	Very high	83.3	Confident	51 Å²	51	63.9 Å²	63.9	36%	0.357	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	143.8	172.1	63.6	0	0	0	0	110.6	I1047 S1048 I1112	I1047-S1093 CarbonylContact C-O 3.59Å; I1047-S1093 WeakPolarHBondContact CA-O 3.43Å; S1048-S1093 PolarHBondContact N-O 2.78Å; S1048-S1093 PolarHBondContact OG-N 3.04Å; S1048-S1093 PolarHBondContact OG-O 2.84Å; S1093-I1112 WeakPolarHBondContact CA-O 3.4Å; S1093-I1112 WeakPolarHBondContact CB-O 3.13Å
1094	C	91.8	Very high	82.3	Confident	5 Å²	5	72 Å²	72	3%	0.034	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	171.9	170.7	64	0	0	0	0	110.1	I1044 I1047 I1112	I1044-C1094 HydrophobicContact CD1-CB 4.22Å; I1044-C1094 HydrophobicContact CG1-CB 4.13Å; I1047-C1094 HydrophobicContact CB-CB 4.49Å; I1047-C1094 HydrophobicContact CG1-CB 3.98Å; C1094-I1112 PolarHBondContact N-O 2.77Å; C1094-I1112 VanDerWaalsContact N-O 3.09Å; C1094-I1112 PolarHBondContact O-N 2.94Å
1095	K	93.9	Very high	81.4	Confident	80 Å²	80	71.5 Å²	71.5	35%	0.348	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137	167	-67.1	173.7	-172.3	165.4	0	108.9	I1044 E1045 D1046 V1109 L1110	I1044-K1095 WeakPolarHBondContact CA-O 3.21Å; E1045-K1095 HydrophobicContact CB-CB 4.34Å; E1045-K1095 PolarHBondContact N-O 2.81Å; E1045-K1095 PolarHBondContact O-N 2.87Å; D1046-K1095 HydrophobicContact CB-CD 4.11Å; D1046-K1095 HydrophobicContact CB-CG 4.27Å; D1046-K1095 WeakPolarHBondContact OD2-CD 3.42Å; D1046-K1095 WeakPolarHBondContact OD2-CE 3.36Å; D1046-K1095 IonicContact OD2-NZ 3.62Å; D1046-K1095 PolarHBondContact OD2-NZ 2.93Å; K1095-V1109 HydrophobicContact CB-CG1 3.97Å; K1095-V1109 HydrophobicContact CD-CG1 4.22Å; K1095-V1109 HydrophobicContact CG-CG1 4.19Å; K1095-L1110 CarbonylContact C-O 3.58Å; K1095-L1110 VanDerWaalsContact CA-O 3.28Å; K1095-L1110 WeakPolarHBondContact CA-O 3.23Å
1096	I	93.9	Very high	81	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	107.9	168.8	-57.5	176.7	0	0	0	107.1	I998 V1000 F1042 C1043 I1044 F1080 V1098 L1110 I1112	I998-I1096 HydrophobicContact CG2-CD1 3.96Å; V1000-I1096 HydrophobicContact CG2-CD1 3.68Å; F1042-I1096 HydrophobicContact CD1-CG2 4.37Å; C1043-I1096 CarbonylContact O-C 3.6Å; C1043-I1096 WeakPolarHBondContact O-CA 3.27Å; I1044-I1096 HydrophobicContact CG1-CG1 4.43Å; F1080-I1096 HydrophobicContact CD2-CD1 3.98Å; F1080-I1096 HydrophobicContact CE2-CD1 4.32Å; F1080-I1096 HydrophobicContact CE2-CG2 4.2Å; F1080-I1096 HydrophobicContact CG-CD1 4.27Å; F1080-I1096 HydrophobicContact CZ-CG2 4.27Å; I1096-V1098 HydrophobicContact CG2-CG2 4.13Å; I1096-L1110 HydrophobicContact CB-CB 4.3Å; I1096-L1110 PolarHBondContact N-O 2.89Å; I1096-L1110 PolarHBondContact O-N 3.22Å; I1096-I1112 HydrophobicContact CD1-CD1 4.31Å; I1096-I1112 HydrophobicContact CD1-CG1 3.91Å; I1096-I1112 HydrophobicContact CG1-CG1 4.04Å
1097	K	93.5	Very high	81.5	Confident	42 Å²	42	75 Å²	75	18%	0.183	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.5	178.6	172.2	168.6	175.3	148.7	0	109.2	F1042 C1043 Y1099 E1107 Q1108 V1109	F1042-K1097 CarbonylContact C-O 3.48Å; F1042-K1097 WeakPolarHBondContact CA-O 3.32Å; C1043-K1097 HydrophobicContact CB-CB 4.4Å; C1043-K1097 PolarHBondContact N-O 2.76Å; C1043-K1097 PolarHBondContact O-N 2.91Å; K1097-Y1099 HydrophobicContact CG-CD1 4.45Å; K1097-E1107 VanDerWaalsContact CE-CD 3.45Å; K1097-E1107 VanDerWaalsContact CE-OE1 3.31Å; K1097-E1107 WeakPolarHBondContact CE-OE1 3.39Å; K1097-E1107 VanDerWaalsContact CE-OE2 3.28Å; K1097-E1107 WeakPolarHBondContact CE-OE2 3.24Å; K1097-E1107 IonicContact NZ-OE1 3.62Å; K1097-E1107 PolarHBondContact NZ-OE1 3.19Å; K1097-E1107 IonicContact NZ-OE2 2.69Å; K1097-E1107 PolarHBondContact NZ-OE2 3Å; K1097-Q1108 WeakPolarHBondContact CA-O 3.48Å; K1097-V1109 HydrophobicContact CB-CG2 4.39Å; K1097-V1109 HydrophobicContact CG-CG2 4.41Å
1098	V	94.6	Very high	82.7	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.4	-172.5	-169.9	0	0	0	0	109.6	L983 L1031 L1040 C1041 F1042 I1096 Q1108 L1110	L983-V1098 HydrophobicContact CD1-CB 3.83Å; L983-V1098 HydrophobicContact CD1-CG1 3.78Å; L983-V1098 HydrophobicContact CD1-CG2 4.1Å; L983-V1098 HydrophobicContact CD2-CG1 4.32Å; L1031-V1098 HydrophobicContact CD2-CG1 4.39Å; L1040-V1098 HydrophobicContact CD1-CG1 3.95Å; L1040-V1098 HydrophobicContact CD2-CG1 3.83Å; L1040-V1098 HydrophobicContact CG-CG1 3.77Å; C1041-V1098 WeakPolarHBondContact O-CA 3.41Å; F1042-V1098 HydrophobicContact CD1-CB 4.35Å; F1042-V1098 HydrophobicContact CD1-CG1 3.93Å; F1042-V1098 HydrophobicContact CD1-CG2 3.55Å; F1042-V1098 HydrophobicContact CE1-CB 4.47Å; F1042-V1098 HydrophobicContact CE1-CG1 3.7Å; F1042-V1098 HydrophobicContact CE1-CG2 3.86Å; F1042-V1098 HydrophobicContact CG-CG1 4.44Å; F1042-V1098 HydrophobicContact CG-CG2 4.41Å; F1042-V1098 HydrophobicContact CZ-CG1 4.04Å; I1096-V1098 HydrophobicContact CG2-CG2 4.13Å; V1098-Q1108 PolarHBondContact N-O 3.13Å; V1098-Q1108 PolarHBondContact O-N 2.93Å; V1098-L1110 HydrophobicContact CG2-CD1 4.35Å
1099	Y	93.1	Very high	83.7	Confident	80 Å²	80	63.2 Å²	63.2	31%	0.314	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	155	-179.4	65.5	-89.6	0	0	0	111.2	L1040 C1041 K1097	L1040-Y1099 WeakPolarHBondContact CD1-O 3.42Å; C1041-Y1099 HydrophobicContact CB-CD1 4.29Å; C1041-Y1099 HydrophobicContact CB-CD2 4.16Å; C1041-Y1099 HydrophobicContact CB-CE1 3.79Å; C1041-Y1099 HydrophobicContact CB-CE2 3.62Å; C1041-Y1099 HydrophobicContact CB-CG 4.46Å; C1041-Y1099 VanDerWaalsContact CB-CZ 3.41Å; C1041-Y1099 PolarHBondContact N-O 2.9Å; C1041-Y1099 PolarHBondContact O-N 3.2Å; C1041-Y1099 VanDerWaalsContact O-N 3.08Å; K1097-Y1099 HydrophobicContact CG-CD1 4.45Å
1100	Q	92.7	Very high	84.7	Confident	6 Å²	6	59.9 Å²	59.9	3%	0.028	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	137.1	175.6	-170.2	-180	19	0	0	110.9	F1033 K1034 N1036 G1038 G1039 L1040 S1103	F1033-Q1100 HydrophobicContact CD2-CB 4.24Å; F1033-Q1100 VanDerWaalsContact CD2-CD 3.44Å; F1033-Q1100 HydrophobicContact CD2-CG 3.85Å; F1033-Q1100 HydrophobicContact CE2-CB 4.41Å; F1033-Q1100 HydrophobicContact CE2-CG 3.68Å; K1034-Q1100 PolarHBondContact O-NE2 2.82Å; N1036-Q1100 PolarHBondContact OD1-NE2 3.26Å; G1038-Q1100 WeakPolarHBondContact O-CG 3.43Å; G1038-Q1100 PolarHBondContact O-NE2 3.42Å; G1039-Q1100 WeakPolarHBondContact O-CA 3.46Å; L1040-Q1100 HydrophobicContact CD1-CB 4.28Å; Q1100-S1103 WeakPolarHBondContact O-CB 3.44Å
1101	E	87.1	Confident	85.8	Confident	88 Å²	88	61.3 Å²	61.3	41%	0.411	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	152	173.6	-147.8	-155.1	-156.1	0	0	111.4	N1036 G1039 S1103	N1036-E1101 PolarHBondContact ND2-O 2.99Å; G1039-E1101 PolarHBondContact O-N 2.82Å; E1101-S1103 PolarHBondContact O-N 3.37Å
1102	N	77	Confident	86.4	Confident	124 Å²	124	56.8 Å²	56.8	66%	0.663	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	23.9	180	-53.4	-56.8	0	0	0	114.4	N1036	N1036-N1102 VanDerWaalsContact ND2-C 3.32Å; N1036-N1102 PolarHBondContact ND2-O 2.82Å; N1036-N1102 VanDerWaalsContact ND2-O 3.1Å
1103	S	73	Confident	86.3	Confident	29 Å²	29	58.4 Å²	58.4	20%	0.203	29%	0.289	C	S	.	.			trans	-121	131	179.7	-164.4	0	0	0	0	110.7	Q1100 E1101 V1105	Q1100-S1103 WeakPolarHBondContact O-CB 3.44Å; E1101-S1103 PolarHBondContact O-N 3.37Å; S1103-V1105 PolarHBondContact O-N 3.3Å; S1103-V1105 WeakPolarHBondContact OG-CB 3.48Å; S1103-V1105 WeakPolarHBondContact OG-CG2 3.27Å; S1103-V1105 PolarHBondContact OG-N 3.17Å
1104	Q	63	Low	85.7	Confident	206 Å²	206	58 Å²	58	96%	0.963	28%	0.283	S	S	*	.			trans	-82.3	7.8	169.3	-68.9	-79	-43.1	0	0	111.7
1105	V	62.4	Low	84.6	Confident	42 Å²	42	63.6 Å²	63.6	26%	0.255	31%	0.309	S	S	.	.	S	Bend	trans	-96.7	128.1	-168	-175.6	0	0	0	0	111.1	L1032 K1034 S1103 E1107	L1032-V1105 HydrophobicContact CB-CG1 4.2Å; L1032-V1105 HydrophobicContact CD1-CG1 4.45Å; K1034-V1105 HydrophobicContact CD-CG2 4.2Å; S1103-V1105 PolarHBondContact O-N 3.3Å; S1103-V1105 WeakPolarHBondContact OG-CB 3.48Å; S1103-V1105 WeakPolarHBondContact OG-CG2 3.27Å; S1103-V1105 PolarHBondContact OG-N 3.17Å; V1105-E1107 PolarHBondContact O-N 3.25Å
1106	Q	73.5	Confident	82.9	Confident	116 Å²	116	67.9 Å²	67.9	54%	0.542	33%	0.327	S	S	.	.			trans	16.3	97.7	161.5	-169.5	170.3	-4.2	0	0	117	L1031	L1031-Q1106 WeakPolarHBondContact CD1-O 3.46Å
1107	E	87	Confident	81.1	Confident	100 Å²	100	71.2 Å²	71.2	47%	0.467	34%	0.342	S	S	.	.			trans	-63	147.6	159.6	59.5	-177	-109.5	0	0	111.5	K1097 V1105	K1097-E1107 VanDerWaalsContact CE-CD 3.45Å; K1097-E1107 VanDerWaalsContact CE-OE1 3.31Å; K1097-E1107 WeakPolarHBondContact CE-OE1 3.39Å; K1097-E1107 VanDerWaalsContact CE-OE2 3.28Å; K1097-E1107 WeakPolarHBondContact CE-OE2 3.24Å; K1097-E1107 IonicContact NZ-OE1 3.62Å; K1097-E1107 PolarHBondContact NZ-OE1 3.19Å; K1097-E1107 IonicContact NZ-OE2 2.69Å; K1097-E1107 PolarHBondContact NZ-OE2 3Å; V1105-E1107 PolarHBondContact O-N 3.25Å
1108	Q	92.5	Very high	79	Confident	33 Å²	33	75.3 Å²	75.3	15%	0.154	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.2	169.2	-75.8	-68.2	1.3	0	0	110.3	L983 S1030 L1031 K1097 V1098	L983-Q1108 HydrophobicContact CD1-CB 4.03Å; S1030-Q1108 PolarHBondContact O-NE2 3.09Å; L1031-Q1108 HydrophobicContact CB-CG 4.26Å; L1031-Q1108 HydrophobicContact CD1-CB 4.36Å; L1031-Q1108 HydrophobicContact CD1-CG 3.77Å; K1097-Q1108 WeakPolarHBondContact CA-O 3.48Å; V1098-Q1108 PolarHBondContact N-O 3.13Å; V1098-Q1108 PolarHBondContact O-N 2.93Å
1109	V	93.2	Very high	76.9	Confident	43 Å²	43	80.3 Å²	80.3	26%	0.261	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	113.1	179.4	-176.7	0	0	0	0	109.9	K1029 K1095 K1097	K1029-V1109 PolarHBondContact NZ-O 2.6Å; K1095-V1109 HydrophobicContact CB-CG1 3.97Å; K1095-V1109 HydrophobicContact CD-CG1 4.22Å; K1095-V1109 HydrophobicContact CG-CG1 4.19Å; K1097-V1109 HydrophobicContact CB-CG2 4.39Å; K1097-V1109 HydrophobicContact CG-CG2 4.41Å
1110	L	93.5	Very high	74.5	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	131.4	171.4	-63.9	160	0	0	0	108.7	L983 A985 V1000 D1026 K1029 K1095 I1096 V1098 I1112	L983-L1110 HydrophobicContact CB-CD1 4.38Å; A985-L1110 HydrophobicContact CB-CD1 4.33Å; V1000-L1110 HydrophobicContact CG1-CD1 3.55Å; V1000-L1110 HydrophobicContact CG2-CD1 4.49Å; D1026-L1110 VanDerWaalsContact OD2-CA 3.23Å; D1026-L1110 WeakPolarHBondContact OD2-CA 3.39Å; K1029-L1110 HydrophobicContact CD-CD2 4.06Å; K1029-L1110 HydrophobicContact CG-CD2 4.05Å; K1095-L1110 CarbonylContact C-O 3.58Å; K1095-L1110 VanDerWaalsContact CA-O 3.28Å; K1095-L1110 WeakPolarHBondContact CA-O 3.23Å; I1096-L1110 HydrophobicContact CB-CB 4.3Å; I1096-L1110 PolarHBondContact N-O 2.89Å; I1096-L1110 PolarHBondContact O-N 3.22Å; V1098-L1110 HydrophobicContact CG2-CD1 4.35Å; L1110-I1112 HydrophobicContact CB-CD1 4.13Å
1111	K	92.7	Very high	71.6	Confident	141 Å²	141	87.8 Å²	87.8	61%	0.613	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	92.9	-178.5	-66	176.7	-176.9	172.3	0	108.4	D1026	D1026-K1111 PolarHBondContact OD2-N 3.26Å
1112	I	91.4	Very high	68.9	Low	5 Å²	5	90.1 Å²	90.1	3%	0.026	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	132.5	-175.9	-49.7	-54.5	0	0	0	110	A985 I998 L1025 S1093 C1094 I1096 L1110	A985-I1112 HydrophobicContact CB-CD1 3.57Å; I998-I1112 HydrophobicContact CD1-CG2 3.87Å; I998-I1112 HydrophobicContact CG1-CG2 4.29Å; I998-I1112 HydrophobicContact CG2-CD1 4.46Å; L1025-I1112 HydrophobicContact CB-CD1 4.16Å; L1025-I1112 HydrophobicContact CB-CG2 4.23Å; L1025-I1112 HydrophobicContact CD1-CD1 4.33Å; L1025-I1112 HydrophobicContact CD1-CG2 3.63Å; L1025-I1112 HydrophobicContact CG-CG2 4.48Å; S1093-I1112 WeakPolarHBondContact CA-O 3.4Å; S1093-I1112 WeakPolarHBondContact CB-O 3.13Å; C1094-I1112 PolarHBondContact N-O 2.77Å; C1094-I1112 VanDerWaalsContact N-O 3.09Å; C1094-I1112 PolarHBondContact O-N 2.94Å; I1096-I1112 HydrophobicContact CD1-CD1 4.31Å; I1096-I1112 HydrophobicContact CD1-CG1 3.91Å; I1096-I1112 HydrophobicContact CG1-CG1 4.04Å; L1110-I1112 HydrophobicContact CB-CD1 4.13Å
1113	S	83.4	Confident	66.6	Low	35 Å²	35	88.6 Å²	88.6	25%	0.245	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	146.9	165	-171.7	0	0	0	0	110.2	V1092 Q1115	V1092-S1113 WeakPolarHBondContact O-CA 3.42Å; S1113-Q1115 VanDerWaalsContact C-N 3.27Å; S1113-Q1115 PolarHBondContact OG-N 2.84Å
1114	N	77.5	Confident	64.6	Low	44 Å²	44	92.9 Å²	92.9	24%	0.235	46%	0.458	C	S	.	.	S	Bend	trans	-82.9	0	170.2	72.3	-32.4	0	0	0	114.1	L990 L1090 N1091 V1092	L990-N1114 VanDerWaalsContact CD2-ND2 3.29Å; L990-N1114 WeakPolarHBondContact CD2-ND2 3.28Å; L1090-N1114 PolarHBondContact O-ND2 2.83Å; N1091-N1114 WeakPolarHBondContact CA-OD1 3.45Å; V1092-N1114 HydrophobicContact CG1-CB 3.65Å; V1092-N1114 PolarHBondContact N-OD1 2.88Å; V1092-N1114 PolarHBondContact O-N 3.17Å; V1092-N1114 VanDerWaalsContact O-N 3.11Å; V1092-N1114 PolarHBondContact O-OD1 3.11Å
1115	Q	68.3	Low	62.9	Low	122 Å²	122	94.9 Å²	94.9	57%	0.57	46%	0.457	S	S	*	.	S	Bend	trans	-67	147	168.1	-63.4	-175.6	3.3	0	0	109.5	S1113 F1117	S1113-Q1115 VanDerWaalsContact C-N 3.27Å; S1113-Q1115 PolarHBondContact OG-N 2.84Å; Q1115-F1117 PolarHBondContact O-N 3.14Å
1116	K	58.3	Low	61.4	Low	169 Å²	169	95.5 Å²	95.5	74%	0.735	46%	0.461	S	S	*	.			trans	-59.1	105.3	-173.2	-172.7	-165.6	-180	-167.2	0	110.7	E1118	K1116-E1118 HydrophobicContact CD-CG 4.1Å; K1116-E1118 VanDerWaalsContact CE-OE1 3.25Å; K1116-E1118 WeakPolarHBondContact CE-OE1 3.49Å; K1116-E1118 HydrophobicContact CG-CG 4.33Å; K1116-E1118 IonicContact NZ-OE1 3.4Å; K1116-E1118 PolarHBondContact NZ-OE1 3.27Å
1117	F	55.7	Low	59	Low	70 Å²	70	96.8 Å²	96.8	31%	0.307	46%	0.461	S	S	.	.			trans	-72.9	129.1	167.6	-165	-101.3	0	0	0	109.1	L1024 D1027 Q1115 L1119	L1024-F1117 HydrophobicContact CD2-CD1 4.36Å; L1024-F1117 HydrophobicContact CD2-CE1 4.22Å; L1024-F1117 WeakPolarHBondContact O-CB 3.35Å; D1027-F1117 HydrophobicContact CB-CZ 4.31Å; D1027-F1117 WeakPolarHBondContact OD1-CZ 3.26Å; Q1115-F1117 PolarHBondContact O-N 3.14Å; F1117-L1119 HydrophobicContact CE1-CD1 4.45Å
1118	E	48.8	Very low	56.2	Low	128 Å²	128	96.1 Å²	96.1	60%	0.598	46%	0.456	S	S	*	.			trans	-114.6	115.7	171.2	-68.6	-174.4	163.4	0	0	107.2	K1116 K1120	K1116-E1118 HydrophobicContact CD-CG 4.1Å; K1116-E1118 VanDerWaalsContact CE-OE1 3.25Å; K1116-E1118 WeakPolarHBondContact CE-OE1 3.49Å; K1116-E1118 HydrophobicContact CG-CG 4.33Å; K1116-E1118 IonicContact NZ-OE1 3.4Å; K1116-E1118 PolarHBondContact NZ-OE1 3.27Å; E1118-K1120 PolarHBondContact O-N 3.14Å; E1118-K1120 VanDerWaalsContact O-N 3.13Å
1119	L	50.7	Low	53	Low	105 Å²	105	103 Å²	103	55%	0.55	49%	0.486	S	S	.	.			trans	-58.7	118.1	-177.9	-174.5	84.3	0	0	0	109.3	L1024 F1117 T1121	L1024-L1119 HydrophobicContact CD2-CD1 3.64Å; F1117-L1119 HydrophobicContact CE1-CD1 4.45Å; L1119-T1121 PolarHBondContact O-N 3.39Å
1120	K	43.5	Very low	49.8	Very low	131 Å²	131	105.3 Å²	105.3	57%	0.57	50%	0.504	S	S	*	.			trans	-74.3	115.8	172.3	-76.8	174.4	149.1	-138.6	0	109.4	E1118 E1122	E1118-K1120 PolarHBondContact O-N 3.14Å; E1118-K1120 VanDerWaalsContact O-N 3.13Å; K1120-E1122 HydrophobicContact CB-CG 4.28Å; K1120-E1122 WeakPolarHBondContact CD-OE1 3.44Å; K1120-E1122 IonicContact NZ-OE1 2.8Å; K1120-E1122 PolarHBondContact NZ-OE1 3.41Å; K1120-E1122 PolarHBondContact O-N 3.08Å
1121	T	30.8	Very low	46.7	Very low	113 Å²	113	110.8 Å²	110.8	69%	0.693	54%	0.542	S	S	*	.			trans	-74.3	51.8	169.3	38.4	0	0	0	0	112	L1119	L1119-T1121 PolarHBondContact O-N 3.39Å
1122	E	30.7	Very low	43.7	Very low	136 Å²	136	113.3 Å²	113.3	64%	0.636	56%	0.557	S	S	*	*			trans	-85.6	105.2	172.1	-75.5	-177.9	-145.8	0	0	109.7	K1120 P1124	K1120-E1122 HydrophobicContact CB-CG 4.28Å; K1120-E1122 WeakPolarHBondContact CD-OE1 3.44Å; K1120-E1122 IonicContact NZ-OE1 2.8Å; K1120-E1122 PolarHBondContact NZ-OE1 3.41Å; K1120-E1122 PolarHBondContact O-N 3.08Å; E1122-P1124 VanDerWaalsContact O-CD 3.23Å; E1122-P1124 WeakPolarHBondContact O-CD 3.45Å
1123	H	28.4	Very low	40.7	Very low	93 Å²	93	118.3 Å²	118.3	43%	0.431	58%	0.583	S	S	.	*			trans	-60.9	116.1	-175.7	-62.1	-63.2	0	0	0	113.9	R1125 T1126 F1128	H1123-R1125 VanDerWaalsContact C-N 3.26Å; H1123-R1125 PolarHBondContact O-N 2.79Å; H1123-T1126 PolarHBondContact ND1-O 2.81Å; H1123-F1128 PolarHBondContact CE1-O 2.74Å
1124	P	30.5	Very low	38.2	Very low	119 Å²	119	126.2 Å²	126.2	77%	0.773	61%	0.608	S	S	*	*	S	Bend	trans	-85.6	69.6	167.5	32.9	-24.5	0	0	0	109.7	E1122 T1126	E1122-P1124 VanDerWaalsContact O-CD 3.23Å; E1122-P1124 WeakPolarHBondContact O-CD 3.45Å; P1124-T1126 PolarHBondContact O-N 2.94Å
1125	R	28.8	Very low	35.8	Very low	248 Å²	248	127.1 Å²	127.1	94%	0.936	62%	0.618	S	S	*	*	S	Bend	trans	57	31.3	175.3	-75.3	-173.6	172.1	152.1	-1.9	117.7	H1123	H1123-R1125 VanDerWaalsContact C-N 3.26Å; H1123-R1125 PolarHBondContact O-N 2.79Å
1126	T	29.5	Very low	33.8	Very low	55 Å²	55	126.2 Å²	126.2	34%	0.337	63%	0.625	S	S	.	*			trans	-131.3	118	150.3	40.1	0	0	0	0	109.1	H1123 P1124 F1128	H1123-T1126 PolarHBondContact ND1-O 2.81Å; P1124-T1126 PolarHBondContact O-N 2.94Å; T1126-F1128 VanDerWaalsContact C-N 3.26Å; T1126-F1128 PolarHBondContact O-N 3.26Å
1127	R	24.4	Very low	32.3	Very low	143 Å²	143	125.8 Å²	125.8	54%	0.54	63%	0.63	S	S	.	*			trans	-89.4	54.7	-178.2	-76.3	-165.9	179.6	136	-13.6	111.6	F1129 E1203	R1127-F1129 PolarHBondContact O-N 2.83Å; R1127-F1129 VanDerWaalsContact O-N 3.09Å; R1127-E1203 IonicContact CZ-OE1 3.65Å; R1127-E1203 IonicContact NH1-OE1 3.64Å; R1127-E1203 PolarHBondContact NH1-OE1 2.81Å
1128	F	27.4	Very low	31	Very low	85 Å²	85	130.1 Å²	130.1	37%	0.373	66%	0.655	S	S	.	*			trans	-70.1	106.1	164.5	-77.1	-70.1	0	0	0	109.3	F762 H1123 T1126 S1130 D1202	F762-F1128 HydrophobicContact CZ-CE1 4.45Å; F762-F1128 HydrophobicContact CZ-CZ 4.29Å; H1123-F1128 PolarHBondContact CE1-O 2.74Å; T1126-F1128 VanDerWaalsContact C-N 3.26Å; T1126-F1128 PolarHBondContact O-N 3.26Å; F1128-S1130 PolarHBondContact O-N 3.39Å; F1128-D1202 WeakPolarHBondContact CD2-OD2 3.29Å; F1128-D1202 VanDerWaalsContact CE1-OD1 3.3Å; F1128-D1202 WeakPolarHBondContact CE1-OD1 3.44Å; F1128-D1202 WeakPolarHBondContact CE2-OD2 3.23Å; F1128-D1202 WeakPolarHBondContact CZ-OD1 3.17Å
1129	F	24.8	Very low	29.9	Very low	177 Å²	177	134.8 Å²	134.8	78%	0.776	67%	0.667	S	S	*	*			trans	-63.5	120	168.1	-82.5	-95.3	0	0	0	109.7	R1127 S1131	R1127-F1129 PolarHBondContact O-N 2.83Å; R1127-F1129 VanDerWaalsContact O-N 3.09Å; F1129-S1131 PolarHBondContact O-N 2.85Å; F1129-S1131 VanDerWaalsContact O-N 3.13Å
1130	S	26.6	Very low	28.7	Very low	92 Å²	92	134.9 Å²	134.9	64%	0.643	68%	0.676	S	S	*	*			trans	-68.4	102.2	163.5	50.4	0	0	0	0	108.8	F1128 E1132	F1128-S1130 PolarHBondContact O-N 3.39Å; S1130-E1132 PolarHBondContact O-N 2.87Å
1131	S	29.1	Very low	28	Very low	115 Å²	115	137.6 Å²	137.6	80%	0.804	69%	0.689	S	S	*	*			trans	-77.5	54.3	-177.2	-174.2	0	0	0	0	113.1	F1129	F1129-S1131 PolarHBondContact O-N 2.85Å; F1129-S1131 VanDerWaalsContact O-N 3.13Å
1132	E	29.4	Very low	28.5	Very low	195 Å²	195	138.6 Å²	138.6	91%	0.911	70%	0.695	S	S	*	*			trans	-108	42.1	167.3	-69.8	-165.2	147.2	0	0	111.4	S1130	S1130-E1132 PolarHBondContact O-N 2.87Å
1133	D	28.1	Very low	29.3	Very low	109 Å²	109	134.9 Å²	134.9	58%	0.583	68%	0.684	S	S	*	*	S	Bend	trans	-150.2	143.1	162.9	-157.9	7.1	0	0	0	111.9
1134	R	31	Very low	30.7	Very low	202 Å²	202	133.7 Å²	133.7	76%	0.762	68%	0.684	S	S	*	*			trans	67.4	104.3	165.5	-41.9	-170.3	-167.6	-138.6	-15.9	119.2
1135	S	27.6	Very low	32.3	Very low	63 Å²	63	129.8 Å²	129.8	44%	0.441	65%	0.654	S	S	.	*			trans	-53.1	161.6	137.4	59.5	0	0	0	0	112.6	I694	I694-S1135 WeakPolarHBondContact CD1-OG 3.25Å
1136	S	27	Very low	34.3	Very low	103 Å²	103	122.1 Å²	122.1	72%	0.72	63%	0.626	S	S	*	*	S	Bend	trans	79.9	132.9	177.2	75.3	0	0	0	0	117.2
1137	D	24.8	Very low	36.5	Very low	159 Å²	159	119.7 Å²	119.7	85%	0.85	61%	0.61	S	S	*	*			trans	68.8	53.5	158.6	-61.1	-5.4	0	0	0	120.8
1138	I	28.3	Very low	39.1	Very low	162 Å²	162	116.4 Å²	116.4	83%	0.831	61%	0.608	S	S	*	*			trans	-124.7	134.8	147.5	-58.8	-177.1	0	0	0	110.3
1139	R	26.8	Very low	41.3	Very low	226 Å²	226	115.3 Å²	115.3	85%	0.853	61%	0.608	S	S	*	*			trans	-76.9	150.2	-177.4	-63.2	175.8	-177.6	167	0.9	111.5	F1141	R1139-F1141 PolarHBondContact O-N 2.8Å
1140	S	24.6	Very low	44.1	Very low	106 Å²	106	110.7 Å²	110.7	74%	0.741	59%	0.594	S	S	*	*			trans	-62.1	103.5	178.8	55.2	0	0	0	0	113	T1142	S1140-T1142 PolarHBondContact O-N 2.83Å
1141	F	28.8	Very low	46.9	Very low	188 Å²	188	107.5 Å²	107.5	83%	0.825	57%	0.571	S	S	*	*			trans	-79.6	104.4	158.9	-82.7	-88.3	0	0	0	108.7	R1139 S1143	R1139-F1141 PolarHBondContact O-N 2.8Å; F1141-S1143 PolarHBondContact O-N 3.24Å; F1141-S1143 VanDerWaalsContact O-N 3.13Å
1142	T	41.3	Very low	49.5	Very low	135 Å²	135	103.2 Å²	103.2	83%	0.828	54%	0.539	S	S	*	.			trans	-87.4	37.1	-172.3	60.1	0	0	0	0	113	S1140	S1140-T1142 PolarHBondContact O-N 2.83Å
1143	S	48.5	Very low	52.1	Low	57 Å²	57	99.8 Å²	99.8	40%	0.399	52%	0.524	S	S	.	.			trans	-150.5	132	-177.7	173.6	0	0	0	0	110	F1141 Y1145	F1141-S1143 PolarHBondContact O-N 3.24Å; F1141-S1143 VanDerWaalsContact O-N 3.13Å; S1143-Y1145 VanDerWaalsContact C-N 3.26Å; S1143-Y1145 PolarHBondContact OG-N 3.05Å; S1143-Y1145 VanDerWaalsContact OG-N 3.12Å; S1143-Y1145 PolarHBondContact OG-O 3.2Å
1144	P	58.6	Low	55	Low	68 Å²	68	101.3 Å²	101.3	44%	0.442	52%	0.521	S	S	.	.	S	Bend	trans	-76	-14.7	170.2	31.8	-33.7	0	0	0	112.8
1145	Y	63.2	Low	57.8	Low	37 Å²	37	91.7 Å²	91.7	15%	0.145	49%	0.485	C	S	.	.			trans	-93.2	143.1	175	-52.7	-78.2	0	0	0	110.7	D752 T764 I765 S1143	D752-Y1145 PolarHBondContact N-OH 3.33Å; T764-Y1145 HydrophobicContact CG2-CE1 4.14Å; I765-Y1145 PolarHBondContact O-OH 2.99Å; S1143-Y1145 VanDerWaalsContact C-N 3.26Å; S1143-Y1145 PolarHBondContact OG-N 3.05Å; S1143-Y1145 VanDerWaalsContact OG-N 3.12Å; S1143-Y1145 PolarHBondContact OG-O 3.2Å
1146	R	70.9	Confident	60.7	Low	88 Å²	88	89.2 Å²	89.2	33%	0.332	47%	0.467	S	S	.	.	S	Bend	trans	-86.8	-41.1	-176.2	-68.7	156.9	146.3	-114.2	-2.4	111.2	P1148 E1197 N1200 R1201 E1203	R1146-P1148 WeakPolarHBondContact O-CD 3.29Å; R1146-E1197 WeakPolarHBondContact CA-OE1 3.43Å; R1146-E1197 WeakPolarHBondContact CB-OE1 3.49Å; R1146-E1197 PolarHBondContact N-OE1 3.36Å; R1146-N1200 PolarHBondContact NH1-O 3.38Å; R1146-N1200 PolarHBondContact NH2-O 2.89Å; R1146-N1200 VanDerWaalsContact NH2-O 3.07Å; R1146-R1201 VanDerWaalsContact NH2-C 3.3Å; R1146-R1201 PolarHBondContact NH2-O 3.4Å; R1146-E1203 VanDerWaalsContact CZ-O 3.27Å; R1146-E1203 PolarHBondContact NH1-O 2.83Å; R1146-E1203 PolarHBondContact NH2-O 2.83Å
1147	L	76.3	Confident	63.6	Low	3 Å²	3	91 Å²	91	2%	0.016	46%	0.462	C	S	.	.	S	Bend	trans	-80.4	120.2	170.2	-63	175.9	0	0	0	108.7	V1149 T1152 L1193 W1196 E1197 V1206 L1209 L1225	L1147-V1149 PolarHBondContact O-N 3.44Å; L1147-T1152 WeakPolarHBondContact CB-OG1 3.38Å; L1147-L1193 HydrophobicContact CD1-CB 4.25Å; L1147-L1193 HydrophobicContact CD1-CD1 4.44Å; L1147-L1193 HydrophobicContact CD1-CD2 3.99Å; L1147-L1193 HydrophobicContact CD1-CG 4.46Å; L1147-W1196 HydrophobicContact CD1-CE3 4.33Å; L1147-W1196 HydrophobicContact CD1-CZ3 4.48Å; L1147-W1196 HydrophobicContact CG-CZ3 4.39Å; L1147-E1197 HydrophobicContact CD1-CG 4.42Å; L1147-E1197 PolarHBondContact N-OE1 3.15Å; L1147-V1206 HydrophobicContact CD2-CG1 4.09Å; L1147-L1209 HydrophobicContact CD1-CD2 4.07Å; L1147-L1209 HydrophobicContact CD2-CD2 4.22Å; L1147-L1225 HydrophobicContact CD2-CD2 3.6Å
1148	P	77.4	Confident	66.6	Low	75 Å²	75	86.3 Å²	86.3	49%	0.487	44%	0.436	S	S	.	.			trans	-57.8	140.1	173.4	-24	34	0	0	0	110.6	R1146 V1150 T1151 T1152	R1146-P1148 WeakPolarHBondContact O-CD 3.29Å; P1148-V1150 PolarHBondContact O-N 3.21Å; P1148-T1151 WeakPolarHBondContact O-CA 3.28Å; P1148-T1151 WeakPolarHBondContact O-CB 3.27Å; P1148-T1151 PolarHBondContact O-N 3.09Å; P1148-T1152 PolarHBondContact O-N 2.87Å; P1148-T1152 PolarHBondContact O-OG1 3.36Å
1149	V	75.4	Confident	69.5	Low	61 Å²	61	78.6 Å²	78.6	37%	0.37	40%	0.397	S	S	.	.	H	α-helix	trans	-50.8	-37.1	-178.9	176.4	0	0	0	0	112.3	L1147 T1152 Q1153	L1147-V1149 PolarHBondContact O-N 3.44Å; V1149-T1152 PolarHBondContact O-N 2.83Å; V1149-Q1153 HydrophobicContact CG1-CG 4.38Å; V1149-Q1153 WeakPolarHBondContact O-CB 3.31Å; V1149-Q1153 VanDerWaalsContact O-CG 3.23Å; V1149-Q1153 WeakPolarHBondContact O-CG 3.28Å; V1149-Q1153 PolarHBondContact O-N 3.3Å
1150	V	82.3	Confident	72.4	Confident	81 Å²	81	70 Å²	70	49%	0.491	37%	0.368	S	S	.	.	H	α-helix	trans	-65.3	-37.9	175.9	-178.4	0	0	0	0	112.4	P1148 R1154	P1148-V1150 PolarHBondContact O-N 3.21Å; V1150-R1154 VanDerWaalsContact O-CG 3.25Å; V1150-R1154 WeakPolarHBondContact O-CG 3.34Å; V1150-R1154 PolarHBondContact O-N 3.06Å; V1150-R1154 VanDerWaalsContact O-N 3.13Å
1151	T	85.2	Confident	75	Confident	25 Å²	25	71 Å²	71	15%	0.153	36%	0.361	C	S	.	.	H	α-helix	trans	-68.9	-47.6	175.4	-57.7	0	0	0	0	110.3	P1148 Q1153 R1154 L1155 L1224 L1225	P1148-T1151 WeakPolarHBondContact O-CA 3.28Å; P1148-T1151 WeakPolarHBondContact O-CB 3.27Å; P1148-T1151 PolarHBondContact O-N 3.09Å; T1151-Q1153 PolarHBondContact O-N 2.86Å; T1151-R1154 PolarHBondContact O-N 3.37Å; T1151-R1154 VanDerWaalsContact O-N 3.14Å; T1151-L1155 HydrophobicContact CG2-CD1 4.06Å; T1151-L1155 HydrophobicContact CG2-CG 4.39Å; T1151-L1155 WeakPolarHBondContact O-CG 3.45Å; T1151-L1155 PolarHBondContact O-N 3.38Å; T1151-L1224 VanDerWaalsContact CG2-O 3.3Å; T1151-L1224 WeakPolarHBondContact CG2-O 3.32Å; T1151-L1225 HydrophobicContact CG2-CD2 4.16Å
1152	T	84.3	Confident	77.4	Confident	24 Å²	24	68.7 Å²	68.7	15%	0.147	35%	0.35	C	S	.	.	H	α-helix	trans	-56.9	-48.3	175.7	-52	0	0	0	0	111.2	L1147 P1148 V1149 R1154 L1155 C1156 L1193	L1147-T1152 WeakPolarHBondContact CB-OG1 3.38Å; P1148-T1152 PolarHBondContact O-N 2.87Å; P1148-T1152 PolarHBondContact O-OG1 3.36Å; V1149-T1152 PolarHBondContact O-N 2.83Å; T1152-R1154 VanDerWaalsContact C-N 3.32Å; T1152-R1154 PolarHBondContact O-N 2.98Å; T1152-L1155 PolarHBondContact O-N 2.87Å; T1152-C1156 WeakPolarHBondContact O-CB 3.16Å; T1152-C1156 PolarHBondContact O-N 2.79Å; T1152-C1156 PolarHBondContact O-SG 2.75Å; T1152-L1193 HydrophobicContact CG2-CD1 3.94Å
1153	Q	84.7	Confident	78.7	Confident	124 Å²	124	67.2 Å²	67.2	58%	0.579	33%	0.334	S	S	*	.	H	α-helix	trans	-58.7	-39.2	176.1	-75.2	172.6	1.6	0	0	113.3	V1149 T1151 K1157	V1149-Q1153 HydrophobicContact CG1-CG 4.38Å; V1149-Q1153 WeakPolarHBondContact O-CB 3.31Å; V1149-Q1153 VanDerWaalsContact O-CG 3.23Å; V1149-Q1153 WeakPolarHBondContact O-CG 3.28Å; V1149-Q1153 PolarHBondContact O-N 3.3Å; T1151-Q1153 PolarHBondContact O-N 2.86Å; Q1153-K1157 PolarHBondContact O-N 2.85Å; Q1153-K1157 VanDerWaalsContact O-N 3.13Å
1154	R	88.4	Confident	80.3	Confident	141 Å²	141	66.2 Å²	66.2	53%	0.532	33%	0.333	S	S	.	.	H	α-helix	trans	-68.6	-44.1	176	-73.9	171.7	-179.8	-166.5	1.4	112.2	V1150 T1151 T1152 K1157 L1158 L1224	V1150-R1154 VanDerWaalsContact O-CG 3.25Å; V1150-R1154 WeakPolarHBondContact O-CG 3.34Å; V1150-R1154 PolarHBondContact O-N 3.06Å; V1150-R1154 VanDerWaalsContact O-N 3.13Å; T1151-R1154 PolarHBondContact O-N 3.37Å; T1151-R1154 VanDerWaalsContact O-N 3.14Å; T1152-R1154 VanDerWaalsContact C-N 3.32Å; T1152-R1154 PolarHBondContact O-N 2.98Å; R1154-K1157 PolarHBondContact O-N 3.38Å; R1154-L1158 WeakPolarHBondContact O-CB 3.45Å; R1154-L1158 WeakPolarHBondContact O-CG 3.44Å; R1154-L1158 PolarHBondContact O-N 3.41Å; R1154-L1224 HydrophobicContact CB-CD1 4.06Å
1155	L	89.8	Confident	81.6	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.6	-46.6	177.5	-70.7	174.3	0	0	0	111.2	T1151 T1152 K1157 L1158 L1159 L1193 F1213 C1221 L1224 L1225	T1151-L1155 HydrophobicContact CG2-CD1 4.06Å; T1151-L1155 HydrophobicContact CG2-CG 4.39Å; T1151-L1155 WeakPolarHBondContact O-CG 3.45Å; T1151-L1155 PolarHBondContact O-N 3.38Å; T1152-L1155 PolarHBondContact O-N 2.87Å; L1155-K1157 PolarHBondContact O-N 2.88Å; L1155-L1158 PolarHBondContact O-N 3.16Å; L1155-L1158 VanDerWaalsContact O-N 3.11Å; L1155-L1159 HydrophobicContact CB-CD1 4.49Å; L1155-L1159 WeakPolarHBondContact O-CB 3.2Å; L1155-L1159 WeakPolarHBondContact O-CG 3.49Å; L1155-L1159 PolarHBondContact O-N 3.14Å; L1155-L1193 HydrophobicContact CB-CD1 3.91Å; L1155-L1193 HydrophobicContact CD1-CD1 4.02Å; L1155-L1193 HydrophobicContact CD1-CD2 4.44Å; L1155-F1213 HydrophobicContact CD1-CE2 3.95Å; L1155-F1213 HydrophobicContact CD1-CZ 4.17Å; L1155-F1213 HydrophobicContact CD2-CD2 4.47Å; L1155-F1213 HydrophobicContact CD2-CE2 3.65Å; L1155-F1213 HydrophobicContact CD2-CZ 3.94Å; L1155-F1213 HydrophobicContact CG-CE2 4.44Å; L1155-C1221 HydrophobicContact CD2-CB 3.7Å; L1155-L1224 HydrophobicContact CD2-CB 4.38Å; L1155-L1224 HydrophobicContact CD2-CD1 4.32Å; L1155-L1225 HydrophobicContact CD1-CD2 4.21Å
1156	C	88.7	Confident	82.9	Confident	10 Å²	10	62.9 Å²	62.9	7%	0.068	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-46.1	176	-62.1	0	0	0	0	111.6	T1152 L1158 L1159 D1160 T1189 T1190	T1152-C1156 WeakPolarHBondContact O-CB 3.16Å; T1152-C1156 PolarHBondContact O-N 2.79Å; T1152-C1156 PolarHBondContact O-SG 2.75Å; C1156-L1158 VanDerWaalsContact C-N 3.32Å; C1156-L1158 PolarHBondContact O-N 2.71Å; C1156-L1159 PolarHBondContact O-N 2.89Å; C1156-D1160 VanDerWaalsContact O-CB 3.22Å; C1156-D1160 WeakPolarHBondContact O-CB 3.34Å; C1156-D1160 VanDerWaalsContact O-CG 3.27Å; C1156-D1160 PolarHBondContact O-N 3.1Å; C1156-T1189 HydrophobicContact CB-CG2 4.38Å; C1156-T1190 PolarHBondContact SG-N 2.89Å; C1156-T1190 VanDerWaalsContact SG-N 3.45Å; C1156-T1190 PolarHBondContact SG-OG1 2.96Å
1157	K	87.2	Confident	83.7	Confident	140 Å²	140	61.5 Å²	61.5	61%	0.609	31%	0.31	S	S	*	.	H	α-helix	trans	-57.8	-43	174.3	-173.1	176.5	178.5	-177.3	0	112.7	Q1153 R1154 L1155 L1159 E1161	Q1153-K1157 PolarHBondContact O-N 2.85Å; Q1153-K1157 VanDerWaalsContact O-N 3.13Å; R1154-K1157 PolarHBondContact O-N 3.38Å; L1155-K1157 PolarHBondContact O-N 2.88Å; K1157-L1159 VanDerWaalsContact C-N 3.3Å; K1157-L1159 PolarHBondContact O-N 2.73Å; K1157-E1161 WeakPolarHBondContact CE-OE1 3.28Å; K1157-E1161 WeakPolarHBondContact CG-OE1 3.4Å; K1157-E1161 WeakPolarHBondContact O-CG 3.2Å
1158	L	88.6	Confident	84.3	Confident	61 Å²	61	65 Å²	65	32%	0.319	33%	0.325	S	S	.	.	H	α-helix	trans	-74.5	-12.4	-177.8	-74.8	173.5	0	0	0	115.2	R1154 L1155 C1156 R1218 L1224	R1154-L1158 WeakPolarHBondContact O-CB 3.45Å; R1154-L1158 WeakPolarHBondContact O-CG 3.44Å; R1154-L1158 PolarHBondContact O-N 3.41Å; L1155-L1158 PolarHBondContact O-N 3.16Å; L1155-L1158 VanDerWaalsContact O-N 3.11Å; C1156-L1158 VanDerWaalsContact C-N 3.32Å; C1156-L1158 PolarHBondContact O-N 2.71Å; L1158-R1218 PolarHBondContact O-NH1 2.96Å; L1158-R1218 PolarHBondContact O-NH2 3.32Å; L1158-L1224 HydrophobicContact CD1-CD1 3.41Å; L1158-L1224 VanDerWaalsContact CD1-CD1 3.41Å
1159	L	88.7	Confident	84.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-122	-28.6	-172.9	-67.3	167.2	0	0	0	113.4	L1155 C1156 K1157 E1165 W1166 L1169 T1189 F1213 M1216	L1155-L1159 HydrophobicContact CB-CD1 4.49Å; L1155-L1159 WeakPolarHBondContact O-CB 3.2Å; L1155-L1159 WeakPolarHBondContact O-CG 3.49Å; L1155-L1159 PolarHBondContact O-N 3.14Å; C1156-L1159 PolarHBondContact O-N 2.89Å; K1157-L1159 VanDerWaalsContact C-N 3.3Å; K1157-L1159 PolarHBondContact O-N 2.73Å; L1159-E1165 HydrophobicContact CD2-CB 4.09Å; L1159-W1166 PolarHBondContact O-N 3.05Å; L1159-L1169 HydrophobicContact CD1-CD2 4.32Å; L1159-T1189 HydrophobicContact CB-CG2 3.94Å; L1159-T1189 VanDerWaalsContact CB-OG1 3.24Å; L1159-T1189 WeakPolarHBondContact CB-OG1 3.35Å; L1159-T1189 HydrophobicContact CD1-CG2 3.7Å; L1159-T1189 HydrophobicContact CG-CG2 4.45Å; L1159-F1213 HydrophobicContact CD1-CE1 3.64Å; L1159-F1213 HydrophobicContact CD1-CZ 3.92Å; L1159-M1216 HydrophobicContact CD2-CE 3.91Å
1160	D	87.7	Confident	85.5	Confident	45 Å²	45	58.6 Å²	58.6	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-80	-24.2	175.2	-62.6	-30.7	0	0	0	112.6	C1156 K1162 S1187 P1188 T1189	C1156-D1160 VanDerWaalsContact O-CB 3.22Å; C1156-D1160 WeakPolarHBondContact O-CB 3.34Å; C1156-D1160 VanDerWaalsContact O-CG 3.27Å; C1156-D1160 PolarHBondContact O-N 3.1Å; D1160-K1162 PolarHBondContact O-N 2.87Å; D1160-S1187 VanDerWaalsContact OD2-CB 3.28Å; D1160-S1187 WeakPolarHBondContact OD2-CB 3.47Å; D1160-S1187 PolarHBondContact OD2-OG 3Å; D1160-P1188 WeakPolarHBondContact OD1-CD 3.38Å; D1160-T1189 WeakPolarHBondContact OD1-CB 3.13Å; D1160-T1189 PolarHBondContact OD1-N 3.23Å; D1160-T1189 PolarHBondContact OD1-OG1 2.95Å
1161	E	80	Confident	85.7	Confident	127 Å²	127	61 Å²	61	59%	0.593	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-13.8	178.3	-86.3	178.9	-165.9	0	0	114.2	K1157	K1157-E1161 WeakPolarHBondContact CE-OE1 3.28Å; K1157-E1161 WeakPolarHBondContact CG-OE1 3.4Å; K1157-E1161 WeakPolarHBondContact O-CG 3.2Å
1162	K	77.7	Confident	85.8	Confident	140 Å²	140	63.8 Å²	63.8	61%	0.609	30%	0.3	S	S	*	.	S	Bend	trans	-143.6	119	-179.7	-67	173.6	-175.2	168.3	0	110.6	D1160 G1164 E1165	D1160-K1162 PolarHBondContact O-N 2.87Å; K1162-G1164 PolarHBondContact O-N 3.22Å; K1162-E1165 HydrophobicContact CB-CB 4.39Å; K1162-E1165 HydrophobicContact CB-CG 3.79Å; K1162-E1165 HydrophobicContact CD-CG 4.22Å; K1162-E1165 PolarHBondContact O-N 2.98Å
1163	E	70.2	Confident	85.7	Confident	104 Å²	104	63.8 Å²	63.8	49%	0.486	30%	0.298	S	S	.	.	H	α-helix	trans	-53.5	-35.4	-174.1	-69.4	-163.2	-171.6	0	0	114.9	E1165 W1166 Q1167 K1183	E1163-E1165 VanDerWaalsContact C-N 3.3Å; E1163-E1165 PolarHBondContact O-N 2.91Å; E1163-W1166 PolarHBondContact O-NE1 2.89Å; E1163-Q1167 WeakPolarHBondContact O-CG 3.49Å; E1163-K1183 VanDerWaalsContact OE1-CE 3.27Å; E1163-K1183 WeakPolarHBondContact OE1-CE 3Å; E1163-K1183 IonicContact OE1-NZ 2.72Å; E1163-K1183 PolarHBondContact OE1-NZ 2.69Å; E1163-K1183 IonicContact OE2-NZ 3.49Å; E1163-K1183 PolarHBondContact OE2-NZ 3.36Å
1164	G	80.2	Confident	85.6	Confident	37 Å²	37	65.9 Å²	65.9	38%	0.381	30%	0.301	S	S	.	.	H	α-helix	trans	-71.1	-18.4	179.9	0	0	0	0	0	115	K1162 K1168	K1162-G1164 PolarHBondContact O-N 3.22Å; G1164-K1168 WeakPolarHBondContact O-CG 3.37Å; G1164-K1168 PolarHBondContact O-N 3.24Å; G1164-K1168 VanDerWaalsContact O-N 3.09Å
1165	E	86.9	Confident	85.1	Confident	28 Å²	28	59.2 Å²	59.2	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-82.3	-47.3	-171.2	-66.9	-63.5	122.9	0	0	112.3	L1159 K1162 E1163 Q1167 K1168 L1169 M1216 R1218	L1159-E1165 HydrophobicContact CD2-CB 4.09Å; K1162-E1165 HydrophobicContact CB-CB 4.39Å; K1162-E1165 HydrophobicContact CB-CG 3.79Å; K1162-E1165 HydrophobicContact CD-CG 4.22Å; K1162-E1165 PolarHBondContact O-N 2.98Å; E1163-E1165 VanDerWaalsContact C-N 3.3Å; E1163-E1165 PolarHBondContact O-N 2.91Å; E1165-Q1167 VanDerWaalsContact C-N 3.25Å; E1165-Q1167 PolarHBondContact O-N 2.82Å; E1165-K1168 WeakPolarHBondContact O-CB 3.34Å; E1165-K1168 PolarHBondContact O-N 2.93Å; E1165-K1168 WeakPolarHBondContact OE1-CE 3.06Å; E1165-K1168 IonicContact OE1-NZ 2.72Å; E1165-K1168 PolarHBondContact OE1-NZ 2.87Å; E1165-K1168 IonicContact OE2-NZ 3.55Å; E1165-L1169 PolarHBondContact O-N 2.72Å; E1165-M1216 WeakPolarHBondContact O-CE 3.13Å; E1165-R1218 VanDerWaalsContact OE2-CD 3.26Å; E1165-R1218 WeakPolarHBondContact OE2-CD 3.29Å; E1165-R1218 IonicContact OE2-CZ 3.64Å; E1165-R1218 IonicContact OE2-NE 3.9Å; E1165-R1218 IonicContact OE2-NH1 2.61Å; E1165-R1218 PolarHBondContact OE2-NH1 3.47Å
1166	W	89.4	Confident	84.6	Confident	6 Å²	6	61.3 Å²	61.3	2%	0.023	29%	0.286	C	S	.	.	H	α-helix	trans	-67	-27.3	169.6	67.5	-102.4	0	0	0	112.2	L1159 E1163 L1169 A1170 I1179 L1182 K1183 P1188 L1192	L1159-W1166 PolarHBondContact O-N 3.05Å; E1163-W1166 PolarHBondContact O-NE1 2.89Å; W1166-L1169 WeakPolarHBondContact O-CB 3.44Å; W1166-L1169 PolarHBondContact O-N 3.05Å; W1166-A1170 WeakPolarHBondContact O-CB 3.24Å; W1166-A1170 PolarHBondContact O-N 3.38Å; W1166-I1179 HydrophobicContact CH2-CG2 4.07Å; W1166-I1179 HydrophobicContact CZ3-CG1 4.33Å; W1166-I1179 HydrophobicContact CZ3-CG2 4.48Å; W1166-L1182 HydrophobicContact CE3-CB 4.23Å; W1166-L1182 HydrophobicContact CE3-CD1 4.47Å; W1166-L1182 HydrophobicContact CH2-CB 4.01Å; W1166-L1182 HydrophobicContact CZ3-CB 3.55Å; W1166-L1182 HydrophobicContact CZ3-CD1 4.05Å; W1166-L1182 HydrophobicContact CZ3-CG 4.46Å; W1166-K1183 HydrophobicContact CH2-CB 4Å; W1166-K1183 HydrophobicContact CZ2-CB 4.05Å; W1166-P1188 HydrophobicContact CB-CB 4.14Å; W1166-P1188 HydrophobicContact CD2-CB 3.45Å; W1166-P1188 VanDerWaalsContact CD2-CB 3.45Å; W1166-P1188 HydrophobicContact CD2-CG 3.95Å; W1166-P1188 HydrophobicContact CE3-CB 3.77Å; W1166-P1188 HydrophobicContact CG-CB 3.63Å; W1166-P1188 HydrophobicContact CG-CG 4.12Å; W1166-P1188 HydrophobicContact CZ2-CB 4.38Å; W1166-P1188 HydrophobicContact CZ2-CG 4.21Å; W1166-P1188 HydrophobicContact CZ3-CB 4.36Å; W1166-L1192 HydrophobicContact CB-CD1 4.22Å; W1166-L1192 WeakPolarHBondContact O-CD1 3.47Å
1167	Q	89.5	Confident	84	Confident	60 Å²	60	65.5 Å²	65.5	28%	0.28	30%	0.3	S	S	.	.	H	α-helix	trans	-66.7	-38.9	173.3	-73.9	171.8	8	0	0	112.3	E1163 E1165 L1169 A1170 K1171	E1163-Q1167 WeakPolarHBondContact O-CG 3.49Å; E1165-Q1167 VanDerWaalsContact C-N 3.25Å; E1165-Q1167 PolarHBondContact O-N 2.82Å; Q1167-L1169 VanDerWaalsContact C-N 3.32Å; Q1167-L1169 PolarHBondContact O-N 3.35Å; Q1167-A1170 PolarHBondContact O-N 2.87Å; Q1167-K1171 WeakPolarHBondContact O-CB 3.26Å; Q1167-K1171 PolarHBondContact O-N 3.47Å
1168	K	88.7	Confident	83.5	Confident	77 Å²	77	59.3 Å²	59.3	34%	0.335	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-42	169.8	-73.3	167.2	176.3	178.7	0	111.6	G1164 E1165 K1171 H1172 M1216	G1164-K1168 WeakPolarHBondContact O-CG 3.37Å; G1164-K1168 PolarHBondContact O-N 3.24Å; G1164-K1168 VanDerWaalsContact O-N 3.09Å; E1165-K1168 WeakPolarHBondContact O-CB 3.34Å; E1165-K1168 PolarHBondContact O-N 2.93Å; E1165-K1168 WeakPolarHBondContact OE1-CE 3.06Å; E1165-K1168 IonicContact OE1-NZ 2.72Å; E1165-K1168 PolarHBondContact OE1-NZ 2.87Å; E1165-K1168 IonicContact OE2-NZ 3.55Å; K1168-K1171 PolarHBondContact O-N 2.72Å; K1168-H1172 PolarHBondContact O-N 2.87Å; K1168-H1172 VanDerWaalsContact O-N 3.1Å; K1168-H1172 PolarHBondContact O-ND1 3.48Å; K1168-M1216 HydrophobicContact CB-CE 3.92Å; K1168-M1216 HydrophobicContact CB-CG 4.02Å; K1168-M1216 HydrophobicContact CB-SD 4.21Å; K1168-M1216 PolarHBondContact NZ-O 2.82Å
1169	L	89.7	Confident	83.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-50.3	177	178.7	60.2	0	0	0	110.9	L1159 E1165 W1166 Q1167 K1171 H1172 M1173 T1189 L1192 L1209 I1212 F1213 M1216	L1159-L1169 HydrophobicContact CD1-CD2 4.32Å; E1165-L1169 PolarHBondContact O-N 2.72Å; W1166-L1169 WeakPolarHBondContact O-CB 3.44Å; W1166-L1169 PolarHBondContact O-N 3.05Å; Q1167-L1169 VanDerWaalsContact C-N 3.32Å; Q1167-L1169 PolarHBondContact O-N 3.35Å; L1169-K1171 PolarHBondContact O-N 3.31Å; L1169-H1172 PolarHBondContact O-N 2.87Å; L1169-H1172 VanDerWaalsContact O-N 3.16Å; L1169-M1173 HydrophobicContact CD1-CG 4.16Å; L1169-M1173 HydrophobicContact CD1-SD 4.01Å; L1169-M1173 HydrophobicContact CG-SD 4.09Å; L1169-M1173 WeakPolarHBondContact O-CB 3.02Å; L1169-M1173 WeakPolarHBondContact O-CG 3.35Å; L1169-M1173 PolarHBondContact O-N 3.4Å; L1169-T1189 HydrophobicContact CD2-CG2 4.35Å; L1169-L1192 HydrophobicContact CB-CD1 4.06Å; L1169-L1192 HydrophobicContact CD2-CB 3.89Å; L1169-L1192 HydrophobicContact CD2-CD1 3.88Å; L1169-L1192 HydrophobicContact CG-CB 4.3Å; L1169-L1192 HydrophobicContact CG-CD1 3.93Å; L1169-L1209 HydrophobicContact CD1-CD1 4.23Å; L1169-I1212 HydrophobicContact CD1-CG2 3.7Å; L1169-F1213 HydrophobicContact CD1-CE1 4.01Å; L1169-F1213 HydrophobicContact CD2-CE1 4.22Å; L1169-M1216 HydrophobicContact CB-CE 4.01Å; L1169-M1216 HydrophobicContact CB-SD 3.87Å; L1169-M1216 HydrophobicContact CD1-SD 4.17Å
1170	A	87.7	Confident	82.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-54.8	-39.4	176.2	0	0	0	0	0	112	W1166 Q1167 M1173 R1174 M1175 L1182 L1192	W1166-A1170 WeakPolarHBondContact O-CB 3.24Å; W1166-A1170 PolarHBondContact O-N 3.38Å; Q1167-A1170 PolarHBondContact O-N 2.87Å; A1170-M1173 CarbonylContact O-C 3.57Å; A1170-M1173 PolarHBondContact O-N 2.81Å; A1170-R1174 PolarHBondContact O-N 2.82Å; A1170-R1174 VanDerWaalsContact O-N 3.09Å; A1170-M1175 HydrophobicContact CB-CB 4.35Å; A1170-M1175 WeakPolarHBondContact O-CA 3.44Å; A1170-M1175 PolarHBondContact O-N 2.76Å; A1170-L1182 HydrophobicContact CB-CD1 3.96Å; A1170-L1192 HydrophobicContact CB-CD1 3.99Å; A1170-L1192 HydrophobicContact CB-CD2 3.82Å
1171	K	87.1	Confident	82	Confident	131 Å²	131	61.5 Å²	61.5	57%	0.57	28%	0.279	S	S	*	.	H	α-helix	trans	-65.7	-47.9	176	-178.5	164	-169.8	174.1	0	113.2	Q1167 K1168 L1169 M1173 R1174	Q1167-K1171 WeakPolarHBondContact O-CB 3.26Å; Q1167-K1171 PolarHBondContact O-N 3.47Å; K1168-K1171 PolarHBondContact O-N 2.72Å; L1169-K1171 PolarHBondContact O-N 3.31Å; K1171-M1173 PolarHBondContact O-N 2.81Å; K1171-R1174 PolarHBondContact O-N 2.86Å
1172	H	85.9	Confident	82.2	Confident	84 Å²	84	55.4 Å²	55.4	39%	0.389	25%	0.25	S	S	.	.	H	α-helix	trans	-61.1	-35.9	175.8	-75.2	90.1	0	0	0	111.8	K1168 L1169 R1174 I1212	K1168-H1172 PolarHBondContact O-N 2.87Å; K1168-H1172 VanDerWaalsContact O-N 3.1Å; K1168-H1172 PolarHBondContact O-ND1 3.48Å; L1169-H1172 PolarHBondContact O-N 2.87Å; L1169-H1172 VanDerWaalsContact O-N 3.16Å; H1172-R1174 VanDerWaalsContact C-N 3.29Å; H1172-R1174 PolarHBondContact O-N 3.47Å; H1172-I1212 HydrophobicContact CB-CG1 4.27Å; H1172-I1212 HydrophobicContact CB-CG2 3.6Å
1173	M	83.6	Confident	82.4	Confident	25 Å²	25	53.9 Å²	53.9	12%	0.123	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	3.6	174.7	-68.6	-171.4	60.9	0	0	115.1	L1169 A1170 K1171 M1175 L1192 M1195 W1196	L1169-M1173 HydrophobicContact CD1-CG 4.16Å; L1169-M1173 HydrophobicContact CD1-SD 4.01Å; L1169-M1173 HydrophobicContact CG-SD 4.09Å; L1169-M1173 WeakPolarHBondContact O-CB 3.02Å; L1169-M1173 WeakPolarHBondContact O-CG 3.35Å; L1169-M1173 PolarHBondContact O-N 3.4Å; A1170-M1173 CarbonylContact O-C 3.57Å; A1170-M1173 PolarHBondContact O-N 2.81Å; K1171-M1173 PolarHBondContact O-N 2.81Å; M1173-M1175 HydrophobicContact CB-CG 4.16Å; M1173-M1175 HydrophobicContact CB-SD 4.5Å; M1173-M1175 HydrophobicContact CE-SD 3.9Å; M1173-M1175 PolarHBondContact O-N 2.03Å; M1173-M1175 VanDerWaalsContact O-N 3.13Å; M1173-L1192 VanDerWaalsContact CE-O 3.28Å; M1173-L1192 WeakPolarHBondContact CE-O 3.35Å; M1173-L1192 HydrophobicContact SD-CB 4.11Å; M1173-L1192 HydrophobicContact SD-CD2 4.48Å; M1173-M1195 HydrophobicContact CE-CB 4.2Å; M1173-W1196 HydrophobicContact CE-CB 3.63Å; M1173-W1196 HydrophobicContact SD-CB 4.15Å
1174	R	81.3	Confident	82.9	Confident	168 Å²	168	52.7 Å²	52.7	63%	0.634	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	23.6	-177.2	-50.4	179.1	-176.1	173.2	2	114.6	I941 A1170 K1171 H1172	I941-R1174 HydrophobicContact CD1-CB 3.98Å; I941-R1174 VanDerWaalsContact CD1-O 3.3Å; I941-R1174 WeakPolarHBondContact CD1-O 3.29Å; A1170-R1174 PolarHBondContact O-N 2.82Å; A1170-R1174 VanDerWaalsContact O-N 3.09Å; K1171-R1174 PolarHBondContact O-N 2.86Å; H1172-R1174 VanDerWaalsContact C-N 3.29Å; H1172-R1174 PolarHBondContact O-N 3.47Å
1175	M	79.3	Confident	82.8	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	24%	0.237	C	C	.	.			trans	-94.5	11.5	174.9	-62.8	-172.6	74.8	0	0	112.9	A1170 M1173 R1177 Y1178 L1192 M1195	A1170-M1175 HydrophobicContact CB-CB 4.35Å; A1170-M1175 WeakPolarHBondContact O-CA 3.44Å; A1170-M1175 PolarHBondContact O-N 2.76Å; M1173-M1175 HydrophobicContact CB-CG 4.16Å; M1173-M1175 HydrophobicContact CB-SD 4.5Å; M1173-M1175 HydrophobicContact CE-SD 3.9Å; M1173-M1175 PolarHBondContact O-N 2.03Å; M1173-M1175 VanDerWaalsContact O-N 3.13Å; M1175-R1177 PolarHBondContact O-N 2.82Å; M1175-R1177 VanDerWaalsContact O-N 3.1Å; M1175-Y1178 HydrophobicContact CB-CD2 4.14Å; M1175-Y1178 HydrophobicContact CE-CD2 4.45Å; M1175-Y1178 WeakPolarHBondContact O-CD2 3.24Å; M1175-Y1178 PolarHBondContact O-N 3Å; M1175-L1192 HydrophobicContact CB-CD2 4.08Å; M1175-L1192 HydrophobicContact CE-CD2 4.27Å; M1175-L1192 HydrophobicContact CG-CD2 4.38Å; M1175-L1192 HydrophobicContact SD-CD2 3.54Å; M1175-L1192 VanDerWaalsContact SD-CD2 3.54Å; M1175-M1195 HydrophobicContact CE-CB 4.01Å; M1175-M1195 HydrophobicContact CE-CE 3.82Å; M1175-M1195 HydrophobicContact CE-CG 3.82Å; M1175-M1195 HydrophobicContact SD-CB 3.78Å; M1175-M1195 HydrophobicContact SD-CG 3.66Å
1176	E	78.6	Confident	82.6	Confident	43 Å²	43	57.8 Å²	57.8	20%	0.201	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-58.4	-23.4	-176.3	63.5	-165	158.1	0	0	114.5	G940 Y1178 I1179	G940-E1176 VanDerWaalsContact CA-OE1 3.3Å; G940-E1176 WeakPolarHBondContact CA-OE1 3.49Å; E1176-Y1178 VanDerWaalsContact C-N 3.28Å; E1176-Y1178 PolarHBondContact O-N 3.05Å; E1176-I1179 HydrophobicContact CB-CD1 4.35Å; E1176-I1179 VanDerWaalsContact O-CD1 3.29Å; E1176-I1179 WeakPolarHBondContact O-CD1 3.35Å; E1176-I1179 VanDerWaalsContact O-CG1 3.28Å; E1176-I1179 WeakPolarHBondContact O-CG1 3.48Å
1177	R	75	Confident	82.4	Confident	99 Å²	99	58.4 Å²	58.4	37%	0.374	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-60.2	-34.7	170.7	-177.3	178.1	-66.3	-175.8	3.1	113	G880 M1175 I1179	G880-R1177 VanDerWaalsContact CA-NH1 3.26Å; M1175-R1177 PolarHBondContact O-N 2.82Å; M1175-R1177 VanDerWaalsContact O-N 3.1Å; R1177-I1179 VanDerWaalsContact C-N 3.35Å; R1177-I1179 PolarHBondContact O-N 2.87Å
1178	Y	77.2	Confident	82.4	Confident	10 Å²	10	56.2 Å²	56.2	4%	0.039	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-93.3	15.1	-169.7	-48.5	-73.9	0	0	0	113.6	E882 I889 C890 H891 M1175 E1176 F1180 Y1181 L1182	E882-Y1178 HydrophobicContact CG-CD1 4.43Å; E882-Y1178 HydrophobicContact CG-CE1 4.27Å; I889-Y1178 HydrophobicContact CB-CD1 4.49Å; I889-Y1178 HydrophobicContact CD1-CD1 4.13Å; I889-Y1178 HydrophobicContact CD1-CG 3.91Å; I889-Y1178 HydrophobicContact CG1-CD1 3.93Å; I889-Y1178 HydrophobicContact CG1-CG 4.24Å; I889-Y1178 HydrophobicContact CG2-CD1 3.99Å; I889-Y1178 HydrophobicContact CG2-CD2 4.4Å; I889-Y1178 HydrophobicContact CG2-CE1 3.92Å; I889-Y1178 HydrophobicContact CG2-CE2 4.36Å; I889-Y1178 HydrophobicContact CG2-CG 4.23Å; C890-Y1178 PolarHBondContact O-OH 3.3Å; H891-Y1178 WeakPolarHBondContact CA-OH 3.41Å; H891-Y1178 HydrophobicContact CB-CE2 4.34Å; H891-Y1178 AromaticContact ND1-CE2 3.59Å; M1175-Y1178 HydrophobicContact CB-CD2 4.14Å; M1175-Y1178 HydrophobicContact CE-CD2 4.45Å; M1175-Y1178 WeakPolarHBondContact O-CD2 3.24Å; M1175-Y1178 PolarHBondContact O-N 3Å; E1176-Y1178 VanDerWaalsContact C-N 3.28Å; E1176-Y1178 PolarHBondContact O-N 3.05Å; Y1178-F1180 VanDerWaalsContact C-N 3.27Å; Y1178-F1180 PolarHBondContact O-N 2.89Å; Y1178-Y1181 PolarHBondContact O-N 2.82Å; Y1178-L1182 WeakPolarHBondContact O-CG 3.05Å; Y1178-L1182 PolarHBondContact O-N 3.06Å
1179	I	81.4	Confident	82.4	Confident	39 Å²	39	52.5 Å²	52.5	20%	0.2	25%	0.252	C	S	.	.	H	α-helix	trans	-54.2	-38	-174.6	-77.2	170.2	0	0	0	113.1	W1166 E1176 R1177 K1183	W1166-I1179 HydrophobicContact CH2-CG2 4.07Å; W1166-I1179 HydrophobicContact CZ3-CG1 4.33Å; W1166-I1179 HydrophobicContact CZ3-CG2 4.48Å; E1176-I1179 HydrophobicContact CB-CD1 4.35Å; E1176-I1179 VanDerWaalsContact O-CD1 3.29Å; E1176-I1179 WeakPolarHBondContact O-CD1 3.35Å; E1176-I1179 VanDerWaalsContact O-CG1 3.28Å; E1176-I1179 WeakPolarHBondContact O-CG1 3.48Å; R1177-I1179 VanDerWaalsContact C-N 3.35Å; R1177-I1179 PolarHBondContact O-N 2.87Å; I1179-K1183 VanDerWaalsContact O-CB 3.26Å; I1179-K1183 WeakPolarHBondContact O-CB 3.47Å; I1179-K1183 PolarHBondContact O-N 3.35Å
1180	F	76.5	Confident	82.2	Confident	87 Å²	87	54.8 Å²	54.8	38%	0.382	27%	0.266	S	S	.	.	H	α-helix	trans	-67.9	-41.2	175.9	-70.2	-11.3	0	0	0	113	N884 F937 Y1178 K1183 S1184	N884-F1180 WeakPolarHBondContact OD1-CD2 3.42Å; F937-F1180 HydrophobicContact CD2-CE2 4.3Å; F937-F1180 HydrophobicContact CE1-CE1 4.36Å; F937-F1180 HydrophobicContact CE1-CZ 4.39Å; F937-F1180 AromaticContact CE2-CD2 3.59Å; F937-F1180 HydrophobicContact CE2-CD2 3.59Å; F937-F1180 HydrophobicContact CE2-CE1 4.41Å; F937-F1180 AromaticContact CE2-CE2 3.29Å; F937-F1180 HydrophobicContact CE2-CE2 3.29Å; F937-F1180 HydrophobicContact CE2-CG 4.27Å; F937-F1180 AromaticContact CE2-CZ 3.74Å; F937-F1180 HydrophobicContact CE2-CZ 3.74Å; F937-F1180 AromaticContact CZ-CD1 3.86Å; F937-F1180 HydrophobicContact CZ-CD1 3.86Å; F937-F1180 AromaticContact CZ-CD2 3.49Å; F937-F1180 HydrophobicContact CZ-CD2 3.49Å; F937-F1180 VanDerWaalsContact CZ-CD2 3.49Å; F937-F1180 AromaticContact CZ-CE1 3.83Å; F937-F1180 HydrophobicContact CZ-CE1 3.83Å; F937-F1180 AromaticContact CZ-CE2 3.47Å; F937-F1180 HydrophobicContact CZ-CE2 3.47Å; F937-F1180 VanDerWaalsContact CZ-CE2 3.47Å; F937-F1180 AromaticContact CZ-CG 3.69Å; F937-F1180 HydrophobicContact CZ-CG 3.69Å; F937-F1180 AromaticContact CZ-CZ 3.64Å; F937-F1180 HydrophobicContact CZ-CZ 3.64Å; Y1178-F1180 VanDerWaalsContact C-N 3.27Å; Y1178-F1180 PolarHBondContact O-N 2.89Å; F1180-K1183 PolarHBondContact O-N 2.8Å; F1180-S1184 PolarHBondContact O-N 2.94Å
1181	Y	76.3	Confident	82.1	Confident	25 Å²	25	55.4 Å²	55.4	10%	0.098	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-48.9	173.5	-175.1	-75.8	0	0	0	110.9	T886 K887 I889 M900 Y1178 K1183 S1184 Q1185	T886-Y1181 VanDerWaalsContact O-CD2 3.27Å; T886-Y1181 WeakPolarHBondContact O-CD2 3.37Å; T886-Y1181 VanDerWaalsContact O-CE2 3.27Å; T886-Y1181 WeakPolarHBondContact O-CE2 3.49Å; K887-Y1181 WeakPolarHBondContact O-CE2 3.31Å; K887-Y1181 PolarHBondContact O-OH 3.02Å; I889-Y1181 HydrophobicContact CD1-CD1 3.31Å; I889-Y1181 HydrophobicContact CD1-CD2 4.41Å; I889-Y1181 HydrophobicContact CD1-CE1 3.8Å; I889-Y1181 HydrophobicContact CD1-CG 3.66Å; I889-Y1181 HydrophobicContact CG1-CD1 3.76Å; I889-Y1181 HydrophobicContact CG1-CD2 3.98Å; I889-Y1181 HydrophobicContact CG1-CE1 4.05Å; I889-Y1181 HydrophobicContact CG1-CE2 4.25Å; I889-Y1181 HydrophobicContact CG1-CG 3.72Å; M900-Y1181 HydrophobicContact CE-CD1 4.37Å; M900-Y1181 HydrophobicContact CE-CE1 3.38Å; Y1178-Y1181 PolarHBondContact O-N 2.82Å; Y1181-K1183 PolarHBondContact O-N 3.27Å; Y1181-S1184 PolarHBondContact O-N 2.9Å; Y1181-S1184 PolarHBondContact O-OG 3.24Å; Y1181-Q1185 HydrophobicContact CD1-CG 3.87Å; Y1181-Q1185 HydrophobicContact CE1-CG 3.64Å; Y1181-Q1185 VanDerWaalsContact CE1-NE2 3.32Å; Y1181-Q1185 WeakPolarHBondContact O-CG 3.38Å; Y1181-Q1185 PolarHBondContact O-N 2.97Å
1182	L	83.3	Confident	82.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.8	-40.7	179.2	-70.9	169	0	0	0	110.9	W1166 A1170 Y1178 S1184 Q1185 P1188 V1191 L1192	W1166-L1182 HydrophobicContact CE3-CB 4.23Å; W1166-L1182 HydrophobicContact CE3-CD1 4.47Å; W1166-L1182 HydrophobicContact CH2-CB 4.01Å; W1166-L1182 HydrophobicContact CZ3-CB 3.55Å; W1166-L1182 HydrophobicContact CZ3-CD1 4.05Å; W1166-L1182 HydrophobicContact CZ3-CG 4.46Å; A1170-L1182 HydrophobicContact CB-CD1 3.96Å; Y1178-L1182 WeakPolarHBondContact O-CG 3.05Å; Y1178-L1182 PolarHBondContact O-N 3.06Å; L1182-S1184 VanDerWaalsContact C-N 3.29Å; L1182-S1184 PolarHBondContact O-N 3.13Å; L1182-Q1185 PolarHBondContact O-N 2.75Å; L1182-P1188 HydrophobicContact CB-CB 4.4Å; L1182-P1188 WeakPolarHBondContact O-CG 3.18Å; L1182-V1191 HydrophobicContact CD2-CB 3.97Å; L1182-V1191 HydrophobicContact CD2-CG1 3.63Å; L1182-L1192 HydrophobicContact CD1-CD2 3.84Å; L1182-L1192 HydrophobicContact CD1-CG 4.47Å; L1182-L1192 HydrophobicContact CD2-CD2 4.08Å; L1182-L1192 HydrophobicContact CD2-CG 4.2Å
1183	K	83.3	Confident	82.2	Confident	108 Å²	108	45.2 Å²	45.2	47%	0.47	23%	0.225	S	C	.	.	H	α-helix	trans	-67	-20.8	174.9	-173.9	162.9	-176.2	164.6	0	114.5	E1163 W1166 I1179 F1180 Y1181	E1163-K1183 VanDerWaalsContact OE1-CE 3.27Å; E1163-K1183 WeakPolarHBondContact OE1-CE 3Å; E1163-K1183 IonicContact OE1-NZ 2.72Å; E1163-K1183 PolarHBondContact OE1-NZ 2.69Å; E1163-K1183 IonicContact OE2-NZ 3.49Å; E1163-K1183 PolarHBondContact OE2-NZ 3.36Å; W1166-K1183 HydrophobicContact CH2-CB 4Å; W1166-K1183 HydrophobicContact CZ2-CB 4.05Å; I1179-K1183 VanDerWaalsContact O-CB 3.26Å; I1179-K1183 WeakPolarHBondContact O-CB 3.47Å; I1179-K1183 PolarHBondContact O-N 3.35Å; F1180-K1183 PolarHBondContact O-N 2.8Å; Y1181-K1183 PolarHBondContact O-N 3.27Å
1184	S	79	Confident	82	Confident	79 Å²	79	45.9 Å²	45.9	55%	0.552	23%	0.229	S	C	*	.	H	α-helix	trans	-85.1	-8.6	174.2	80	0	0	0	0	113.7	F1180 Y1181 L1182	F1180-S1184 PolarHBondContact O-N 2.94Å; Y1181-S1184 PolarHBondContact O-N 2.9Å; Y1181-S1184 PolarHBondContact O-OG 3.24Å; L1182-S1184 VanDerWaalsContact C-N 3.29Å; L1182-S1184 PolarHBondContact O-N 3.13Å
1185	Q	79	Confident	82	Confident	38 Å²	38	38 Å²	38	18%	0.178	20%	0.199	C	C	.	.	S	Bend	trans	-85.6	147.9	-178.8	-59	-55.5	-66.1	0	0	112.3	Y1181 L1182 S1187 V1191	Y1181-Q1185 HydrophobicContact CD1-CG 3.87Å; Y1181-Q1185 HydrophobicContact CE1-CG 3.64Å; Y1181-Q1185 VanDerWaalsContact CE1-NE2 3.32Å; Y1181-Q1185 WeakPolarHBondContact O-CG 3.38Å; Y1181-Q1185 PolarHBondContact O-N 2.97Å; L1182-Q1185 PolarHBondContact O-N 2.75Å; Q1185-S1187 PolarHBondContact O-N 3.02Å; Q1185-S1187 VanDerWaalsContact O-N 3.07Å; Q1185-V1191 HydrophobicContact CB-CG2 4.3Å; Q1185-V1191 HydrophobicContact CG-CG2 4.07Å
1186	P	82.2	Confident	82.2	Confident	134 Å²	134	38.1 Å²	38.1	87%	0.87	20%	0.199	S	C	*	.	S	Bend	trans	-60.7	-18.6	177.3	-25	34.7	0	0	0	115.1
1187	S	86.4	Confident	82.3	Confident	19 Å²	19	37.3 Å²	37.3	13%	0.133	20%	0.196	C	C	.	.			trans	-152.9	100.5	172	168.8	0	0	0	0	108.3	D1160 Q1185 T1189 T1190	D1160-S1187 VanDerWaalsContact OD2-CB 3.28Å; D1160-S1187 WeakPolarHBondContact OD2-CB 3.47Å; D1160-S1187 PolarHBondContact OD2-OG 3Å; Q1185-S1187 PolarHBondContact O-N 3.02Å; Q1185-S1187 VanDerWaalsContact O-N 3.07Å; S1187-T1189 PolarHBondContact O-N 2.96Å; S1187-T1190 VanDerWaalsContact CB-OG1 3.25Å; S1187-T1190 WeakPolarHBondContact CB-OG1 3.39Å; S1187-T1190 PolarHBondContact O-N 3.06Å; S1187-T1190 WeakPolarHBondContact OG-CB 3.36Å; S1187-T1190 PolarHBondContact OG-N 2.96Å; S1187-T1190 VanDerWaalsContact OG-N 3.08Å; S1187-T1190 PolarHBondContact OG-OG1 2.88Å
1188	P	87.9	Confident	82.2	Confident	13 Å²	13	32.8 Å²	32.8	8%	0.084	18%	0.179	C	C	.	.	H	α-helix	trans	-52.9	-43.1	173.6	-23.7	29	0	0	0	112.1	D1160 W1166 L1182 T1190 V1191 L1192	D1160-P1188 WeakPolarHBondContact OD1-CD 3.38Å; W1166-P1188 HydrophobicContact CB-CB 4.14Å; W1166-P1188 HydrophobicContact CD2-CB 3.45Å; W1166-P1188 VanDerWaalsContact CD2-CB 3.45Å; W1166-P1188 HydrophobicContact CD2-CG 3.95Å; W1166-P1188 HydrophobicContact CE3-CB 3.77Å; W1166-P1188 HydrophobicContact CG-CB 3.63Å; W1166-P1188 HydrophobicContact CG-CG 4.12Å; W1166-P1188 HydrophobicContact CZ2-CB 4.38Å; W1166-P1188 HydrophobicContact CZ2-CG 4.21Å; W1166-P1188 HydrophobicContact CZ3-CB 4.36Å; L1182-P1188 HydrophobicContact CB-CB 4.4Å; L1182-P1188 WeakPolarHBondContact O-CG 3.18Å; P1188-T1190 PolarHBondContact O-N 2.76Å; P1188-V1191 PolarHBondContact O-N 2.8Å; P1188-L1192 WeakPolarHBondContact O-CG 3.31Å; P1188-L1192 PolarHBondContact O-N 2.86Å; P1188-L1192 VanDerWaalsContact O-N 3.13Å
1189	T	90.1	Very high	82.1	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.8	-36.9	-179	-56.3	0	0	0	0	112.6	C1156 L1159 D1160 L1169 S1187 V1191 L1192 L1193	C1156-T1189 HydrophobicContact CB-CG2 4.38Å; L1159-T1189 HydrophobicContact CB-CG2 3.94Å; L1159-T1189 VanDerWaalsContact CB-OG1 3.24Å; L1159-T1189 WeakPolarHBondContact CB-OG1 3.35Å; L1159-T1189 HydrophobicContact CD1-CG2 3.7Å; L1159-T1189 HydrophobicContact CG-CG2 4.45Å; D1160-T1189 WeakPolarHBondContact OD1-CB 3.13Å; D1160-T1189 PolarHBondContact OD1-N 3.23Å; D1160-T1189 PolarHBondContact OD1-OG1 2.95Å; L1169-T1189 HydrophobicContact CD2-CG2 4.35Å; S1187-T1189 PolarHBondContact O-N 2.96Å; T1189-V1191 VanDerWaalsContact C-N 3.28Å; T1189-V1191 PolarHBondContact O-N 2.95Å; T1189-L1192 PolarHBondContact O-N 3.45Å; T1189-L1193 HydrophobicContact CG2-CD1 3.86Å; T1189-L1193 HydrophobicContact CG2-CG 4.09Å; T1189-L1193 WeakPolarHBondContact O-CG 3.36Å; T1189-L1193 PolarHBondContact O-N 2.93Å
1190	T	85.6	Confident	81.7	Confident	47 Å²	47	34 Å²	34	29%	0.288	19%	0.19	S	C	.	.	H	α-helix	trans	-60.4	-40.4	176.5	-60	0	0	0	0	111.1	C1156 S1187 P1188 N1194	C1156-T1190 PolarHBondContact SG-N 2.89Å; C1156-T1190 VanDerWaalsContact SG-N 3.45Å; C1156-T1190 PolarHBondContact SG-OG1 2.96Å; S1187-T1190 VanDerWaalsContact CB-OG1 3.25Å; S1187-T1190 WeakPolarHBondContact CB-OG1 3.39Å; S1187-T1190 PolarHBondContact O-N 3.06Å; S1187-T1190 WeakPolarHBondContact OG-CB 3.36Å; S1187-T1190 PolarHBondContact OG-N 2.96Å; S1187-T1190 VanDerWaalsContact OG-N 3.08Å; S1187-T1190 PolarHBondContact OG-OG1 2.88Å; P1188-T1190 PolarHBondContact O-N 2.76Å; T1190-N1194 WeakPolarHBondContact O-CB 3.34Å; T1190-N1194 PolarHBondContact O-N 3.11Å; T1190-N1194 PolarHBondContact O-ND2 3.21Å; T1190-N1194 PolarHBondContact O-OD1 2.8Å
1191	V	84.1	Confident	81.3	Confident	13 Å²	13	31.7 Å²	31.7	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-68.5	-41.5	178.1	172.8	0	0	0	0	111.6	M900 L1182 Q1185 P1188 T1189 N1194 M1195	M900-V1191 HydrophobicContact CE-CG1 3.61Å; M900-V1191 HydrophobicContact CE-CG2 4.27Å; M900-V1191 HydrophobicContact SD-CG1 3.99Å; M900-V1191 HydrophobicContact SD-CG2 4.47Å; L1182-V1191 HydrophobicContact CD2-CB 3.97Å; L1182-V1191 HydrophobicContact CD2-CG1 3.63Å; Q1185-V1191 HydrophobicContact CB-CG2 4.3Å; Q1185-V1191 HydrophobicContact CG-CG2 4.07Å; P1188-V1191 PolarHBondContact O-N 2.8Å; T1189-V1191 VanDerWaalsContact C-N 3.28Å; T1189-V1191 PolarHBondContact O-N 2.95Å; V1191-N1194 PolarHBondContact O-N 2.78Å; V1191-M1195 PolarHBondContact O-N 3.07Å
1192	L	87.8	Confident	80.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-46.8	175	-65.6	172.3	0	0	0	111.5	W1166 L1169 A1170 M1173 M1175 L1182 P1188 T1189 M1195 W1196	W1166-L1192 HydrophobicContact CB-CD1 4.22Å; W1166-L1192 WeakPolarHBondContact O-CD1 3.47Å; L1169-L1192 HydrophobicContact CB-CD1 4.06Å; L1169-L1192 HydrophobicContact CD2-CB 3.89Å; L1169-L1192 HydrophobicContact CD2-CD1 3.88Å; L1169-L1192 HydrophobicContact CG-CB 4.3Å; L1169-L1192 HydrophobicContact CG-CD1 3.93Å; A1170-L1192 HydrophobicContact CB-CD1 3.99Å; A1170-L1192 HydrophobicContact CB-CD2 3.82Å; M1173-L1192 VanDerWaalsContact CE-O 3.28Å; M1173-L1192 WeakPolarHBondContact CE-O 3.35Å; M1173-L1192 HydrophobicContact SD-CB 4.11Å; M1173-L1192 HydrophobicContact SD-CD2 4.48Å; M1175-L1192 HydrophobicContact CB-CD2 4.08Å; M1175-L1192 HydrophobicContact CE-CD2 4.27Å; M1175-L1192 HydrophobicContact CG-CD2 4.38Å; M1175-L1192 HydrophobicContact SD-CD2 3.54Å; M1175-L1192 VanDerWaalsContact SD-CD2 3.54Å; L1182-L1192 HydrophobicContact CD1-CD2 3.84Å; L1182-L1192 HydrophobicContact CD1-CG 4.47Å; L1182-L1192 HydrophobicContact CD2-CD2 4.08Å; L1182-L1192 HydrophobicContact CD2-CG 4.2Å; P1188-L1192 WeakPolarHBondContact O-CG 3.31Å; P1188-L1192 PolarHBondContact O-N 2.86Å; P1188-L1192 VanDerWaalsContact O-N 3.13Å; T1189-L1192 PolarHBondContact O-N 3.45Å; L1192-M1195 PolarHBondContact O-N 2.91Å; L1192-W1196 PolarHBondContact O-N 2.86Å
1193	L	87.3	Confident	79.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-40.1	178.8	-67.1	177	0	0	0	112.4	L1147 T1152 L1155 T1189 M1195 W1196 E1197 L1209 F1213	L1147-L1193 HydrophobicContact CD1-CB 4.25Å; L1147-L1193 HydrophobicContact CD1-CD1 4.44Å; L1147-L1193 HydrophobicContact CD1-CD2 3.99Å; L1147-L1193 HydrophobicContact CD1-CG 4.46Å; T1152-L1193 HydrophobicContact CG2-CD1 3.94Å; L1155-L1193 HydrophobicContact CB-CD1 3.91Å; L1155-L1193 HydrophobicContact CD1-CD1 4.02Å; L1155-L1193 HydrophobicContact CD1-CD2 4.44Å; T1189-L1193 HydrophobicContact CG2-CD1 3.86Å; T1189-L1193 HydrophobicContact CG2-CG 4.09Å; T1189-L1193 WeakPolarHBondContact O-CG 3.36Å; T1189-L1193 PolarHBondContact O-N 2.93Å; L1193-M1195 VanDerWaalsContact C-N 3.3Å; L1193-M1195 PolarHBondContact O-N 3.45Å; L1193-W1196 PolarHBondContact O-N 2.96Å; L1193-E1197 PolarHBondContact O-N 3.06Å; L1193-L1209 HydrophobicContact CD2-CD1 4.08Å; L1193-L1209 HydrophobicContact CD2-CD2 3.78Å; L1193-F1213 HydrophobicContact CD2-CZ 4.43Å
1194	N	81	Confident	78.2	Confident	40 Å²	40	36.4 Å²	36.4	21%	0.214	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-37.6	173.8	-71.7	-7.7	0	0	0	112.1	L817 T1190 V1191 A1198	L817-N1194 WeakPolarHBondContact CD2-O 3.18Å; T1190-N1194 WeakPolarHBondContact O-CB 3.34Å; T1190-N1194 PolarHBondContact O-N 3.11Å; T1190-N1194 PolarHBondContact O-ND2 3.21Å; T1190-N1194 PolarHBondContact O-OD1 2.8Å; V1191-N1194 PolarHBondContact O-N 2.78Å; N1194-A1198 WeakPolarHBondContact O-CB 2.95Å; N1194-A1198 PolarHBondContact O-N 2.92Å
1195	M	81.4	Confident	77.5	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-68.3	-43.1	173.9	-165.8	66.5	74.6	0	0	111	L817 I889 H891 H898 M1173 M1175 V1191 L1192 L1193 E1197 A1198 C1199	L817-M1195 HydrophobicContact CD1-CE 4.01Å; L817-M1195 HydrophobicContact CD1-SD 4.2Å; L817-M1195 HydrophobicContact CD2-SD 4.19Å; I889-M1195 HydrophobicContact CG2-CE 4.42Å; H891-M1195 HydrophobicContact CB-CE 4.16Å; H891-M1195 HydrophobicContact CB-SD 4.45Å; H898-M1195 HydrophobicContact CB-CE 4.1Å; H898-M1195 HydrophobicContact CB-SD 3.41Å; H898-M1195 WeakPolarHBondContact CB-SD 3.11Å; M1173-M1195 HydrophobicContact CE-CB 4.2Å; M1175-M1195 HydrophobicContact CE-CB 4.01Å; M1175-M1195 HydrophobicContact CE-CE 3.82Å; M1175-M1195 HydrophobicContact CE-CG 3.82Å; M1175-M1195 HydrophobicContact SD-CB 3.78Å; M1175-M1195 HydrophobicContact SD-CG 3.66Å; V1191-M1195 PolarHBondContact O-N 3.07Å; L1192-M1195 PolarHBondContact O-N 2.91Å; L1193-M1195 VanDerWaalsContact C-N 3.3Å; L1193-M1195 PolarHBondContact O-N 3.45Å; M1195-E1197 PolarHBondContact O-N 3.09Å; M1195-A1198 WeakPolarHBondContact O-CA 3.48Å; M1195-A1198 PolarHBondContact O-N 3.05Å; M1195-C1199 PolarHBondContact O-N 2.04Å; M1195-C1199 PolarHBondContact O-SG 3.04Å; M1195-C1199 VanDerWaalsContact O-SG 3.38Å
1196	W	83.8	Confident	77.6	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.015	21%	0.205	C	C	.	.	H	α-helix	trans	-58.3	-45.5	178.4	-179.2	79.4	0	0	0	111.9	L1147 M1173 L1192 L1193 A1198 C1199 N1200 V1206 E1208 L1209	L1147-W1196 HydrophobicContact CD1-CE3 4.33Å; L1147-W1196 HydrophobicContact CD1-CZ3 4.48Å; L1147-W1196 HydrophobicContact CG-CZ3 4.39Å; M1173-W1196 HydrophobicContact CE-CB 3.63Å; M1173-W1196 HydrophobicContact SD-CB 4.15Å; L1192-W1196 PolarHBondContact O-N 2.86Å; L1193-W1196 PolarHBondContact O-N 2.96Å; W1196-A1198 VanDerWaalsContact C-N 3.27Å; W1196-A1198 PolarHBondContact O-N 3.45Å; W1196-C1199 PolarHBondContact O-N 3.33Å; W1196-N1200 HydrophobicContact CH2-CB 4.5Å; W1196-N1200 HydrophobicContact CZ2-CB 4Å; W1196-N1200 PolarHBondContact NE1-ND2 2.88Å; W1196-N1200 WeakPolarHBondContact O-CB 3.41Å; W1196-N1200 PolarHBondContact O-N 2.84Å; W1196-V1206 HydrophobicContact CH2-CB 4.38Å; W1196-V1206 HydrophobicContact CH2-CG1 4.04Å; W1196-V1206 HydrophobicContact CZ3-CG1 4.42Å; W1196-E1208 PolarHBondContact NE1-OE2 2.7Å; W1196-L1209 HydrophobicContact CD2-CB 4.16Å; W1196-L1209 HydrophobicContact CD2-CD1 4.34Å; W1196-L1209 HydrophobicContact CD2-CD2 4.21Å; W1196-L1209 HydrophobicContact CD2-CG 4.47Å; W1196-L1209 HydrophobicContact CE3-CD2 4.06Å; W1196-L1209 HydrophobicContact CG-CD1 4.22Å; W1196-L1209 HydrophobicContact CH2-CB 4.33Å; W1196-L1209 HydrophobicContact CZ2-CB 3.85Å; W1196-L1209 HydrophobicContact CZ3-CD2 4.33Å
1197	E	80	Confident	77.6	Confident	26 Å²	26	33 Å²	33	12%	0.121	19%	0.189	C	C	.	.	H	α-helix	trans	-62.4	-32.9	174.5	-70.9	-158.8	142.6	0	0	113.1	R1146 L1147 L1193 M1195	R1146-E1197 WeakPolarHBondContact CA-OE1 3.43Å; R1146-E1197 WeakPolarHBondContact CB-OE1 3.49Å; R1146-E1197 PolarHBondContact N-OE1 3.36Å; L1147-E1197 HydrophobicContact CD1-CG 4.42Å; L1147-E1197 PolarHBondContact N-OE1 3.15Å; L1193-E1197 PolarHBondContact O-N 3.06Å; M1195-E1197 PolarHBondContact O-N 3.09Å
1198	A	73.7	Confident	77.4	Confident	4 Å²	4	36.5 Å²	36.5	3%	0.033	20%	0.203	C	C	.	.	H	α-helix	trans	-79.1	-29	-179.2	0	0	0	0	0	113.8	L817 H898 N1194 M1195 W1196 R1201	L817-A1198 HydrophobicContact CD2-CB 3.48Å; L817-A1198 VanDerWaalsContact CD2-CB 3.48Å; L817-A1198 HydrophobicContact CG-CB 4.27Å; H898-A1198 PolarHBondContact CE1-O 3.17Å; H898-A1198 VanDerWaalsContact CE1-O 3.28Å; N1194-A1198 WeakPolarHBondContact O-CB 2.95Å; N1194-A1198 PolarHBondContact O-N 2.92Å; M1195-A1198 WeakPolarHBondContact O-CA 3.48Å; M1195-A1198 PolarHBondContact O-N 3.05Å; W1196-A1198 VanDerWaalsContact C-N 3.27Å; W1196-A1198 PolarHBondContact O-N 3.45Å; A1198-R1201 WeakPolarHBondContact O-CD 3.42Å; A1198-R1201 WeakPolarHBondContact O-CG 3.33Å; A1198-R1201 PolarHBondContact O-NE 2.82Å
1199	C	74.3	Confident	77.3	Confident	46 Å²	46	35.9 Å²	35.9	31%	0.311	20%	0.199	S	C	.	.	H	α-helix	trans	-79.1	-43.3	171.6	-61.3	0	0	0	0	111.2	D893 M1195 W1196 R1201	D893-C1199 PolarHBondContact OD2-SG 3.21Å; M1195-C1199 PolarHBondContact O-N 2.04Å; M1195-C1199 PolarHBondContact O-SG 3.04Å; M1195-C1199 VanDerWaalsContact O-SG 3.38Å; W1196-C1199 PolarHBondContact O-N 3.33Å; C1199-R1201 VanDerWaalsContact C-N 3.32Å; C1199-R1201 PolarHBondContact O-N 3.02Å
1200	N	72.9	Confident	77.2	Confident	30 Å²	30	38.3 Å²	38.3	16%	0.16	21%	0.21	C	C	.	.			trans	-89.5	31.2	-174.6	-81.4	-80.1	0	0	0	114.9	R1146 W1196 D1202 E1208	R1146-N1200 PolarHBondContact NH1-O 3.38Å; R1146-N1200 PolarHBondContact NH2-O 2.89Å; R1146-N1200 VanDerWaalsContact NH2-O 3.07Å; W1196-N1200 HydrophobicContact CH2-CB 4.5Å; W1196-N1200 HydrophobicContact CZ2-CB 4Å; W1196-N1200 PolarHBondContact NE1-ND2 2.88Å; W1196-N1200 WeakPolarHBondContact O-CB 3.41Å; W1196-N1200 PolarHBondContact O-N 2.84Å; N1200-D1202 PolarHBondContact O-N 2.93Å; N1200-D1202 VanDerWaalsContact O-N 3.12Å; N1200-E1208 PolarHBondContact ND2-OE2 3.41Å
1201	R	68.1	Low	77.2	Confident	38 Å²	38	38.8 Å²	38.8	14%	0.143	22%	0.219	C	C	.	.	S	Bend	trans	-53.7	-34.5	-176.5	-72.3	167.9	-179.3	-75.6	-12.7	114.2	T764 R1146 A1198 C1199	T764-R1201 PolarHBondContact OG1-NH2 3.22Å; T764-R1201 VanDerWaalsContact OG1-NH2 3.09Å; R1146-R1201 VanDerWaalsContact NH2-C 3.3Å; R1146-R1201 PolarHBondContact NH2-O 3.4Å; A1198-R1201 WeakPolarHBondContact O-CD 3.42Å; A1198-R1201 WeakPolarHBondContact O-CG 3.33Å; A1198-R1201 PolarHBondContact O-NE 2.82Å; C1199-R1201 VanDerWaalsContact C-N 3.32Å; C1199-R1201 PolarHBondContact O-N 3.02Å
1202	D	60	Low	77.3	Confident	44 Å²	44	39.1 Å²	39.1	24%	0.235	22%	0.22	C	C	.	.	S	Bend	trans	-94.2	-36.5	-167.1	-55.6	7.7	0	0	0	113	F1128 N1200 P1204	F1128-D1202 WeakPolarHBondContact CD2-OD2 3.29Å; F1128-D1202 VanDerWaalsContact CE1-OD1 3.3Å; F1128-D1202 WeakPolarHBondContact CE1-OD1 3.44Å; F1128-D1202 WeakPolarHBondContact CE2-OD2 3.23Å; F1128-D1202 WeakPolarHBondContact CZ-OD1 3.17Å; N1200-D1202 PolarHBondContact O-N 2.93Å; N1200-D1202 VanDerWaalsContact O-N 3.12Å; D1202-P1204 WeakPolarHBondContact O-CD 3.37Å
1203	E	62.1	Low	77.4	Confident	73 Å²	73	39.1 Å²	39.1	34%	0.341	22%	0.22	S	C	.	.			trans	-80.8	117.9	-176.2	-87.5	-65	149.3	0	0	109.9	R1127 R1146 S1205	R1127-E1203 IonicContact CZ-OE1 3.65Å; R1127-E1203 IonicContact NH1-OE1 3.64Å; R1127-E1203 PolarHBondContact NH1-OE1 2.81Å; R1146-E1203 VanDerWaalsContact CZ-O 3.27Å; R1146-E1203 PolarHBondContact NH1-O 2.83Å; R1146-E1203 PolarHBondContact NH2-O 2.83Å; E1203-S1205 PolarHBondContact O-N 2.83Å
1204	P	54.6	Low	77.5	Confident	114 Å²	114	42.2 Å²	42.2	74%	0.74	24%	0.242	S	C	*	.			trans	-78	14.5	-165.9	32.2	-38	0	0	0	114.4	D1202	D1202-P1204 WeakPolarHBondContact O-CD 3.37Å
1205	S	64.4	Low	77.8	Confident	40 Å²	40	43.3 Å²	43.3	28%	0.28	26%	0.256	S	S	.	.			trans	-131.5	136.6	-172.3	78.9	0	0	0	0	113.9	E1203 N1207	E1203-S1205 PolarHBondContact O-N 2.83Å; S1205-N1207 VanDerWaalsContact CB-ND2 3.28Å; S1205-N1207 WeakPolarHBondContact CB-ND2 3.11Å; S1205-N1207 PolarHBondContact O-N 2.88Å; S1205-N1207 VanDerWaalsContact O-N 3.12Å; S1205-N1207 PolarHBondContact OG-ND2 3.43Å
1206	V	81.5	Confident	78.1	Confident	40 Å²	40	43.5 Å²	43.5	24%	0.242	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	9	171.2	-63.8	0	0	0	0	113.3	L1147 W1196 E1208 L1209 K1210 L1225	L1147-V1206 HydrophobicContact CD2-CG1 4.09Å; W1196-V1206 HydrophobicContact CH2-CB 4.38Å; W1196-V1206 HydrophobicContact CH2-CG1 4.04Å; W1196-V1206 HydrophobicContact CZ3-CG1 4.42Å; V1206-E1208 VanDerWaalsContact C-N 3.29Å; V1206-E1208 PolarHBondContact O-N 2.86Å; V1206-L1209 PolarHBondContact O-N 2.74Å; V1206-K1210 WeakPolarHBondContact O-CB 3.41Å; V1206-K1210 PolarHBondContact O-N 2.89Å; V1206-L1225 HydrophobicContact CG2-CB 4.09Å
1207	N	82.7	Confident	78.2	Confident	101 Å²	101	50.4 Å²	50.4	54%	0.54	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-32.2	-175.7	-71.6	-39.3	0	0	0	112.9	S1205 A1211	S1205-N1207 VanDerWaalsContact CB-ND2 3.28Å; S1205-N1207 WeakPolarHBondContact CB-ND2 3.11Å; S1205-N1207 PolarHBondContact O-N 2.88Å; S1205-N1207 VanDerWaalsContact O-N 3.12Å; S1205-N1207 PolarHBondContact OG-ND2 3.43Å; N1207-A1211 VanDerWaalsContact O-CB 3.32Å; N1207-A1211 WeakPolarHBondContact O-CB 3.27Å; N1207-A1211 PolarHBondContact O-N 3.15Å
1208	E	82	Confident	78.5	Confident	91 Å²	91	50.6 Å²	50.6	43%	0.425	29%	0.294	S	S	.	.	H	α-helix	trans	-65.7	-51.6	174.6	-169.7	-162.1	-130.9	0	0	110.9	W1196 N1200 V1206 K1210 A1211 I1212	W1196-E1208 PolarHBondContact NE1-OE2 2.7Å; N1200-E1208 PolarHBondContact ND2-OE2 3.41Å; V1206-E1208 VanDerWaalsContact C-N 3.29Å; V1206-E1208 PolarHBondContact O-N 2.86Å; E1208-K1210 VanDerWaalsContact C-N 3.26Å; E1208-K1210 PolarHBondContact O-N 2.92Å; E1208-A1211 CarbonylContact O-C 3.57Å; E1208-A1211 WeakPolarHBondContact O-CA 3.34Å; E1208-A1211 WeakPolarHBondContact O-CB 3.12Å; E1208-A1211 PolarHBondContact O-N 3.29Å; E1208-I1212 HydrophobicContact CG-CD1 4.15Å; E1208-I1212 WeakPolarHBondContact O-CG1 3.33Å; E1208-I1212 PolarHBondContact O-N 3.18Å
1209	L	86.7	Confident	79.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.3	-38	177.8	-171.2	65.3	0	0	0	111.6	L1147 L1169 L1193 W1196 V1206 I1212 F1213 L1225	L1147-L1209 HydrophobicContact CD1-CD2 4.07Å; L1147-L1209 HydrophobicContact CD2-CD2 4.22Å; L1169-L1209 HydrophobicContact CD1-CD1 4.23Å; L1193-L1209 HydrophobicContact CD2-CD1 4.08Å; L1193-L1209 HydrophobicContact CD2-CD2 3.78Å; W1196-L1209 HydrophobicContact CD2-CB 4.16Å; W1196-L1209 HydrophobicContact CD2-CD1 4.34Å; W1196-L1209 HydrophobicContact CD2-CD2 4.21Å; W1196-L1209 HydrophobicContact CD2-CG 4.47Å; W1196-L1209 HydrophobicContact CE3-CD2 4.06Å; W1196-L1209 HydrophobicContact CG-CD1 4.22Å; W1196-L1209 HydrophobicContact CH2-CB 4.33Å; W1196-L1209 HydrophobicContact CZ2-CB 3.85Å; W1196-L1209 HydrophobicContact CZ3-CD2 4.33Å; V1206-L1209 PolarHBondContact O-N 2.74Å; L1209-I1212 PolarHBondContact O-N 2.97Å; L1209-F1213 HydrophobicContact CD1-CE1 4.31Å; L1209-F1213 HydrophobicContact CD1-CE2 4.11Å; L1209-F1213 HydrophobicContact CD1-CZ 3.88Å; L1209-F1213 HydrophobicContact CD2-CE2 3.99Å; L1209-F1213 HydrophobicContact CD2-CZ 4.29Å; L1209-F1213 HydrophobicContact CG-CD2 4.17Å; L1209-F1213 HydrophobicContact CG-CE2 3.66Å; L1209-F1213 HydrophobicContact CG-CZ 3.97Å; L1209-F1213 WeakPolarHBondContact O-CD2 3.39Å; L1209-F1213 WeakPolarHBondContact O-CG 3.35Å; L1209-F1213 PolarHBondContact O-N 2.7Å; L1209-L1225 HydrophobicContact CB-CD1 3.98Å; L1209-L1225 HydrophobicContact CD2-CD1 3.89Å; L1209-L1225 HydrophobicContact CD2-CD2 4.24Å; L1209-L1225 HydrophobicContact CG-CD1 3.84Å
1210	K	86.4	Confident	79.8	Confident	51 Å²	51	54.2 Å²	54.2	22%	0.222	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-39.8	172.7	-169.3	-179.1	-179	-178.3	0	112.8	V1206 E1208 S1214 A1222 L1225 E1226	V1206-K1210 WeakPolarHBondContact O-CB 3.41Å; V1206-K1210 PolarHBondContact O-N 2.89Å; E1208-K1210 VanDerWaalsContact C-N 3.26Å; E1208-K1210 PolarHBondContact O-N 2.92Å; K1210-S1214 WeakPolarHBondContact O-CB 3.38Å; K1210-S1214 PolarHBondContact O-N 3.04Å; K1210-S1214 PolarHBondContact O-OG 2.96Å; K1210-A1222 HydrophobicContact CG-CB 3.95Å; K1210-L1225 HydrophobicContact CB-CD1 4.04Å; K1210-E1226 WeakPolarHBondContact CE-OE1 3.33Å; K1210-E1226 VanDerWaalsContact NZ-CG 3.32Å; K1210-E1226 IonicContact NZ-OE1 3.45Å; K1210-E1226 PolarHBondContact NZ-OE1 2.78Å
1211	A	86.7	Confident	80.5	Confident	58 Å²	58	52.8 Å²	52.8	48%	0.479	31%	0.31	S	S	.	.	H	α-helix	trans	-68.3	-38.6	174.4	0	0	0	0	0	111.6	N1207 E1208 S1214 A1215	N1207-A1211 VanDerWaalsContact O-CB 3.32Å; N1207-A1211 WeakPolarHBondContact O-CB 3.27Å; N1207-A1211 PolarHBondContact O-N 3.15Å; E1208-A1211 CarbonylContact O-C 3.57Å; E1208-A1211 WeakPolarHBondContact O-CA 3.34Å; E1208-A1211 WeakPolarHBondContact O-CB 3.12Å; E1208-A1211 PolarHBondContact O-N 3.29Å; A1211-S1214 WeakPolarHBondContact O-CB 3.1Å; A1211-S1214 PolarHBondContact O-N 2.82Å; A1211-A1215 WeakPolarHBondContact O-CB 3.42Å; A1211-A1215 PolarHBondContact O-N 3.27Å
1212	I	86.5	Confident	81.3	Confident	20 Å²	20	51.1 Å²	51.1	10%	0.103	30%	0.304	C	S	.	.	H	α-helix	trans	-61.3	-51.1	173.4	-69.8	166.8	0	0	0	110.4	L1169 H1172 E1208 L1209 S1214 A1215 M1216	L1169-I1212 HydrophobicContact CD1-CG2 3.7Å; H1172-I1212 HydrophobicContact CB-CG1 4.27Å; H1172-I1212 HydrophobicContact CB-CG2 3.6Å; E1208-I1212 HydrophobicContact CG-CD1 4.15Å; E1208-I1212 WeakPolarHBondContact O-CG1 3.33Å; E1208-I1212 PolarHBondContact O-N 3.18Å; L1209-I1212 PolarHBondContact O-N 2.97Å; I1212-S1214 VanDerWaalsContact C-N 3.27Å; I1212-S1214 PolarHBondContact O-N 3.18Å; I1212-A1215 CarbonylContact O-C 3.53Å; I1212-A1215 PolarHBondContact O-N 2.98Å; I1212-A1215 VanDerWaalsContact O-N 3.08Å; I1212-M1216 HydrophobicContact CG2-CG 4.47Å; I1212-M1216 HydrophobicContact CG2-SD 3.84Å; I1212-M1216 VanDerWaalsContact O-CG 3.28Å; I1212-M1216 WeakPolarHBondContact O-CG 3.3Å; I1212-M1216 PolarHBondContact O-N 2.96Å
1213	F	90.3	Very high	82.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-34.8	175.7	-67.8	-33	0	0	0	112.8	L1155 L1159 L1169 L1193 L1209 M1216 R1218 C1221 A1222 L1225	L1155-F1213 HydrophobicContact CD1-CE2 3.95Å; L1155-F1213 HydrophobicContact CD1-CZ 4.17Å; L1155-F1213 HydrophobicContact CD2-CD2 4.47Å; L1155-F1213 HydrophobicContact CD2-CE2 3.65Å; L1155-F1213 HydrophobicContact CD2-CZ 3.94Å; L1155-F1213 HydrophobicContact CG-CE2 4.44Å; L1159-F1213 HydrophobicContact CD1-CE1 3.64Å; L1159-F1213 HydrophobicContact CD1-CZ 3.92Å; L1169-F1213 HydrophobicContact CD1-CE1 4.01Å; L1169-F1213 HydrophobicContact CD2-CE1 4.22Å; L1193-F1213 HydrophobicContact CD2-CZ 4.43Å; L1209-F1213 HydrophobicContact CD1-CE1 4.31Å; L1209-F1213 HydrophobicContact CD1-CE2 4.11Å; L1209-F1213 HydrophobicContact CD1-CZ 3.88Å; L1209-F1213 HydrophobicContact CD2-CE2 3.99Å; L1209-F1213 HydrophobicContact CD2-CZ 4.29Å; L1209-F1213 HydrophobicContact CG-CD2 4.17Å; L1209-F1213 HydrophobicContact CG-CE2 3.66Å; L1209-F1213 HydrophobicContact CG-CZ 3.97Å; L1209-F1213 WeakPolarHBondContact O-CD2 3.39Å; L1209-F1213 WeakPolarHBondContact O-CG 3.35Å; L1209-F1213 PolarHBondContact O-N 2.7Å; F1213-M1216 HydrophobicContact CD1-CE 4.26Å; F1213-M1216 HydrophobicContact CD1-SD 4.05Å; F1213-M1216 PolarHBondContact O-N 2.63Å; F1213-R1218 HydrophobicContact CB-CB 4.47Å; F1213-R1218 CarbonylContact O-C 3.54Å; F1213-R1218 WeakPolarHBondContact O-CA 3.48Å; F1213-R1218 PolarHBondContact O-N 2.62Å; F1213-C1221 HydrophobicContact CB-CB 4.01Å; F1213-C1221 HydrophobicContact CD1-CB 3.97Å; F1213-C1221 HydrophobicContact CD2-CB 3.57Å; F1213-C1221 HydrophobicContact CE1-CB 4.31Å; F1213-C1221 HydrophobicContact CE2-CB 3.93Å; F1213-C1221 HydrophobicContact CG-CB 3.59Å; F1213-C1221 HydrophobicContact CZ-CB 4.3Å; F1213-A1222 HydrophobicContact CB-CB 4.17Å; F1213-L1225 HydrophobicContact CD2-CD1 3.75Å; F1213-L1225 HydrophobicContact CE2-CD1 3.83Å; F1213-L1225 HydrophobicContact CE2-CG 4.44Å
1214	S	88.1	Confident	83.6	Confident	66 Å²	66	52.1 Å²	52.1	46%	0.462	31%	0.312	S	S	.	.	H	α-helix	trans	-64.7	-40.8	172.4	-56.2	0	0	0	0	112.2	K1210 A1211 I1212 M1216 D1217	K1210-S1214 WeakPolarHBondContact O-CB 3.38Å; K1210-S1214 PolarHBondContact O-N 3.04Å; K1210-S1214 PolarHBondContact O-OG 2.96Å; A1211-S1214 WeakPolarHBondContact O-CB 3.1Å; A1211-S1214 PolarHBondContact O-N 2.82Å; I1212-S1214 VanDerWaalsContact C-N 3.27Å; I1212-S1214 PolarHBondContact O-N 3.18Å; S1214-M1216 VanDerWaalsContact C-N 3.25Å; S1214-M1216 PolarHBondContact O-N 3.31Å; S1214-D1217 PolarHBondContact O-N 3.21Å
1215	A	87.8	Confident	84.9	Confident	63 Å²	63	47.8 Å²	47.8	52%	0.521	28%	0.282	S	S	.	.	H	α-helix	trans	-73	-14.2	175.8	0	0	0	0	0	114	A1211 I1212	A1211-A1215 WeakPolarHBondContact O-CB 3.42Å; A1211-A1215 PolarHBondContact O-N 3.27Å; I1212-A1215 CarbonylContact O-C 3.53Å; I1212-A1215 PolarHBondContact O-N 2.98Å; I1212-A1215 VanDerWaalsContact O-N 3.08Å
1216	M	87.2	Confident	85.4	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.02	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	1.6	173.4	-70.8	174.3	43.6	0	0	114	L1159 E1165 K1168 L1169 I1212 F1213 S1214 R1218	L1159-M1216 HydrophobicContact CD2-CE 3.91Å; E1165-M1216 WeakPolarHBondContact O-CE 3.13Å; K1168-M1216 HydrophobicContact CB-CE 3.92Å; K1168-M1216 HydrophobicContact CB-CG 4.02Å; K1168-M1216 HydrophobicContact CB-SD 4.21Å; K1168-M1216 PolarHBondContact NZ-O 2.82Å; L1169-M1216 HydrophobicContact CB-CE 4.01Å; L1169-M1216 HydrophobicContact CB-SD 3.87Å; L1169-M1216 HydrophobicContact CD1-SD 4.17Å; I1212-M1216 HydrophobicContact CG2-CG 4.47Å; I1212-M1216 HydrophobicContact CG2-SD 3.84Å; I1212-M1216 VanDerWaalsContact O-CG 3.28Å; I1212-M1216 WeakPolarHBondContact O-CG 3.3Å; I1212-M1216 PolarHBondContact O-N 2.96Å; F1213-M1216 HydrophobicContact CD1-CE 4.26Å; F1213-M1216 HydrophobicContact CD1-SD 4.05Å; F1213-M1216 PolarHBondContact O-N 2.63Å; S1214-M1216 VanDerWaalsContact C-N 3.25Å; S1214-M1216 PolarHBondContact O-N 3.31Å; M1216-R1218 HydrophobicContact CB-CB 4.35Å; M1216-R1218 HydrophobicContact CB-CG 4.08Å; M1216-R1218 HydrophobicContact CE-CG 4.3Å; M1216-R1218 PolarHBondContact O-N 2.74Å
1217	D	86.5	Confident	85.6	Confident	150 Å²	150	55.3 Å²	55.3	80%	0.802	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	25.3	-166.9	-57.9	-55.2	0	0	0	113.9	S1214	S1214-D1217 PolarHBondContact O-N 3.21Å
1218	R	86.8	Confident	85.7	Confident	29 Å²	29	52.9 Å²	52.9	11%	0.109	30%	0.301	C	S	.	.			trans	-106.5	62.7	-177.4	-63.8	-56.3	-61.7	-86.5	-1.8	112.4	L1158 E1165 F1213 M1216 D1220 C1221 A1222	L1158-R1218 PolarHBondContact O-NH1 2.96Å; L1158-R1218 PolarHBondContact O-NH2 3.32Å; E1165-R1218 VanDerWaalsContact OE2-CD 3.26Å; E1165-R1218 WeakPolarHBondContact OE2-CD 3.29Å; E1165-R1218 IonicContact OE2-CZ 3.64Å; E1165-R1218 IonicContact OE2-NE 3.9Å; E1165-R1218 IonicContact OE2-NH1 2.61Å; E1165-R1218 PolarHBondContact OE2-NH1 3.47Å; F1213-R1218 HydrophobicContact CB-CB 4.47Å; F1213-R1218 CarbonylContact O-C 3.54Å; F1213-R1218 WeakPolarHBondContact O-CA 3.48Å; F1213-R1218 PolarHBondContact O-N 2.62Å; M1216-R1218 HydrophobicContact CB-CB 4.35Å; M1216-R1218 HydrophobicContact CB-CG 4.08Å; M1216-R1218 HydrophobicContact CE-CG 4.3Å; M1216-R1218 PolarHBondContact O-N 2.74Å; R1218-D1220 WeakPolarHBondContact CA-OD1 3.22Å; R1218-D1220 IonicContact CZ-OD1 3.61Å; R1218-D1220 IonicContact CZ-OD2 3.55Å; R1218-D1220 IonicContact NE-OD1 2.82Å; R1218-D1220 PolarHBondContact NE-OD1 3.24Å; R1218-D1220 IonicContact NE-OD2 3.42Å; R1218-D1220 PolarHBondContact NE-OD2 3Å; R1218-D1220 IonicContact NH2-OD1 3.5Å; R1218-D1220 IonicContact NH2-OD2 2.68Å; R1218-D1220 PolarHBondContact NH2-OD2 3.12Å; R1218-D1220 PolarHBondContact O-N 2.75Å; R1218-C1221 HydrophobicContact CB-CB 4.08Å; R1218-C1221 PolarHBondContact O-N 2.93Å; R1218-A1222 PolarHBondContact O-N 3.03Å
1219	A	85.3	Confident	85.9	Confident	58 Å²	58	50.8 Å²	50.8	48%	0.479	29%	0.294	S	S	.	.	H	α-helix	trans	-58.2	-28	173.4	0	0	0	0	0	112.9	A1222 N1223	A1219-A1222 PolarHBondContact O-N 2.91Å; A1219-N1223 VanDerWaalsContact O-CB 3.32Å; A1219-N1223 WeakPolarHBondContact O-CB 3.41Å; A1219-N1223 PolarHBondContact O-N 2.91Å; A1219-N1223 PolarHBondContact O-ND2 2.78Å; A1219-N1223 PolarHBondContact O-OD1 3.33Å
1220	D	88.8	Confident	85.9	Confident	68 Å²	68	53.8 Å²	53.8	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-63.7	-39.5	172.6	63.3	-46.6	0	0	0	112.7	R1218 L1224	R1218-D1220 WeakPolarHBondContact CA-OD1 3.22Å; R1218-D1220 IonicContact CZ-OD1 3.61Å; R1218-D1220 IonicContact CZ-OD2 3.55Å; R1218-D1220 IonicContact NE-OD1 2.82Å; R1218-D1220 PolarHBondContact NE-OD1 3.24Å; R1218-D1220 IonicContact NE-OD2 3.42Å; R1218-D1220 PolarHBondContact NE-OD2 3Å; R1218-D1220 IonicContact NH2-OD1 3.5Å; R1218-D1220 IonicContact NH2-OD2 2.68Å; R1218-D1220 PolarHBondContact NH2-OD2 3.12Å; R1218-D1220 PolarHBondContact O-N 2.75Å; D1220-L1224 WeakPolarHBondContact O-CG 3.24Å
1221	C	88.1	Confident	85.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-74.5	-37	173.1	-63.2	0	0	0	0	112	L1155 F1213 R1218 N1223 L1224	L1155-C1221 HydrophobicContact CD2-CB 3.7Å; F1213-C1221 HydrophobicContact CB-CB 4.01Å; F1213-C1221 HydrophobicContact CD1-CB 3.97Å; F1213-C1221 HydrophobicContact CD2-CB 3.57Å; F1213-C1221 HydrophobicContact CE1-CB 4.31Å; F1213-C1221 HydrophobicContact CE2-CB 3.93Å; F1213-C1221 HydrophobicContact CG-CB 3.59Å; F1213-C1221 HydrophobicContact CZ-CB 4.3Å; R1218-C1221 HydrophobicContact CB-CB 4.08Å; R1218-C1221 PolarHBondContact O-N 2.93Å; C1221-N1223 PolarHBondContact O-N 3.49Å; C1221-L1224 PolarHBondContact O-N 3.38Å
1222	A	85.5	Confident	85.8	Confident	3 Å²	3	53.7 Å²	53.7	3%	0.025	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-38.3	176.1	0	0	0	0	0	112.6	K1210 F1213 R1218 A1219 L1224 L1225	K1210-A1222 HydrophobicContact CG-CB 3.95Å; F1213-A1222 HydrophobicContact CB-CB 4.17Å; R1218-A1222 PolarHBondContact O-N 3.03Å; A1219-A1222 PolarHBondContact O-N 2.91Å; A1222-L1224 VanDerWaalsContact C-N 3.26Å; A1222-L1224 PolarHBondContact O-N 2.93Å; A1222-L1225 PolarHBondContact O-N 2.81Å
1223	N	85.4	Confident	85.7	Confident	98 Å²	98	56.1 Å²	56.1	52%	0.524	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-7.4	177.2	-64	-0.7	0	0	0	113.6	A1219 C1221	A1219-N1223 VanDerWaalsContact O-CB 3.32Å; A1219-N1223 WeakPolarHBondContact O-CB 3.41Å; A1219-N1223 PolarHBondContact O-N 2.91Å; A1219-N1223 PolarHBondContact O-ND2 2.78Å; A1219-N1223 PolarHBondContact O-OD1 3.33Å; C1221-N1223 PolarHBondContact O-N 3.49Å
1224	L	84.9	Confident	85.4	Confident	40 Å²	40	60.4 Å²	60.4	21%	0.209	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-3.9	170	-78.8	171.2	0	0	0	113	T1151 R1154 L1155 L1158 D1220 C1221 A1222	T1151-L1224 VanDerWaalsContact CG2-O 3.3Å; T1151-L1224 WeakPolarHBondContact CG2-O 3.32Å; R1154-L1224 HydrophobicContact CB-CD1 4.06Å; L1155-L1224 HydrophobicContact CD2-CB 4.38Å; L1155-L1224 HydrophobicContact CD2-CD1 4.32Å; L1158-L1224 HydrophobicContact CD1-CD1 3.41Å; L1158-L1224 VanDerWaalsContact CD1-CD1 3.41Å; D1220-L1224 WeakPolarHBondContact O-CG 3.24Å; C1221-L1224 PolarHBondContact O-N 3.38Å; A1222-L1224 VanDerWaalsContact C-N 3.26Å; A1222-L1224 PolarHBondContact O-N 2.93Å
1225	L	81.3	Confident	85.2	Confident	23 Å²	23	59.9 Å²	59.9	12%	0.12	34%	0.336	C	S	.	.			trans	-104.5	4.7	173	-61	177.2	0	0	0	112.5	L1147 T1151 L1155 V1206 L1209 K1210 F1213 A1222	L1147-L1225 HydrophobicContact CD2-CD2 3.6Å; T1151-L1225 HydrophobicContact CG2-CD2 4.16Å; L1155-L1225 HydrophobicContact CD1-CD2 4.21Å; V1206-L1225 HydrophobicContact CG2-CB 4.09Å; L1209-L1225 HydrophobicContact CB-CD1 3.98Å; L1209-L1225 HydrophobicContact CD2-CD1 3.89Å; L1209-L1225 HydrophobicContact CD2-CD2 4.24Å; L1209-L1225 HydrophobicContact CG-CD1 3.84Å; K1210-L1225 HydrophobicContact CB-CD1 4.04Å; F1213-L1225 HydrophobicContact CD2-CD1 3.75Å; F1213-L1225 HydrophobicContact CE2-CD1 3.83Å; F1213-L1225 HydrophobicContact CE2-CG 4.44Å; A1222-L1225 PolarHBondContact O-N 2.81Å
1226	E	74.2	Confident	84.9	Confident	183 Å²	183	59.6 Å²	59.6	86%	0.855	32%	0.319	S	S	*	.			trans	-94.8	0	168.9	-61.3	-166.7	144.9	0	0	111.3	K1210	K1210-E1226 WeakPolarHBondContact CE-OE1 3.33Å; K1210-E1226 VanDerWaalsContact NZ-CG 3.32Å; K1210-E1226 IonicContact NZ-OE1 3.45Å; K1210-E1226 PolarHBondContact NZ-OE1 2.78Å

Retrieved 1,226 of 1,226 residues in 196.8 ms (Link to these results)

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