A0A061IKB4_CRIGR Loading...

WD repeat-containing protein 3

Part of the small subunit (SSU) processome, first precursor of the small eukaryotic ribosomal subunit. During the assembly of the SSU processome in the nucleolus, many ribosome biogenesis factors, an RNA chaperone and ribosomal proteins associate with the nascent pre-rRNA and work in concert to generate RNA folding, modifications, rearrangements and cleavage as well as targeted degradation of pre-ribosomal RNA by the RNA exosome.

AlphaFold DB , UniProt , Accession A0A061IKB4, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Wdr3, Length 941 aa.

						>A0A061IKB4_CRIGR|A0A061IKB4|Wdr3
MGLTKQYLRYVASAVFGLIGSQKGNIVFVTLRGEKGRYVAVPACEHVFIWDLRKGEKILILQGLKQEVTCLCPSPDGLHLAVGYEDGSIRIFSLLSGEGNITFNGHKAAITSLKYDQLGGRLASGSKDTDVIIWDVINESGLYRLKGHKDAVTQALFLRERNLLVTSGKDTMVKWWDLDNQHCFKTMVGHRTEVWGLVLVSEEKRLITGAADSELRAWDIAYLQEIDDPEEPEPKKIKGCPGRQDTPEAEDGPLEADEASEDRILSCKKAGSIMREGRDRVVNLTVDKTGRILACHGTDSVLEVFCVLSKAEIQKKMDKKLKKARKKAKLNSASGEEDPETSVSMTLQDEIHRVANIKTSSKIKSFDLIHSPQGELKAVFLLQNNLVELYSLNTSLPTPQPVRTSRITIGGHRSDVRTLSFSSDNIAVLSASADSIKIWNRSTLQCIRTMPCEYALCSFFVPGDRQVVIGTKTGNLQLYDLASGNLLETIAAHDGALWSMSLSPDQRGFVTGGADKAVKFWDFELVTDKNSTQKRLSVRQTRTLQLDEDVLCVSYSPNQKLLAVSLLDCTVKIFYVDTLKFFLSLYGHKLPVICMDISHDGALIVTGSADRNVKIWGLDFGDCHRSLFAHDDSVMYLRFVPKSHLFFTAGKDRKIKQWDADKFEHIQTLEGHHQEIWCLAVSPNGDYVVSASHDKSLRLWERTREPLILEEEREMQREAEYEDSVAKEDQPAVAGETQGDNYFTGKKTIETVKAAERIMEAIELYREETAKMKEHRAICRAAGKEVPLPVNPILMAHGNILPSAYVLETFKGVKSSELEEALLVLPFSYVPDILKLFNEFIQMGSDIELLCRCLFFLLRIHFGQITSNQMLVPVIEKLKETTISKVRQVQDVIGFNMAGLDYLKRECEAKSEVMFFAEATSHLEEKRRKRKNRKKMILTLT
					

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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	37.3	Very low	69.8	Low	242 Å²	242	98.7 Å²	98.7	100%	1.192	53%	0.527	S	S	*	.				0	101.5	0	-67.6	-176.3	-172.9	0	0	106.7
2	G	40.8	Very low	71.4	Confident	72 Å²	72	94.8 Å²	94.8	74%	0.742	52%	0.519	S	S	*	.			trans	-64	136.7	178.7	0	0	0	0	0	109.3	T4	G2-T4 PolarHBondContact O-N 3.13Å
3	L	42.1	Very low	72.4	Confident	173 Å²	173	92.5 Å²	92.5	91%	0.906	51%	0.514	S	S	*	.			trans	-51.5	110.9	166.6	-111.8	83.7	0	0	0	106.8	K5	L3-K5 PolarHBondContact O-N 2.67Å
4	T	59.1	Low	73.3	Confident	118 Å²	118	87.6 Å²	87.6	72%	0.724	49%	0.491	S	S	*	.			trans	-60	112.3	167.3	40.3	0	0	0	0	106	G2 Q6	G2-T4 PolarHBondContact O-N 3.13Å; T4-Q6 PolarHBondContact O-N 3.43Å
5	K	65.2	Low	74.3	Confident	122 Å²	122	83 Å²	83	53%	0.53	47%	0.466	S	S	.	.			trans	-54.6	111.8	171.6	-79.3	-175.7	179.7	179	0	106.4	L3 D661	L3-K5 PolarHBondContact O-N 2.67Å; K5-D661 IonicContact NZ-OD2 3.85Å; K5-D661 PolarHBondContact NZ-OD2 3.02Å
6	Q	77.9	Confident	75.2	Confident	150 Å²	150	78.2 Å²	78.2	70%	0.701	44%	0.438	S	S	*	.			trans	-78.3	122.5	175.3	-69.5	177.7	-16.7	0	0	107.8	T4	T4-Q6 PolarHBondContact O-N 3.43Å
7	Y	86.1	Confident	75.8	Confident	15 Å²	15	73.6 Å²	73.6	6%	0.059	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	138	170.9	-59.3	-68.8	0	0	0	108.8	L645 D659 K662 I666 P706 L707 L709	Y7-L645 HydrophobicContact CD1-CD2 4.45Å; Y7-L645 HydrophobicContact CE1-CD2 4.1Å; Y7-D659 HydrophobicContact CE1-CB 4.41Å; Y7-D659 WeakPolarHBondContact CE1-OD2 3.16Å; Y7-D659 PolarHBondContact OH-OD2 2.83Å; Y7-K662 WeakPolarHBondContact OH-CD 3.41Å; Y7-K662 WeakPolarHBondContact OH-CE 3.29Å; Y7-K662 PolarHBondContact OH-NZ 3.12Å; Y7-I666 HydrophobicContact CD1-CD1 3.48Å; Y7-I666 VanDerWaalsContact CD1-CD1 3.48Å; Y7-I666 HydrophobicContact CD1-CG1 4.06Å; Y7-I666 HydrophobicContact CD1-CG2 4.4Å; Y7-I666 HydrophobicContact CE1-CD1 3.54Å; Y7-I666 HydrophobicContact CE1-CG1 4.08Å; Y7-I666 HydrophobicContact CG-CD1 4.25Å; Y7-I666 HydrophobicContact CG-CG1 4.41Å; Y7-I666 HydrophobicContact CG-CG2 4.15Å; Y7-P706 CarbonylContact O-C 3.54Å; Y7-P706 WeakPolarHBondContact O-CA 3.22Å; Y7-L707 PolarHBondContact O-N 3.05Å; Y7-L709 HydrophobicContact CD2-CD1 4.28Å; Y7-L709 HydrophobicContact CD2-CD2 4.05Å; Y7-L709 HydrophobicContact CD2-CG 4.15Å; Y7-L709 HydrophobicContact CE2-CD1 3.81Å; Y7-L709 HydrophobicContact CE2-CD2 4.28Å; Y7-L709 HydrophobicContact CE2-CG 4.2Å
8	L	88.4	Confident	76.4	Confident	50 Å²	50	69.6 Å²	69.6	26%	0.262	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	138.2	176.6	-65.6	178.2	0	0	0	109.1	R702	L8-R702 HydrophobicContact CB-CG 3.75Å; L8-R702 HydrophobicContact CD1-CG 4.24Å
9	R	89.4	Confident	77	Confident	82 Å²	82	65.9 Å²	65.9	31%	0.309	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	140	-177.4	-171.4	176.9	-176	128.1	3.2	111.7	V11 R702 T703 E705 L707	R9-V11 HydrophobicContact CG-CG2 4.1Å; R9-R702 CarbonylContact O-C 3.58Å; R9-R702 WeakPolarHBondContact O-CA 3.47Å; R9-T703 PolarHBondContact O-N 3.46Å; R9-T703 PolarHBondContact O-OG1 3.48Å; R9-E705 PolarHBondContact N-O 2.88Å; R9-L707 HydrophobicContact CB-CD1 4.27Å; R9-L707 HydrophobicContact CG-CD1 4.36Å
10	Y	91.4	Very high	77.4	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.016	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.9	164.5	-74.2	-98	0	0	0	110	F647 Q667 L669 G685 V688 W700 E701 R702	Y10-F647 HydrophobicContact CD1-CZ 4.23Å; Y10-F647 HydrophobicContact CD2-CE1 4.39Å; Y10-F647 AromaticContact CD2-CZ 3.76Å; Y10-F647 HydrophobicContact CD2-CZ 3.76Å; Y10-F647 HydrophobicContact CE1-CE2 4.43Å; Y10-F647 HydrophobicContact CE1-CZ 4.06Å; Y10-F647 HydrophobicContact CE2-CE2 4.29Å; Y10-F647 AromaticContact CE2-CZ 3.57Å; Y10-F647 HydrophobicContact CE2-CZ 3.57Å; Y10-F647 HydrophobicContact CG-CZ 4.08Å; Y10-F647 AromaticContact CZ-CZ 3.71Å; Y10-Q667 PolarHBondContact O-NE2 3.31Å; Y10-Q667 PolarHBondContact O-OE1 3.21Å; Y10-L669 WeakPolarHBondContact O-CD2 3.24Å; Y10-G685 PolarHBondContact OH-O 2.92Å; Y10-V688 HydrophobicContact CD1-CG2 4.2Å; Y10-V688 HydrophobicContact CE1-CG2 3.82Å; Y10-W700 HydrophobicContact CD1-CB 4.5Å; Y10-E701 CarbonylContact C-O 3.54Å; Y10-E701 WeakPolarHBondContact CA-O 3.29Å; Y10-R702 HydrophobicContact CD1-CB 4.02Å; Y10-R702 HydrophobicContact CE1-CB 3.67Å; Y10-R702 HydrophobicContact CE1-CG 4.27Å; Y10-R702 HydrophobicContact CE2-CB 4.38Å; Y10-R702 HydrophobicContact CE2-CG 4.09Å
11	V	90.1	Very high	77.8	Confident	58 Å²	58	60 Å²	60	35%	0.352	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.7	-180	-179.4	0	0	0	0	109.5	R9 S13 W700 E701 T703	R9-V11 HydrophobicContact CG-CG2 4.1Å; V11-S13 PolarHBondContact O-N 3.29Å; V11-W700 CarbonylContact O-C 3.57Å; V11-W700 VanDerWaalsContact O-CA 3.31Å; V11-W700 WeakPolarHBondContact O-CA 3.28Å; V11-E701 PolarHBondContact N-O 3.44Å; V11-E701 PolarHBondContact O-N 3.48Å; V11-T703 HydrophobicContact CB-CG2 4.1Å; V11-T703 HydrophobicContact CG2-CG2 3.68Å
12	A	88.3	Confident	79.9	Confident	52 Å²	52	52.2 Å²	52.2	43%	0.43	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	116	172.3	0	0	0	0	0	109.2	W700	A12-W700 HydrophobicContact CB-CE3 3.81Å; A12-W700 HydrophobicContact CB-CH2 4.14Å; A12-W700 HydrophobicContact CB-CZ3 3.54Å
13	S	85.3	Confident	81.9	Confident	65 Å²	65	52.5 Å²	52.5	46%	0.455	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-49.9	179.8	-179.8	0	0	0	0	110.8	V11 L699	V11-S13 PolarHBondContact O-N 3.29Å; S13-L699 PolarHBondContact N-O 3.47Å
14	A	84.9	Confident	83.8	Confident	24 Å²	24	44.4 Å²	44.4	20%	0.198	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	151.6	-177.4	0	0	0	0	0	114.8	L444 R698 L699	A14-L444 HydrophobicContact CB-CD1 3.24Å; A14-L444 HydrophobicContact CB-CD2 4.4Å; A14-L444 HydrophobicContact CB-CG 4.44Å; A14-R698 WeakPolarHBondContact O-CA 3.5Å; A14-L699 PolarHBondContact N-O 3.22Å; A14-L699 PolarHBondContact O-N 3.46Å
15	V	87.9	Confident	85.3	Confident	18 Å²	18	41 Å²	41	11%	0.109	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.6	171.8	-170.5	0	0	0	0	109.9	L697 R698	V15-L697 WeakPolarHBondContact CA-O 3.36Å; V15-R698 HydrophobicContact CG1-CG 4.37Å; V15-R698 HydrophobicContact CG2-CG 4.15Å
16	F	89.1	Confident	86.6	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	-178.6	179.3	66	-78.2	0	0	0	111.2	L18 W439 L444 V689 L697 L699	F16-L18 PolarHBondContact O-N 2.83Å; F16-W439 HydrophobicContact CD2-CB 4.5Å; F16-W439 AromaticContact CD2-CD2 3.74Å; F16-W439 HydrophobicContact CD2-CD2 3.74Å; F16-W439 AromaticContact CD2-CE3 3.67Å; F16-W439 HydrophobicContact CD2-CE3 3.67Å; F16-W439 HydrophobicContact CD2-CG 4.1Å; F16-W439 HydrophobicContact CD2-CZ3 4.17Å; F16-W439 HydrophobicContact CE2-CB 3.92Å; F16-W439 AromaticContact CE2-CD2 3.77Å; F16-W439 HydrophobicContact CE2-CD2 3.77Å; F16-W439 HydrophobicContact CE2-CE3 4.16Å; F16-W439 AromaticContact CE2-CG 3.63Å; F16-W439 HydrophobicContact CE2-CG 3.63Å; F16-L444 HydrophobicContact CB-CB 4.17Å; F16-L444 HydrophobicContact CD1-CD2 3.79Å; F16-L444 HydrophobicContact CE1-CD2 3.99Å; F16-L444 HydrophobicContact CG-CB 4.32Å; F16-L444 HydrophobicContact CG-CD2 4.25Å; F16-V689 HydrophobicContact CZ-CG1 4.34Å; F16-L697 HydrophobicContact CD1-CB 4.16Å; F16-L697 WeakPolarHBondContact CD1-O 3.47Å; F16-L697 HydrophobicContact CD2-CB 3.96Å; F16-L697 HydrophobicContact CD2-CD1 4.01Å; F16-L697 HydrophobicContact CE1-CB 3.93Å; F16-L697 HydrophobicContact CE2-CB 3.72Å; F16-L697 HydrophobicContact CE2-CD1 3.54Å; F16-L697 HydrophobicContact CE2-CG 4.28Å; F16-L697 HydrophobicContact CG-CB 4.18Å; F16-L697 HydrophobicContact CZ-CB 3.71Å; F16-L697 HydrophobicContact CZ-CD1 4.18Å; F16-L697 PolarHBondContact N-O 2.87Å; F16-L697 PolarHBondContact O-N 2.98Å; F16-L699 HydrophobicContact CE1-CB 4.16Å
17	G	84.3	Confident	87.1	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.01	16%	0.158	C	C	.	.	S	Bend	trans	75.9	-3.1	-175.5	0	0	0	0	0	115.6	N385 G410 G411 H412	G17-N385 PolarHBondContact O-ND2 3.02Å; G17-G410 CarbonylContact C-O 3.56Å; G17-G410 VanDerWaalsContact C-O 3.26Å; G17-G410 WeakPolarHBondContact CA-O 3.39Å; G17-G411 WeakPolarHBondContact O-CA 3.17Å; G17-H412 PolarHBondContact O-N 2.73Å
18	L	87.5	Confident	87.3	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.157	C	C	.	.			trans	-111.5	131.6	177.9	-167.4	65.6	0	0	0	111.4	F16 A43 C44 F48 G410	F16-L18 PolarHBondContact O-N 2.83Å; L18-A43 HydrophobicContact CD2-CB 3.9Å; L18-A43 HydrophobicContact CG-CB 4.46Å; L18-C44 HydrophobicContact CD2-CB 4.26Å; L18-C44 VanDerWaalsContact CD2-SG 3.51Å; L18-F48 WeakPolarHBondContact O-CE2 3.43Å; L18-G410 PolarHBondContact N-O 3.13Å
19	I	87.6	Confident	87.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	-98.4	-47	170	-62.3	166.9	0	0	0	109.2	V41 W50 N385 V387 I407	I19-V41 VanDerWaalsContact O-CG1 3.26Å; I19-V41 WeakPolarHBondContact O-CG1 3.43Å; I19-W50 HydrophobicContact CB-CZ2 4.29Å; I19-W50 HydrophobicContact CG1-CH2 4.43Å; I19-W50 HydrophobicContact CG1-CZ2 4.17Å; I19-W50 HydrophobicContact CG2-CZ2 4.11Å; I19-W50 PolarHBondContact O-NE1 3.12Å; I19-N385 WeakPolarHBondContact CA-OD1 3.37Å; I19-N385 WeakPolarHBondContact CB-OD1 3.49Å; I19-N385 WeakPolarHBondContact CD1-O 3.25Å; I19-N385 PolarHBondContact N-OD1 2.82Å; I19-V387 HydrophobicContact CG2-CB 4.43Å; I19-V387 HydrophobicContact CG2-CG2 3.75Å; I19-I407 HydrophobicContact CD1-CG2 4.04Å; I19-I407 HydrophobicContact CG1-CG2 4.34Å; I19-I407 HydrophobicContact CG2-CB 4.47Å; I19-I407 HydrophobicContact CG2-CG2 4.05Å
20	G	85.4	Confident	86.9	Confident	2 Å²	2	23.4 Å²	23.4	2%	0.021	14%	0.139	C	C	.	.			trans	-157.8	138.7	171.9	0	0	0	0	0	113.9	P42 N385	G20-P42 CarbonylContact C-O 3.6Å; G20-P42 VanDerWaalsContact CA-O 3.23Å; G20-P42 WeakPolarHBondContact CA-O 3.47Å; G20-N385 PolarHBondContact N-OD1 3.17Å; G20-N385 PolarHBondContact O-OD1 3.03Å
21	S	85.3	Confident	86.2	Confident	5 Å²	5	24 Å²	24	4%	0.035	14%	0.143	C	C	.	.			trans	-73.3	150.6	174	175.5	0	0	0	0	111.1	K23 P42 L381	S21-K23 VanDerWaalsContact C-N 3.33Å; S21-K23 PolarHBondContact O-N 3.19Å; S21-K23 PolarHBondContact OG-N 2.92Å; S21-P42 PolarHBondContact N-O 3.32Å; S21-L381 WeakPolarHBondContact O-CD2 3.41Å
22	Q	81.4	Confident	85.5	Confident	78 Å²	78	31.6 Å²	31.6	36%	0.364	17%	0.165	S	C	.	.	S	Bend	trans	-76	-18.4	-178.6	-63	177.8	-2.6	0	0	113.3	K364 Q383	Q22-K364 WeakPolarHBondContact O-CE 3.36Å; Q22-K364 VanDerWaalsContact O-CG 3.25Å; Q22-K364 WeakPolarHBondContact O-CG 3.32Å; Q22-Q383 PolarHBondContact NE2-O 3.46Å
23	K	82.8	Confident	84.6	Confident	79 Å²	79	32.6 Å²	32.6	34%	0.343	18%	0.18	S	C	.	.	S	Bend	trans	-75.3	-35.1	-174.3	-74	-163.1	-176.9	161.5	0	113.1	S21 E67 E85	S21-K23 VanDerWaalsContact C-N 3.33Å; S21-K23 PolarHBondContact O-N 3.19Å; S21-K23 PolarHBondContact OG-N 2.92Å; K23-E67 HydrophobicContact CD-CB 4.39Å; K23-E67 WeakPolarHBondContact CD-OE2 3.32Å; K23-E67 WeakPolarHBondContact CE-OE2 3.47Å; K23-E67 IonicContact NZ-OE2 2.72Å; K23-E67 PolarHBondContact NZ-OE2 3.25Å; K23-E85 IonicContact NZ-OE1 3.42Å; K23-E85 PolarHBondContact NZ-OE1 3.38Å; K23-E85 IonicContact NZ-OE2 2.97Å; K23-E85 PolarHBondContact NZ-OE2 2.87Å
24	G	82.8	Confident	84.2	Confident	3 Å²	3	33.2 Å²	33.2	3%	0.031	18%	0.176	C	C	.	.	S	Bend	trans	-96.7	170.1	-171.5	0	0	0	0	0	117.3	T69 S365	G24-T69 VanDerWaalsContact CA-O 3.26Å; G24-T69 WeakPolarHBondContact CA-O 3.23Å; G24-S365 PolarHBondContact O-OG 3.48Å
25	N	90.3	Very high	83.8	Confident	45 Å²	45	38.9 Å²	38.9	24%	0.241	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-88.1	156.5	171.4	65.2	-31	0	0	0	111.9	P42 C70 L71 S365	N25-P42 VanDerWaalsContact O-CD 3.27Å; N25-P42 WeakPolarHBondContact O-CD 3.41Å; N25-C70 VanDerWaalsContact OD1-CA 3.28Å; N25-C70 WeakPolarHBondContact OD1-CA 3.34Å; N25-L71 PolarHBondContact ND2-O 2.96Å; N25-L71 WeakPolarHBondContact O-CD1 3.39Å; N25-L71 PolarHBondContact OD1-N 3.49Å; N25-S365 WeakPolarHBondContact CA-OG 3.45Å
26	I	91.7	Very high	83.1	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-99.2	144.6	174	-167.7	153.5	0	0	0	109.5	V39 V41 S365 D367 V379 L381 V387	I26-V39 HydrophobicContact CD1-CG1 3.65Å; I26-V39 HydrophobicContact CG1-CG1 3.35Å; I26-V41 HydrophobicContact CD1-CG2 3.78Å; I26-V41 HydrophobicContact CG1-CG2 4.13Å; I26-S365 PolarHBondContact N-OG 3.44Å; I26-S365 VanDerWaalsContact N-OG 3.09Å; I26-D367 WeakPolarHBondContact O-CB 3.16Å; I26-V379 HydrophobicContact CD1-CG1 3.44Å; I26-V379 VanDerWaalsContact CD1-CG1 3.44Å; I26-V379 HydrophobicContact CG1-CG1 3.87Å; I26-L381 HydrophobicContact CB-CB 3.95Å; I26-L381 HydrophobicContact CD1-CB 3.83Å; I26-L381 HydrophobicContact CG2-CB 4.11Å; I26-V387 HydrophobicContact CD1-CG1 3.98Å; I26-V387 HydrophobicContact CD1-CG2 3.95Å
27	V	89.8	Confident	83	Confident	7 Å²	7	40.1 Å²	40.1	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	137.9	-174.6	167.5	0	0	0	0	110.5	V29 V39 A40 L71 P73 D367	V27-V29 HydrophobicContact CG1-CG2 4.45Å; V27-V39 WeakPolarHBondContact O-CA 3.07Å; V27-A40 PolarHBondContact N-O 3.28Å; V27-A40 PolarHBondContact O-N 3.02Å; V27-L71 HydrophobicContact CB-CB 4.47Å; V27-L71 HydrophobicContact CG2-CB 3.88Å; V27-L71 WeakPolarHBondContact CG2-O 3.46Å; V27-P73 HydrophobicContact CG1-CB 3.83Å; V27-P73 VanDerWaalsContact CG1-CD 3.44Å; V27-P73 HydrophobicContact CG1-CG 3.38Å; V27-D367 WeakPolarHBondContact CA-OD2 3.48Å
28	F	89.6	Confident	83.2	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.035	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	134.5	167.2	-79.6	-76.4	0	0	0	112.2	V39 L52 D367 I369 K377 V379 L389	F28-V39 HydrophobicContact CD1-CG2 3.81Å; F28-V39 HydrophobicContact CE1-CG2 4.04Å; F28-L52 HydrophobicContact CE1-CD1 4.12Å; F28-D367 HydrophobicContact CD2-CB 4.01Å; F28-D367 WeakPolarHBondContact CD2-OD2 3.38Å; F28-D367 PolarHBondContact N-OD2 3.18Å; F28-I369 HydrophobicContact CB-CD1 3.16Å; F28-I369 HydrophobicContact CB-CG1 3.89Å; F28-I369 HydrophobicContact CD1-CD1 4.04Å; F28-I369 HydrophobicContact CD2-CB 4.09Å; F28-I369 HydrophobicContact CD2-CD1 3.74Å; F28-I369 HydrophobicContact CD2-CG1 3.53Å; F28-I369 HydrophobicContact CE2-CB 4.12Å; F28-I369 HydrophobicContact CE2-CG1 4.08Å; F28-I369 HydrophobicContact CG-CD1 3.42Å; F28-I369 VanDerWaalsContact CG-CD1 3.42Å; F28-I369 HydrophobicContact CG-CG1 3.8Å; F28-K377 HydrophobicContact CZ-CB 4.11Å; F28-V379 HydrophobicContact CD1-CG2 4.37Å; F28-V379 HydrophobicContact CE1-CB 4.42Å; F28-V379 HydrophobicContact CE1-CG2 3.47Å; F28-V379 VanDerWaalsContact CE1-CG2 3.47Å; F28-V379 HydrophobicContact CE2-CB 4.03Å; F28-V379 HydrophobicContact CE2-CG2 3.82Å; F28-V379 HydrophobicContact CZ-CB 3.89Å; F28-V379 HydrophobicContact CZ-CG2 3.16Å; F28-L389 HydrophobicContact CZ-CD1 4.17Å
29	V	85.9	Confident	83.4	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	144.2	179.8	175.8	0	0	0	0	110.5	V27 L31 Y38 A40 L94	V27-V29 HydrophobicContact CG1-CG2 4.45Å; V29-L31 HydrophobicContact CG1-CD1 3.94Å; V29-L31 HydrophobicContact CG1-CG 4.07Å; V29-Y38 PolarHBondContact N-O 3.25Å; V29-A40 HydrophobicContact CG2-CB 3.53Å; V29-L94 HydrophobicContact CG1-CD1 3.35Å; V29-L94 HydrophobicContact CG1-CD2 3.8Å; V29-L94 HydrophobicContact CG1-CG 4.17Å
30	T	83.6	Confident	83.6	Confident	32 Å²	32	40.6 Å²	40.6	20%	0.196	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	102.1	175.7	57.4	0	0	0	0	109.1	K35 G77	T30-K35 HydrophobicContact CG2-CB 4.11Å; T30-K35 HydrophobicContact CG2-CD 3.92Å; T30-K35 HydrophobicContact CG2-CG 3.56Å; T30-G77 WeakPolarHBondContact OG1-CA 3.17Å; T30-G77 PolarHBondContact OG1-O 3.46Å
31	L	77.1	Confident	83.9	Confident	17 Å²	17	40.6 Å²	40.6	9%	0.089	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.3	174.9	-84.9	145.7	0	0	0	109.4	V29 G33 E34 Y38 I49 L94	V29-L31 HydrophobicContact CG1-CD1 3.94Å; V29-L31 HydrophobicContact CG1-CG 4.07Å; L31-G33 PolarHBondContact O-N 3.3Å; L31-E34 PolarHBondContact O-N 2.98Å; L31-E34 VanDerWaalsContact O-N 3.15Å; L31-Y38 HydrophobicContact CB-CD2 3.55Å; L31-Y38 HydrophobicContact CB-CE2 3.77Å; L31-Y38 HydrophobicContact CB-CG 4.1Å; L31-Y38 HydrophobicContact CD1-CD2 4.36Å; L31-Y38 HydrophobicContact CD1-CG 4.06Å; L31-Y38 WeakPolarHBondContact O-CE2 3.45Å; L31-I49 HydrophobicContact CD1-CD1 4.34Å; L31-I49 HydrophobicContact CD1-CG2 3.51Å; L31-L94 HydrophobicContact CD2-CB 4.1Å; L31-L94 WeakPolarHBondContact CD2-O 3.26Å
32	R	75.1	Confident	84.2	Confident	217 Å²	217	40.3 Å²	40.3	82%	0.819	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	33.7	178.2	-53.1	179	-179.5	-180	-0.5	113.3	E34	R32-E34 VanDerWaalsContact C-N 3.26Å; R32-E34 PolarHBondContact O-N 3.02Å
33	G	69.4	Low	84.6	Confident	73 Å²	73	36.6 Å²	36.6	75%	0.753	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	-6.1	179	0	0	0	0	0	116	L31	L31-G33 PolarHBondContact O-N 3.3Å
34	E	77.1	Confident	84.9	Confident	78 Å²	78	32.9 Å²	32.9	36%	0.364	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	112.9	177.4	-67	-169.6	154.8	0	0	111.1	L31 R32 R37 Y38	L31-E34 PolarHBondContact O-N 2.98Å; L31-E34 VanDerWaalsContact O-N 3.15Å; R32-E34 VanDerWaalsContact C-N 3.26Å; R32-E34 PolarHBondContact O-N 3.02Å; E34-R37 IonicContact OE1-NH1 2.99Å; E34-R37 WeakPolarHBondContact OE2-CD 3.36Å; E34-R37 IonicContact OE2-CZ 2.72Å; E34-R37 IonicContact OE2-NE 3.96Å; E34-R37 IonicContact OE2-NH1 3.67Å; E34-R37 PolarHBondContact OE2-NH1 3.49Å; E34-Y38 HydrophobicContact CB-CE2 4.24Å
35	K	75.9	Confident	85.2	Confident	143 Å²	143	33.4 Å²	33.4	62%	0.622	17%	0.168	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	138	174.4	-52.4	-159.8	172.3	169.7	0	111.4	T30	T30-K35 HydrophobicContact CG2-CB 4.11Å; T30-K35 HydrophobicContact CG2-CD 3.92Å; T30-K35 HydrophobicContact CG2-CG 3.56Å
36	G	74.4	Confident	85.3	Confident	4 Å²	4	32.5 Å²	32.5	4%	0.041	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.6	14.6	171.3	0	0	0	0	0	115.9
37	R	85.3	Confident	85.3	Confident	46 Å²	46	32.4 Å²	32.4	17%	0.174	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-40.8	172.8	-179.7	179.7	177.6	-179.4	-7.4	112.7	E34 D51 L52 R53	E34-R37 IonicContact OE1-NH1 2.99Å; E34-R37 WeakPolarHBondContact OE2-CD 3.36Å; E34-R37 IonicContact OE2-CZ 2.72Å; E34-R37 IonicContact OE2-NE 3.96Å; E34-R37 IonicContact OE2-NH1 3.67Å; E34-R37 PolarHBondContact OE2-NH1 3.49Å; R37-D51 VanDerWaalsContact CG-OD1 3.31Å; R37-D51 WeakPolarHBondContact CG-OD1 3.46Å; R37-D51 IonicContact CZ-OD1 3.2Å; R37-D51 IonicContact CZ-OD2 2.83Å; R37-D51 IonicContact NE-OD1 2.73Å; R37-D51 PolarHBondContact NE-OD1 3.32Å; R37-D51 IonicContact NE-OD2 2.8Å; R37-D51 PolarHBondContact NE-OD2 2.65Å; R37-D51 VanDerWaalsContact NE-OD2 3.12Å; R37-D51 IonicContact NH2-OD1 3.94Å; R37-D51 IonicContact NH2-OD2 3.34Å; R37-D51 PolarHBondContact NH2-OD2 2.96Å; R37-L52 WeakPolarHBondContact O-CB 3.46Å; R37-L52 WeakPolarHBondContact O-CG 3.4Å; R37-L52 PolarHBondContact O-N 2.82Å; R37-L52 VanDerWaalsContact O-N 3.09Å; R37-R53 HydrophobicContact CG-CG 4.46Å
38	Y	90.3	Very high	85.4	Confident	13 Å²	13	32.1 Å²	32.1	5%	0.051	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	144.3	-175.2	-52.8	-72	0	0	0	111	V29 L31 E34 W50 D51 I58	V29-Y38 PolarHBondContact N-O 3.25Å; L31-Y38 HydrophobicContact CB-CD2 3.55Å; L31-Y38 HydrophobicContact CB-CE2 3.77Å; L31-Y38 HydrophobicContact CB-CG 4.1Å; L31-Y38 HydrophobicContact CD1-CD2 4.36Å; L31-Y38 HydrophobicContact CD1-CG 4.06Å; L31-Y38 WeakPolarHBondContact O-CE2 3.45Å; E34-Y38 HydrophobicContact CB-CE2 4.24Å; Y38-W50 WeakPolarHBondContact CA-O 3.37Å; Y38-D51 HydrophobicContact CD1-CB 4.35Å; Y38-D51 HydrophobicContact CE1-CB 4.25Å; Y38-I58 HydrophobicContact CD1-CD1 3.51Å; Y38-I58 HydrophobicContact CE1-CD1 3.17Å
39	V	90.8	Very high	85.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.4	-179.3	175.9	0	0	0	0	109.1	I26 V27 F28 V41 I49 W50 L52 V379	I26-V39 HydrophobicContact CD1-CG1 3.65Å; I26-V39 HydrophobicContact CG1-CG1 3.35Å; V27-V39 WeakPolarHBondContact O-CA 3.07Å; F28-V39 HydrophobicContact CD1-CG2 3.81Å; F28-V39 HydrophobicContact CE1-CG2 4.04Å; V39-V41 HydrophobicContact CG1-CG2 3.78Å; V39-I49 WeakPolarHBondContact O-CA 3.46Å; V39-W50 PolarHBondContact N-O 2.75Å; V39-W50 VanDerWaalsContact N-O 3.09Å; V39-W50 PolarHBondContact O-N 3.47Å; V39-L52 HydrophobicContact CB-CD2 4.44Å; V39-L52 HydrophobicContact CG2-CD1 3.53Å; V39-L52 HydrophobicContact CG2-CD2 3.9Å; V39-L52 HydrophobicContact CG2-CG 3.72Å; V39-V379 HydrophobicContact CG1-CG1 4.05Å; V39-V379 HydrophobicContact CG2-CG1 4.16Å; V39-V379 HydrophobicContact CG2-CG2 4Å
40	A	92.1	Very high	85.7	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128.3	167.9	0	0	0	0	0	109.4	V27 V29 V47 I49 L71 L80	V27-A40 PolarHBondContact N-O 3.28Å; V27-A40 PolarHBondContact O-N 3.02Å; V29-A40 HydrophobicContact CG2-CB 3.53Å; A40-V47 HydrophobicContact CB-CG1 3.99Å; A40-I49 HydrophobicContact CB-CG1 4.31Å; A40-L71 HydrophobicContact CB-CD1 4.19Å; A40-L80 HydrophobicContact CB-CD2 4.04Å
41	V	91.6	Very high	86.1	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.3	179.9	-170.4	0	0	0	0	108.2	I19 I26 V39 F48 L381 V387	I19-V41 VanDerWaalsContact O-CG1 3.26Å; I19-V41 WeakPolarHBondContact O-CG1 3.43Å; I26-V41 HydrophobicContact CD1-CG2 3.78Å; I26-V41 HydrophobicContact CG1-CG2 4.13Å; V39-V41 HydrophobicContact CG1-CG2 3.78Å; V41-F48 PolarHBondContact N-O 2.9Å; V41-F48 PolarHBondContact O-N 2.83Å; V41-L381 HydrophobicContact CG1-CD1 3.94Å; V41-L381 HydrophobicContact CG1-CD2 4.32Å; V41-V387 HydrophobicContact CG2-CG2 4.18Å
42	P	91.8	Very high	86.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	137.1	176.2	29.5	-33.6	0	0	0	109.3	G20 S21 N25 V68 L71 L381	G20-P42 CarbonylContact C-O 3.6Å; G20-P42 VanDerWaalsContact CA-O 3.23Å; G20-P42 WeakPolarHBondContact CA-O 3.47Å; S21-P42 PolarHBondContact N-O 3.32Å; N25-P42 VanDerWaalsContact O-CD 3.27Å; N25-P42 WeakPolarHBondContact O-CD 3.41Å; P42-V68 HydrophobicContact CB-CB 3.99Å; P42-V68 HydrophobicContact CB-CG1 3.83Å; P42-L71 HydrophobicContact CB-CD1 4.37Å; P42-L71 HydrophobicContact CG-CD1 4.46Å; P42-L381 HydrophobicContact CG-CD2 4.44Å
43	A	89.1	Confident	86.9	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	78.7	-176.3	0	0	0	0	0	109.8	L18 E45 H46 F48	L18-A43 HydrophobicContact CD2-CB 3.9Å; L18-A43 HydrophobicContact CG-CB 4.46Å; A43-E45 PolarHBondContact O-N 3.09Å; A43-E45 VanDerWaalsContact O-N 3.13Å; A43-H46 CarbonylContact C-O 3.57Å; A43-H46 WeakPolarHBondContact CA-O 3.27Å; A43-H46 PolarHBondContact N-O 3.35Å; A43-H46 PolarHBondContact O-N 2.98Å; A43-F48 HydrophobicContact CB-CB 4.47Å; A43-F48 HydrophobicContact CB-CD1 4.04Å; A43-F48 HydrophobicContact CB-CD2 3.35Å; A43-F48 HydrophobicContact CB-CE1 4.06Å; A43-F48 HydrophobicContact CB-CE2 3.36Å; A43-F48 HydrophobicContact CB-CG 3.7Å; A43-F48 HydrophobicContact CB-CZ 3.74Å
44	C	88.8	Confident	87.7	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	-112.3	-172.2	-67.9	0	0	0	0	109.8	L18 E67 V68 H673	L18-C44 HydrophobicContact CD2-CB 4.26Å; L18-C44 VanDerWaalsContact CD2-SG 3.51Å; C44-E67 CarbonylContact O-C 3.39Å; C44-E67 WeakPolarHBondContact O-CA 3.45Å; C44-V68 PolarHBondContact O-N 2.79Å; C44-H673 WeakPolarHBondContact CB-ND1 3.43Å
45	E	90.1	Very high	87.9	Confident	15 Å²	15	29 Å²	29	7%	0.07	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-14.6	177.7	71.3	-141.9	-169.7	0	0	114.2	A43 G63 Q66 H673 R698	A43-E45 PolarHBondContact O-N 3.09Å; A43-E45 VanDerWaalsContact O-N 3.13Å; E45-G63 WeakPolarHBondContact O-CA 3.43Å; E45-G63 PolarHBondContact O-N 3.41Å; E45-Q66 VanDerWaalsContact CA-O 3.22Å; E45-Q66 WeakPolarHBondContact CA-O 3.37Å; E45-Q66 WeakPolarHBondContact CB-O 3.43Å; E45-H673 IonicContact OE2-CE1 3.96Å; E45-H673 PolarHBondContact OE2-CE1 2.81Å; E45-H673 VanDerWaalsContact OE2-CE1 3.3Å; E45-H673 IonicContact OE2-NE2 3.35Å; E45-R698 IonicContact OE1-CZ 3.32Å; E45-R698 IonicContact OE1-NH1 2.76Å; E45-R698 PolarHBondContact OE1-NH1 3.45Å; E45-R698 IonicContact OE1-NH2 3.84Å; E45-R698 IonicContact OE2-CZ 3.2Å; E45-R698 IonicContact OE2-NH1 3.9Å; E45-R698 PolarHBondContact OE2-NH1 2.94Å; E45-R698 IonicContact OE2-NH2 3.46Å; E45-R698 PolarHBondContact OE2-NH2 2.9Å
46	H	91.4	Very high	88.4	Confident	25 Å²	25	27.3 Å²	27.3	12%	0.116	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	166.7	-177.3	-57.6	-30.5	0	0	0	111.5	A43 F48 I60 L61 G63	A43-H46 CarbonylContact C-O 3.57Å; A43-H46 WeakPolarHBondContact CA-O 3.27Å; A43-H46 PolarHBondContact N-O 3.35Å; A43-H46 PolarHBondContact O-N 2.98Å; H46-F48 HydrophobicContact CB-CD1 4.47Å; H46-F48 HydrophobicContact CB-CE1 4.03Å; H46-I60 HydrophobicContact CB-CG2 4.23Å; H46-L61 WeakPolarHBondContact CA-O 3.27Å; H46-L61 WeakPolarHBondContact CB-O 3.46Å; H46-G63 PolarHBondContact ND1-N 3.34Å
47	V	92.3	Very high	89	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	123.5	167.8	-175.2	0	0	0	0	108.8	A40 L61 V68 L71 L80 V82	A40-V47 HydrophobicContact CB-CG1 3.99Å; V47-L61 HydrophobicContact CB-CB 4.09Å; V47-L61 HydrophobicContact CB-CD1 4.15Å; V47-L61 HydrophobicContact CB-CG 4.47Å; V47-L61 HydrophobicContact CG1-CD1 4.38Å; V47-L61 PolarHBondContact N-O 2.91Å; V47-L61 PolarHBondContact O-N 2.93Å; V47-V68 HydrophobicContact CG2-CG1 4.29Å; V47-V68 HydrophobicContact CG2-CG2 4Å; V47-L71 HydrophobicContact CG1-CD1 3.94Å; V47-L71 HydrophobicContact CG1-CD2 4.09Å; V47-L71 HydrophobicContact CG2-CD2 3.71Å; V47-L80 HydrophobicContact CG1-CD2 4.17Å; V47-V82 HydrophobicContact CG2-CG1 3.87Å; V47-V82 HydrophobicContact CG2-CG2 3.98Å
48	F	91.8	Very high	89.1	Confident	1 Å²	1	32.1 Å²	32.1	0%	0.004	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.7	177.6	-65.8	-19.2	0	0	0	110.7	L18 V41 A43 H46 W50 K57 I60	L18-F48 WeakPolarHBondContact O-CE2 3.43Å; V41-F48 PolarHBondContact N-O 2.9Å; V41-F48 PolarHBondContact O-N 2.83Å; A43-F48 HydrophobicContact CB-CB 4.47Å; A43-F48 HydrophobicContact CB-CD1 4.04Å; A43-F48 HydrophobicContact CB-CD2 3.35Å; A43-F48 HydrophobicContact CB-CE1 4.06Å; A43-F48 HydrophobicContact CB-CE2 3.36Å; A43-F48 HydrophobicContact CB-CG 3.7Å; A43-F48 HydrophobicContact CB-CZ 3.74Å; H46-F48 HydrophobicContact CB-CD1 4.47Å; H46-F48 HydrophobicContact CB-CE1 4.03Å; F48-W50 HydrophobicContact CD2-CZ2 4.46Å; F48-K57 HydrophobicContact CD2-CD 4.4Å; F48-I60 HydrophobicContact CD1-CB 4.26Å; F48-I60 HydrophobicContact CD1-CD1 4.46Å; F48-I60 HydrophobicContact CD1-CG1 3.81Å; F48-I60 HydrophobicContact CD1-CG2 3.92Å; F48-I60 HydrophobicContact CE1-CB 4.36Å; F48-I60 HydrophobicContact CE1-CD1 4.1Å; F48-I60 HydrophobicContact CE1-CG1 3.91Å; F48-I60 HydrophobicContact CE1-CG2 3.7Å
49	I	92	Very high	88.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	117.4	171.6	-66.6	160.8	0	0	0	108.9	L31 V39 A40 I58 L59 L61 L94	L31-I49 HydrophobicContact CD1-CD1 4.34Å; L31-I49 HydrophobicContact CD1-CG2 3.51Å; V39-I49 WeakPolarHBondContact O-CA 3.46Å; A40-I49 HydrophobicContact CB-CG1 4.31Å; I49-I58 PolarHBondContact O-N 2.92Å; I49-L59 HydrophobicContact CB-CB 4.22Å; I49-L59 HydrophobicContact CD1-CB 4.02Å; I49-L59 HydrophobicContact CD1-CD2 3.86Å; I49-L59 HydrophobicContact CD1-CG 4.29Å; I49-L59 PolarHBondContact N-O 3.34Å; I49-L61 HydrophobicContact CD1-CD1 4.21Å; I49-L61 HydrophobicContact CD1-CG 4.31Å; I49-L94 HydrophobicContact CD1-CD2 3.75Å
50	W	90.8	Very high	88.9	Confident	6 Å²	6	37.2 Å²	37.2	2%	0.023	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	140.8	-177.7	-68.8	93.2	0	0	0	111.8	I19 Y38 V39 F48 G55 K57 I407	I19-W50 HydrophobicContact CB-CZ2 4.29Å; I19-W50 HydrophobicContact CG1-CH2 4.43Å; I19-W50 HydrophobicContact CG1-CZ2 4.17Å; I19-W50 HydrophobicContact CG2-CZ2 4.11Å; I19-W50 PolarHBondContact O-NE1 3.12Å; Y38-W50 WeakPolarHBondContact CA-O 3.37Å; V39-W50 PolarHBondContact N-O 2.75Å; V39-W50 VanDerWaalsContact N-O 3.09Å; V39-W50 PolarHBondContact O-N 3.47Å; F48-W50 HydrophobicContact CD2-CZ2 4.46Å; W50-G55 WeakPolarHBondContact CZ3-O 3.37Å; W50-K57 HydrophobicContact CD2-CG 4.03Å; W50-K57 HydrophobicContact CE3-CG 3.78Å; W50-K57 HydrophobicContact CH2-CD 3.91Å; W50-K57 HydrophobicContact CH2-CG 3.36Å; W50-K57 HydrophobicContact CZ2-CD 3.98Å; W50-K57 HydrophobicContact CZ2-CG 3.6Å; W50-K57 HydrophobicContact CZ3-CD 4.45Å; W50-K57 HydrophobicContact CZ3-CG 3.44Å; W50-K57 VanDerWaalsContact CZ3-CG 3.44Å; W50-I407 HydrophobicContact CB-CD1 3.89Å; W50-I407 HydrophobicContact CD2-CD1 4.16Å; W50-I407 HydrophobicContact CE3-CD1 4.12Å; W50-I407 HydrophobicContact CE3-CG2 4.14Å; W50-I407 HydrophobicContact CG-CD1 4.11Å; W50-I407 HydrophobicContact CH2-CG2 4.29Å; W50-I407 HydrophobicContact CZ3-CG2 3.99Å
51	D	90.1	Very high	88.8	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	115.4	163	-169	-14.3	0	0	0	109.6	R37 Y38 R53 K54 G55 E56 I58	R37-D51 VanDerWaalsContact CG-OD1 3.31Å; R37-D51 WeakPolarHBondContact CG-OD1 3.46Å; R37-D51 IonicContact CZ-OD1 3.2Å; R37-D51 IonicContact CZ-OD2 2.83Å; R37-D51 IonicContact NE-OD1 2.73Å; R37-D51 PolarHBondContact NE-OD1 3.32Å; R37-D51 IonicContact NE-OD2 2.8Å; R37-D51 PolarHBondContact NE-OD2 2.65Å; R37-D51 VanDerWaalsContact NE-OD2 3.12Å; R37-D51 IonicContact NH2-OD1 3.94Å; R37-D51 IonicContact NH2-OD2 3.34Å; R37-D51 PolarHBondContact NH2-OD2 2.96Å; Y38-D51 HydrophobicContact CD1-CB 4.35Å; Y38-D51 HydrophobicContact CE1-CB 4.25Å; D51-R53 PolarHBondContact O-N 3.3Å; D51-R53 PolarHBondContact OD1-N 3.12Å; D51-K54 HydrophobicContact CB-CB 4.36Å; D51-G55 WeakPolarHBondContact O-CA 3.31Å; D51-G55 PolarHBondContact O-N 3.12Å; D51-E56 PolarHBondContact N-O 3.35Å; D51-I58 HydrophobicContact CB-CD1 3.71Å; D51-I58 HydrophobicContact CB-CG1 4.37Å
52	L	85.1	Confident	88.5	Confident	7 Å²	7	44 Å²	44	4%	0.037	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.2	-179.9	-66.9	179	0	0	0	113.8	F28 R37 V39 V379 V387 L389 S405 I407	F28-L52 HydrophobicContact CE1-CD1 4.12Å; R37-L52 WeakPolarHBondContact O-CB 3.46Å; R37-L52 WeakPolarHBondContact O-CG 3.4Å; R37-L52 PolarHBondContact O-N 2.82Å; R37-L52 VanDerWaalsContact O-N 3.09Å; V39-L52 HydrophobicContact CB-CD2 4.44Å; V39-L52 HydrophobicContact CG2-CD1 3.53Å; V39-L52 HydrophobicContact CG2-CD2 3.9Å; V39-L52 HydrophobicContact CG2-CG 3.72Å; L52-V379 HydrophobicContact CD1-CG2 3.77Å; L52-V387 HydrophobicContact CD2-CG1 4.18Å; L52-L389 HydrophobicContact CD1-CB 4.36Å; L52-L389 HydrophobicContact CD1-CD1 4.09Å; L52-L389 HydrophobicContact CD1-CD2 3.94Å; L52-L389 HydrophobicContact CD1-CG 4.34Å; L52-S405 WeakPolarHBondContact O-CB 3.46Å; L52-S405 PolarHBondContact O-OG 3.4Å; L52-I407 HydrophobicContact CD2-CD1 4.1Å
53	R	85.7	Confident	87.9	Confident	178 Å²	178	44.4 Å²	44.4	67%	0.672	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-43.7	179.5	-69.5	-177.8	177.2	160.4	-0.8	112.1	R37 D51	R37-R53 HydrophobicContact CG-CG 4.46Å; D51-R53 PolarHBondContact O-N 3.3Å; D51-R53 PolarHBondContact OD1-N 3.12Å
54	K	84.4	Confident	87.4	Confident	139 Å²	139	49.6 Å²	49.6	60%	0.604	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-26	-177.8	-65.6	-174.3	174.1	-170.9	0	113.1	D51 E56	D51-K54 HydrophobicContact CB-CB 4.36Å; K54-E56 VanDerWaalsContact C-N 3.26Å; K54-E56 HydrophobicContact CB-CB 4.3Å; K54-E56 HydrophobicContact CB-CG 4.12Å
55	G	82.4	Confident	87	Confident	29 Å²	29	56.2 Å²	56.2	30%	0.299	27%	0.267	S	S	.	.			trans	70.4	24	-171.9	0	0	0	0	0	113.1	W50 D51	W50-G55 WeakPolarHBondContact CZ3-O 3.37Å; D51-G55 WeakPolarHBondContact O-CA 3.31Å; D51-G55 PolarHBondContact O-N 3.12Å
56	E	85.5	Confident	86.8	Confident	106 Å²	106	59.2 Å²	59.2	50%	0.495	28%	0.281	S	S	.	.			trans	-105.2	150.2	-180	-68.4	176.9	163.7	0	0	111	D51 K54	D51-E56 PolarHBondContact N-O 3.35Å; K54-E56 VanDerWaalsContact C-N 3.26Å; K54-E56 HydrophobicContact CB-CB 4.3Å; K54-E56 HydrophobicContact CB-CG 4.12Å
57	K	87.4	Confident	86.7	Confident	71 Å²	71	58 Å²	58	31%	0.309	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.8	171.6	-59.7	-178.4	-180	-174.4	0	108.6	F48 W50	F48-K57 HydrophobicContact CD2-CD 4.4Å; W50-K57 HydrophobicContact CD2-CG 4.03Å; W50-K57 HydrophobicContact CE3-CG 3.78Å; W50-K57 HydrophobicContact CH2-CD 3.91Å; W50-K57 HydrophobicContact CH2-CG 3.36Å; W50-K57 HydrophobicContact CZ2-CD 3.98Å; W50-K57 HydrophobicContact CZ2-CG 3.6Å; W50-K57 HydrophobicContact CZ3-CD 4.45Å; W50-K57 HydrophobicContact CZ3-CG 3.44Å; W50-K57 VanDerWaalsContact CZ3-CG 3.44Å
58	I	87.6	Confident	86.8	Confident	81 Å²	81	58 Å²	58	42%	0.415	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-49.5	178.7	-68.7	169.8	0	0	0	111.1	Y38 I49 D51	Y38-I58 HydrophobicContact CD1-CD1 3.51Å; Y38-I58 HydrophobicContact CE1-CD1 3.17Å; I49-I58 PolarHBondContact O-N 2.92Å; D51-I58 HydrophobicContact CB-CD1 3.71Å; D51-I58 HydrophobicContact CB-CG1 4.37Å
59	L	87.1	Confident	86.8	Confident	43 Å²	43	59 Å²	59	23%	0.225	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.1	-174	-172.4	66	0	0	0	109.3	I49 L61	I49-L59 HydrophobicContact CB-CB 4.22Å; I49-L59 HydrophobicContact CD1-CB 4.02Å; I49-L59 HydrophobicContact CD1-CD2 3.86Å; I49-L59 HydrophobicContact CD1-CG 4.29Å; I49-L59 PolarHBondContact N-O 3.34Å; L59-L61 HydrophobicContact CD2-CD2 3.78Å; L59-L61 HydrophobicContact CG-CD2 4.12Å
60	I	89.9	Confident	86.7	Confident	77 Å²	77	59.2 Å²	59.2	40%	0.395	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	115.6	172.8	-60.4	175	0	0	0	106.3	H46 F48 Q62	H46-I60 HydrophobicContact CB-CG2 4.23Å; F48-I60 HydrophobicContact CD1-CB 4.26Å; F48-I60 HydrophobicContact CD1-CD1 4.46Å; F48-I60 HydrophobicContact CD1-CG1 3.81Å; F48-I60 HydrophobicContact CD1-CG2 3.92Å; F48-I60 HydrophobicContact CE1-CB 4.36Å; F48-I60 HydrophobicContact CE1-CD1 4.1Å; F48-I60 HydrophobicContact CE1-CG1 3.91Å; F48-I60 HydrophobicContact CE1-CG2 3.7Å; I60-Q62 HydrophobicContact CG2-CG 4.15Å
61	L	89.3	Confident	86.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.4	170.2	-54.3	176.4	0	0	0	107.1	H46 V47 I49 L59 G63 L80 F92	H46-L61 WeakPolarHBondContact CA-O 3.27Å; H46-L61 WeakPolarHBondContact CB-O 3.46Å; V47-L61 HydrophobicContact CB-CB 4.09Å; V47-L61 HydrophobicContact CB-CD1 4.15Å; V47-L61 HydrophobicContact CB-CG 4.47Å; V47-L61 HydrophobicContact CG1-CD1 4.38Å; V47-L61 PolarHBondContact N-O 2.91Å; V47-L61 PolarHBondContact O-N 2.93Å; I49-L61 HydrophobicContact CD1-CD1 4.21Å; I49-L61 HydrophobicContact CD1-CG 4.31Å; L59-L61 HydrophobicContact CD2-CD2 3.78Å; L59-L61 HydrophobicContact CG-CD2 4.12Å; L61-G63 PolarHBondContact O-N 3.45Å; L61-L80 HydrophobicContact CD1-CD2 3.69Å; L61-F92 HydrophobicContact CB-CD1 4.02Å; L61-F92 HydrophobicContact CB-CE1 4.15Å; L61-F92 HydrophobicContact CB-CG 4.22Å; L61-F92 HydrophobicContact CB-CZ 4.45Å; L61-F92 HydrophobicContact CD1-CB 3.88Å; L61-F92 HydrophobicContact CD1-CD2 4.38Å; L61-F92 HydrophobicContact CD1-CG 4.04Å; L61-F92 HydrophobicContact CD2-CB 4.15Å; L61-F92 HydrophobicContact CD2-CD1 4.12Å; L61-F92 HydrophobicContact CD2-CG 4.3Å; L61-F92 HydrophobicContact CG-CD1 4.46Å; L61-F92 HydrophobicContact CG-CG 4.42Å
62	Q	85.8	Confident	87	Confident	142 Å²	142	59.4 Å²	59.4	66%	0.664	29%	0.285	S	S	*	.			trans	-79.8	109.6	-177	-68.3	-179	-20.2	0	0	110.2	I60	I60-Q62 HydrophobicContact CG2-CG 4.15Å
63	G	80.2	Confident	87.3	Confident	9 Å²	9	61.2 Å²	61.2	9%	0.093	30%	0.297	C	S	.	.			trans	-83.1	174.3	162.1	0	0	0	0	0	112.5	E45 H46 L61 Y84	E45-G63 WeakPolarHBondContact O-CA 3.43Å; E45-G63 PolarHBondContact O-N 3.41Å; H46-G63 PolarHBondContact ND1-N 3.34Å; L61-G63 PolarHBondContact O-N 3.45Å; G63-Y84 WeakPolarHBondContact CA-OH 3.28Å
64	L	77.3	Confident	87.5	Confident	110 Å²	110	53.1 Å²	53.1	58%	0.576	27%	0.268	S	S	*	.			trans	-79.8	-77.3	-173.8	-73.2	179.5	0	0	0	113.5	R90	L64-R90 VanDerWaalsContact CG-NH2 3.26Å
65	K	80.8	Confident	87.4	Confident	139 Å²	139	48.8 Å²	48.8	60%	0.604	25%	0.254	S	S	*	.	S	Bend	trans	-141.5	-30.6	-165.9	-69.2	-174.3	179.8	-178.8	0	113.7	H673	K65-H673 PolarHBondContact O-NE2 2.65Å
66	Q	86.8	Confident	87.4	Confident	78 Å²	78	52.5 Å²	52.5	36%	0.364	27%	0.267	S	S	.	.	S	Bend	trans	-96.4	155.6	-172	-60.9	-65	-6.8	0	0	111.8	E45 Y84 D86	E45-Q66 VanDerWaalsContact CA-O 3.22Å; E45-Q66 WeakPolarHBondContact CA-O 3.37Å; E45-Q66 WeakPolarHBondContact CB-O 3.43Å; Q66-Y84 HydrophobicContact CB-CD1 4.45Å; Q66-Y84 VanDerWaalsContact O-CD1 3.31Å; Q66-Y84 WeakPolarHBondContact O-CD1 3.34Å; Q66-D86 HydrophobicContact CG-CB 3.94Å
67	E	88.9	Confident	87.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-70.7	142.9	179	-62	-165.4	116.4	0	0	112.2	K23 C44 Y84 E85 H673	K23-E67 HydrophobicContact CD-CB 4.39Å; K23-E67 WeakPolarHBondContact CD-OE2 3.32Å; K23-E67 WeakPolarHBondContact CE-OE2 3.47Å; K23-E67 IonicContact NZ-OE2 2.72Å; K23-E67 PolarHBondContact NZ-OE2 3.25Å; C44-E67 CarbonylContact O-C 3.39Å; C44-E67 WeakPolarHBondContact O-CA 3.45Å; E67-Y84 CarbonylContact O-C 3.56Å; E67-Y84 WeakPolarHBondContact O-CA 3.31Å; E67-E85 PolarHBondContact O-N 2.73Å; E67-H673 HydrophobicContact CG-CB 3.48Å; E67-H673 VanDerWaalsContact CG-CB 3.48Å; E67-H673 WeakPolarHBondContact CG-CD2 3.47Å; E67-H673 WeakPolarHBondContact CG-ND1 3.32Å; E67-H673 WeakPolarHBondContact OE1-CB 3.24Å; E67-H673 IonicContact OE1-CG 2.64Å; E67-H673 IonicContact OE1-ND1 3.11Å
68	V	93	Very high	87.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	123	171.5	177.4	0	0	0	0	109.8	P42 C44 V47 L71 V82 Y84	P42-V68 HydrophobicContact CB-CB 3.99Å; P42-V68 HydrophobicContact CB-CG1 3.83Å; C44-V68 PolarHBondContact O-N 2.79Å; V47-V68 HydrophobicContact CG2-CG1 4.29Å; V47-V68 HydrophobicContact CG2-CG2 4Å; V68-L71 HydrophobicContact CG1-CD2 3.75Å; V68-L71 HydrophobicContact CG1-CG 4.24Å; V68-V82 HydrophobicContact CB-CG1 4.21Å; V68-V82 HydrophobicContact CG1-CG1 3.53Å; V68-V82 HydrophobicContact CG2-CG1 3.63Å; V68-Y84 HydrophobicContact CG2-CD1 4.01Å; V68-Y84 HydrophobicContact CG2-CE1 3.63Å
69	T	91.7	Very high	87.3	Confident	22 Å²	22	47.5 Å²	47.5	14%	0.135	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-27.5	-179.4	59.2	0	0	0	0	112.8	G24 G83 E85 A109 I110	G24-T69 VanDerWaalsContact CA-O 3.26Å; G24-T69 WeakPolarHBondContact CA-O 3.23Å; T69-G83 PolarHBondContact N-O 3.41Å; T69-G83 PolarHBondContact OG1-O 2.92Å; T69-E85 HydrophobicContact CG2-CB 4.03Å; T69-A109 HydrophobicContact CG2-CB 4.32Å; T69-I110 VanDerWaalsContact CB-O 3.27Å; T69-I110 WeakPolarHBondContact CB-O 3.45Å; T69-I110 PolarHBondContact OG1-O 2.9Å
70	C	91.8	Very high	87.5	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.027	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	150.9	-179.6	57.6	0	0	0	0	112.9	N25 V82 G83 I110 L113	N25-C70 VanDerWaalsContact OD1-CA 3.28Å; N25-C70 WeakPolarHBondContact OD1-CA 3.34Å; C70-V82 WeakPolarHBondContact O-CA 3.37Å; C70-G83 PolarHBondContact N-O 3.45Å; C70-G83 PolarHBondContact O-N 3.45Å; C70-I110 WeakPolarHBondContact SG-CG2 3.43Å; C70-L113 WeakPolarHBondContact SG-CD1 3.12Å; C70-L113 VanDerWaalsContact SG-CG 3.59Å
71	L	93.8	Very high	87.7	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.7	-179	-62.3	-178.5	0	0	0	108.5	N25 V27 A40 P42 V47 V68 L80 A81 V82	N25-L71 PolarHBondContact ND2-O 2.96Å; N25-L71 WeakPolarHBondContact O-CD1 3.39Å; N25-L71 PolarHBondContact OD1-N 3.49Å; V27-L71 HydrophobicContact CB-CB 4.47Å; V27-L71 HydrophobicContact CG2-CB 3.88Å; V27-L71 WeakPolarHBondContact CG2-O 3.46Å; A40-L71 HydrophobicContact CB-CD1 4.19Å; P42-L71 HydrophobicContact CB-CD1 4.37Å; P42-L71 HydrophobicContact CG-CD1 4.46Å; V47-L71 HydrophobicContact CG1-CD1 3.94Å; V47-L71 HydrophobicContact CG1-CD2 4.09Å; V47-L71 HydrophobicContact CG2-CD2 3.71Å; V68-L71 HydrophobicContact CG1-CD2 3.75Å; V68-L71 HydrophobicContact CG1-CG 4.24Å; L71-L80 HydrophobicContact CD2-CD2 4.46Å; L71-A81 WeakPolarHBondContact CA-O 3.47Å; L71-V82 HydrophobicContact CD2-CB 4.16Å; L71-V82 HydrophobicContact CD2-CG1 3.91Å; L71-V82 HydrophobicContact CD2-CG2 3.7Å
72	C	92.1	Very high	87.9	Confident	8 Å²	8	41.8 Å²	41.8	5%	0.054	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	119.2	173.8	-167.3	0	0	0	0	109.8	A81 L113 Y115	C72-A81 HydrophobicContact CB-CB 4.43Å; C72-A81 PolarHBondContact N-O 3.23Å; C72-A81 PolarHBondContact O-N 3.41Å; C72-L113 HydrophobicContact CB-CB 3.78Å; C72-L113 PolarHBondContact SG-O 3.39Å; C72-Y115 HydrophobicContact CB-CD2 4.36Å; C72-Y115 WeakPolarHBondContact O-CE2 3.48Å
73	P	91.7	Very high	88.3	Confident	45 Å²	45	35 Å²	35	29%	0.292	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	141.5	177.4	35.3	-31	0	0	0	109.3	V27 L80	V27-P73 HydrophobicContact CG1-CB 3.83Å; V27-P73 VanDerWaalsContact CG1-CD 3.44Å; V27-P73 HydrophobicContact CG1-CG 3.38Å; P73-L80 HydrophobicContact CB-CD1 4.27Å
74	S	89.2	Confident	88.9	Confident	8 Å²	8	34.8 Å²	34.8	6%	0.056	18%	0.183	C	C	.	.			trans	-61.7	147.9	169.7	57.4	0	0	0	0	111	D76 G77 L78 H79	S74-D76 PolarHBondContact O-N 2.98Å; S74-G77 PolarHBondContact O-N 2.82Å; S74-G77 PolarHBondContact OG-N 2.82Å; S74-L78 PolarHBondContact OG-N 2.81Å; S74-H79 WeakPolarHBondContact CB-O 3.4Å; S74-H79 PolarHBondContact N-O 3.45Å; S74-H79 WeakPolarHBondContact OG-CA 3.43Å; S74-H79 PolarHBondContact OG-N 2.94Å; S74-H79 PolarHBondContact OG-O 3.37Å
75	P	84.2	Confident	89.5	Confident	49 Å²	49	32.8 Å²	32.8	32%	0.318	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-33.6	172.5	-24	32.6	0	0	0	113.3	G77 D116	P75-G77 VanDerWaalsContact C-N 3.26Å; P75-G77 PolarHBondContact O-N 3.18Å; P75-D116 WeakPolarHBondContact CG-O 3.38Å
76	D	81.5	Confident	89.7	Confident	106 Å²	106	29.3 Å²	29.3	57%	0.567	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-21.3	179.6	-56.6	-28.7	0	0	0	112.8	S74 L78	S74-D76 PolarHBondContact O-N 2.98Å; D76-L78 VanDerWaalsContact C-N 3.27Å; D76-L78 PolarHBondContact O-N 3.25Å
77	G	82.3	Confident	89.7	Confident	9 Å²	9	25.7 Å²	25.7	9%	0.093	14%	0.142	C	C	.	.	S	Bend	trans	76.9	11.1	178.6	0	0	0	0	0	114.7	T30 S74 P75 L94	T30-G77 WeakPolarHBondContact OG1-CA 3.17Å; T30-G77 PolarHBondContact OG1-O 3.46Å; S74-G77 PolarHBondContact O-N 2.82Å; S74-G77 PolarHBondContact OG-N 2.82Å; P75-G77 VanDerWaalsContact C-N 3.26Å; P75-G77 PolarHBondContact O-N 3.18Å; G77-L94 WeakPolarHBondContact O-CD1 3.48Å
78	L	85.6	Confident	89.7	Confident	82 Å²	82	26.1 Å²	26.1	43%	0.429	15%	0.146	S	C	.	.	S	Bend	trans	-96.2	-35.7	178.4	-67.3	174.4	0	0	0	112.5	S74 D76 L94 L95	S74-L78 PolarHBondContact OG-N 2.81Å; D76-L78 VanDerWaalsContact C-N 3.27Å; D76-L78 PolarHBondContact O-N 3.25Å; L78-L94 WeakPolarHBondContact O-CB 3.47Å; L78-L94 WeakPolarHBondContact O-CG 3.4Å; L78-L94 PolarHBondContact O-N 3.32Å; L78-L95 HydrophobicContact CD2-CD1 4.06Å
79	H	89.6	Confident	89.7	Confident	62 Å²	62	26.1 Å²	26.1	29%	0.287	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	152.5	-176.5	-57.3	-66.8	0	0	0	112.1	S74 I91 F92	S74-H79 WeakPolarHBondContact CB-O 3.4Å; S74-H79 PolarHBondContact N-O 3.45Å; S74-H79 WeakPolarHBondContact OG-CA 3.43Å; S74-H79 PolarHBondContact OG-N 2.94Å; S74-H79 PolarHBondContact OG-O 3.37Å; H79-I91 HydrophobicContact CB-CG2 3.8Å; H79-F92 CarbonylContact C-O 3.58Å; H79-F92 VanDerWaalsContact CA-O 3.28Å; H79-F92 WeakPolarHBondContact CA-O 3.42Å
80	L	92.3	Very high	89.7	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	117.8	173.1	-177.5	70.8	0	0	0	109.1	A40 V47 L61 L71 P73 V82 I91 F92 L94	A40-L80 HydrophobicContact CB-CD2 4.04Å; V47-L80 HydrophobicContact CG1-CD2 4.17Å; L61-L80 HydrophobicContact CD1-CD2 3.69Å; L71-L80 HydrophobicContact CD2-CD2 4.46Å; P73-L80 HydrophobicContact CB-CD1 4.27Å; L80-V82 HydrophobicContact CD2-CG2 4.22Å; L80-V82 HydrophobicContact CG-CG2 4.19Å; L80-I91 WeakPolarHBondContact O-CA 3.43Å; L80-F92 PolarHBondContact N-O 3.13Å; L80-F92 PolarHBondContact O-N 2.99Å; L80-L94 HydrophobicContact CB-CD2 4.06Å; L80-L94 HydrophobicContact CB-CG 4.36Å; L80-L94 HydrophobicContact CD2-CD2 4.44Å
81	A	93.2	Very high	89.7	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	133.8	169.2	0	0	0	0	0	110	L71 C72 R90 I91 L113 Y115 L122	L71-A81 WeakPolarHBondContact CA-O 3.47Å; C72-A81 HydrophobicContact CB-CB 4.43Å; C72-A81 PolarHBondContact N-O 3.23Å; C72-A81 PolarHBondContact O-N 3.41Å; A81-R90 CarbonylContact C-O 3.59Å; A81-R90 WeakPolarHBondContact CA-O 3.48Å; A81-I91 HydrophobicContact CB-CG1 4.39Å; A81-L113 HydrophobicContact CB-CD1 4.28Å; A81-Y115 HydrophobicContact CB-CE2 3.6Å; A81-Y115 WeakPolarHBondContact CB-OH 3.32Å; A81-L122 HydrophobicContact CB-CD1 4.27Å; A81-L122 HydrophobicContact CB-CD2 4.12Å
82	V	93.8	Very high	89.6	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.8	-177.7	-177.9	0	0	0	0	107.6	V47 V68 C70 L71 L80 Y84 I89 R90 F92	V47-V82 HydrophobicContact CG2-CG1 3.87Å; V47-V82 HydrophobicContact CG2-CG2 3.98Å; V68-V82 HydrophobicContact CB-CG1 4.21Å; V68-V82 HydrophobicContact CG1-CG1 3.53Å; V68-V82 HydrophobicContact CG2-CG1 3.63Å; C70-V82 WeakPolarHBondContact O-CA 3.37Å; L71-V82 HydrophobicContact CD2-CB 4.16Å; L71-V82 HydrophobicContact CD2-CG1 3.91Å; L71-V82 HydrophobicContact CD2-CG2 3.7Å; L80-V82 HydrophobicContact CD2-CG2 4.22Å; L80-V82 HydrophobicContact CG-CG2 4.19Å; V82-Y84 HydrophobicContact CB-CE2 4.23Å; V82-Y84 HydrophobicContact CG1-CD2 4.45Å; V82-Y84 HydrophobicContact CG1-CE1 4.43Å; V82-Y84 HydrophobicContact CG1-CE2 3.79Å; V82-I89 CarbonylContact O-C 3.55Å; V82-I89 WeakPolarHBondContact O-CA 3.29Å; V82-R90 PolarHBondContact N-O 3.27Å; V82-R90 PolarHBondContact O-N 2.96Å; V82-F92 HydrophobicContact CB-CD2 4.21Å; V82-F92 HydrophobicContact CB-CE2 4.07Å; V82-F92 HydrophobicContact CG2-CD2 3.56Å; V82-F92 HydrophobicContact CG2-CE2 3.82Å
83	G	94	Very high	89.5	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	141.9	173.9	0	0	0	0	0	111.5	T69 C70	T69-G83 PolarHBondContact N-O 3.41Å; T69-G83 PolarHBondContact OG1-O 2.92Å; C70-G83 PolarHBondContact N-O 3.45Å; C70-G83 PolarHBondContact O-N 3.45Å
84	Y	93	Very high	89.2	Confident	4 Å²	4	25.5 Å²	25.5	2%	0.016	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	168.2	-176.1	-66.2	-90.9	0	0	0	112.5	G63 Q66 E67 V68 V82 D86 G87 S88 R90 I110	G63-Y84 WeakPolarHBondContact CA-OH 3.28Å; Q66-Y84 HydrophobicContact CB-CD1 4.45Å; Q66-Y84 VanDerWaalsContact O-CD1 3.31Å; Q66-Y84 WeakPolarHBondContact O-CD1 3.34Å; E67-Y84 CarbonylContact O-C 3.56Å; E67-Y84 WeakPolarHBondContact O-CA 3.31Å; V68-Y84 HydrophobicContact CG2-CD1 4.01Å; V68-Y84 HydrophobicContact CG2-CE1 3.63Å; V82-Y84 HydrophobicContact CB-CE2 4.23Å; V82-Y84 HydrophobicContact CG1-CD2 4.45Å; V82-Y84 HydrophobicContact CG1-CE1 4.43Å; V82-Y84 HydrophobicContact CG1-CE2 3.79Å; Y84-D86 VanDerWaalsContact C-N 3.31Å; Y84-D86 WeakPolarHBondContact CB-OD1 3.22Å; Y84-D86 PolarHBondContact O-N 2.9Å; Y84-G87 PolarHBondContact O-N 3.25Å; Y84-S88 WeakPolarHBondContact CB-OG 3.44Å; Y84-S88 WeakPolarHBondContact CD2-O 3.43Å; Y84-S88 WeakPolarHBondContact CD2-OG 3.45Å; Y84-S88 PolarHBondContact N-O 3.46Å; Y84-R90 HydrophobicContact CD2-CG 4.27Å; Y84-R90 HydrophobicContact CE2-CB 3.87Å; Y84-R90 HydrophobicContact CE2-CG 3.55Å; Y84-I110 PolarHBondContact O-N 2.79Å
85	E	90	Very high	89.1	Confident	69 Å²	69	31.4 Å²	31.4	32%	0.322	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-23.6	-179.8	-175.3	164.2	-153.5	0	0	114.2	K23 E67 T69 G87 A109	K23-E85 IonicContact NZ-OE1 3.42Å; K23-E85 PolarHBondContact NZ-OE1 3.38Å; K23-E85 IonicContact NZ-OE2 2.97Å; K23-E85 PolarHBondContact NZ-OE2 2.87Å; E67-E85 PolarHBondContact O-N 2.73Å; T69-E85 HydrophobicContact CG2-CB 4.03Å; E85-G87 VanDerWaalsContact C-N 3.27Å; E85-G87 PolarHBondContact O-N 3.17Å; E85-A109 HydrophobicContact CB-CB 4.5Å; E85-A109 HydrophobicContact CG-CB 4.17Å; E85-A109 WeakPolarHBondContact O-CA 3.45Å; E85-A109 WeakPolarHBondContact O-CB 3.46Å; E85-A109 PolarHBondContact O-N 3.36Å
86	D	85.5	Confident	89.1	Confident	65 Å²	65	32 Å²	32	35%	0.348	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-8.2	175	57	3.8	0	0	0	114	Q66 Y84 S88	Q66-D86 HydrophobicContact CG-CB 3.94Å; Y84-D86 VanDerWaalsContact C-N 3.31Å; Y84-D86 WeakPolarHBondContact CB-OD1 3.22Å; Y84-D86 PolarHBondContact O-N 2.9Å; D86-S88 VanDerWaalsContact OD1-CB 3.28Å; D86-S88 WeakPolarHBondContact OD1-CB 3.1Å; D86-S88 PolarHBondContact OD1-N 2.85Å; D86-S88 PolarHBondContact OD1-OG 3.01Å; D86-S88 PolarHBondContact OD2-OG 3.19Å
87	G	86.8	Confident	89.1	Confident	2 Å²	2	27.6 Å²	27.6	2%	0.021	15%	0.151	C	C	.	.	S	Bend	trans	90.9	5.2	-174.3	0	0	0	0	0	114.3	Y84 E85 A108 I110	Y84-G87 PolarHBondContact O-N 3.25Å; E85-G87 VanDerWaalsContact C-N 3.27Å; E85-G87 PolarHBondContact O-N 3.17Å; G87-A108 WeakPolarHBondContact CA-O 3.29Å; G87-A108 PolarHBondContact N-O 3.44Å; G87-I110 VanDerWaalsContact C-CD1 3.43Å; G87-I110 WeakPolarHBondContact O-CD1 3.48Å
88	S	89.4	Confident	89.2	Confident	10 Å²	10	33.4 Å²	33.4	7%	0.07	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	145	172.1	70.1	0	0	0	0	111.5	Y84 D86 F103 N104 I110	Y84-S88 WeakPolarHBondContact CB-OG 3.44Å; Y84-S88 WeakPolarHBondContact CD2-O 3.43Å; Y84-S88 WeakPolarHBondContact CD2-OG 3.45Å; Y84-S88 PolarHBondContact N-O 3.46Å; D86-S88 VanDerWaalsContact OD1-CB 3.28Å; D86-S88 WeakPolarHBondContact OD1-CB 3.1Å; D86-S88 PolarHBondContact OD1-N 2.85Å; D86-S88 PolarHBondContact OD1-OG 3.01Å; D86-S88 PolarHBondContact OD2-OG 3.19Å; S88-F103 CarbonylContact C-O 3.53Å; S88-F103 WeakPolarHBondContact CA-O 3.34Å; S88-N104 VanDerWaalsContact CB-OD1 3.24Å; S88-N104 WeakPolarHBondContact CB-OD1 3.27Å; S88-I110 WeakPolarHBondContact O-CD1 3.49Å
89	I	92.4	Very high	88.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.9	173.8	-51.1	161.5	0	0	0	107.6	V82 T102 F103 I110 L113 L122 S124 W134	V82-I89 CarbonylContact O-C 3.55Å; V82-I89 WeakPolarHBondContact O-CA 3.29Å; I89-T102 CarbonylContact O-C 3.59Å; I89-T102 WeakPolarHBondContact O-CA 3.46Å; I89-F103 HydrophobicContact CB-CB 4.13Å; I89-F103 HydrophobicContact CB-CD2 4.28Å; I89-F103 HydrophobicContact CD1-CB 4.49Å; I89-F103 HydrophobicContact CG2-CD2 4.42Å; I89-F103 PolarHBondContact N-O 3.4Å; I89-F103 PolarHBondContact O-N 3.02Å; I89-I110 HydrophobicContact CB-CD1 4.48Å; I89-I110 HydrophobicContact CD1-CD1 4.34Å; I89-I110 HydrophobicContact CG1-CD1 3.38Å; I89-I110 HydrophobicContact CG1-CG1 4.21Å; I89-L113 HydrophobicContact CD1-CD2 3.84Å; I89-L113 HydrophobicContact CG1-CD2 4.19Å; I89-L113 HydrophobicContact CG2-CD1 4.15Å; I89-L113 HydrophobicContact CG2-CD2 4.27Å; I89-L122 HydrophobicContact CG2-CD2 4.09Å; I89-S124 VanDerWaalsContact CD1-CB 3.48Å; I89-W134 HydrophobicContact CD1-CZ2 4.5Å
90	R	91.5	Very high	88.4	Confident	43 Å²	43	32.8 Å²	32.8	16%	0.162	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.3	173.5	-60.5	-171.8	165.7	-151.8	-16	111.2	L64 A81 V82 Y84 F92 I101 T102	L64-R90 VanDerWaalsContact CG-NH2 3.26Å; A81-R90 CarbonylContact C-O 3.59Å; A81-R90 WeakPolarHBondContact CA-O 3.48Å; V82-R90 PolarHBondContact N-O 3.27Å; V82-R90 PolarHBondContact O-N 2.96Å; Y84-R90 HydrophobicContact CD2-CG 4.27Å; Y84-R90 HydrophobicContact CE2-CB 3.87Å; Y84-R90 HydrophobicContact CE2-CG 3.55Å; R90-F92 HydrophobicContact CB-CD2 4.27Å; R90-F92 HydrophobicContact CB-CE2 3.72Å; R90-F92 HydrophobicContact CB-CZ 4.29Å; R90-I101 VanDerWaalsContact CA-O 3.29Å; R90-I101 WeakPolarHBondContact CA-O 3.39Å; R90-T102 HydrophobicContact CG-CG2 4.01Å
91	I	92.3	Very high	88.1	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	115.7	174	-59.3	-179.9	0	0	0	108.3	H79 L80 A81 N100 I101 F103 L122 V136	H79-I91 HydrophobicContact CB-CG2 3.8Å; L80-I91 WeakPolarHBondContact O-CA 3.43Å; A81-I91 HydrophobicContact CB-CG1 4.39Å; I91-N100 PolarHBondContact O-N 3.17Å; I91-I101 HydrophobicContact CB-CB 4.23Å; I91-I101 HydrophobicContact CD1-CD1 4.34Å; I91-I101 PolarHBondContact N-O 3.49Å; I91-F103 HydrophobicContact CD1-CE2 3.68Å; I91-F103 HydrophobicContact CD1-CZ 4.37Å; I91-F103 HydrophobicContact CG1-CE2 4.37Å; I91-L122 HydrophobicContact CD1-CD2 4.48Å; I91-V136 HydrophobicContact CD1-CB 4.41Å; I91-V136 HydrophobicContact CD1-CG1 3.69Å; I91-V136 HydrophobicContact CD1-CG2 4.06Å
92	F	91.7	Very high	87.8	Confident	3 Å²	3	34.4 Å²	34.4	1%	0.013	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	139.2	176.5	-69.8	-89.3	0	0	0	111	L61 H79 L80 V82 R90 E98 G99	L61-F92 HydrophobicContact CB-CD1 4.02Å; L61-F92 HydrophobicContact CB-CE1 4.15Å; L61-F92 HydrophobicContact CB-CG 4.22Å; L61-F92 HydrophobicContact CB-CZ 4.45Å; L61-F92 HydrophobicContact CD1-CB 3.88Å; L61-F92 HydrophobicContact CD1-CD2 4.38Å; L61-F92 HydrophobicContact CD1-CG 4.04Å; L61-F92 HydrophobicContact CD2-CB 4.15Å; L61-F92 HydrophobicContact CD2-CD1 4.12Å; L61-F92 HydrophobicContact CD2-CG 4.3Å; L61-F92 HydrophobicContact CG-CD1 4.46Å; L61-F92 HydrophobicContact CG-CG 4.42Å; H79-F92 CarbonylContact C-O 3.58Å; H79-F92 VanDerWaalsContact CA-O 3.28Å; H79-F92 WeakPolarHBondContact CA-O 3.42Å; L80-F92 PolarHBondContact N-O 3.13Å; L80-F92 PolarHBondContact O-N 2.99Å; V82-F92 HydrophobicContact CB-CD2 4.21Å; V82-F92 HydrophobicContact CB-CE2 4.07Å; V82-F92 HydrophobicContact CG2-CD2 3.56Å; V82-F92 HydrophobicContact CG2-CE2 3.82Å; R90-F92 HydrophobicContact CB-CD2 4.27Å; R90-F92 HydrophobicContact CB-CE2 3.72Å; R90-F92 HydrophobicContact CB-CZ 4.29Å; F92-E98 WeakPolarHBondContact CA-O 3.36Å; F92-G99 VanDerWaalsContact CD1-CA 3.45Å
93	S	89.5	Confident	87.5	Confident	16 Å²	16	34.5 Å²	34.5	11%	0.112	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.9	164.2	178.3	0	0	0	0	109.5	L95 S96 G97 E98	S93-L95 PolarHBondContact O-N 3.12Å; S93-S96 WeakPolarHBondContact CB-OG 3.37Å; S93-G97 VanDerWaalsContact O-CA 3.25Å; S93-G97 WeakPolarHBondContact O-CA 3.5Å; S93-G97 PolarHBondContact O-N 3.03Å; S93-E98 PolarHBondContact N-O 3.46Å
94	L	86.3	Confident	87.1	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.031	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-15.7	179.7	-67.7	168.2	0	0	0	113	V29 L31 I49 G77 L78 L80	V29-L94 HydrophobicContact CG1-CD1 3.35Å; V29-L94 HydrophobicContact CG1-CD2 3.8Å; V29-L94 HydrophobicContact CG1-CG 4.17Å; L31-L94 HydrophobicContact CD2-CB 4.1Å; L31-L94 WeakPolarHBondContact CD2-O 3.26Å; I49-L94 HydrophobicContact CD1-CD2 3.75Å; G77-L94 WeakPolarHBondContact O-CD1 3.48Å; L78-L94 WeakPolarHBondContact O-CB 3.47Å; L78-L94 WeakPolarHBondContact O-CG 3.4Å; L78-L94 PolarHBondContact O-N 3.32Å; L80-L94 HydrophobicContact CB-CD2 4.06Å; L80-L94 HydrophobicContact CB-CG 4.36Å; L80-L94 HydrophobicContact CD2-CD2 4.44Å
95	L	86.5	Confident	86.5	Confident	132 Å²	132	36.3 Å²	36.3	69%	0.691	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-46.8	179	-68.5	172.1	0	0	0	112	L78 S93	L78-L95 HydrophobicContact CD2-CD1 4.06Å; S93-L95 PolarHBondContact O-N 3.12Å
96	S	83.6	Confident	86.4	Confident	62 Å²	62	33.1 Å²	33.1	43%	0.434	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-28.7	179.4	58.1	0	0	0	0	112.9	S93 E98	S93-S96 WeakPolarHBondContact CB-OG 3.37Å; S96-E98 PolarHBondContact OG-N 3.48Å
97	G	81.1	Confident	86.2	Confident	13 Å²	13	35 Å²	35	13%	0.134	19%	0.194	C	C	.	.			trans	78.4	4.8	-170.5	0	0	0	0	0	114	S93	S93-G97 VanDerWaalsContact O-CA 3.25Å; S93-G97 WeakPolarHBondContact O-CA 3.5Å; S93-G97 PolarHBondContact O-N 3.03Å
98	E	85.2	Confident	86.3	Confident	130 Å²	130	36.3 Å²	36.3	61%	0.607	20%	0.204	S	C	*	.			trans	-87.3	143.9	180	-65.9	174.6	167.2	0	0	111.1	F92 S93 S96 N100	F92-E98 WeakPolarHBondContact CA-O 3.36Å; S93-E98 PolarHBondContact N-O 3.46Å; S96-E98 PolarHBondContact OG-N 3.48Å; E98-N100 PolarHBondContact O-N 3.13Å
99	G	79.3	Confident	86.4	Confident	35 Å²	35	36.8 Å²	36.8	36%	0.361	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	97.8	174	0	0	0	0	0	109.4	F92	F92-G99 VanDerWaalsContact CD1-CA 3.45Å
100	N	78.9	Confident	86.5	Confident	97 Å²	97	36.9 Å²	36.9	52%	0.519	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-39.9	-174.1	-68.6	8	0	0	0	111.7	I91 E98	I91-N100 PolarHBondContact O-N 3.17Å; E98-N100 PolarHBondContact O-N 3.13Å
101	I	85.5	Confident	86.5	Confident	17 Å²	17	37.5 Å²	37.5	9%	0.087	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135.4	-168.1	-50.4	167.8	0	0	0	109.4	R90 I91 F103 V136 E139	R90-I101 VanDerWaalsContact CA-O 3.29Å; R90-I101 WeakPolarHBondContact CA-O 3.39Å; I91-I101 HydrophobicContact CB-CB 4.23Å; I91-I101 HydrophobicContact CD1-CD1 4.34Å; I91-I101 PolarHBondContact N-O 3.49Å; I101-F103 HydrophobicContact CG2-CD1 4.17Å; I101-F103 HydrophobicContact CG2-CE1 3.58Å; I101-F103 HydrophobicContact CG2-CE2 4.06Å; I101-F103 HydrophobicContact CG2-CZ 3.53Å; I101-V136 HydrophobicContact CD1-CG1 4.27Å; I101-V136 WeakPolarHBondContact CD1-O 3.24Å; I101-E139 HydrophobicContact CD1-CG 3.97Å; I101-E139 HydrophobicContact CG1-CG 4.1Å; I101-E139 WeakPolarHBondContact CG1-OE1 3.15Å; I101-E139 HydrophobicContact CG2-CB 4.12Å; I101-E139 HydrophobicContact CG2-CG 3.89Å
102	T	87.9	Confident	86.4	Confident	16 Å²	16	38 Å²	38	10%	0.098	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	117.9	175.6	58.8	0	0	0	0	110.3	I89 R90 S816	I89-T102 CarbonylContact O-C 3.59Å; I89-T102 WeakPolarHBondContact O-CA 3.46Å; R90-T102 HydrophobicContact CG-CG2 4.01Å; T102-S816 WeakPolarHBondContact O-CB 3.32Å; T102-S816 PolarHBondContact O-OG 3.39Å; T102-S816 VanDerWaalsContact O-OG 3.14Å
103	F	88.1	Confident	86.6	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.009	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.7	173.3	-58.8	-53.8	0	0	0	110.9	S88 I89 I91 I101 L122 W134 E139	S88-F103 CarbonylContact C-O 3.53Å; S88-F103 WeakPolarHBondContact CA-O 3.34Å; I89-F103 HydrophobicContact CB-CB 4.13Å; I89-F103 HydrophobicContact CB-CD2 4.28Å; I89-F103 HydrophobicContact CD1-CB 4.49Å; I89-F103 HydrophobicContact CG2-CD2 4.42Å; I89-F103 PolarHBondContact N-O 3.4Å; I89-F103 PolarHBondContact O-N 3.02Å; I91-F103 HydrophobicContact CD1-CE2 3.68Å; I91-F103 HydrophobicContact CD1-CZ 4.37Å; I91-F103 HydrophobicContact CG1-CE2 4.37Å; I101-F103 HydrophobicContact CG2-CD1 4.17Å; I101-F103 HydrophobicContact CG2-CE1 3.58Å; I101-F103 HydrophobicContact CG2-CE2 4.06Å; I101-F103 HydrophobicContact CG2-CZ 3.53Å; F103-L122 HydrophobicContact CE2-CD2 4.45Å; F103-W134 HydrophobicContact CB-CD2 3.97Å; F103-W134 HydrophobicContact CB-CE3 3.83Å; F103-W134 HydrophobicContact CB-CH2 4.01Å; F103-W134 HydrophobicContact CB-CZ2 4.12Å; F103-W134 HydrophobicContact CB-CZ3 3.86Å; F103-W134 HydrophobicContact CD1-CD2 4.18Å; F103-W134 AromaticContact CD1-CE3 3.55Å; F103-W134 HydrophobicContact CD1-CE3 3.55Å; F103-W134 AromaticContact CD1-CZ3 3.99Å; F103-W134 HydrophobicContact CD1-CZ3 3.99Å; F103-W134 HydrophobicContact CD2-CB 4.26Å; F103-W134 HydrophobicContact CD2-CD2 4.12Å; F103-W134 HydrophobicContact CD2-CE3 4.32Å; F103-W134 HydrophobicContact CD2-CG 4.08Å; F103-W134 HydrophobicContact CE1-CE3 4.15Å; F103-W134 HydrophobicContact CE2-CB 4.02Å; F103-W134 HydrophobicContact CE2-CG 4.34Å; F103-W134 AromaticContact CG-CD2 3.84Å; F103-W134 HydrophobicContact CG-CD2 3.84Å; F103-W134 AromaticContact CG-CE3 3.66Å; F103-W134 HydrophobicContact CG-CE3 3.66Å; F103-W134 HydrophobicContact CG-CG 4.29Å; F103-W134 HydrophobicContact CG-CZ3 4.14Å; F103-W134 HydrophobicContact CZ-CB 4.24Å; F103-E139 HydrophobicContact CE1-CB 4.18Å
104	N	85.1	Confident	86.7	Confident	39 Å²	39	42.1 Å²	42.1	21%	0.209	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	126.2	173.5	-63.9	-32.4	0	0	0	107.8	S88 T748	S88-N104 VanDerWaalsContact CB-OD1 3.24Å; S88-N104 WeakPolarHBondContact CB-OD1 3.27Å; N104-T748 HydrophobicContact CB-CG2 4.25Å
105	G	80.2	Confident	87	Confident	3 Å²	3	42.6 Å²	42.6	3%	0.031	24%	0.239	C	C	.	.			trans	-172.7	-30.5	178.9	0	0	0	0	0	114	T744	G105-T744 WeakPolarHBondContact CA-O 3.5Å
106	H	87.1	Confident	87.1	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.009	21%	0.214	C	C	.	.			trans	-75.4	147.8	170.8	-69.2	-66.6	0	0	0	111.8	S124 S126 D128 D130 I132	H106-S124 WeakPolarHBondContact NE2-CB 2.75Å; H106-S124 PolarHBondContact NE2-O 3.3Å; H106-S124 PolarHBondContact NE2-OG 3.13Å; H106-S126 VanDerWaalsContact CG-CB 3.45Å; H106-S126 WeakPolarHBondContact ND1-CB 3.33Å; H106-D128 WeakPolarHBondContact CA-OD2 3.4Å; H106-D128 IonicContact CG-OD2 3.98Å; H106-D128 IonicContact ND1-OD1 3.94Å; H106-D128 PolarHBondContact ND1-OD1 3.49Å; H106-D128 IonicContact ND1-OD2 2.72Å; H106-D128 PolarHBondContact ND1-OD2 3.31Å; H106-D130 PolarHBondContact CE1-O 3.43Å; H106-I132 VanDerWaalsContact CE1-CG1 3.49Å; H106-I132 WeakPolarHBondContact CE1-CG1 3.3Å
107	K	82.9	Confident	87.1	Confident	105 Å²	105	39.6 Å²	39.6	46%	0.457	22%	0.216	S	C	.	.	S	Bend	trans	-88.3	-20.4	176.3	-64.3	-172.3	176.2	-168.4	0	112.7	D128 D729	K107-D128 HydrophobicContact CB-CB 4.11Å; K107-D128 PolarHBondContact N-OD2 3.13Å; K107-D729 IonicContact NZ-OD1 2.86Å; K107-D729 PolarHBondContact NZ-OD1 2.9Å
108	A	88.4	Confident	87.3	Confident	29 Å²	29	45.7 Å²	45.7	24%	0.24	25%	0.245	C	C	.	.	S	Bend	trans	-137	176.3	-174.2	0	0	0	0	0	111.2	G87 I110 S126 K127 D128	G87-A108 WeakPolarHBondContact CA-O 3.29Å; G87-A108 PolarHBondContact N-O 3.44Å; A108-I110 PolarHBondContact O-N 2.82Å; A108-S126 PolarHBondContact O-OG 3.43Å; A108-K127 HydrophobicContact CB-CB 4.02Å; A108-D128 HydrophobicContact CB-CB 3.97Å
109	A	91.1	Very high	87.2	Confident	20 Å²	20	40 Å²	40	17%	0.165	22%	0.221	C	C	.	.			trans	-50.8	131.7	-179.2	0	0	0	0	0	113.3	T69 E85 T111 S126 K127	T69-A109 HydrophobicContact CG2-CB 4.32Å; E85-A109 HydrophobicContact CB-CB 4.5Å; E85-A109 HydrophobicContact CG-CB 4.17Å; E85-A109 WeakPolarHBondContact O-CA 3.45Å; E85-A109 WeakPolarHBondContact O-CB 3.46Å; E85-A109 PolarHBondContact O-N 3.36Å; A109-T111 PolarHBondContact O-N 3.22Å; A109-S126 PolarHBondContact O-OG 3.14Å; A109-K127 WeakPolarHBondContact O-CB 3.47Å; A109-K127 PolarHBondContact O-N 3.35Å
110	I	94.2	Very high	87.5	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.9	173.8	-61.4	136.8	0	0	0	108.7	T69 C70 Y84 G87 S88 I89 A108 L113 G125	T69-I110 VanDerWaalsContact CB-O 3.27Å; T69-I110 WeakPolarHBondContact CB-O 3.45Å; T69-I110 PolarHBondContact OG1-O 2.9Å; C70-I110 WeakPolarHBondContact SG-CG2 3.43Å; Y84-I110 PolarHBondContact O-N 2.79Å; G87-I110 VanDerWaalsContact C-CD1 3.43Å; G87-I110 WeakPolarHBondContact O-CD1 3.48Å; S88-I110 WeakPolarHBondContact O-CD1 3.49Å; I89-I110 HydrophobicContact CB-CD1 4.48Å; I89-I110 HydrophobicContact CD1-CD1 4.34Å; I89-I110 HydrophobicContact CG1-CD1 3.38Å; I89-I110 HydrophobicContact CG1-CG1 4.21Å; A108-I110 PolarHBondContact O-N 2.82Å; I110-L113 HydrophobicContact CG2-CD1 4.42Å; I110-L113 HydrophobicContact CG2-CD2 3.95Å; I110-L113 HydrophobicContact CG2-CG 3.82Å; I110-G125 WeakPolarHBondContact CG2-O 3.41Å
111	T	92.1	Very high	88.1	Confident	56 Å²	56	38 Å²	38	34%	0.344	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-34.1	-177.9	52.5	0	0	0	0	111.7	A109 G125 K127 V152	A109-T111 PolarHBondContact O-N 3.22Å; T111-G125 PolarHBondContact N-O 3.25Å; T111-G125 PolarHBondContact OG1-O 3.43Å; T111-K127 HydrophobicContact CG2-CB 4.26Å; T111-V152 VanDerWaalsContact CB-O 3.22Å; T111-V152 WeakPolarHBondContact CB-O 3.34Å; T111-V152 PolarHBondContact OG1-O 2.81Å
112	S	90.8	Very high	88.5	Confident	12 Å²	12	37.2 Å²	37.2	8%	0.084	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	141.1	-177.4	64.2	0	0	0	0	112.1	S124 G125	S112-S124 WeakPolarHBondContact O-CA 3.48Å; S112-G125 PolarHBondContact N-O 2.91Å; S112-G125 VanDerWaalsContact N-O 3.12Å; S112-G125 PolarHBondContact O-N 3.28Å
113	L	93.9	Very high	88.7	Confident	16 Å²	16	36.5 Å²	36.5	8%	0.084	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.1	174.2	-74.1	174.2	0	0	0	109.4	C70 C72 A81 I89 I110 L122 A123 S124	C70-L113 WeakPolarHBondContact SG-CD1 3.12Å; C70-L113 VanDerWaalsContact SG-CG 3.59Å; C72-L113 HydrophobicContact CB-CB 3.78Å; C72-L113 PolarHBondContact SG-O 3.39Å; A81-L113 HydrophobicContact CB-CD1 4.28Å; I89-L113 HydrophobicContact CD1-CD2 3.84Å; I89-L113 HydrophobicContact CG1-CD2 4.19Å; I89-L113 HydrophobicContact CG2-CD1 4.15Å; I89-L113 HydrophobicContact CG2-CD2 4.27Å; I110-L113 HydrophobicContact CG2-CD1 4.42Å; I110-L113 HydrophobicContact CG2-CD2 3.95Å; I110-L113 HydrophobicContact CG2-CG 3.82Å; L113-L122 HydrophobicContact CD2-CD1 4.39Å; L113-L122 HydrophobicContact CD2-CD2 4.37Å; L113-L122 HydrophobicContact CD2-CG 4.43Å; L113-A123 WeakPolarHBondContact CA-O 3Å; L113-S124 VanDerWaalsContact CD2-CB 3.49Å
114	K	92.8	Very high	89	Confident	91 Å²	91	36.4 Å²	36.4	40%	0.396	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	126	175.9	-160.2	69.6	179.2	177.1	0	111.5	A123 A155 L156 F157	K114-A123 PolarHBondContact N-O 3.46Å; K114-A123 PolarHBondContact O-N 3.13Å; K114-A155 WeakPolarHBondContact CB-O 3.49Å; K114-L156 HydrophobicContact CD-CD2 4.14Å; K114-L156 HydrophobicContact CG-CD2 4.24Å; K114-F157 WeakPolarHBondContact O-CE2 3.23Å
115	Y	92.5	Very high	89.4	Confident	15 Å²	15	34.5 Å²	34.5	6%	0.059	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	148.7	168.4	-79.6	-78.9	0	0	0	111.1	C72 A81 L122 V136	C72-Y115 HydrophobicContact CB-CD2 4.36Å; C72-Y115 WeakPolarHBondContact O-CE2 3.48Å; A81-Y115 HydrophobicContact CB-CE2 3.6Å; A81-Y115 WeakPolarHBondContact CB-OH 3.32Å; Y115-L122 HydrophobicContact CD1-CB 4.26Å; Y115-L122 HydrophobicContact CD1-CD1 3.99Å; Y115-L122 HydrophobicContact CD2-CD1 3.99Å; Y115-L122 HydrophobicContact CE1-CB 4.23Å; Y115-L122 HydrophobicContact CE1-CD1 4.04Å; Y115-L122 HydrophobicContact CE2-CD1 4.02Å; Y115-L122 HydrophobicContact CG-CD1 3.98Å; Y115-V136 HydrophobicContact CD1-CG2 4.48Å; Y115-V136 HydrophobicContact CE1-CG2 3.82Å
116	D	89.1	Confident	90.1	Very high	31 Å²	31	34.4 Å²	34.4	17%	0.166	18%	0.181	C	C	.	.			trans	-65.6	162.7	162.5	-175.7	25.8	0	0	0	111.1	P75 L118 G119 R121 F157	P75-D116 WeakPolarHBondContact CG-O 3.38Å; D116-L118 PolarHBondContact O-N 3.43Å; D116-G119 PolarHBondContact O-N 3.5Å; D116-R121 HydrophobicContact CB-CB 4.05Å; D116-R121 PolarHBondContact N-O 2.86Å; D116-F157 HydrophobicContact CB-CD2 4.11Å; D116-F157 HydrophobicContact CB-CE2 4.24Å; D116-F157 HydrophobicContact CB-CG 4.42Å
117	Q	83.6	Confident	90.3	Very high	100 Å²	100	40.8 Å²	40.8	47%	0.467	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-32.3	-176.9	-176.8	55.9	63.7	0	0	113	R159	Q117-R159 VanDerWaalsContact OE1-NE 3.16Å
118	L	83.8	Confident	90.6	Very high	142 Å²	142	37.1 Å²	37.1	74%	0.743	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-10.1	176	-64.2	176	0	0	0	113.5	D116 G120	D116-L118 PolarHBondContact O-N 3.43Å; L118-G120 VanDerWaalsContact C-N 3.26Å; L118-G120 PolarHBondContact O-N 2.82Å
119	G	83.6	Confident	90.6	Very high	11 Å²	11	37.6 Å²	37.6	11%	0.113	19%	0.194	C	C	.	.	S	Bend	trans	78	-3.1	-179.4	0	0	0	0	0	116.1	D116	D116-G119 PolarHBondContact O-N 3.5Å
120	G	86.6	Confident	90.6	Very high	18 Å²	18	37.1 Å²	37.1	19%	0.186	19%	0.188	C	C	.	.	S	Bend	trans	-74.9	-32.5	179.9	0	0	0	0	0	114.5	L118 V136	L118-G120 VanDerWaalsContact C-N 3.26Å; L118-G120 PolarHBondContact O-N 2.82Å; G120-V136 WeakPolarHBondContact O-CB 3.15Å; G120-V136 PolarHBondContact O-N 2.96Å
121	R	90.9	Very high	90.5	Very high	72 Å²	72	37 Å²	37	27%	0.272	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	145.1	178.1	-58.1	179.5	-168.4	-178.7	3.2	111.3	D116 I133 W134 F157	D116-R121 HydrophobicContact CB-CB 4.05Å; D116-R121 PolarHBondContact N-O 2.86Å; R121-I133 HydrophobicContact CB-CG2 4.45Å; R121-W134 CarbonylContact C-O 3.59Å; R121-W134 WeakPolarHBondContact CA-O 3.48Å; R121-F157 HydrophobicContact CB-CZ 4.42Å
122	L	93.1	Very high	90.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	120.8	176.8	176	70.8	0	0	0	109.4	A81 I89 I91 F103 L113 Y115 I133 W134 V136	A81-L122 HydrophobicContact CB-CD1 4.27Å; A81-L122 HydrophobicContact CB-CD2 4.12Å; I89-L122 HydrophobicContact CG2-CD2 4.09Å; I91-L122 HydrophobicContact CD1-CD2 4.48Å; F103-L122 HydrophobicContact CE2-CD2 4.45Å; L113-L122 HydrophobicContact CD2-CD1 4.39Å; L113-L122 HydrophobicContact CD2-CD2 4.37Å; L113-L122 HydrophobicContact CD2-CG 4.43Å; Y115-L122 HydrophobicContact CD1-CB 4.26Å; Y115-L122 HydrophobicContact CD1-CD1 3.99Å; Y115-L122 HydrophobicContact CD2-CD1 3.99Å; Y115-L122 HydrophobicContact CE1-CB 4.23Å; Y115-L122 HydrophobicContact CE1-CD1 4.04Å; Y115-L122 HydrophobicContact CE2-CD1 4.02Å; Y115-L122 HydrophobicContact CG-CD1 3.98Å; L122-I133 WeakPolarHBondContact O-CA 3.42Å; L122-W134 HydrophobicContact CB-CB 4.26Å; L122-W134 PolarHBondContact N-O 2.85Å; L122-W134 PolarHBondContact O-N 3.48Å; L122-V136 HydrophobicContact CB-CG2 3.96Å
123	A	93.7	Very high	90.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.9	170.6	0	0	0	0	0	109.9	L113 K114 A155 F157 L164	L113-A123 WeakPolarHBondContact CA-O 3Å; K114-A123 PolarHBondContact N-O 3.46Å; K114-A123 PolarHBondContact O-N 3.13Å; A123-A155 HydrophobicContact CB-CB 4.42Å; A123-F157 HydrophobicContact CB-CD2 4.42Å; A123-F157 HydrophobicContact CB-CE1 4.44Å; A123-F157 HydrophobicContact CB-CE2 3.49Å; A123-F157 VanDerWaalsContact CB-CE2 3.49Å; A123-F157 HydrophobicContact CB-CZ 3.51Å; A123-L164 HydrophobicContact CB-CD1 4.02Å
124	S	94.4	Very high	90.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.7	171.7	60.6	0	0	0	0	110.8	I89 H106 S112 L113 V131 I132 W134	I89-S124 VanDerWaalsContact CD1-CB 3.48Å; H106-S124 WeakPolarHBondContact NE2-CB 2.75Å; H106-S124 PolarHBondContact NE2-O 3.3Å; H106-S124 PolarHBondContact NE2-OG 3.13Å; S112-S124 WeakPolarHBondContact O-CA 3.48Å; L113-S124 VanDerWaalsContact CD2-CB 3.49Å; S124-V131 CarbonylContact O-C 3.59Å; S124-V131 VanDerWaalsContact O-CA 3.28Å; S124-V131 WeakPolarHBondContact O-CA 3.29Å; S124-I132 PolarHBondContact N-O 2.91Å; S124-I132 PolarHBondContact O-N 3.47Å; S124-I132 PolarHBondContact OG-O 3.4Å; S124-W134 PolarHBondContact OG-NE1 3.26Å
125	G	93.6	Very high	90.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.9	168.5	0	0	0	0	0	109.5	I110 T111 S112	I110-G125 WeakPolarHBondContact CG2-O 3.41Å; T111-G125 PolarHBondContact N-O 3.25Å; T111-G125 PolarHBondContact OG1-O 3.43Å; S112-G125 PolarHBondContact N-O 2.91Å; S112-G125 VanDerWaalsContact N-O 3.12Å; S112-G125 PolarHBondContact O-N 3.28Å
126	S	93.1	Very high	90	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	166.3	-175.3	154.5	0	0	0	0	112.2	H106 A108 A109 D128 T129 D130 V152	H106-S126 VanDerWaalsContact CG-CB 3.45Å; H106-S126 WeakPolarHBondContact ND1-CB 3.33Å; A108-S126 PolarHBondContact O-OG 3.43Å; A109-S126 PolarHBondContact O-OG 3.14Å; S126-D128 WeakPolarHBondContact CB-OD1 3.39Å; S126-D128 PolarHBondContact O-N 3.25Å; S126-D128 PolarHBondContact OG-N 2.87Å; S126-D128 VanDerWaalsContact OG-N 3.1Å; S126-D128 PolarHBondContact OG-OD1 3.34Å; S126-T129 PolarHBondContact O-N 3.44Å; S126-D130 PolarHBondContact N-O 3.11Å; S126-V152 PolarHBondContact O-N 3.48Å
127	K	91.9	Very high	89.9	Confident	137 Å²	137	35.4 Å²	35.4	60%	0.596	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.9	173.3	-166.9	178.9	178.4	-173.6	0	112.9	A108 A109 T111 T129 A151	A108-K127 HydrophobicContact CB-CB 4.02Å; A109-K127 WeakPolarHBondContact O-CB 3.47Å; A109-K127 PolarHBondContact O-N 3.35Å; T111-K127 HydrophobicContact CG2-CB 4.26Å; K127-T129 PolarHBondContact O-N 2.81Å; K127-A151 HydrophobicContact CB-CB 4.41Å; K127-A151 HydrophobicContact CG-CB 4.06Å
128	D	88.6	Confident	89.7	Confident	27 Å²	27	34.8 Å²	34.8	14%	0.144	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	12.5	175.2	69.8	-9	0	0	0	114.2	H106 K107 A108 S126 D130	H106-D128 WeakPolarHBondContact CA-OD2 3.4Å; H106-D128 IonicContact CG-OD2 3.98Å; H106-D128 IonicContact ND1-OD1 3.94Å; H106-D128 PolarHBondContact ND1-OD1 3.49Å; H106-D128 IonicContact ND1-OD2 2.72Å; H106-D128 PolarHBondContact ND1-OD2 3.31Å; K107-D128 HydrophobicContact CB-CB 4.11Å; K107-D128 PolarHBondContact N-OD2 3.13Å; A108-D128 HydrophobicContact CB-CB 3.97Å; S126-D128 WeakPolarHBondContact CB-OD1 3.39Å; S126-D128 PolarHBondContact O-N 3.25Å; S126-D128 PolarHBondContact OG-N 2.87Å; S126-D128 VanDerWaalsContact OG-N 3.1Å; S126-D128 PolarHBondContact OG-OD1 3.34Å; D128-D130 PolarHBondContact O-N 3.5Å; D128-D130 PolarHBondContact OD1-N 3.33Å
129	T	89.9	Confident	89.8	Confident	39 Å²	39	30.2 Å²	30.2	24%	0.239	16%	0.155	C	C	.	.	S	Bend	trans	74.3	-11	178.3	76.2	0	0	0	0	115.5	S126 K127	S126-T129 PolarHBondContact O-N 3.44Å; K127-T129 PolarHBondContact O-N 2.81Å
130	D	90.3	Very high	89.7	Confident	10 Å²	10	30.5 Å²	30.5	5%	0.053	16%	0.156	C	C	.	.			trans	-90.8	148.4	-174.9	-66.9	-16.5	0	0	0	111.4	H106 S126 D128 R144 K146	H106-D130 PolarHBondContact CE1-O 3.43Å; S126-D130 PolarHBondContact N-O 3.11Å; D128-D130 PolarHBondContact O-N 3.5Å; D128-D130 PolarHBondContact OD1-N 3.33Å; D130-R144 IonicContact OD2-CZ 3.09Å; D130-R144 IonicContact OD2-NE 3.62Å; D130-R144 PolarHBondContact OD2-NE 3.45Å; D130-R144 IonicContact OD2-NH2 3.37Å; D130-R144 PolarHBondContact OD2-NH2 2.92Å; D130-K146 WeakPolarHBondContact OD1-CG 3.43Å; D130-K146 WeakPolarHBondContact OD2-CE 3.41Å
131	V	92	Very high	89.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.4	168.6	-179.4	0	0	0	0	108.3	S124 L145 V152 L164 T166	S124-V131 CarbonylContact O-C 3.59Å; S124-V131 VanDerWaalsContact O-CA 3.28Å; S124-V131 WeakPolarHBondContact O-CA 3.29Å; V131-L145 HydrophobicContact CB-CB 4.24Å; V131-L145 PolarHBondContact N-O 2.83Å; V131-L145 VanDerWaalsContact N-O 3.15Å; V131-L145 PolarHBondContact O-N 2.78Å; V131-V152 HydrophobicContact CG2-CB 4.35Å; V131-V152 HydrophobicContact CG2-CG1 3.97Å; V131-V152 HydrophobicContact CG2-CG2 3.62Å; V131-L164 HydrophobicContact CG1-CD2 3.88Å; V131-T166 HydrophobicContact CG1-CG2 4.33Å; V131-T166 HydrophobicContact CG2-CG2 4.05Å
132	I	92	Very high	89.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	136.7	178.6	-57.6	173	0	0	0	109.1	H106 S124 W134 Y143 R144 T744	H106-I132 VanDerWaalsContact CE1-CG1 3.49Å; H106-I132 WeakPolarHBondContact CE1-CG1 3.3Å; S124-I132 PolarHBondContact N-O 2.91Å; S124-I132 PolarHBondContact O-N 3.47Å; S124-I132 PolarHBondContact OG-O 3.4Å; I132-W134 HydrophobicContact CB-CZ2 3.99Å; I132-W134 HydrophobicContact CD1-CZ2 3.93Å; I132-W134 HydrophobicContact CG2-CD2 3.93Å; I132-W134 HydrophobicContact CG2-CE3 4.44Å; I132-W134 HydrophobicContact CG2-CG 4.45Å; I132-W134 HydrophobicContact CG2-CH2 4.01Å; I132-W134 HydrophobicContact CG2-CZ2 3.44Å; I132-W134 VanDerWaalsContact CG2-CZ2 3.44Å; I132-W134 HydrophobicContact CG2-CZ3 4.47Å; I132-Y143 WeakPolarHBondContact CA-O 3.36Å; I132-R144 HydrophobicContact CG1-CG 4.27Å; I132-T744 HydrophobicContact CG2-CG2 3.89Å
133	I	92.1	Very high	88.6	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.5	172.7	-61.6	173.5	0	0	0	107.8	R121 L122 G141 L142 Y143 L145 L164 L178	R121-I133 HydrophobicContact CB-CG2 4.45Å; L122-I133 WeakPolarHBondContact O-CA 3.42Å; I133-G141 CarbonylContact O-C 3.54Å; I133-L142 HydrophobicContact CG2-CD1 4.28Å; I133-L142 WeakPolarHBondContact O-CB 3.24Å; I133-L142 PolarHBondContact O-N 2.89Å; I133-Y143 HydrophobicContact CB-CD2 4.23Å; I133-Y143 HydrophobicContact CD1-CD2 4.13Å; I133-Y143 HydrophobicContact CG2-CD2 4.42Å; I133-Y143 PolarHBondContact N-O 3.43Å; I133-Y143 PolarHBondContact O-N 3.38Å; I133-L145 HydrophobicContact CD1-CD1 3.85Å; I133-L145 HydrophobicContact CG1-CD1 4.45Å; I133-L164 HydrophobicContact CD1-CD2 4.26Å; I133-L178 HydrophobicContact CD1-CD1 4.47Å; I133-L178 HydrophobicContact CD1-CD2 3.14Å; I133-L178 HydrophobicContact CD1-CG 4.37Å
134	W	91.5	Very high	88.3	Confident	8 Å²	8	32.8 Å²	32.8	3%	0.03	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.4	179.4	-53.5	92.1	0	0	0	110	I89 F103 R121 L122 S124 I132 S140	I89-W134 HydrophobicContact CD1-CZ2 4.5Å; F103-W134 HydrophobicContact CB-CD2 3.97Å; F103-W134 HydrophobicContact CB-CE3 3.83Å; F103-W134 HydrophobicContact CB-CH2 4.01Å; F103-W134 HydrophobicContact CB-CZ2 4.12Å; F103-W134 HydrophobicContact CB-CZ3 3.86Å; F103-W134 HydrophobicContact CD1-CD2 4.18Å; F103-W134 AromaticContact CD1-CE3 3.55Å; F103-W134 HydrophobicContact CD1-CE3 3.55Å; F103-W134 AromaticContact CD1-CZ3 3.99Å; F103-W134 HydrophobicContact CD1-CZ3 3.99Å; F103-W134 HydrophobicContact CD2-CB 4.26Å; F103-W134 HydrophobicContact CD2-CD2 4.12Å; F103-W134 HydrophobicContact CD2-CE3 4.32Å; F103-W134 HydrophobicContact CD2-CG 4.08Å; F103-W134 HydrophobicContact CE1-CE3 4.15Å; F103-W134 HydrophobicContact CE2-CB 4.02Å; F103-W134 HydrophobicContact CE2-CG 4.34Å; F103-W134 AromaticContact CG-CD2 3.84Å; F103-W134 HydrophobicContact CG-CD2 3.84Å; F103-W134 AromaticContact CG-CE3 3.66Å; F103-W134 HydrophobicContact CG-CE3 3.66Å; F103-W134 HydrophobicContact CG-CG 4.29Å; F103-W134 HydrophobicContact CG-CZ3 4.14Å; F103-W134 HydrophobicContact CZ-CB 4.24Å; R121-W134 CarbonylContact C-O 3.59Å; R121-W134 WeakPolarHBondContact CA-O 3.48Å; L122-W134 HydrophobicContact CB-CB 4.26Å; L122-W134 PolarHBondContact N-O 2.85Å; L122-W134 PolarHBondContact O-N 3.48Å; S124-W134 PolarHBondContact OG-NE1 3.26Å; I132-W134 HydrophobicContact CB-CZ2 3.99Å; I132-W134 HydrophobicContact CD1-CZ2 3.93Å; I132-W134 HydrophobicContact CG2-CD2 3.93Å; I132-W134 HydrophobicContact CG2-CE3 4.44Å; I132-W134 HydrophobicContact CG2-CG 4.45Å; I132-W134 HydrophobicContact CG2-CH2 4.01Å; I132-W134 HydrophobicContact CG2-CZ2 3.44Å; I132-W134 VanDerWaalsContact CG2-CZ2 3.44Å; I132-W134 HydrophobicContact CG2-CZ3 4.47Å; W134-S140 WeakPolarHBondContact CA-O 3.46Å
135	D	89.4	Confident	88	Confident	24 Å²	24	33 Å²	33	13%	0.128	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	121.9	161.2	-167.6	-20.8	0	0	0	108.6	I137 N138 E139 S140 L142	D135-I137 VanDerWaalsContact C-N 3.34Å; D135-I137 PolarHBondContact OD1-N 3.23Å; D135-N138 HydrophobicContact CB-CB 4.11Å; D135-N138 PolarHBondContact OD1-N 3.44Å; D135-N138 PolarHBondContact OD2-ND2 3.47Å; D135-E139 VanDerWaalsContact O-CA 3.32Å; D135-E139 WeakPolarHBondContact O-CA 3.15Å; D135-E139 PolarHBondContact O-N 2.83Å; D135-E139 VanDerWaalsContact O-N 3.09Å; D135-S140 PolarHBondContact N-O 3.45Å; D135-S140 PolarHBondContact O-N 3.38Å; D135-L142 HydrophobicContact CB-CD1 3.93Å; D135-L142 HydrophobicContact CB-CD2 4.19Å; D135-L142 HydrophobicContact CB-CG 3.89Å
136	V	87.8	Confident	87.6	Confident	20 Å²	20	37.9 Å²	37.9	12%	0.121	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-27.8	-177.9	179.3	0	0	0	0	110.9	I91 I101 Y115 G120 L122	I91-V136 HydrophobicContact CD1-CB 4.41Å; I91-V136 HydrophobicContact CD1-CG1 3.69Å; I91-V136 HydrophobicContact CD1-CG2 4.06Å; I101-V136 HydrophobicContact CD1-CG1 4.27Å; I101-V136 WeakPolarHBondContact CD1-O 3.24Å; Y115-V136 HydrophobicContact CD1-CG2 4.48Å; Y115-V136 HydrophobicContact CE1-CG2 3.82Å; G120-V136 WeakPolarHBondContact O-CB 3.15Å; G120-V136 PolarHBondContact O-N 2.96Å; L122-V136 HydrophobicContact CB-CG2 3.96Å
137	I	86.1	Confident	87.2	Confident	135 Å²	135	39.2 Å²	39.2	69%	0.692	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-47	-175.5	-58.5	170.8	0	0	0	110	D135 E139	D135-I137 VanDerWaalsContact C-N 3.34Å; D135-I137 PolarHBondContact OD1-N 3.23Å; I137-E139 PolarHBondContact O-N 2.79Å
138	N	79.7	Confident	87.1	Confident	88 Å²	88	33.2 Å²	33.2	47%	0.471	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-9.2	176.4	-72.1	-42.7	0	0	0	112.9	D135 S140 R852	D135-N138 HydrophobicContact CB-CB 4.11Å; D135-N138 PolarHBondContact OD1-N 3.44Å; D135-N138 PolarHBondContact OD2-ND2 3.47Å; N138-S140 PolarHBondContact O-N 2.97Å; N138-R852 PolarHBondContact O-NH1 3.37Å
139	E	84.7	Confident	87.2	Confident	45 Å²	45	40 Å²	40	21%	0.21	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	42.7	-177.2	-54.1	179.9	178.1	0	0	112.4	I101 F103 D135 I137 S815 S816	I101-E139 HydrophobicContact CD1-CG 3.97Å; I101-E139 HydrophobicContact CG1-CG 4.1Å; I101-E139 WeakPolarHBondContact CG1-OE1 3.15Å; I101-E139 HydrophobicContact CG2-CB 4.12Å; I101-E139 HydrophobicContact CG2-CG 3.89Å; F103-E139 HydrophobicContact CE1-CB 4.18Å; D135-E139 VanDerWaalsContact O-CA 3.32Å; D135-E139 WeakPolarHBondContact O-CA 3.15Å; D135-E139 PolarHBondContact O-N 2.83Å; D135-E139 VanDerWaalsContact O-N 3.09Å; I137-E139 PolarHBondContact O-N 2.79Å; E139-S815 WeakPolarHBondContact OE2-CB 3.24Å; E139-S815 PolarHBondContact OE2-OG 2.96Å; E139-S816 WeakPolarHBondContact O-CA 3.34Å
140	S	81.6	Confident	87.3	Confident	18 Å²	18	40.7 Å²	40.7	13%	0.126	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	151.4	-176.3	73	0	0	0	0	112	W134 D135 N138 L142 R852	W134-S140 WeakPolarHBondContact CA-O 3.46Å; D135-S140 PolarHBondContact N-O 3.45Å; D135-S140 PolarHBondContact O-N 3.38Å; N138-S140 PolarHBondContact O-N 2.97Å; S140-L142 PolarHBondContact O-N 2.87Å; S140-R852 VanDerWaalsContact CB-NH2 3.27Å
141	G	82.9	Confident	87.3	Confident	12 Å²	12	40.8 Å²	40.8	12%	0.124	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	109.8	170.3	0	0	0	0	0	109.7	I133 T744	I133-G141 CarbonylContact O-C 3.54Å; G141-T744 WeakPolarHBondContact CA-OG1 3.45Å; G141-T744 PolarHBondContact O-OG1 3.17Å
142	L	83.6	Confident	87.4	Confident	57 Å²	57	40.8 Å²	40.8	30%	0.298	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	-56.5	-179.6	-68.2	171.6	0	0	0	111.5	I133 D135 S140	I133-L142 HydrophobicContact CG2-CD1 4.28Å; I133-L142 WeakPolarHBondContact O-CB 3.24Å; I133-L142 PolarHBondContact O-N 2.89Å; D135-L142 HydrophobicContact CB-CD1 3.93Å; D135-L142 HydrophobicContact CB-CD2 4.19Å; D135-L142 HydrophobicContact CB-CG 3.89Å; S140-L142 PolarHBondContact O-N 2.87Å
143	Y	82.4	Confident	87.4	Confident	51 Å²	51	41.8 Å²	41.8	20%	0.2	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140	-169.3	-49.2	-55.7	0	0	0	111.5	I132 I133 Q181	I132-Y143 WeakPolarHBondContact CA-O 3.36Å; I133-Y143 HydrophobicContact CB-CD2 4.23Å; I133-Y143 HydrophobicContact CD1-CD2 4.13Å; I133-Y143 HydrophobicContact CG2-CD2 4.42Å; I133-Y143 PolarHBondContact N-O 3.43Å; I133-Y143 PolarHBondContact O-N 3.38Å; Y143-Q181 HydrophobicContact CD1-CG 3.62Å; Y143-Q181 VanDerWaalsContact CD1-OE1 3.27Å; Y143-Q181 HydrophobicContact CE1-CG 3.76Å; Y143-Q181 HydrophobicContact CG-CG 4.06Å
144	R	86.5	Confident	87.4	Confident	17 Å²	17	43.2 Å²	43.2	6%	0.064	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	100.1	168.8	-170.5	176.5	-172.4	140.1	6.7	109.1	D130 I132 K146 T744	D130-R144 IonicContact OD2-CZ 3.09Å; D130-R144 IonicContact OD2-NE 3.62Å; D130-R144 PolarHBondContact OD2-NE 3.45Å; D130-R144 IonicContact OD2-NH2 3.37Å; D130-R144 PolarHBondContact OD2-NH2 2.92Å; I132-R144 HydrophobicContact CG1-CG 4.27Å; R144-K146 HydrophobicContact CG-CG 4.34Å; R144-K146 PolarHBondContact O-N 3Å; R144-T744 HydrophobicContact CB-CG2 3.78Å
145	L	88	Confident	87.4	Confident	5 Å²	5	43 Å²	43	3%	0.026	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	106.4	179.6	-57.6	175.2	0	0	0	109.3	V131 I133 L164 W176 L178	V131-L145 HydrophobicContact CB-CB 4.24Å; V131-L145 PolarHBondContact N-O 2.83Å; V131-L145 VanDerWaalsContact N-O 3.15Å; V131-L145 PolarHBondContact O-N 2.78Å; I133-L145 HydrophobicContact CD1-CD1 3.85Å; I133-L145 HydrophobicContact CG1-CD1 4.45Å; L145-L164 HydrophobicContact CD1-CD2 3.83Å; L145-W176 HydrophobicContact CB-CD2 4.11Å; L145-W176 HydrophobicContact CB-CE3 3.89Å; L145-W176 HydrophobicContact CB-CH2 4.12Å; L145-W176 HydrophobicContact CB-CZ2 4.33Å; L145-W176 HydrophobicContact CB-CZ3 3.88Å; L145-W176 HydrophobicContact CD1-CB 3.95Å; L145-W176 HydrophobicContact CD1-CD2 3.9Å; L145-W176 HydrophobicContact CD1-CE3 4.12Å; L145-W176 HydrophobicContact CD1-CG 3.81Å; L145-W176 HydrophobicContact CD2-CD2 4.44Å; L145-W176 HydrophobicContact CD2-CE3 3.82Å; L145-W176 HydrophobicContact CD2-CZ3 4.26Å; L145-W176 HydrophobicContact CG-CD2 4.38Å; L145-W176 HydrophobicContact CG-CE3 4.15Å; L145-L178 HydrophobicContact CD1-CD2 4.49Å
146	K	86.1	Confident	87.4	Confident	102 Å²	102	42.5 Å²	42.5	44%	0.443	22%	0.22	S	C	.	.			trans	-99.2	127.8	175	-68	-160.2	170.3	174.2	0	110.4	D130 R144 W176	D130-K146 WeakPolarHBondContact OD1-CG 3.43Å; D130-K146 WeakPolarHBondContact OD2-CE 3.41Å; R144-K146 HydrophobicContact CG-CG 4.34Å; R144-K146 PolarHBondContact O-N 3Å; K146-W176 WeakPolarHBondContact O-CH2 3.39Å
147	G	84.9	Confident	87.5	Confident	29 Å²	29	42.6 Å²	42.6	30%	0.299	22%	0.219	S	C	.	.			trans	178.8	-22.4	171.3	0	0	0	0	0	115.5	K174	G147-K174 VanDerWaalsContact C-CE 3.43Å; G147-K174 WeakPolarHBondContact O-CE 3.26Å; G147-K174 PolarHBondContact O-NZ 3.45Å
148	H	89.6	Confident	87.4	Confident	11 Å²	11	36.4 Å²	36.4	5%	0.051	19%	0.187	C	C	.	.			trans	-69	147.8	171	-76.9	-71.3	0	0	0	111	V152 T166 D170	H148-V152 HydrophobicContact CB-CG2 4.38Å; H148-T166 PolarHBondContact NE2-OG1 3.46Å; H148-D170 WeakPolarHBondContact CA-OD2 3.22Å; H148-D170 IonicContact CG-OD2 2.68Å; H148-D170 IonicContact ND1-OD1 2.78Å; H148-D170 PolarHBondContact ND1-OD1 3.47Å; H148-D170 IonicContact ND1-OD2 3.87Å; H148-D170 PolarHBondContact ND1-OD2 2.91Å; H148-D170 VanDerWaalsContact ND1-OD2 3.09Å
149	K	89.9	Confident	87.2	Confident	169 Å²	169	39 Å²	39	74%	0.735	19%	0.19	S	C	*	.	S	Bend	trans	-94.2	-19.6	178.3	-65	-175.2	178.8	-177.7	0	113.2	D170	K149-D170 HydrophobicContact CB-CB 4.05Å; K149-D170 PolarHBondContact N-OD2 3.46Å
150	D	91.4	Very high	86.6	Confident	54 Å²	54	44.7 Å²	44.7	29%	0.289	22%	0.216	S	C	.	.	S	Bend	trans	-139	176.6	178.9	-161.6	-6.6	0	0	0	108.5	V152 K169 D170	D150-V152 PolarHBondContact O-N 2.78Å; D150-K169 HydrophobicContact CB-CB 4.09Å; D150-K169 IonicContact OD1-NZ 3.57Å; D150-K169 WeakPolarHBondContact OD2-CG 3.43Å; D150-K169 IonicContact OD2-NZ 3.5Å; D150-K169 PolarHBondContact OD2-NZ 2.9Å; D150-D170 HydrophobicContact CB-CB 4.1Å
151	A	92.2	Very high	86.3	Confident	11 Å²	11	48.7 Å²	48.7	9%	0.091	23%	0.229	C	C	.	.			trans	-49	134.8	-174.4	0	0	0	0	0	113	K127 K169	K127-A151 HydrophobicContact CB-CB 4.41Å; K127-A151 HydrophobicContact CG-CB 4.06Å; A151-K169 HydrophobicContact CB-CB 4.5Å; A151-K169 WeakPolarHBondContact O-CB 3.47Å; A151-K169 PolarHBondContact O-N 3.1Å
152	V	94.1	Very high	86.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.7	173.3	-176.6	0	0	0	0	107.9	T111 S126 V131 H148 D150	T111-V152 VanDerWaalsContact CB-O 3.22Å; T111-V152 WeakPolarHBondContact CB-O 3.34Å; T111-V152 PolarHBondContact OG1-O 2.81Å; S126-V152 PolarHBondContact O-N 3.48Å; V131-V152 HydrophobicContact CG2-CB 4.35Å; V131-V152 HydrophobicContact CG2-CG1 3.97Å; V131-V152 HydrophobicContact CG2-CG2 3.62Å; H148-V152 HydrophobicContact CB-CG2 4.38Å; D150-V152 PolarHBondContact O-N 2.78Å
153	T	91.3	Very high	86.6	Confident	22 Å²	22	49.3 Å²	49.3	14%	0.135	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-38.8	-178.8	53.3	0	0	0	0	112	S167 K169 V194 W195	T153-S167 PolarHBondContact N-O 2.83Å; T153-S167 PolarHBondContact OG1-O 3.35Å; T153-S167 VanDerWaalsContact OG1-O 3.05Å; T153-S167 PolarHBondContact OG1-OG 2.9Å; T153-K169 HydrophobicContact CG2-CB 4.29Å; T153-V194 WeakPolarHBondContact CB-O 3.5Å; T153-V194 VanDerWaalsContact CG2-O 3.3Å; T153-V194 WeakPolarHBondContact CG2-O 3.18Å; T153-V194 PolarHBondContact OG1-O 2.83Å; T153-W195 HydrophobicContact CG2-CD2 4.48Å; T153-W195 HydrophobicContact CG2-CE3 4.05Å; T153-W195 HydrophobicContact CG2-CZ3 4.35Å
154	Q	90.9	Very high	87	Confident	29 Å²	29	46.9 Å²	46.9	14%	0.136	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	146.4	-179.8	-166	166	1.2	0	0	111.7	T166 S167 L197	Q154-T166 WeakPolarHBondContact O-CA 3.44Å; Q154-S167 WeakPolarHBondContact CB-OG 3.25Å; Q154-S167 PolarHBondContact N-O 3.13Å; Q154-S167 PolarHBondContact N-OG 3.06Å; Q154-S167 PolarHBondContact O-N 2.76Å; Q154-S167 PolarHBondContact O-OG 2.75Å; Q154-L197 HydrophobicContact CB-CB 4.24Å; Q154-L197 HydrophobicContact CG-CB 4.38Å; Q154-L197 PolarHBondContact NE2-O 2.81Å; Q154-L197 PolarHBondContact OE1-O 3.24Å
155	A	92.2	Very high	87.3	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.025	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	139.9	174.3	0	0	0	0	0	110.6	K114 A123 T166	K114-A155 WeakPolarHBondContact CB-O 3.49Å; A123-A155 HydrophobicContact CB-CB 4.42Å; A155-T166 HydrophobicContact CB-CG2 4.26Å
156	L	89.8	Confident	87.5	Confident	15 Å²	15	45.9 Å²	45.9	8%	0.079	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	129.7	179.8	-74.4	177.2	0	0	0	111.9	K114 L164 V165 L197	K114-L156 HydrophobicContact CD-CD2 4.14Å; K114-L156 HydrophobicContact CG-CD2 4.24Å; L156-L164 WeakPolarHBondContact O-CD1 3.22Å; L156-V165 PolarHBondContact N-O 3.39Å; L156-V165 PolarHBondContact O-N 2.62Å; L156-L197 HydrophobicContact CB-CD2 4.5Å; L156-L197 HydrophobicContact CD1-CD2 4.16Å; L156-L197 HydrophobicContact CD1-CG 4.16Å; L156-L197 WeakPolarHBondContact CD1-O 3.47Å; L156-L197 HydrophobicContact CG-CD2 4.45Å
157	F	89.8	Confident	87.8	Confident	22 Å²	22	41 Å²	41	10%	0.096	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	146.7	166.4	-70.4	-71.3	0	0	0	111.3	K114 D116 R121 A123 L164 L178	K114-F157 WeakPolarHBondContact O-CE2 3.23Å; D116-F157 HydrophobicContact CB-CD2 4.11Å; D116-F157 HydrophobicContact CB-CE2 4.24Å; D116-F157 HydrophobicContact CB-CG 4.42Å; R121-F157 HydrophobicContact CB-CZ 4.42Å; A123-F157 HydrophobicContact CB-CD2 4.42Å; A123-F157 HydrophobicContact CB-CE1 4.44Å; A123-F157 HydrophobicContact CB-CE2 3.49Å; A123-F157 VanDerWaalsContact CB-CE2 3.49Å; A123-F157 HydrophobicContact CB-CZ 3.51Å; F157-L164 HydrophobicContact CD1-CB 4.48Å; F157-L164 HydrophobicContact CD1-CD1 3.67Å; F157-L164 HydrophobicContact CD2-CD1 4.4Å; F157-L164 HydrophobicContact CE1-CD1 3.71Å; F157-L164 HydrophobicContact CE2-CD1 4.46Å; F157-L164 HydrophobicContact CG-CD1 4.04Å; F157-L164 HydrophobicContact CZ-CD1 4.13Å; F157-L178 HydrophobicContact CD1-CD1 4.11Å; F157-L178 HydrophobicContact CE1-CD1 3.77Å
158	L	84.1	Confident	88.1	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.026	18%	0.18	C	C	.	.			trans	-85.1	146.6	164.6	-74.5	144.5	0	0	0	109.6	L163 V165 W175 L199 E203	L158-L163 HydrophobicContact CB-CB 4.45Å; L158-L163 HydrophobicContact CD1-CB 3.38Å; L158-L163 HydrophobicContact CD1-CD1 4.2Å; L158-L163 HydrophobicContact CD1-CG 4.42Å; L158-L163 HydrophobicContact CG-CB 4.49Å; L158-L163 PolarHBondContact N-O 3.28Å; L158-L163 VanDerWaalsContact N-O 3.13Å; L158-V165 HydrophobicContact CD1-CG2 3.91Å; L158-W175 HydrophobicContact CD1-CE3 4.23Å; L158-W175 HydrophobicContact CD1-CZ3 3.65Å; L158-L199 HydrophobicContact CD2-CD1 3.63Å; L158-L199 HydrophobicContact CD2-CD2 4.25Å; L158-L199 HydrophobicContact CG-CD1 4.02Å; L158-E203 HydrophobicContact CD2-CB 3.93Å; L158-E203 HydrophobicContact CD2-CG 4.08Å; L158-E203 WeakPolarHBondContact CD2-OE2 3.39Å
159	R	74.6	Confident	88.2	Confident	142 Å²	142	42.1 Å²	42.1	54%	0.536	19%	0.191	S	C	.	.	S	Bend	trans	-83.2	-35.9	-174.9	-68.5	174.3	159.4	161.4	0.6	112.5	Q117 E203 K288	Q117-R159 VanDerWaalsContact OE1-NE 3.16Å; R159-E203 WeakPolarHBondContact CA-OE1 3.49Å; R159-E203 WeakPolarHBondContact CB-OE1 3.34Å; R159-E203 VanDerWaalsContact CG-OE1 3.23Å; R159-E203 WeakPolarHBondContact CG-OE1 3.37Å; R159-E203 PolarHBondContact N-OE1 3.02Å; R159-E203 PolarHBondContact N-OE2 3.39Å; R159-K288 PolarHBondContact NH2-O 3.49Å
160	E	72.9	Confident	88.2	Confident	164 Å²	164	35 Å²	35	77%	0.766	16%	0.161	S	C	*	.	S	Bend	trans	-92.6	-22.3	-174.3	-65.5	-169	172.5	0	0	113.4
161	R	75.3	Confident	88.1	Confident	103 Å²	103	34.3 Å²	34.3	39%	0.389	16%	0.159	S	C	.	.	S	Bend	trans	-134.4	151.8	-175	-61	-172.1	-178	-159.7	-1	111.2	L163 Y222	R161-L163 HydrophobicContact CB-CD1 4.23Å; R161-L163 HydrophobicContact CB-CG 4.11Å; R161-L163 PolarHBondContact O-N 3.43Å; R161-Y222 VanDerWaalsContact CZ-CD1 3.45Å
162	N	85	Confident	88.1	Confident	73 Å²	73	35.9 Å²	35.9	39%	0.39	17%	0.165	S	C	.	.	S	Bend	trans	-71.6	54.1	175.2	-77.2	-4.7	0	0	0	112.6	L178 D179	N162-L178 HydrophobicContact CB-CB 4.34Å; N162-L178 WeakPolarHBondContact O-CB 3.24Å; N162-L178 VanDerWaalsContact O-CG 3.27Å; N162-L178 WeakPolarHBondContact O-CG 3.47Å; N162-L178 PolarHBondContact O-N 3.04Å; N162-L178 VanDerWaalsContact O-N 3.13Å; N162-D179 PolarHBondContact ND2-OD1 2.9Å; N162-D179 VanDerWaalsContact ND2-OD1 3.13Å
163	L	88.6	Confident	87.9	Confident	9 Å²	9	35.9 Å²	35.9	5%	0.047	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.5	-178.1	-65.8	-179.6	0	0	0	109.8	L158 R161 W176 D177 F184 Y222	L158-L163 HydrophobicContact CB-CB 4.45Å; L158-L163 HydrophobicContact CD1-CB 3.38Å; L158-L163 HydrophobicContact CD1-CD1 4.2Å; L158-L163 HydrophobicContact CD1-CG 4.42Å; L158-L163 HydrophobicContact CG-CB 4.49Å; L158-L163 PolarHBondContact N-O 3.28Å; L158-L163 VanDerWaalsContact N-O 3.13Å; R161-L163 HydrophobicContact CB-CD1 4.23Å; R161-L163 HydrophobicContact CB-CG 4.11Å; R161-L163 PolarHBondContact O-N 3.43Å; L163-W176 WeakPolarHBondContact CA-O 3.37Å; L163-D177 HydrophobicContact CD2-CB 4.06Å; L163-F184 HydrophobicContact CD2-CE1 3.92Å; L163-F184 HydrophobicContact CD2-CZ 4.43Å; L163-Y222 HydrophobicContact CD1-CE1 4.27Å
164	L	90.8	Very high	88	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.7	176.8	-179.7	80.8	0	0	0	110.1	A123 V131 I133 L145 L156 F157 T166 W175 W176 L178	A123-L164 HydrophobicContact CB-CD1 4.02Å; V131-L164 HydrophobicContact CG1-CD2 3.88Å; I133-L164 HydrophobicContact CD1-CD2 4.26Å; L145-L164 HydrophobicContact CD1-CD2 3.83Å; L156-L164 WeakPolarHBondContact O-CD1 3.22Å; F157-L164 HydrophobicContact CD1-CB 4.48Å; F157-L164 HydrophobicContact CD1-CD1 3.67Å; F157-L164 HydrophobicContact CD2-CD1 4.4Å; F157-L164 HydrophobicContact CE1-CD1 3.71Å; F157-L164 HydrophobicContact CE2-CD1 4.46Å; F157-L164 HydrophobicContact CG-CD1 4.04Å; F157-L164 HydrophobicContact CZ-CD1 4.13Å; L164-T166 HydrophobicContact CD2-CG2 3.77Å; L164-T166 HydrophobicContact CG-CG2 3.97Å; L164-W175 WeakPolarHBondContact O-CA 3.44Å; L164-W176 HydrophobicContact CB-CB 4.19Å; L164-W176 PolarHBondContact N-O 3.02Å; L164-W176 PolarHBondContact O-N 3Å; L164-L178 HydrophobicContact CB-CD2 3.9Å; L164-L178 HydrophobicContact CB-CG 4.47Å
165	V	91.6	Very high	88	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.6	174.1	-165.9	0	0	0	0	109.3	L156 L158 V173 K174 W175 L197 L206	L156-V165 PolarHBondContact N-O 3.39Å; L156-V165 PolarHBondContact O-N 2.62Å; L158-V165 HydrophobicContact CD1-CG2 3.91Å; V165-V173 HydrophobicContact CG1-CG1 3.68Å; V165-K174 WeakPolarHBondContact CA-O 3.27Å; V165-W175 HydrophobicContact CG1-CD2 4.28Å; V165-W175 HydrophobicContact CG1-CZ2 4.24Å; V165-W175 HydrophobicContact CG2-CD2 3.79Å; V165-W175 HydrophobicContact CG2-CE3 3.5Å; V165-W175 HydrophobicContact CG2-CH2 3.74Å; V165-W175 HydrophobicContact CG2-CZ2 4.01Å; V165-W175 HydrophobicContact CG2-CZ3 3.5Å; V165-L197 HydrophobicContact CB-CD2 4.1Å; V165-L197 HydrophobicContact CG1-CD1 4.29Å; V165-L197 HydrophobicContact CG1-CD2 3.76Å; V165-L206 HydrophobicContact CG1-CD2 4.5Å
166	T	92.7	Very high	87.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141	-174.6	54.2	0	0	0	0	109.9	V131 H148 Q154 A155 L164 V173 K174 W176	V131-T166 HydrophobicContact CG1-CG2 4.33Å; V131-T166 HydrophobicContact CG2-CG2 4.05Å; H148-T166 PolarHBondContact NE2-OG1 3.46Å; Q154-T166 WeakPolarHBondContact O-CA 3.44Å; A155-T166 HydrophobicContact CB-CG2 4.26Å; L164-T166 HydrophobicContact CD2-CG2 3.77Å; L164-T166 HydrophobicContact CG-CG2 3.97Å; T166-V173 CarbonylContact O-C 3.59Å; T166-V173 VanDerWaalsContact O-CA 3.31Å; T166-V173 WeakPolarHBondContact O-CA 3.37Å; T166-V173 WeakPolarHBondContact O-CG1 3.48Å; T166-K174 PolarHBondContact N-O 3.48Å; T166-K174 PolarHBondContact O-N 3.41Å; T166-K174 PolarHBondContact OG1-O 2.88Å; T166-K174 VanDerWaalsContact OG1-O 3.12Å; T166-W176 PolarHBondContact OG1-NE1 3.16Å
167	S	91.8	Very high	87.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.2	173.1	60.1	0	0	0	0	110.4	T153 Q154	T153-S167 PolarHBondContact N-O 2.83Å; T153-S167 PolarHBondContact OG1-O 3.35Å; T153-S167 VanDerWaalsContact OG1-O 3.05Å; T153-S167 PolarHBondContact OG1-OG 2.9Å; Q154-S167 WeakPolarHBondContact CB-OG 3.25Å; Q154-S167 PolarHBondContact N-O 3.13Å; Q154-S167 PolarHBondContact N-OG 3.06Å; Q154-S167 PolarHBondContact O-N 2.76Å; Q154-S167 PolarHBondContact O-OG 2.75Å
168	G	91.6	Very high	87.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	157.8	178.7	0	0	0	0	0	113	D170 T171 M172 V194	G168-D170 WeakPolarHBondContact CA-OD1 3.32Å; G168-D170 PolarHBondContact O-N 3.09Å; G168-T171 PolarHBondContact O-N 2.89Å; G168-M172 PolarHBondContact N-O 3.22Å; G168-V194 PolarHBondContact O-N 3.33Å
169	K	91.6	Very high	87.8	Confident	63 Å²	63	38 Å²	38	27%	0.274	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.3	167.3	-174.7	162.4	164.1	-81	0	112	D150 A151 T153 T171 E193 W195	D150-K169 HydrophobicContact CB-CB 4.09Å; D150-K169 IonicContact OD1-NZ 3.57Å; D150-K169 WeakPolarHBondContact OD2-CG 3.43Å; D150-K169 IonicContact OD2-NZ 3.5Å; D150-K169 PolarHBondContact OD2-NZ 2.9Å; A151-K169 HydrophobicContact CB-CB 4.5Å; A151-K169 WeakPolarHBondContact O-CB 3.47Å; A151-K169 PolarHBondContact O-N 3.1Å; T153-K169 HydrophobicContact CG2-CB 4.29Å; K169-T171 PolarHBondContact O-N 3.39Å; K169-E193 WeakPolarHBondContact CE-OE1 3.46Å; K169-E193 HydrophobicContact CG-CB 4.25Å; K169-E193 VanDerWaalsContact CG-CD 3.49Å; K169-E193 HydrophobicContact CG-CG 4.03Å; K169-E193 IonicContact NZ-OE1 3.54Å; K169-E193 WeakPolarHBondContact O-CG 3.35Å; K169-W195 HydrophobicContact CD-CH2 4.39Å; K169-W195 HydrophobicContact CD-CZ2 4.39Å
170	D	90.1	Very high	88.1	Confident	19 Å²	19	36.1 Å²	36.1	10%	0.102	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	12.7	172.8	63.2	2.6	0	0	0	115	H148 K149 D150 G168 M172	H148-D170 WeakPolarHBondContact CA-OD2 3.22Å; H148-D170 IonicContact CG-OD2 2.68Å; H148-D170 IonicContact ND1-OD1 2.78Å; H148-D170 PolarHBondContact ND1-OD1 3.47Å; H148-D170 IonicContact ND1-OD2 3.87Å; H148-D170 PolarHBondContact ND1-OD2 2.91Å; H148-D170 VanDerWaalsContact ND1-OD2 3.09Å; K149-D170 HydrophobicContact CB-CB 4.05Å; K149-D170 PolarHBondContact N-OD2 3.46Å; D150-D170 HydrophobicContact CB-CB 4.1Å; G168-D170 WeakPolarHBondContact CA-OD1 3.32Å; G168-D170 PolarHBondContact O-N 3.09Å; D170-M172 PolarHBondContact O-N 3.19Å; D170-M172 PolarHBondContact OD1-N 3.21Å; D170-M172 VanDerWaalsContact OD1-N 3.14Å
171	T	90.3	Very high	88.7	Confident	40 Å²	40	30.7 Å²	30.7	25%	0.245	15%	0.151	C	C	.	.	S	Bend	trans	70.5	-3.5	-177.2	76.9	0	0	0	0	115.2	G168 K169 T192	G168-T171 PolarHBondContact O-N 2.89Å; K169-T171 PolarHBondContact O-N 3.39Å; T171-T192 WeakPolarHBondContact CB-O 3.08Å; T171-T192 VanDerWaalsContact CG2-C 3.46Å; T171-T192 WeakPolarHBondContact CG2-O 3.5Å
172	M	90.8	Very high	89.1	Confident	44 Å²	44	29.2 Å²	29.2	22%	0.217	15%	0.148	C	C	.	.			trans	-96.7	147.9	-172.8	-59.7	178.1	-169.7	0	0	111.4	G168 D170 T186	G168-M172 PolarHBondContact N-O 3.22Å; D170-M172 PolarHBondContact O-N 3.19Å; D170-M172 PolarHBondContact OD1-N 3.21Å; D170-M172 VanDerWaalsContact OD1-N 3.14Å; M172-T186 HydrophobicContact CB-CG2 4.11Å; M172-T186 HydrophobicContact CG-CG2 4.23Å; M172-T186 HydrophobicContact SD-CG2 3.99Å
173	V	91.5	Very high	89.2	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.8	165.2	-179.2	0	0	0	0	107.9	V165 T166 M187 V194 L197 L206 T208	V165-V173 HydrophobicContact CG1-CG1 3.68Å; T166-V173 CarbonylContact O-C 3.59Å; T166-V173 VanDerWaalsContact O-CA 3.31Å; T166-V173 WeakPolarHBondContact O-CA 3.37Å; T166-V173 WeakPolarHBondContact O-CG1 3.48Å; V173-M187 HydrophobicContact CB-CB 4.34Å; V173-M187 HydrophobicContact CB-CE 3.53Å; V173-M187 HydrophobicContact CG1-CE 3.36Å; V173-M187 HydrophobicContact CG2-CE 4.33Å; V173-M187 PolarHBondContact O-N 2.64Å; V173-V194 HydrophobicContact CG2-CG1 4.19Å; V173-V194 HydrophobicContact CG2-CG2 4.33Å; V173-L197 HydrophobicContact CG1-CD1 3.86Å; V173-L197 HydrophobicContact CG2-CD1 4.36Å; V173-L206 HydrophobicContact CG1-CD2 4.32Å; V173-T208 HydrophobicContact CG2-CG2 4.02Å
174	K	91.5	Very high	89.1	Confident	22 Å²	22	28.7 Å²	28.7	10%	0.096	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.5	-176.1	-69.4	-177.2	178.5	-117.4	0	111.3	G147 V165 T166 W176 T186	G147-K174 VanDerWaalsContact C-CE 3.43Å; G147-K174 WeakPolarHBondContact O-CE 3.26Å; G147-K174 PolarHBondContact O-NZ 3.45Å; V165-K174 WeakPolarHBondContact CA-O 3.27Å; T166-K174 PolarHBondContact N-O 3.48Å; T166-K174 PolarHBondContact O-N 3.41Å; T166-K174 PolarHBondContact OG1-O 2.88Å; T166-K174 VanDerWaalsContact OG1-O 3.12Å; K174-W176 HydrophobicContact CB-CZ2 4.2Å; K174-W176 HydrophobicContact CD-CH2 4.46Å; K174-W176 HydrophobicContact CD-CZ2 3.76Å; K174-T186 HydrophobicContact CG-CG2 4.25Å
175	W	90.8	Very high	88.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.6	175.2	-65.1	71.2	0	0	0	108.9	L158 L164 V165 C183 F184 K185 M187 L206 I220 L265	L158-W175 HydrophobicContact CD1-CE3 4.23Å; L158-W175 HydrophobicContact CD1-CZ3 3.65Å; L164-W175 WeakPolarHBondContact O-CA 3.44Å; V165-W175 HydrophobicContact CG1-CD2 4.28Å; V165-W175 HydrophobicContact CG1-CZ2 4.24Å; V165-W175 HydrophobicContact CG2-CD2 3.79Å; V165-W175 HydrophobicContact CG2-CE3 3.5Å; V165-W175 HydrophobicContact CG2-CH2 3.74Å; V165-W175 HydrophobicContact CG2-CZ2 4.01Å; V165-W175 HydrophobicContact CG2-CZ3 3.5Å; W175-C183 WeakPolarHBondContact O-CA 3.42Å; W175-F184 HydrophobicContact CB-CD1 4.4Å; W175-F184 HydrophobicContact CB-CE1 3.71Å; W175-F184 HydrophobicContact CB-CE2 4.42Å; W175-F184 HydrophobicContact CB-CZ 3.73Å; W175-F184 HydrophobicContact CE3-CZ 4.44Å; W175-F184 HydrophobicContact CG-CZ 4.47Å; W175-F184 PolarHBondContact O-N 3.48Å; W175-K185 HydrophobicContact CB-CB 4.1Å; W175-K185 HydrophobicContact CG-CB 4.4Å; W175-K185 PolarHBondContact N-O 3.48Å; W175-M187 VanDerWaalsContact NE1-CE 3.32Å; W175-L206 HydrophobicContact CZ2-CD2 4.22Å; W175-I220 HydrophobicContact CH2-CD1 3.73Å; W175-I220 HydrophobicContact CH2-CG1 4.05Å; W175-I220 HydrophobicContact CH2-CG2 4.32Å; W175-I220 HydrophobicContact CZ2-CD1 4.29Å; W175-I220 HydrophobicContact CZ2-CG1 4.36Å; W175-L265 HydrophobicContact CD2-CD2 3.71Å; W175-L265 HydrophobicContact CE3-CD2 3.43Å; W175-L265 VanDerWaalsContact CE3-CD2 3.43Å; W175-L265 HydrophobicContact CH2-CD2 3.61Å; W175-L265 HydrophobicContact CZ2-CD2 3.87Å; W175-L265 HydrophobicContact CZ3-CD2 3.36Å
176	W	90.4	Very high	88.7	Confident	5 Å²	5	33.6 Å²	33.6	2%	0.019	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.2	-177.5	-54.3	90.6	0	0	0	108.8	L145 K146 L163 L164 T166 K174 C183	L145-W176 HydrophobicContact CB-CD2 4.11Å; L145-W176 HydrophobicContact CB-CE3 3.89Å; L145-W176 HydrophobicContact CB-CH2 4.12Å; L145-W176 HydrophobicContact CB-CZ2 4.33Å; L145-W176 HydrophobicContact CB-CZ3 3.88Å; L145-W176 HydrophobicContact CD1-CB 3.95Å; L145-W176 HydrophobicContact CD1-CD2 3.9Å; L145-W176 HydrophobicContact CD1-CE3 4.12Å; L145-W176 HydrophobicContact CD1-CG 3.81Å; L145-W176 HydrophobicContact CD2-CD2 4.44Å; L145-W176 HydrophobicContact CD2-CE3 3.82Å; L145-W176 HydrophobicContact CD2-CZ3 4.26Å; L145-W176 HydrophobicContact CG-CD2 4.38Å; L145-W176 HydrophobicContact CG-CE3 4.15Å; K146-W176 WeakPolarHBondContact O-CH2 3.39Å; L163-W176 WeakPolarHBondContact CA-O 3.37Å; L164-W176 HydrophobicContact CB-CB 4.19Å; L164-W176 PolarHBondContact N-O 3.02Å; L164-W176 PolarHBondContact O-N 3Å; T166-W176 PolarHBondContact OG1-NE1 3.16Å; K174-W176 HydrophobicContact CB-CZ2 4.2Å; K174-W176 HydrophobicContact CD-CH2 4.46Å; K174-W176 HydrophobicContact CD-CZ2 3.76Å; W176-C183 HydrophobicContact CD2-CB 4.05Å; W176-C183 HydrophobicContact CE3-CB 3.6Å; W176-C183 HydrophobicContact CH2-CB 3.74Å; W176-C183 HydrophobicContact CZ2-CB 4.18Å; W176-C183 HydrophobicContact CZ3-CB 3.44Å; W176-C183 VanDerWaalsContact CZ3-CB 3.44Å
177	D	88.6	Confident	88.3	Confident	13 Å²	13	34.2 Å²	34.2	7%	0.07	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	124.6	164.5	-173.9	5.9	0	0	0	108.4	L163 D179 N180 Q181 H182 F184	L163-D177 HydrophobicContact CD2-CB 4.06Å; D177-D179 VanDerWaalsContact C-N 3.34Å; D177-D179 PolarHBondContact OD1-N 2.92Å; D177-N180 HydrophobicContact CB-CB 4.43Å; D177-N180 PolarHBondContact OD2-ND2 3.43Å; D177-Q181 VanDerWaalsContact O-CA 3.26Å; D177-Q181 WeakPolarHBondContact O-CA 3.32Å; D177-Q181 PolarHBondContact O-N 3.4Å; D177-H182 PolarHBondContact N-O 3.25Å; D177-F184 HydrophobicContact CB-CD1 3.99Å; D177-F184 HydrophobicContact CB-CE1 4.39Å
178	L	85.8	Confident	87.8	Confident	4 Å²	4	40 Å²	40	2%	0.021	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-24.1	-176.9	-59.1	-176.6	0	0	0	112.2	I133 L145 F157 N162 L164	I133-L178 HydrophobicContact CD1-CD1 4.47Å; I133-L178 HydrophobicContact CD1-CD2 3.14Å; I133-L178 HydrophobicContact CD1-CG 4.37Å; L145-L178 HydrophobicContact CD1-CD2 4.49Å; F157-L178 HydrophobicContact CD1-CD1 4.11Å; F157-L178 HydrophobicContact CE1-CD1 3.77Å; N162-L178 HydrophobicContact CB-CB 4.34Å; N162-L178 WeakPolarHBondContact O-CB 3.24Å; N162-L178 VanDerWaalsContact O-CG 3.27Å; N162-L178 WeakPolarHBondContact O-CG 3.47Å; N162-L178 PolarHBondContact O-N 3.04Å; N162-L178 VanDerWaalsContact O-N 3.13Å; L164-L178 HydrophobicContact CB-CD2 3.9Å; L164-L178 HydrophobicContact CB-CG 4.47Å
179	D	86.9	Confident	86.9	Confident	97 Å²	97	41.6 Å²	41.6	52%	0.519	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-44.8	-179.6	-61.6	-28.9	0	0	0	109.5	N162 D177	N162-D179 PolarHBondContact ND2-OD1 2.9Å; N162-D179 VanDerWaalsContact ND2-OD1 3.13Å; D177-D179 VanDerWaalsContact C-N 3.34Å; D177-D179 PolarHBondContact OD1-N 2.92Å
180	N	82.6	Confident	86.5	Confident	102 Å²	102	39.3 Å²	39.3	55%	0.545	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-4.4	180	-62.9	-43.5	0	0	0	114.8	D177 H182	D177-N180 HydrophobicContact CB-CB 4.43Å; D177-N180 PolarHBondContact OD2-ND2 3.43Å; N180-H182 WeakPolarHBondContact CB-CE1 3.43Å; N180-H182 WeakPolarHBondContact CB-ND1 3.5Å; N180-H182 PolarHBondContact O-N 3.3Å; N180-H182 PolarHBondContact O-ND1 3.26Å
181	Q	83.9	Confident	86.2	Confident	51 Å²	51	49.7 Å²	49.7	24%	0.238	26%	0.255	C	S	.	.			trans	58	18.8	172.6	-60.6	164.5	47.8	0	0	116.4	Y143 D177 N741	Y143-Q181 HydrophobicContact CD1-CG 3.62Å; Y143-Q181 VanDerWaalsContact CD1-OE1 3.27Å; Y143-Q181 HydrophobicContact CE1-CG 3.76Å; Y143-Q181 HydrophobicContact CG-CG 4.06Å; D177-Q181 VanDerWaalsContact O-CA 3.26Å; D177-Q181 WeakPolarHBondContact O-CA 3.32Å; D177-Q181 PolarHBondContact O-N 3.4Å; Q181-N741 PolarHBondContact OE1-OD1 3.47Å; Q181-N741 VanDerWaalsContact OE1-OD1 3.06Å
182	H	85.1	Confident	86.1	Confident	72 Å²	72	50.1 Å²	50.1	33%	0.333	26%	0.258	S	S	.	.	S	Bend	trans	-119.2	158.4	178.9	68.4	-81.3	0	0	0	111.6	D177 N180 F184	D177-H182 PolarHBondContact N-O 3.25Å; N180-H182 WeakPolarHBondContact CB-CE1 3.43Å; N180-H182 WeakPolarHBondContact CB-ND1 3.5Å; N180-H182 PolarHBondContact O-N 3.3Å; N180-H182 PolarHBondContact O-ND1 3.26Å; H182-F184 PolarHBondContact O-N 3.35Å
183	C	86.2	Confident	86	Confident	36 Å²	36	51 Å²	51	24%	0.243	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	98.2	171.6	172.7	0	0	0	0	109	W175 W176 K185	W175-C183 WeakPolarHBondContact O-CA 3.42Å; W176-C183 HydrophobicContact CD2-CB 4.05Å; W176-C183 HydrophobicContact CE3-CB 3.6Å; W176-C183 HydrophobicContact CH2-CB 3.74Å; W176-C183 HydrophobicContact CZ2-CB 4.18Å; W176-C183 HydrophobicContact CZ3-CB 3.44Å; W176-C183 VanDerWaalsContact CZ3-CB 3.44Å; C183-K185 VanDerWaalsContact C-N 3.35Å
184	F	87.3	Confident	86	Confident	34 Å²	34	51 Å²	51	15%	0.149	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-19.8	178.4	72.9	-86.8	0	0	0	112.9	L163 W175 D177 H182 I264 L265	L163-F184 HydrophobicContact CD2-CE1 3.92Å; L163-F184 HydrophobicContact CD2-CZ 4.43Å; W175-F184 HydrophobicContact CB-CD1 4.4Å; W175-F184 HydrophobicContact CB-CE1 3.71Å; W175-F184 HydrophobicContact CB-CE2 4.42Å; W175-F184 HydrophobicContact CB-CZ 3.73Å; W175-F184 HydrophobicContact CE3-CZ 4.44Å; W175-F184 HydrophobicContact CG-CZ 4.47Å; W175-F184 PolarHBondContact O-N 3.48Å; D177-F184 HydrophobicContact CB-CD1 3.99Å; D177-F184 HydrophobicContact CB-CE1 4.39Å; H182-F184 PolarHBondContact O-N 3.35Å; F184-I264 HydrophobicContact CE2-CB 4.41Å; F184-L265 HydrophobicContact CE2-CB 3.98Å; F184-L265 HydrophobicContact CZ-CB 4.41Å
185	K	84.6	Confident	85.8	Confident	43 Å²	43	52.9 Å²	52.9	19%	0.187	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	125	-178.8	-172.6	175.6	-171.9	173.5	0	114.1	W175 C183 L265 C267	W175-K185 HydrophobicContact CB-CB 4.1Å; W175-K185 HydrophobicContact CG-CB 4.4Å; W175-K185 PolarHBondContact N-O 3.48Å; C183-K185 VanDerWaalsContact C-N 3.35Å; K185-L265 PolarHBondContact NZ-O 2.81Å; K185-C267 PolarHBondContact NZ-SG 3.12Å; K185-C267 VanDerWaalsContact NZ-SG 3.36Å
186	T	89.6	Confident	85.5	Confident	60 Å²	60	52.9 Å²	52.9	37%	0.368	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.6	170.3	-58.4	0	0	0	0	109.7	M172 K174 V188	M172-T186 HydrophobicContact CB-CG2 4.11Å; M172-T186 HydrophobicContact CG-CG2 4.23Å; M172-T186 HydrophobicContact SD-CG2 3.99Å; K174-T186 HydrophobicContact CG-CG2 4.25Å; T186-V188 HydrophobicContact CG2-CG2 4.34Å
187	M	84.1	Confident	85.5	Confident	13 Å²	13	52.7 Å²	52.7	6%	0.064	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	117.3	175.8	-63.6	-168.9	-57.8	0	0	110.6	V173 W175 L206 C267	V173-M187 HydrophobicContact CB-CB 4.34Å; V173-M187 HydrophobicContact CB-CE 3.53Å; V173-M187 HydrophobicContact CG1-CE 3.36Å; V173-M187 HydrophobicContact CG2-CE 4.33Å; V173-M187 PolarHBondContact O-N 2.64Å; W175-M187 VanDerWaalsContact NE1-CE 3.32Å; M187-L206 HydrophobicContact CE-CD2 3.54Å; M187-C267 HydrophobicContact SD-CB 3.6Å; M187-C267 VanDerWaalsContact SD-CB 3.6Å
188	V	80.7	Confident	85.3	Confident	123 Å²	123	52.7 Å²	52.7	75%	0.745	27%	0.268	S	S	*	.			trans	-108.3	102.7	175.3	-174.1	0	0	0	0	108.2	T186	T186-V188 HydrophobicContact CG2-CG2 4.34Å
189	G	72.3	Confident	85.3	Confident	33 Å²	33	53.7 Å²	53.7	34%	0.34	27%	0.273	S	S	.	.			trans	-158.7	-0.3	178.8	0	0	0	0	0	115
190	H	82.8	Confident	85	Confident	14 Å²	14	49.1 Å²	49.1	7%	0.065	25%	0.249	C	C	.	.			trans	-102.9	136.3	176.9	-67.1	-78.4	0	0	0	109.3	T192 V194 T208 W218	H190-T192 WeakPolarHBondContact CB-O 3Å; H190-V194 HydrophobicContact CB-CG2 3.93Å; H190-V194 VanDerWaalsContact CD2-CG2 3.49Å; H190-V194 WeakPolarHBondContact CD2-CG2 3.39Å; H190-T208 PolarHBondContact CE1-OG1 3.38Å; H190-T208 PolarHBondContact NE2-OG1 3.33Å; H190-W218 AromaticContact NE2-CZ2 3.75Å; H190-W218 AromaticContact NE2-NE1 3.86Å
191	R	83.9	Confident	84.3	Confident	238 Å²	238	45.9 Å²	45.9	90%	0.898	23%	0.234	S	C	*	.	S	Bend	trans	-87.1	-18.6	172	-68.2	-176.2	176.2	-178.5	-1.9	112.3
192	T	87.9	Confident	83.6	Confident	48 Å²	48	50.7 Å²	50.7	29%	0.294	26%	0.256	S	S	.	.	S	Bend	trans	-128.7	167.3	-175.6	57.9	0	0	0	0	110.3	T171 H190	T171-T192 WeakPolarHBondContact CB-O 3.08Å; T171-T192 VanDerWaalsContact CG2-C 3.46Å; T171-T192 WeakPolarHBondContact CG2-O 3.5Å; H190-T192 WeakPolarHBondContact CB-O 3Å
193	E	89.9	Confident	83	Confident	62 Å²	62	48.1 Å²	48.1	29%	0.29	25%	0.245	S	C	.	.			trans	-57.6	138.1	-176.3	-48.2	178.9	158.1	0	0	111.6	K169 W195 A210 A211	K169-E193 WeakPolarHBondContact CE-OE1 3.46Å; K169-E193 HydrophobicContact CG-CB 4.25Å; K169-E193 VanDerWaalsContact CG-CD 3.49Å; K169-E193 HydrophobicContact CG-CG 4.03Å; K169-E193 IonicContact NZ-OE1 3.54Å; K169-E193 WeakPolarHBondContact O-CG 3.35Å; E193-W195 VanDerWaalsContact OE2-CZ2 3.27Å; E193-W195 WeakPolarHBondContact OE2-CZ2 3.44Å; E193-W195 PolarHBondContact OE2-NE1 2.93Å; E193-A210 CarbonylContact O-C 3.6Å; E193-A210 WeakPolarHBondContact O-CA 3.37Å; E193-A210 WeakPolarHBondContact O-CB 3.36Å; E193-A211 PolarHBondContact O-N 2.92Å
194	V	90.5	Very high	82.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.4	177.8	-176.4	0	0	0	0	108.8	T153 G168 V173 H190	T153-V194 WeakPolarHBondContact CB-O 3.5Å; T153-V194 VanDerWaalsContact CG2-O 3.3Å; T153-V194 WeakPolarHBondContact CG2-O 3.18Å; T153-V194 PolarHBondContact OG1-O 2.83Å; G168-V194 PolarHBondContact O-N 3.33Å; V173-V194 HydrophobicContact CG2-CG1 4.19Å; V173-V194 HydrophobicContact CG2-CG2 4.33Å; H190-V194 HydrophobicContact CB-CG2 3.93Å; H190-V194 VanDerWaalsContact CD2-CG2 3.49Å; H190-V194 WeakPolarHBondContact CD2-CG2 3.39Å
195	W	88.1	Confident	82.3	Confident	63 Å²	63	51.1 Å²	51.1	24%	0.239	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-28.3	-175	-74.9	93.5	0	0	0	113.3	T153 K169 E193 G209 V281	T153-W195 HydrophobicContact CG2-CD2 4.48Å; T153-W195 HydrophobicContact CG2-CE3 4.05Å; T153-W195 HydrophobicContact CG2-CZ3 4.35Å; K169-W195 HydrophobicContact CD-CH2 4.39Å; K169-W195 HydrophobicContact CD-CZ2 4.39Å; E193-W195 VanDerWaalsContact OE2-CZ2 3.27Å; E193-W195 WeakPolarHBondContact OE2-CZ2 3.44Å; E193-W195 PolarHBondContact OE2-NE1 2.93Å; W195-G209 PolarHBondContact N-O 3.36Å; W195-V281 WeakPolarHBondContact CB-O 3.39Å
196	G	84.9	Confident	82.5	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	143.8	-178.6	0	0	0	0	0	112.1	T208 G209	G196-T208 CarbonylContact O-C 3.57Å; G196-T208 WeakPolarHBondContact O-CA 3.27Å; G196-G209 PolarHBondContact N-O 3.27Å; G196-G209 VanDerWaalsContact N-O 3.08Å; G196-G209 PolarHBondContact O-N 2.91Å
197	L	89.1	Confident	82.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	121.9	-176.3	-178	80.3	0	0	0	108.4	Q154 L156 V165 V173 L206 T208	Q154-L197 HydrophobicContact CB-CB 4.24Å; Q154-L197 HydrophobicContact CG-CB 4.38Å; Q154-L197 PolarHBondContact NE2-O 2.81Å; Q154-L197 PolarHBondContact OE1-O 3.24Å; L156-L197 HydrophobicContact CB-CD2 4.5Å; L156-L197 HydrophobicContact CD1-CD2 4.16Å; L156-L197 HydrophobicContact CD1-CG 4.16Å; L156-L197 WeakPolarHBondContact CD1-O 3.47Å; L156-L197 HydrophobicContact CG-CD2 4.45Å; V165-L197 HydrophobicContact CB-CD2 4.1Å; V165-L197 HydrophobicContact CG1-CD1 4.29Å; V165-L197 HydrophobicContact CG1-CD2 3.76Å; V173-L197 HydrophobicContact CG1-CD1 3.86Å; V173-L197 HydrophobicContact CG2-CD1 4.36Å; L197-L206 HydrophobicContact CD1-CD1 3.59Å; L197-L206 HydrophobicContact CD1-CD2 3.74Å; L197-L206 HydrophobicContact CD1-CG 3.87Å; L197-L206 HydrophobicContact CG-CD1 3.98Å; L197-T208 HydrophobicContact CD1-CG2 3.64Å
198	V	85.6	Confident	82.7	Confident	13 Å²	13	45.6 Å²	45.6	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	145.2	171.5	-172.2	0	0	0	0	113.5	I207 L284 V286	V198-I207 PolarHBondContact N-O 3Å; V198-I207 PolarHBondContact O-N 3.02Å; V198-L284 HydrophobicContact CB-CD2 3.38Å; V198-L284 HydrophobicContact CG2-CB 4.18Å; V198-L284 HydrophobicContact CG2-CD2 3.21Å; V198-L284 HydrophobicContact CG2-CG 4.23Å; V198-L284 WeakPolarHBondContact CG2-O 3.4Å; V198-V286 HydrophobicContact CB-CG2 3.98Å; V198-V286 HydrophobicContact CG1-CB 3.49Å; V198-V286 VanDerWaalsContact CG1-CB 3.49Å; V198-V286 HydrophobicContact CG1-CG2 3.19Å; V198-V286 HydrophobicContact CG2-CG2 4.49Å
199	L	85.7	Confident	83	Confident	25 Å²	25	39.8 Å²	39.8	13%	0.131	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	134.3	172.8	-66.2	164.3	0	0	0	111.5	L158 R205 L206 I220	L158-L199 HydrophobicContact CD2-CD1 3.63Å; L158-L199 HydrophobicContact CD2-CD2 4.25Å; L158-L199 HydrophobicContact CG-CD1 4.02Å; L199-R205 CarbonylContact C-O 3.54Å; L199-R205 WeakPolarHBondContact CA-O 3.4Å; L199-L206 HydrophobicContact CD2-CB 4.36Å; L199-L206 HydrophobicContact CD2-CD1 3.55Å; L199-L206 HydrophobicContact CG-CD1 4Å; L199-I220 HydrophobicContact CD2-CD1 3.68Å
200	V	79.8	Confident	83.7	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	156.1	-175.1	171.9	0	0	0	0	110	E203 R205 I207 V286 V307	V200-E203 PolarHBondContact O-N 3.49Å; V200-R205 PolarHBondContact N-O 3.04Å; V200-R205 PolarHBondContact O-N 3.06Å; V200-R205 VanDerWaalsContact O-N 3.16Å; V200-I207 HydrophobicContact CB-CD1 4.27Å; V200-I207 HydrophobicContact CG2-CD1 3.73Å; V200-I207 HydrophobicContact CG2-CG1 4.28Å; V200-V286 HydrophobicContact CG2-CG2 3.74Å; V200-V307 HydrophobicContact CG1-CB 4.12Å; V200-V307 HydrophobicContact CG1-CG1 3.86Å; V200-V307 HydrophobicContact CG1-CG2 3.41Å; V200-V307 VanDerWaalsContact CG1-CG2 3.41Å
201	S	68.8	Low	83.8	Confident	34 Å²	34	39.1 Å²	39.1	24%	0.238	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	50.7	175.7	-62.7	0	0	0	0	113.9	E203 K204 V307	S201-E203 VanDerWaalsContact C-N 3.33Å; S201-E203 PolarHBondContact O-N 2.98Å; S201-K204 PolarHBondContact O-N 3.42Å; S201-V307 WeakPolarHBondContact OG-CG1 3.49Å
202	E	68.7	Low	83.8	Confident	151 Å²	151	29.5 Å²	29.5	71%	0.706	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	48.8	-179.5	-56	167.7	171.8	0	0	111.1	K204	E202-K204 PolarHBondContact O-N 3.42Å; E202-K204 VanDerWaalsContact O-N 3.08Å; E202-K204 IonicContact OE2-NZ 3.19Å
203	E	72.1	Confident	83.5	Confident	19 Å²	19	28.6 Å²	28.6	9%	0.089	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	8.2	172.2	-48.4	-173.3	163	0	0	115.5	L158 R159 V200 S201 R205 I220	L158-E203 HydrophobicContact CD2-CB 3.93Å; L158-E203 HydrophobicContact CD2-CG 4.08Å; L158-E203 WeakPolarHBondContact CD2-OE2 3.39Å; R159-E203 WeakPolarHBondContact CA-OE1 3.49Å; R159-E203 WeakPolarHBondContact CB-OE1 3.34Å; R159-E203 VanDerWaalsContact CG-OE1 3.23Å; R159-E203 WeakPolarHBondContact CG-OE1 3.37Å; R159-E203 PolarHBondContact N-OE1 3.02Å; R159-E203 PolarHBondContact N-OE2 3.39Å; V200-E203 PolarHBondContact O-N 3.49Å; S201-E203 VanDerWaalsContact C-N 3.33Å; S201-E203 PolarHBondContact O-N 2.98Å; E203-R205 VanDerWaalsContact C-N 3.33Å; E203-I220 WeakPolarHBondContact O-CD1 3.35Å
204	K	75.8	Confident	83.3	Confident	100 Å²	100	28.2 Å²	28.2	44%	0.435	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-20.7	175.3	-69.4	169.6	-175	153.7	0	112.7	S201 E202 I220	S201-K204 PolarHBondContact O-N 3.42Å; E202-K204 PolarHBondContact O-N 3.42Å; E202-K204 VanDerWaalsContact O-N 3.08Å; E202-K204 IonicContact OE2-NZ 3.19Å; K204-I220 PolarHBondContact O-N 2.94Å
205	R	84.3	Confident	83.1	Confident	32 Å²	32	28.2 Å²	28.2	12%	0.121	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.2	179.7	-73.4	-166.6	172.3	164.2	13.3	112.9	L199 V200 E203 W218 D219 E350	L199-R205 CarbonylContact C-O 3.54Å; L199-R205 WeakPolarHBondContact CA-O 3.4Å; V200-R205 PolarHBondContact N-O 3.04Å; V200-R205 PolarHBondContact O-N 3.06Å; V200-R205 VanDerWaalsContact O-N 3.16Å; E203-R205 VanDerWaalsContact C-N 3.33Å; R205-W218 CarbonylContact C-O 3.6Å; R205-W218 VanDerWaalsContact CA-O 3.28Å; R205-W218 WeakPolarHBondContact CA-O 3.48Å; R205-D219 WeakPolarHBondContact CG-OD1 3.49Å; R205-D219 IonicContact CZ-OD1 2.68Å; R205-D219 IonicContact NE-OD1 3.91Å; R205-D219 PolarHBondContact NE-OD1 3.48Å; R205-D219 IonicContact NH2-OD1 3.11Å; R205-E350 VanDerWaalsContact CZ-CD 3.45Å; R205-E350 IonicContact CZ-OE1 3.71Å; R205-E350 IonicContact CZ-OE2 3.58Å; R205-E350 IonicContact NH1-OE1 2.81Å; R205-E350 PolarHBondContact NH1-OE1 2.98Å; R205-E350 VanDerWaalsContact NH1-OE1 3.09Å; R205-E350 IonicContact NH1-OE2 3.24Å; R205-E350 PolarHBondContact NH1-OE2 3.31Å; R205-E350 IonicContact NH2-OE1 3.12Å; R205-E350 IonicContact NH2-OE2 3.78Å; R205-E350 PolarHBondContact NH2-OE2 2.94Å
206	L	87.4	Confident	83.1	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.2	168.7	-173.8	74.6	0	0	0	109.3	V165 V173 W175 M187 L197 L199 T208 A217 W218 I220	V165-L206 HydrophobicContact CG1-CD2 4.5Å; V173-L206 HydrophobicContact CG1-CD2 4.32Å; W175-L206 HydrophobicContact CZ2-CD2 4.22Å; M187-L206 HydrophobicContact CE-CD2 3.54Å; L197-L206 HydrophobicContact CD1-CD1 3.59Å; L197-L206 HydrophobicContact CD1-CD2 3.74Å; L197-L206 HydrophobicContact CD1-CG 3.87Å; L197-L206 HydrophobicContact CG-CD1 3.98Å; L199-L206 HydrophobicContact CD2-CB 4.36Å; L199-L206 HydrophobicContact CD2-CD1 3.55Å; L199-L206 HydrophobicContact CG-CD1 4Å; L206-T208 HydrophobicContact CD2-CG2 4.04Å; L206-T208 HydrophobicContact CG-CG2 4.24Å; L206-A217 CarbonylContact O-C 3.58Å; L206-A217 WeakPolarHBondContact O-CA 3.25Å; L206-W218 HydrophobicContact CB-CB 4.23Å; L206-W218 PolarHBondContact N-O 2.84Å; L206-W218 PolarHBondContact O-N 3.03Å; L206-I220 HydrophobicContact CB-CD1 3.95Å; L206-I220 HydrophobicContact CB-CG1 4.4Å
207	I	88.9	Confident	83.3	Confident	1 Å²	1	26 Å²	26	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.7	172.6	-58.5	179.4	0	0	0	107.8	V198 V200 L215 R216 A217 L284 L293 I351	V198-I207 PolarHBondContact N-O 3Å; V198-I207 PolarHBondContact O-N 3.02Å; V200-I207 HydrophobicContact CB-CD1 4.27Å; V200-I207 HydrophobicContact CG2-CD1 3.73Å; V200-I207 HydrophobicContact CG2-CG1 4.28Å; I207-L215 HydrophobicContact CG2-CB 4.31Å; I207-R216 WeakPolarHBondContact CA-O 3.4Å; I207-A217 HydrophobicContact CG1-CB 4.49Å; I207-L284 HydrophobicContact CB-CD2 4.45Å; I207-L284 HydrophobicContact CG2-CD1 4.16Å; I207-L284 HydrophobicContact CG2-CD2 4.3Å; I207-L293 HydrophobicContact CD1-CD2 3.52Å; I207-L293 HydrophobicContact CG2-CD2 4.44Å; I207-I351 HydrophobicContact CD1-CD1 3.79Å
208	T	88.8	Confident	83.2	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.8	175.8	54.6	0	0	0	0	109.9	V173 H190 G196 L197 L206 R216 W218	V173-T208 HydrophobicContact CG2-CG2 4.02Å; H190-T208 PolarHBondContact CE1-OG1 3.38Å; H190-T208 PolarHBondContact NE2-OG1 3.33Å; G196-T208 CarbonylContact O-C 3.57Å; G196-T208 WeakPolarHBondContact O-CA 3.27Å; L197-T208 HydrophobicContact CD1-CG2 3.64Å; L206-T208 HydrophobicContact CD2-CG2 4.04Å; L206-T208 HydrophobicContact CG-CG2 4.24Å; T208-R216 PolarHBondContact N-O 3.12Å; T208-R216 PolarHBondContact O-N 3.28Å; T208-R216 PolarHBondContact OG1-O 2.94Å; T208-W218 PolarHBondContact OG1-NE1 2.92Å
209	G	88	Confident	83.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.8	171.8	0	0	0	0	0	109.6	W195 G196	W195-G209 PolarHBondContact N-O 3.36Å; G196-G209 PolarHBondContact N-O 3.27Å; G196-G209 VanDerWaalsContact N-O 3.08Å; G196-G209 PolarHBondContact O-N 2.91Å
210	A	86.5	Confident	83.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-176.4	175.8	0	0	0	0	0	111.1	E193 D212 V281	E193-A210 CarbonylContact O-C 3.6Å; E193-A210 WeakPolarHBondContact O-CA 3.37Å; E193-A210 WeakPolarHBondContact O-CB 3.36Å; A210-D212 WeakPolarHBondContact CB-OD1 3.5Å; A210-D212 PolarHBondContact O-N 3.41Å; A210-V281 WeakPolarHBondContact O-CG2 3.26Å; A210-V281 PolarHBondContact O-N 3.12Å
211	A	85	Confident	83	Confident	33 Å²	33	31 Å²	31	27%	0.273	17%	0.165	S	C	.	.	S	Bend	trans	-69.9	-10.9	176.4	0	0	0	0	0	113.3	E193 R280	E193-A211 PolarHBondContact O-N 2.92Å; A211-R280 HydrophobicContact CB-CB 4.16Å; A211-R280 WeakPolarHBondContact O-CA 3.46Å
212	D	83.6	Confident	83.1	Confident	37 Å²	37	32.5 Å²	32.5	20%	0.198	17%	0.166	C	C	.	.	S	Bend	trans	-83.9	173	171.7	59.8	7.3	0	0	0	112.2	A210 E214 R216	A210-D212 WeakPolarHBondContact CB-OD1 3.5Å; A210-D212 PolarHBondContact O-N 3.41Å; D212-E214 PolarHBondContact O-N 2.88Å; D212-R216 VanDerWaalsContact CG-NH1 3.31Å; D212-R216 IonicContact OD1-NH1 3.59Å; D212-R216 PolarHBondContact OD1-NH1 2.91Å; D212-R216 IonicContact OD2-CZ 3.27Å; D212-R216 IonicContact OD2-NH1 3.9Å; D212-R216 PolarHBondContact OD2-NH1 3.4Å; D212-R216 IonicContact OD2-NH2 3.61Å; D212-R216 PolarHBondContact OD2-NH2 3.06Å
213	S	82.9	Confident	83.1	Confident	29 Å²	29	29.9 Å²	29.9	20%	0.203	16%	0.156	C	C	.	.	S	Bend	trans	-76.4	2.7	176.8	56.9	0	0	0	0	113.6	R275	S213-R275 WeakPolarHBondContact O-CB 3.19Å; S213-R275 WeakPolarHBondContact O-CG 3.39Å; S213-R275 PolarHBondContact O-N 3.49Å
214	E	84.8	Confident	82.1	Confident	53 Å²	53	37.8 Å²	37.8	25%	0.248	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	119.2	-177.1	-73.6	-176.4	-173.2	0	0	111.7	D212 R216 M274	D212-E214 PolarHBondContact O-N 2.88Å; E214-R216 IonicContact OE2-CZ 3.04Å; E214-R216 VanDerWaalsContact OE2-CZ 3.23Å; E214-R216 IonicContact OE2-NE 3.83Å; E214-R216 IonicContact OE2-NH1 3.77Å; E214-R216 IonicContact OE2-NH2 2.83Å; E214-R216 PolarHBondContact OE2-NH2 3.35Å; E214-M274 HydrophobicContact CG-CE 4.32Å; E214-M274 HydrophobicContact CG-SD 3.51Å; E214-M274 VanDerWaalsContact CG-SD 3.51Å
215	L	86.9	Confident	80.3	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	121	161.6	-62	178.6	0	0	0	108.7	I207 S272 I273 R275 V281 L284 F305	I207-L215 HydrophobicContact CG2-CB 4.31Å; L215-S272 CarbonylContact O-C 3.58Å; L215-S272 VanDerWaalsContact O-CA 3.29Å; L215-S272 WeakPolarHBondContact O-CA 3.4Å; L215-I273 HydrophobicContact CB-CB 4.27Å; L215-I273 PolarHBondContact N-O 2.82Å; L215-I273 PolarHBondContact O-N 3.45Å; L215-R275 HydrophobicContact CD1-CG 4.11Å; L215-R275 HydrophobicContact CG-CG 3.9Å; L215-V281 HydrophobicContact CD2-CG2 3.9Å; L215-L284 HydrophobicContact CD1-CD1 4.5Å; L215-L284 HydrophobicContact CD2-CD1 3.62Å; L215-F305 HydrophobicContact CD1-CE2 4.07Å; L215-F305 HydrophobicContact CD1-CZ 4.37Å
216	R	88	Confident	78	Confident	16 Å²	16	47.3 Å²	47.3	6%	0.06	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	130.4	179.5	-67.1	177.1	-178.5	75.8	1.9	109.4	I207 T208 D212 E214 W218	I207-R216 WeakPolarHBondContact CA-O 3.4Å; T208-R216 PolarHBondContact N-O 3.12Å; T208-R216 PolarHBondContact O-N 3.28Å; T208-R216 PolarHBondContact OG1-O 2.94Å; D212-R216 VanDerWaalsContact CG-NH1 3.31Å; D212-R216 IonicContact OD1-NH1 3.59Å; D212-R216 PolarHBondContact OD1-NH1 2.91Å; D212-R216 IonicContact OD2-CZ 3.27Å; D212-R216 IonicContact OD2-NH1 3.9Å; D212-R216 PolarHBondContact OD2-NH1 3.4Å; D212-R216 IonicContact OD2-NH2 3.61Å; D212-R216 PolarHBondContact OD2-NH2 3.06Å; E214-R216 IonicContact OE2-CZ 3.04Å; E214-R216 VanDerWaalsContact OE2-CZ 3.23Å; E214-R216 IonicContact OE2-NE 3.83Å; E214-R216 IonicContact OE2-NH1 3.77Å; E214-R216 IonicContact OE2-NH2 2.83Å; E214-R216 PolarHBondContact OE2-NH2 3.35Å; R216-W218 HydrophobicContact CB-CZ2 4.28Å
217	A	88	Confident	75.4	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	134.4	174.4	0	0	0	0	0	109.6	L206 I207 A270 G271 L347	L206-A217 CarbonylContact O-C 3.58Å; L206-A217 WeakPolarHBondContact O-CA 3.25Å; I207-A217 HydrophobicContact CG1-CB 4.49Å; A217-A270 WeakPolarHBondContact O-CB 3.23Å; A217-A270 PolarHBondContact O-N 2.85Å; A217-G271 PolarHBondContact N-O 3.16Å; A217-G271 PolarHBondContact O-N 3.49Å; A217-L347 HydrophobicContact CB-CD1 3.83Å; A217-L347 HydrophobicContact CB-CD2 3.59Å; A217-L347 HydrophobicContact CB-CG 4.38Å
218	W	87.6	Confident	72.5	Confident	21 Å²	21	61.7 Å²	61.7	8%	0.08	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.7	-179.1	-51.3	85.9	0	0	0	108.6	H190 R205 L206 T208 R216 K268 K269	H190-W218 AromaticContact NE2-CZ2 3.75Å; H190-W218 AromaticContact NE2-NE1 3.86Å; R205-W218 CarbonylContact C-O 3.6Å; R205-W218 VanDerWaalsContact CA-O 3.28Å; R205-W218 WeakPolarHBondContact CA-O 3.48Å; L206-W218 HydrophobicContact CB-CB 4.23Å; L206-W218 PolarHBondContact N-O 2.84Å; L206-W218 PolarHBondContact O-N 3.03Å; T208-W218 PolarHBondContact OG1-NE1 2.92Å; R216-W218 HydrophobicContact CB-CZ2 4.28Å; W218-K268 CarbonylContact C-O 3.59Å; W218-K268 WeakPolarHBondContact CA-O 3.48Å; W218-K269 HydrophobicContact CE3-CB 3.77Å; W218-K269 HydrophobicContact CE3-CG 4.26Å; W218-K269 HydrophobicContact CH2-CB 4.13Å; W218-K269 HydrophobicContact CH2-CD 4.21Å; W218-K269 HydrophobicContact CH2-CG 4.15Å; W218-K269 HydrophobicContact CZ3-CB 3.52Å; W218-K269 HydrophobicContact CZ3-CD 4.44Å; W218-K269 HydrophobicContact CZ3-CG 4.01Å
219	D	84.9	Confident	70.3	Confident	61 Å²	61	67.3 Å²	67.3	33%	0.326	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.6	172	-72.9	-27	0	0	0	108.8	R205 C267 K268 A270	R205-D219 WeakPolarHBondContact CG-OD1 3.49Å; R205-D219 IonicContact CZ-OD1 2.68Å; R205-D219 IonicContact NE-OD1 3.91Å; R205-D219 PolarHBondContact NE-OD1 3.48Å; R205-D219 IonicContact NH2-OD1 3.11Å; D219-C267 WeakPolarHBondContact O-CA 3.47Å; D219-K268 PolarHBondContact N-O 3.2Å; D219-K268 PolarHBondContact O-N 3.02Å; D219-A270 HydrophobicContact CB-CB 4.47Å; D219-A270 WeakPolarHBondContact OD2-CB 3.09Å
220	I	83.8	Confident	67.5	Low	14 Å²	14	76 Å²	76	7%	0.072	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.3	177.6	-60	164.1	0	0	0	107	W175 L199 E203 K204 L206 Y222 L265	W175-I220 HydrophobicContact CH2-CD1 3.73Å; W175-I220 HydrophobicContact CH2-CG1 4.05Å; W175-I220 HydrophobicContact CH2-CG2 4.32Å; W175-I220 HydrophobicContact CZ2-CD1 4.29Å; W175-I220 HydrophobicContact CZ2-CG1 4.36Å; L199-I220 HydrophobicContact CD2-CD1 3.68Å; E203-I220 WeakPolarHBondContact O-CD1 3.35Å; K204-I220 PolarHBondContact O-N 2.94Å; L206-I220 HydrophobicContact CB-CD1 3.95Å; L206-I220 HydrophobicContact CB-CG1 4.4Å; I220-Y222 HydrophobicContact CG2-CD2 4.4Å; I220-Y222 HydrophobicContact CG2-CE2 3.79Å; I220-L265 HydrophobicContact CG2-CD1 3.33Å; I220-L265 HydrophobicContact CG2-CD2 4.26Å; I220-L265 HydrophobicContact CG2-CG 4.19Å
221	A	78	Confident	64.7	Low	49 Å²	49	85 Å²	85	41%	0.405	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	113.7	173.1	0	0	0	0	0	109.4	S266	A221-S266 WeakPolarHBondContact CB-OG 3.49Å; A221-S266 PolarHBondContact N-O 2.92Å; A221-S266 PolarHBondContact O-N 3.26Å; A221-S266 PolarHBondContact O-OG 3.25Å
222	Y	71.6	Confident	62.1	Low	64 Å²	64	88.7 Å²	88.7	25%	0.251	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	126.7	171.4	-59.6	-84.3	0	0	0	108.2	R161 L163 I220 Q224 L265	R161-Y222 VanDerWaalsContact CZ-CD1 3.45Å; L163-Y222 HydrophobicContact CD1-CE1 4.27Å; I220-Y222 HydrophobicContact CG2-CD2 4.4Å; I220-Y222 HydrophobicContact CG2-CE2 3.79Å; Y222-Q224 PolarHBondContact O-N 3.35Å; Y222-L265 HydrophobicContact CD1-CD1 3.31Å; Y222-L265 HydrophobicContact CD2-CD1 4.3Å; Y222-L265 HydrophobicContact CE1-CD1 3.32Å; Y222-L265 HydrophobicContact CE2-CD1 4.29Å; Y222-L265 HydrophobicContact CG-CD1 3.83Å
223	L	68.4	Low	59.6	Low	97 Å²	97	95.7 Å²	95.7	51%	0.508	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-70.6	125.6	166.2	-83.3	96.1	0	0	0	106.5	I264	L223-I264 PolarHBondContact N-O 3.26Å
224	Q	50.1	Low	57	Low	184 Å²	184	100 Å²	100	86%	0.86	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-67.6	134.8	167.9	-82.5	176.7	-43.6	0	0	107.9	Y222 I226	Y222-Q224 PolarHBondContact O-N 3.35Å; Q224-I226 PolarHBondContact O-N 3.4Å
225	E	39.5	Very low	54.1	Low	186 Å²	186	106.6 Å²	106.6	87%	0.869	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-51.8	131.5	162.9	-69.7	173.3	164.3	0	0	108	D227	E225-D227 PolarHBondContact O-N 2.94Å
226	I	35	Very low	51.3	Low	147 Å²	147	116.2 Å²	116.2	75%	0.754	59%	0.59	S	S	*	*			trans	-69.6	102.8	177.7	-62.8	166	0	0	0	106.7	Q224 D228	Q224-I226 PolarHBondContact O-N 3.4Å; I226-D228 PolarHBondContact O-N 3.16Å
227	D	32.4	Very low	48.4	Very low	163 Å²	163	123.7 Å²	123.7	87%	0.872	63%	0.629	S	S	*	*			trans	-78	103	156.8	-83.4	-28.7	0	0	0	107.6	E225	E225-D227 PolarHBondContact O-N 2.94Å
228	D	27.9	Very low	45.4	Very low	140 Å²	140	133.1 Å²	133.1	75%	0.749	67%	0.67	S	S	*	*			trans	-90.1	145.5	155	-92.6	-25.7	0	0	0	107.7	I226	I226-D228 PolarHBondContact O-N 3.16Å
229	P	43.8	Very low	42.4	Very low	118 Å²	118	135.4 Å²	135.4	77%	0.766	70%	0.7	S	S	*	*				-148.2	173.6	54	37.6	-16.1	0	0	0	117.3
230	E	28.2	Very low	39.5	Very low	181 Å²	181	138.3 Å²	138.3	85%	0.846	72%	0.724	S	S	*	*			trans	102.7	101.5	161.8	-64.5	-175.2	156.3	0	0	119.1
231	E	27.5	Very low	37	Very low	190 Å²	190	143.6 Å²	143.6	89%	0.888	76%	0.759	S	S	*	*			trans	93.6	149.1	140	-80.8	-156.5	175.8	0	0	121.5
232	P	30.5	Very low	34.4	Very low	110 Å²	110	145 Å²	145	71%	0.714	78%	0.778	S	S	*	*				-107	164.2	-117.8	39.9	-38	0	0	0	115.7
233	E	31.1	Very low	32.2	Very low	184 Å²	184	154 Å²	154	86%	0.86	81%	0.811	S	S	*	*			trans	-49.5	154.8	174.1	-59.1	-175.3	162.3	0	0	115.1
234	P	28.8	Very low	30.2	Very low	121 Å²	121	157.5 Å²	157.5	79%	0.786	83%	0.825	S	S	*	*			trans	-125.4	114.9	139	32.9	-20.3	0	0	0	113.7
235	K	24.6	Very low	29	Very low	190 Å²	190	156.3 Å²	156.3	83%	0.826	83%	0.825	S	S	*	*				51.5	108.1	127	-65.1	179.7	-179.5	174.5	0	119.7
236	K	28	Very low	28.3	Very low	203 Å²	203	153.8 Å²	153.8	88%	0.883	82%	0.822	S	S	*	*			trans	0.3	129.1	137.4	-69.1	176.3	177.7	170.3	0	117.4
237	I	26.9	Very low	28.4	Very low	173 Å²	173	151.8 Å²	151.8	89%	0.887	82%	0.819	S	S	*	*			trans	-124	120.1	146.9	-63.9	177.5	0	0	0	108.8
238	K	25.8	Very low	28	Very low	200 Å²	200	153.2 Å²	153.2	87%	0.87	82%	0.82	S	S	*	*			trans	-89.7	143.4	168.2	-99	-179	171.2	-178.3	0	109.3
239	G	24.3	Very low	27.9	Very low	69 Å²	69	150.9 Å²	150.9	71%	0.711	82%	0.82	S	S	*	*			trans	177	90.2	158.7	0	0	0	0	0	108.6
240	C	22.7	Very low	27.1	Very low	122 Å²	122	154 Å²	154	82%	0.824	82%	0.824	S	S	*	*				71.8	155.1	85.9	-71.7	0	0	0	0	113.5
241	P	32.2	Very low	27	Very low	124 Å²	124	152.6 Å²	152.6	81%	0.805	82%	0.823	S	S	*	*				-139.2	162.4	-57.4	35.9	-17.9	0	0	0	113.6
242	G	22.8	Very low	26.9	Very low	78 Å²	78	146.6 Å²	146.6	80%	0.804	81%	0.812	S	S	*	*			trans	81.1	111.7	138.1	0	0	0	0	0	120.9
243	R	26.3	Very low	26.8	Very low	253 Å²	253	147.1 Å²	147.1	96%	0.955	82%	0.816	S	S	*	*				-153.7	120.2	122.2	-144.9	171.3	-175.5	170.9	0.3	110.4
244	Q	25.2	Very low	26.7	Very low	172 Å²	172	146.3 Å²	146.3	80%	0.804	82%	0.816	S	S	*	*			trans	-72.1	141.7	168.3	-70.9	165.5	-42.5	0	0	108.9
245	D	24.9	Very low	26.8	Very low	158 Å²	158	150.1 Å²	150.1	85%	0.845	82%	0.824	S	S	*	*				-173.9	130.4	113	-80.8	-23.5	0	0	0	110.1
246	T	25.2	Very low	26.9	Very low	133 Å²	133	145.3 Å²	145.3	82%	0.816	82%	0.819	S	S	*	*			trans	-86.6	-168.2	-175.8	46.9	0	0	0	0	112.2
247	P	37.7	Very low	27.2	Very low	105 Å²	105	143.7 Å²	143.7	68%	0.682	82%	0.82	S	S	*	*				-127.1	174.8	-63.4	36.5	-19.7	0	0	0	111.3
248	E	23.8	Very low	27.5	Very low	194 Å²	194	144.6 Å²	144.6	91%	0.907	82%	0.821	S	S	*	*			trans	172.2	141.9	134.5	-95.4	171.7	-165.4	0	0	113.1
249	A	26.6	Very low	27.8	Very low	91 Å²	91	139.4 Å²	139.4	75%	0.752	82%	0.816	S	S	*	*			trans	87.4	84.6	167.5	0	0	0	0	0	119.5
250	E	25.9	Very low	28.5	Very low	182 Å²	182	142 Å²	142	85%	0.85	82%	0.822	S	S	*	*				30.3	138.7	112.2	-59.4	177.3	174.5	0	0	117.8
251	D	26.4	Very low	29.3	Very low	152 Å²	152	144.5 Å²	144.5	81%	0.813	82%	0.822	S	S	*	*			cis	-165.5	145.8	0.4	-119.7	-22.9	0	0	0	106.6
252	G	24.9	Very low	29.8	Very low	64 Å²	64	144.7 Å²	144.7	66%	0.66	82%	0.816	S	S	*	*			trans	-80.4	-172.9	176.2	0	0	0	0	0	113.5
253	P	29.8	Very low	31.3	Very low	122 Å²	122	150.7 Å²	150.7	79%	0.792	82%	0.815	S	S	*	*				-128.1	116	121.2	19.9	-2.9	0	0	0	111.8
254	L	27.8	Very low	33	Very low	167 Å²	167	142 Å²	142	87%	0.874	79%	0.787	S	S	*	*				37.5	90.2	127.8	-61.2	163.3	0	0	0	116.2	A256	L254-A256 PolarHBondContact O-N 3.4Å
255	E	30.7	Very low	35.2	Very low	200 Å²	200	134 Å²	134	94%	0.935	75%	0.749	S	S	*	*			trans	-70.2	101.5	147.7	-74.4	-175.2	163.8	0	0	106.9
256	A	28	Very low	37.5	Very low	89 Å²	89	127.9 Å²	127.9	74%	0.736	72%	0.719	S	S	*	*			trans	-69.1	140.5	171.1	0	0	0	0	0	109.9	L254 E258	L254-A256 PolarHBondContact O-N 3.4Å; A256-E258 PolarHBondContact O-N 3.01Å
257	D	33.8	Very low	39.9	Very low	169 Å²	169	122.7 Å²	122.7	90%	0.904	69%	0.688	S	S	*	*			trans	-44.2	120	178	-61.8	-57.1	0	0	0	113.6
258	E	33.9	Very low	42	Very low	192 Å²	192	125 Å²	125	90%	0.897	69%	0.687	S	S	*	*			trans	-117.2	124.9	157	-80.5	-174.2	172.2	0	0	109.1	A256	A256-E258 PolarHBondContact O-N 3.01Å
259	A	32.2	Very low	44.7	Very low	92 Å²	92	120.9 Å²	120.9	76%	0.76	67%	0.666	S	S	*	*			trans	-54.8	143.9	-172.1	0	0	0	0	0	113.4	E261	A259-E261 PolarHBondContact O-N 3.43Å
260	S	38.8	Very low	47.1	Very low	122 Å²	122	118.4 Å²	118.4	85%	0.853	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	24.3	-173.5	50.5	0	0	0	0	115.4
261	E	38.8	Very low	49.8	Very low	175 Å²	175	110.7 Å²	110.7	82%	0.818	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-10.4	-172.2	-68.9	-168.9	158.7	0	0	116	A259	A259-E261 PolarHBondContact O-N 3.43Å
262	D	43.4	Very low	52.5	Low	129 Å²	129	105.7 Å²	105.7	69%	0.69	59%	0.592	S	S	*	*			trans	-118.5	24.3	-171.6	-71.6	-28.9	0	0	0	116.9	I264	D262-I264 PolarHBondContact O-N 2.93Å
263	R	53.7	Low	55.4	Low	204 Å²	204	103.2 Å²	103.2	77%	0.77	56%	0.564	S	S	*	*			trans	-92.9	72.6	-178.3	-76.8	-175.6	174.7	171.7	1.8	113.7	L265	R263-L265 PolarHBondContact O-N 3.39Å
264	I	60.8	Low	57.9	Low	71 Å²	71	102.6 Å²	102.6	36%	0.364	55%	0.551	S	S	.	*	S	Bend	trans	-59.3	-29.9	167.1	-57.4	170.9	0	0	0	111.1	F184 L223 D262	F184-I264 HydrophobicContact CE2-CB 4.41Å; L223-I264 PolarHBondContact N-O 3.26Å; D262-I264 PolarHBondContact O-N 2.93Å
265	L	72.3	Confident	60.5	Low	2 Å²	2	95.5 Å²	95.5	1%	0.01	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	131.5	-172.5	-170.4	74.8	0	0	0	112.6	W175 F184 K185 I220 Y222 R263 C267	W175-L265 HydrophobicContact CD2-CD2 3.71Å; W175-L265 HydrophobicContact CE3-CD2 3.43Å; W175-L265 VanDerWaalsContact CE3-CD2 3.43Å; W175-L265 HydrophobicContact CH2-CD2 3.61Å; W175-L265 HydrophobicContact CZ2-CD2 3.87Å; W175-L265 HydrophobicContact CZ3-CD2 3.36Å; F184-L265 HydrophobicContact CE2-CB 3.98Å; F184-L265 HydrophobicContact CZ-CB 4.41Å; K185-L265 PolarHBondContact NZ-O 2.81Å; I220-L265 HydrophobicContact CG2-CD1 3.33Å; I220-L265 HydrophobicContact CG2-CD2 4.26Å; I220-L265 HydrophobicContact CG2-CG 4.19Å; Y222-L265 HydrophobicContact CD1-CD1 3.31Å; Y222-L265 HydrophobicContact CD2-CD1 4.3Å; Y222-L265 HydrophobicContact CE1-CD1 3.32Å; Y222-L265 HydrophobicContact CE2-CD1 4.29Å; Y222-L265 HydrophobicContact CG-CD1 3.83Å; R263-L265 PolarHBondContact O-N 3.39Å; L265-C267 WeakPolarHBondContact CD2-SG 3.43Å
266	S	73.1	Confident	62.7	Low	31 Å²	31	92 Å²	92	22%	0.217	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	134.8	164.2	74.8	0	0	0	0	110.5	A221	A221-S266 WeakPolarHBondContact CB-OG 3.49Å; A221-S266 PolarHBondContact N-O 2.92Å; A221-S266 PolarHBondContact O-N 3.26Å; A221-S266 PolarHBondContact O-OG 3.25Å
267	C	76.3	Confident	64.8	Low	24 Å²	24	88.4 Å²	88.4	16%	0.162	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	113.3	179.9	-67	0	0	0	0	105.6	K185 M187 D219 L265	K185-C267 PolarHBondContact NZ-SG 3.12Å; K185-C267 VanDerWaalsContact NZ-SG 3.36Å; M187-C267 HydrophobicContact SD-CB 3.6Å; M187-C267 VanDerWaalsContact SD-CB 3.6Å; D219-C267 WeakPolarHBondContact O-CA 3.47Å; L265-C267 WeakPolarHBondContact CD2-SG 3.43Å
268	K	80.4	Confident	66.8	Low	154 Å²	154	91 Å²	91	67%	0.67	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.2	-179.6	-68.9	-176.8	-179.5	178.1	0	109.3	W218 D219 A270	W218-K268 CarbonylContact C-O 3.59Å; W218-K268 WeakPolarHBondContact CA-O 3.48Å; D219-K268 PolarHBondContact N-O 3.2Å; D219-K268 PolarHBondContact O-N 3.02Å; K268-A270 PolarHBondContact O-N 2.67Å; K268-A270 VanDerWaalsContact O-N 3.15Å
269	K	80.9	Confident	69.1	Low	107 Å²	107	84.6 Å²	84.6	47%	0.465	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	112.6	175.7	-168.8	179.2	176.2	-175.8	0	108.8	W218	W218-K269 HydrophobicContact CE3-CB 3.77Å; W218-K269 HydrophobicContact CE3-CG 4.26Å; W218-K269 HydrophobicContact CH2-CB 4.13Å; W218-K269 HydrophobicContact CH2-CD 4.21Å; W218-K269 HydrophobicContact CH2-CG 4.15Å; W218-K269 HydrophobicContact CZ3-CB 3.52Å; W218-K269 HydrophobicContact CZ3-CD 4.44Å; W218-K269 HydrophobicContact CZ3-CG 4.01Å
270	A	78.3	Confident	71.6	Confident	39 Å²	39	86 Å²	86	32%	0.322	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-31.3	177.3	0	0	0	0	0	111.2	A217 D219 K268 L347	A217-A270 WeakPolarHBondContact O-CB 3.23Å; A217-A270 PolarHBondContact O-N 2.85Å; D219-A270 HydrophobicContact CB-CB 4.47Å; D219-A270 WeakPolarHBondContact OD2-CB 3.09Å; K268-A270 PolarHBondContact O-N 2.67Å; K268-A270 VanDerWaalsContact O-N 3.15Å; A270-L347 HydrophobicContact CB-CD1 3.84Å; A270-L347 WeakPolarHBondContact O-CD1 3.48Å
271	G	82.2	Confident	73.8	Confident	20 Å²	20	80.2 Å²	80.2	21%	0.206	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.2	-167.1	175.4	0	0	0	0	0	113.7	A217	A217-G271 PolarHBondContact N-O 3.16Å; A217-G271 PolarHBondContact O-N 3.49Å
272	S	83.5	Confident	75.9	Confident	46 Å²	46	73.7 Å²	73.7	32%	0.322	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	147.2	-178.2	52.8	0	0	0	0	113	L215	L215-S272 CarbonylContact O-C 3.58Å; L215-S272 VanDerWaalsContact O-CA 3.29Å; L215-S272 WeakPolarHBondContact O-CA 3.4Å
273	I	84.7	Confident	77.8	Confident	13 Å²	13	69.2 Å²	69.2	7%	0.067	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.1	175.9	-60	169.1	0	0	0	107.6	L215 F305 I351	L215-I273 HydrophobicContact CB-CB 4.27Å; L215-I273 PolarHBondContact N-O 2.82Å; L215-I273 PolarHBondContact O-N 3.45Å; I273-F305 HydrophobicContact CG2-CE1 4.11Å; I273-I351 HydrophobicContact CD1-CB 3.83Å; I273-I351 HydrophobicContact CD1-CD1 3.8Å; I273-I351 HydrophobicContact CD1-CG1 4.35Å; I273-I351 HydrophobicContact CD1-CG2 3.83Å
274	M	82.8	Confident	79.3	Confident	109 Å²	109	59.5 Å²	59.5	54%	0.537	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	127.9	178.1	-62.1	-59.3	-66	0	0	110.5	E214	E214-M274 HydrophobicContact CG-CE 4.32Å; E214-M274 HydrophobicContact CG-SD 3.51Å; E214-M274 VanDerWaalsContact CG-SD 3.51Å
275	R	81.6	Confident	80.3	Confident	18 Å²	18	57.4 Å²	57.4	7%	0.068	29%	0.285	C	S	.	.			trans	-80.4	157.8	170.1	-62.8	175	61.6	-142.8	-4.9	110.8	S213 L215 D279 H296 E303	S213-R275 WeakPolarHBondContact O-CB 3.19Å; S213-R275 WeakPolarHBondContact O-CG 3.39Å; S213-R275 PolarHBondContact O-N 3.49Å; L215-R275 HydrophobicContact CD1-CG 4.11Å; L215-R275 HydrophobicContact CG-CG 3.9Å; R275-D279 PolarHBondContact NH1-O 3.16Å; R275-H296 VanDerWaalsContact NH2-C 3.33Å; R275-E303 WeakPolarHBondContact CB-OE2 3.37Å; R275-E303 WeakPolarHBondContact CG-OE2 3.42Å; R275-E303 IonicContact NE-OE2 3.83Å; R275-E303 PolarHBondContact NE-OE2 2.95Å
276	E	77.4	Confident	80.8	Confident	125 Å²	125	58.9 Å²	58.9	58%	0.584	29%	0.294	S	S	*	.	S	Bend	trans	-80.7	-37.2	173.1	-171	177.8	178.8	0	0	110.5	E303 R353 N356	E276-E303 WeakPolarHBondContact CB-OE1 3.11Å; E276-E303 PolarHBondContact N-OE1 3.36Å; E276-R353 IonicContact OE2-CZ 3.87Å; E276-R353 IonicContact OE2-NH1 3.48Å; E276-R353 PolarHBondContact OE2-NH1 3.46Å; E276-R353 IonicContact OE2-NH2 3.68Å; E276-R353 PolarHBondContact OE2-NH2 3.37Å; E276-N356 PolarHBondContact OE2-ND2 3.09Å
277	G	72.8	Confident	81.1	Confident	15 Å²	15	57.9 Å²	57.9	16%	0.155	29%	0.286	C	S	.	.			trans	-66.7	128.3	168.3	0	0	0	0	0	111.5	D279 E303	G277-D279 VanDerWaalsContact C-N 3.3Å; G277-E303 PolarHBondContact N-OE1 3.36Å; G277-E303 VanDerWaalsContact N-OE1 3.15Å
278	R	75.8	Confident	80.8	Confident	222 Å²	222	63.1 Å²	63.1	84%	0.838	31%	0.306	S	S	*	.			trans	-85.4	-6.7	175.5	-66.6	-175	179.6	-175.4	-0.8	113.6
279	D	80.4	Confident	80.2	Confident	59 Å²	59	59.6 Å²	59.6	32%	0.316	30%	0.298	S	S	.	.	S	Bend	trans	-82.1	157.9	-177.7	-77.8	0.7	0	0	0	112.6	R275 G277 T298	R275-D279 PolarHBondContact NH1-O 3.16Å; G277-D279 VanDerWaalsContact C-N 3.3Å; D279-T298 VanDerWaalsContact CB-OG1 3.23Å; D279-T298 WeakPolarHBondContact CB-OG1 3.44Å; D279-T298 PolarHBondContact OD2-OG1 2.96Å
280	R	85.3	Confident	79.7	Confident	122 Å²	122	55.2 Å²	55.2	46%	0.46	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-50.1	140.2	175.9	66.7	177.6	176.1	-168.8	-3.2	112.2	A211 V282 G297 T298	A211-R280 HydrophobicContact CB-CB 4.16Å; A211-R280 WeakPolarHBondContact O-CA 3.46Å; R280-V282 HydrophobicContact CG-CG2 4.38Å; R280-V282 PolarHBondContact O-N 3.31Å; R280-G297 VanDerWaalsContact O-CA 3.22Å; R280-G297 WeakPolarHBondContact O-CA 3.47Å; R280-T298 HydrophobicContact CG-CG2 4.15Å
281	V	84.9	Confident	79.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-66.3	131.1	168.7	-177.9	0	0	0	0	107.9	W195 A210 L215	W195-V281 WeakPolarHBondContact CB-O 3.39Å; A210-V281 WeakPolarHBondContact O-CG2 3.26Å; A210-V281 PolarHBondContact O-N 3.12Å; L215-V281 HydrophobicContact CD2-CG2 3.9Å
282	V	83.3	Confident	79.7	Confident	37 Å²	37	59.7 Å²	59.7	22%	0.224	29%	0.285	C	S	.	.			trans	-102.6	-40.3	177	175.9	0	0	0	0	110.9	R280 H296 T298	R280-V282 HydrophobicContact CG-CG2 4.38Å; R280-V282 PolarHBondContact O-N 3.31Å; V282-H296 WeakPolarHBondContact CB-CE1 3.43Å; V282-H296 PolarHBondContact N-O 3.01Å; V282-H296 VanDerWaalsContact N-O 3.1Å; V282-T298 HydrophobicContact CG2-CG2 3.8Å
283	N	82.4	Confident	79.8	Confident	36 Å²	36	57.6 Å²	57.6	19%	0.193	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	147.9	178.1	-158.6	0	0	0	0	110	H296 F366	N283-H296 WeakPolarHBondContact CB-CE1 3.33Å; N283-H296 PolarHBondContact N-CE1 3.48Å; N283-H296 PolarHBondContact N-ND1 3.23Å; N283-H296 VanDerWaalsContact N-ND1 3.14Å; N283-H296 PolarHBondContact O-N 3.31Å; N283-H296 PolarHBondContact O-ND1 3.01Å; N283-F366 HydrophobicContact CB-CE1 4.2Å
284	L	85.6	Confident	80	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	122.8	-180	-161.3	136.7	0	0	0	106.6	V198 I207 L215 L293 C295	V198-L284 HydrophobicContact CB-CD2 3.38Å; V198-L284 HydrophobicContact CG2-CB 4.18Å; V198-L284 HydrophobicContact CG2-CD2 3.21Å; V198-L284 HydrophobicContact CG2-CG 4.23Å; V198-L284 WeakPolarHBondContact CG2-O 3.4Å; I207-L284 HydrophobicContact CB-CD2 4.45Å; I207-L284 HydrophobicContact CG2-CD1 4.16Å; I207-L284 HydrophobicContact CG2-CD2 4.3Å; L215-L284 HydrophobicContact CD1-CD1 4.5Å; L215-L284 HydrophobicContact CD2-CD1 3.62Å; L284-L293 HydrophobicContact CD1-CD1 4.44Å; L284-L293 HydrophobicContact CD2-CD1 3.35Å; L284-L293 HydrophobicContact CG-CD1 3.8Å; L284-C295 HydrophobicContact CD1-CB 4.14Å; L284-C295 HydrophobicContact CG-CB 4.36Å
285	T	83.4	Confident	80.2	Confident	26 Å²	26	51.8 Å²	51.8	16%	0.16	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	152.1	-177.3	64.2	0	0	0	0	110.5	A294 F366	T285-A294 PolarHBondContact N-O 2.79Å; T285-A294 PolarHBondContact O-N 3.24Å; T285-F366 HydrophobicContact CG2-CE2 4.5Å; T285-F366 HydrophobicContact CG2-CZ 4.32Å; T285-F366 WeakPolarHBondContact OG1-CE2 3.32Å; T285-F366 VanDerWaalsContact OG1-CZ 3.31Å; T285-F366 WeakPolarHBondContact OG1-CZ 3.42Å
286	V	82.6	Confident	80.5	Confident	34 Å²	34	50.9 Å²	50.9	21%	0.206	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.9	178	170	0	0	0	0	108.7	V198 V200 G290 I292 L293	V198-V286 HydrophobicContact CB-CG2 3.98Å; V198-V286 HydrophobicContact CG1-CB 3.49Å; V198-V286 VanDerWaalsContact CG1-CB 3.49Å; V198-V286 HydrophobicContact CG1-CG2 3.19Å; V198-V286 HydrophobicContact CG2-CG2 4.49Å; V200-V286 HydrophobicContact CG2-CG2 3.74Å; V286-G290 VanDerWaalsContact CG1-CA 3.49Å; V286-I292 VanDerWaalsContact CA-O 3.3Å; V286-I292 WeakPolarHBondContact CA-O 3.39Å; V286-L293 HydrophobicContact CG2-CB 4.09Å; V286-L293 HydrophobicContact CG2-CD1 3.55Å; V286-L293 HydrophobicContact CG2-CG 4.47Å
287	D	78.9	Confident	80.8	Confident	9 Å²	9	45 Å²	45	5%	0.048	21%	0.211	C	C	.	.			trans	-64.5	158.6	175	178.4	49.2	0	0	0	111.7	T289 G290 I292 H370	D287-T289 PolarHBondContact O-N 2.86Å; D287-T289 PolarHBondContact OD2-N 2.82Å; D287-T289 PolarHBondContact OD2-OG1 3.22Å; D287-G290 PolarHBondContact O-N 2.9Å; D287-I292 HydrophobicContact CB-CB 4.26Å; D287-I292 PolarHBondContact N-O 2.92Å; D287-H370 WeakPolarHBondContact OD1-CB 3.49Å; D287-H370 PolarHBondContact OD1-N 3.01Å; D287-H370 WeakPolarHBondContact OD2-CB 3.36Å; D287-H370 IonicContact OD2-CG 3.12Å
288	K	69.1	Low	81.4	Confident	135 Å²	135	45.9 Å²	45.9	59%	0.587	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-29.3	-179.3	-65.7	-168.6	177.2	-165.9	0	113.3	R159 G290	R159-K288 PolarHBondContact NH2-O 3.49Å; K288-G290 VanDerWaalsContact C-N 3.32Å
289	T	69.1	Low	81.9	Confident	80 Å²	80	38.3 Å²	38.3	49%	0.491	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-8.9	178.8	63.6	0	0	0	0	114.3	D287 R291	D287-T289 PolarHBondContact O-N 2.86Å; D287-T289 PolarHBondContact OD2-N 2.82Å; D287-T289 PolarHBondContact OD2-OG1 3.22Å; T289-R291 PolarHBondContact O-N 2.87Å
290	G	70.1	Confident	82.2	Confident	14 Å²	14	37 Å²	37	14%	0.144	19%	0.185	C	C	.	.	S	Bend	trans	74.8	2	179.3	0	0	0	0	0	115	V286 D287 K288	V286-G290 VanDerWaalsContact CG1-CA 3.49Å; D287-G290 PolarHBondContact O-N 2.9Å; K288-G290 VanDerWaalsContact C-N 3.32Å
291	R	77.4	Confident	82.4	Confident	145 Å²	145	33 Å²	33	55%	0.547	17%	0.174	S	C	.	.			trans	-93	-34.3	-173	-67.8	-170.7	-177.9	-167.3	1.9	114.3	T289 C306 V307	T289-R291 PolarHBondContact O-N 2.87Å; R291-C306 WeakPolarHBondContact O-CA 3.26Å; R291-V307 WeakPolarHBondContact O-CB 3.46Å; R291-V307 PolarHBondContact O-N 3.27Å
292	I	83.1	Confident	82.6	Confident	9 Å²	9	33 Å²	33	5%	0.046	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123.4	-176.1	-59.8	162.9	0	0	0	107.6	V286 D287 V304 F305 L376 T394	V286-I292 VanDerWaalsContact CA-O 3.3Å; V286-I292 WeakPolarHBondContact CA-O 3.39Å; D287-I292 HydrophobicContact CB-CB 4.26Å; D287-I292 PolarHBondContact N-O 2.92Å; I292-V304 HydrophobicContact CG2-CG1 3.56Å; I292-F305 WeakPolarHBondContact CA-O 3.37Å; I292-L376 HydrophobicContact CD1-CD1 4.02Å; I292-L376 HydrophobicContact CD1-CD2 4.34Å; I292-L376 HydrophobicContact CG2-CD2 3.98Å; I292-T394 HydrophobicContact CD1-CG2 3.78Å
293	L	85.8	Confident	82.8	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.9	174.7	167	71.9	0	0	0	107.7	I207 L284 V286 F305	I207-L293 HydrophobicContact CD1-CD2 3.52Å; I207-L293 HydrophobicContact CG2-CD2 4.44Å; L284-L293 HydrophobicContact CD1-CD1 4.44Å; L284-L293 HydrophobicContact CD2-CD1 3.35Å; L284-L293 HydrophobicContact CG-CD1 3.8Å; V286-L293 HydrophobicContact CG2-CB 4.09Å; V286-L293 HydrophobicContact CG2-CD1 3.55Å; V286-L293 HydrophobicContact CG2-CG 4.47Å; L293-F305 HydrophobicContact CB-CB 4.11Å; L293-F305 HydrophobicContact CD2-CB 4.11Å; L293-F305 HydrophobicContact CD2-CD2 4.15Å; L293-F305 HydrophobicContact CD2-CG 4.35Å; L293-F305 HydrophobicContact CG-CB 4.34Å; L293-F305 HydrophobicContact CG-CD2 4.34Å; L293-F305 PolarHBondContact N-O 3.13Å; L293-F305 WeakPolarHBondContact O-CA 3.25Å; L293-F305 PolarHBondContact O-N 3.03Å
294	A	87.6	Confident	83	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.8	168.4	0	0	0	0	0	111.1	T285 L302 E303 V304 F366 L368	T285-A294 PolarHBondContact N-O 2.79Å; T285-A294 PolarHBondContact O-N 3.24Å; A294-L302 HydrophobicContact CB-CD1 4.13Å; A294-L302 HydrophobicContact CB-CD2 4.21Å; A294-L302 HydrophobicContact CB-CG 4.33Å; A294-E303 VanDerWaalsContact CA-O 3.32Å; A294-E303 WeakPolarHBondContact CA-O 3.4Å; A294-V304 HydrophobicContact CB-CG2 4.31Å; A294-F366 HydrophobicContact CB-CE2 3.69Å; A294-F366 HydrophobicContact CB-CZ 3.95Å; A294-L368 HydrophobicContact CB-CD1 3.5Å; A294-L368 VanDerWaalsContact CB-CD1 3.5Å
295	C	86.9	Confident	83.1	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.1	174.2	75.8	0	0	0	0	110.5	L284 L302 E303	L284-C295 HydrophobicContact CD1-CB 4.14Å; L284-C295 HydrophobicContact CG-CB 4.36Å; C295-L302 WeakPolarHBondContact O-CD1 3.43Å; C295-E303 PolarHBondContact N-O 3.48Å; C295-E303 PolarHBondContact O-N 3.25Å
296	H	87.9	Confident	83.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	157.6	168.9	68.8	1.5	0	0	0	111.2	R275 V282 N283 L302 I363 K364 F366	R275-H296 VanDerWaalsContact NH2-C 3.33Å; V282-H296 WeakPolarHBondContact CB-CE1 3.43Å; V282-H296 PolarHBondContact N-O 3.01Å; V282-H296 VanDerWaalsContact N-O 3.1Å; N283-H296 WeakPolarHBondContact CB-CE1 3.33Å; N283-H296 PolarHBondContact N-CE1 3.48Å; N283-H296 PolarHBondContact N-ND1 3.23Å; N283-H296 VanDerWaalsContact N-ND1 3.14Å; N283-H296 PolarHBondContact O-N 3.31Å; N283-H296 PolarHBondContact O-ND1 3.01Å; H296-L302 HydrophobicContact CB-CD1 3.89Å; H296-I363 VanDerWaalsContact CD2-CG2 3.46Å; H296-I363 WeakPolarHBondContact CD2-CG2 3.29Å; H296-K364 PolarHBondContact NE2-O 2.72Å; H296-K364 VanDerWaalsContact NE2-O 3.11Å; H296-F366 HydrophobicContact CB-CD1 4.33Å; H296-F366 HydrophobicContact CB-CE1 4.13Å; H296-F366 AromaticContact CD2-CD1 3.39Å; H296-F366 WeakPolarHBondContact CD2-CD1 3.27Å; H296-F366 AromaticContact CD2-CE1 3.83Å; H296-F366 AromaticContact CG-CD1 3.67Å; H296-F366 AromaticContact CG-CE1 3.61Å; H296-F366 AromaticContact ND1-CE1 3.8Å; H296-F366 AromaticContact NE2-CD1 3.72Å
297	G	85.1	Confident	83	Confident	2 Å²	2	29 Å²	29	2%	0.021	15%	0.151	C	C	.	.			trans	-103.3	-156.8	167.6	0	0	0	0	0	111	R280 D299	R280-G297 VanDerWaalsContact O-CA 3.22Å; R280-G297 WeakPolarHBondContact O-CA 3.47Å; G297-D299 PolarHBondContact O-N 3.21Å
298	T	84.4	Confident	83	Confident	32 Å²	32	29.6 Å²	29.6	20%	0.196	15%	0.154	C	C	.	.	S	Bend	trans	-76.8	-5	170.3	37	0	0	0	0	114.3	D279 R280 V282	D279-T298 VanDerWaalsContact CB-OG1 3.23Å; D279-T298 WeakPolarHBondContact CB-OG1 3.44Å; D279-T298 PolarHBondContact OD2-OG1 2.96Å; R280-T298 HydrophobicContact CG-CG2 4.15Å; V282-T298 HydrophobicContact CG2-CG2 3.8Å
299	D	87	Confident	83.3	Confident	64 Å²	64	25 Å²	25	34%	0.342	14%	0.139	S	C	.	.	S	Bend	trans	-81.4	-179.2	179.5	-78.9	-30	0	0	0	113.7	G297 V301 I363	G297-D299 PolarHBondContact O-N 3.21Å; D299-V301 VanDerWaalsContact C-N 3.29Å; D299-I363 PolarHBondContact O-N 2.83Å
300	S	87.4	Confident	83.5	Confident	30 Å²	30	28.7 Å²	28.7	21%	0.21	15%	0.148	C	C	.	.	S	Bend	trans	-85.5	5.4	176.7	56.1	0	0	0	0	114	T359 S361	S300-T359 PolarHBondContact O-N 3.29Å; S300-T359 PolarHBondContact O-OG1 3.48Å; S300-S361 VanDerWaalsContact CB-O 3.25Å; S300-S361 WeakPolarHBondContact CB-O 3.39Å
301	V	89.1	Confident	83.7	Confident	40 Å²	40	30.7 Å²	30.7	24%	0.242	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.7	-173.4	-176.3	0	0	0	0	110.5	D299 N356 I357 K358	D299-V301 VanDerWaalsContact C-N 3.29Å; V301-N356 HydrophobicContact CG1-CB 3.95Å; V301-I357 WeakPolarHBondContact CA-O 3.34Å; V301-K358 HydrophobicContact CG2-CG 4.49Å
302	L	88.4	Confident	83.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128.8	164.8	-177.1	79.2	0	0	0	109.1	A294 C295 H296 V304 N356 I357 I363 F366 F380	A294-L302 HydrophobicContact CB-CD1 4.13Å; A294-L302 HydrophobicContact CB-CD2 4.21Å; A294-L302 HydrophobicContact CB-CG 4.33Å; C295-L302 WeakPolarHBondContact O-CD1 3.43Å; H296-L302 HydrophobicContact CB-CD1 3.89Å; L302-V304 HydrophobicContact CD2-CG2 3.9Å; L302-V304 HydrophobicContact CG-CG2 4.32Å; L302-N356 CarbonylContact O-C 3.35Å; L302-N356 WeakPolarHBondContact O-CA 3.45Å; L302-I357 HydrophobicContact CB-CB 4.19Å; L302-I357 HydrophobicContact CD2-CD1 4.2Å; L302-I357 PolarHBondContact N-O 2.72Å; L302-I357 PolarHBondContact O-N 2.52Å; L302-I363 HydrophobicContact CB-CD1 4.2Å; L302-F366 HydrophobicContact CD1-CD1 3.75Å; L302-F366 HydrophobicContact CD1-CD2 3.82Å; L302-F366 HydrophobicContact CD1-CE1 3.57Å; L302-F366 HydrophobicContact CD1-CE2 3.65Å; L302-F366 HydrophobicContact CD1-CG 3.88Å; L302-F366 HydrophobicContact CD1-CZ 3.53Å; L302-F366 HydrophobicContact CD2-CD2 4.29Å; L302-F366 HydrophobicContact CD2-CE2 4.42Å; L302-F380 HydrophobicContact CB-CE1 3.79Å; L302-F380 HydrophobicContact CB-CZ 4.02Å; L302-F380 HydrophobicContact CD1-CE1 4.23Å; L302-F380 HydrophobicContact CD2-CE1 3.64Å; L302-F380 HydrophobicContact CD2-CZ 3.53Å; L302-F380 HydrophobicContact CG-CE1 4.07Å; L302-F380 HydrophobicContact CG-CZ 4.3Å
303	E	87	Confident	83.3	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.019	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	122	174.9	-56.1	179.5	163.4	0	0	109	R275 E276 G277 A294 C295 F305 R353	R275-E303 WeakPolarHBondContact CB-OE2 3.37Å; R275-E303 WeakPolarHBondContact CG-OE2 3.42Å; R275-E303 IonicContact NE-OE2 3.83Å; R275-E303 PolarHBondContact NE-OE2 2.95Å; E276-E303 WeakPolarHBondContact CB-OE1 3.11Å; E276-E303 PolarHBondContact N-OE1 3.36Å; G277-E303 PolarHBondContact N-OE1 3.36Å; G277-E303 VanDerWaalsContact N-OE1 3.15Å; A294-E303 VanDerWaalsContact CA-O 3.32Å; A294-E303 WeakPolarHBondContact CA-O 3.4Å; C295-E303 PolarHBondContact N-O 3.48Å; C295-E303 PolarHBondContact O-N 3.25Å; E303-F305 HydrophobicContact CB-CE2 3.76Å; E303-F305 HydrophobicContact CB-CZ 4.13Å; E303-R353 IonicContact OE1-NH2 3.3Å; E303-R353 PolarHBondContact OE1-NH2 2.94Å
304	V	88.1	Confident	82.8	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	125.1	177.7	-175.3	0	0	0	0	109.5	I292 A294 L302 V354 A355 I357 L376	I292-V304 HydrophobicContact CG2-CG1 3.56Å; A294-V304 HydrophobicContact CB-CG2 4.31Å; L302-V304 HydrophobicContact CD2-CG2 3.9Å; L302-V304 HydrophobicContact CG-CG2 4.32Å; V304-V354 HydrophobicContact CG1-CB 4.41Å; V304-V354 PolarHBondContact O-N 2.96Å; V304-A355 PolarHBondContact N-O 3.28Å; V304-A355 VanDerWaalsContact N-O 3.09Å; V304-I357 HydrophobicContact CG2-CD1 4.38Å; V304-I357 HydrophobicContact CG2-CG1 4.47Å; V304-L376 HydrophobicContact CG1-CD2 4.28Å
305	F	86.7	Confident	82.5	Confident	8 Å²	8	41 Å²	41	4%	0.035	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	147.3	175.6	-57.7	-88.3	0	0	0	110.1	L215 I273 I292 L293 E303 I351 H352 R353	L215-F305 HydrophobicContact CD1-CE2 4.07Å; L215-F305 HydrophobicContact CD1-CZ 4.37Å; I273-F305 HydrophobicContact CG2-CE1 4.11Å; I292-F305 WeakPolarHBondContact CA-O 3.37Å; L293-F305 HydrophobicContact CB-CB 4.11Å; L293-F305 HydrophobicContact CD2-CB 4.11Å; L293-F305 HydrophobicContact CD2-CD2 4.15Å; L293-F305 HydrophobicContact CD2-CG 4.35Å; L293-F305 HydrophobicContact CG-CB 4.34Å; L293-F305 HydrophobicContact CG-CD2 4.34Å; L293-F305 PolarHBondContact N-O 3.13Å; L293-F305 WeakPolarHBondContact O-CA 3.25Å; L293-F305 PolarHBondContact O-N 3.03Å; E303-F305 HydrophobicContact CB-CE2 3.76Å; E303-F305 HydrophobicContact CB-CZ 4.13Å; F305-I351 HydrophobicContact CB-CG2 3.77Å; F305-I351 HydrophobicContact CD1-CG2 4.15Å; F305-I351 HydrophobicContact CG-CG2 4.24Å; F305-H352 CarbonylContact C-O 3.44Å; F305-H352 VanDerWaalsContact CA-O 3.3Å; F305-H352 WeakPolarHBondContact CA-O 3.49Å; F305-R353 HydrophobicContact CD1-CB 4.14Å; F305-R353 HydrophobicContact CD1-CG 4.31Å; F305-R353 HydrophobicContact CE1-CB 4.15Å; F305-R353 HydrophobicContact CE1-CG 4.09Å
306	C	82.8	Confident	82	Confident	29 Å²	29	44.8 Å²	44.8	20%	0.196	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.8	174.7	170.3	0	0	0	0	109.2	R291 H352 V354	R291-C306 WeakPolarHBondContact O-CA 3.26Å; C306-H352 VanDerWaalsContact CB-NE2 3.33Å; C306-H352 WeakPolarHBondContact CB-NE2 3.1Å; C306-H352 PolarHBondContact N-O 3.26Å; C306-H352 PolarHBondContact O-CD2 3.03Å; C306-H352 PolarHBondContact O-N 3.31Å; C306-H352 PolarHBondContact SG-NE2 2.98Å; C306-H352 VanDerWaalsContact SG-NE2 3.41Å; C306-V354 HydrophobicContact CB-CG2 3.23Å
307	V	82.1	Confident	81.2	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.042	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	117.8	179.4	-178.6	0	0	0	0	106.5	V200 S201 R291 I351	V200-V307 HydrophobicContact CG1-CB 4.12Å; V200-V307 HydrophobicContact CG1-CG1 3.86Å; V200-V307 HydrophobicContact CG1-CG2 3.41Å; V200-V307 VanDerWaalsContact CG1-CG2 3.41Å; S201-V307 WeakPolarHBondContact OG-CG1 3.49Å; R291-V307 WeakPolarHBondContact O-CB 3.46Å; R291-V307 PolarHBondContact O-N 3.27Å; V307-I351 HydrophobicContact CG2-CG1 4.17Å
308	L	78.6	Confident	80.9	Confident	21 Å²	21	49.7 Å²	49.7	11%	0.11	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-77.2	147.8	-175.7	-67.5	167	0	0	0	111.3	E312 I313 K316 E350	L308-E312 HydrophobicContact CB-CB 4.19Å; L308-E312 HydrophobicContact CD2-CB 4.32Å; L308-I313 HydrophobicContact CB-CG1 3.95Å; L308-K316 HydrophobicContact CD1-CD 3.96Å; L308-E350 PolarHBondContact N-O 3.11Å
309	S	75.5	Confident	80.7	Confident	37 Å²	37	55.1 Å²	55.1	26%	0.259	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-68.4	153.8	172.9	63.4	0	0	0	0	111.2	A311 E312 I313	S309-A311 PolarHBondContact O-N 3.37Å; S309-A311 VanDerWaalsContact O-N 3.09Å; S309-E312 PolarHBondContact N-OE2 3.45Å; S309-E312 PolarHBondContact O-N 3.22Å; S309-E312 VanDerWaalsContact OG-CG 3.31Å; S309-E312 WeakPolarHBondContact OG-CG 3.34Å; S309-E312 PolarHBondContact OG-OE2 3.31Å; S309-I313 WeakPolarHBondContact O-CG1 3.32Å; S309-I313 PolarHBondContact O-N 2.73Å
310	K	72.6	Confident	80.4	Confident	159 Å²	159	55.8 Å²	55.8	69%	0.691	28%	0.278	S	S	*	.	H	α-helix	trans	-50.8	-37.7	177.1	-67.2	-177	177.1	-177.8	0	113.2	I313 Q314	K310-I313 PolarHBondContact O-N 3.42Å; K310-Q314 WeakPolarHBondContact O-CB 3.48Å; K310-Q314 PolarHBondContact O-N 3.5Å
311	A	74.3	Confident	79.9	Confident	56 Å²	56	56.8 Å²	56.8	46%	0.463	28%	0.281	S	S	.	.	H	α-helix	trans	-68.3	-35.7	177.8	0	0	0	0	0	113.2	S309 K315	S309-A311 PolarHBondContact O-N 3.37Å; S309-A311 VanDerWaalsContact O-N 3.09Å; A311-K315 WeakPolarHBondContact O-CG 3.49Å; A311-K315 PolarHBondContact O-N 3.3Å; A311-K315 VanDerWaalsContact O-N 3.1Å
312	E	76.5	Confident	79.4	Confident	82 Å²	82	61.7 Å²	61.7	38%	0.383	30%	0.299	S	S	.	.	H	α-helix	trans	-74.7	-38	175.9	-71.3	162.7	157	0	0	111.7	L308 S309 Q314 K315 K316	L308-E312 HydrophobicContact CB-CB 4.19Å; L308-E312 HydrophobicContact CD2-CB 4.32Å; S309-E312 PolarHBondContact N-OE2 3.45Å; S309-E312 PolarHBondContact O-N 3.22Å; S309-E312 VanDerWaalsContact OG-CG 3.31Å; S309-E312 WeakPolarHBondContact OG-CG 3.34Å; S309-E312 PolarHBondContact OG-OE2 3.31Å; E312-Q314 VanDerWaalsContact C-N 3.34Å; E312-K315 PolarHBondContact O-N 3.22Å; E312-K316 PolarHBondContact O-N 3.47Å
313	I	74.7	Confident	79	Confident	18 Å²	18	68.9 Å²	68.9	9%	0.092	33%	0.33	C	S	.	.	H	α-helix	trans	-57.6	-50.3	171.7	-62.9	168.4	0	0	0	109.1	L308 S309 K310 K315 K316 M317 M345 E350	L308-I313 HydrophobicContact CB-CG1 3.95Å; S309-I313 WeakPolarHBondContact O-CG1 3.32Å; S309-I313 PolarHBondContact O-N 2.73Å; K310-I313 PolarHBondContact O-N 3.42Å; I313-K315 PolarHBondContact O-N 3.47Å; I313-K316 CarbonylContact O-C 3.6Å; I313-K316 WeakPolarHBondContact O-CB 3.41Å; I313-K316 PolarHBondContact O-N 3.28Å; I313-K316 VanDerWaalsContact O-N 3.07Å; I313-M317 HydrophobicContact CG2-CG 4.28Å; I313-M317 WeakPolarHBondContact O-CG 3.29Å; I313-M317 PolarHBondContact O-N 3.36Å; I313-M345 HydrophobicContact CG2-CE 3.85Å; I313-E350 HydrophobicContact CD1-CB 4.38Å; I313-E350 HydrophobicContact CD1-CG 3.7Å; I313-E350 HydrophobicContact CG1-CG 4.45Å
314	Q	76.9	Confident	78.4	Confident	131 Å²	131	70 Å²	70	61%	0.612	34%	0.34	S	S	*	.	H	α-helix	trans	-62.2	-41.7	179.9	-161.1	169	11.2	0	0	112.2	K310 E312 K316 M317 D318	K310-Q314 WeakPolarHBondContact O-CB 3.48Å; K310-Q314 PolarHBondContact O-N 3.5Å; E312-Q314 VanDerWaalsContact C-N 3.34Å; Q314-K316 VanDerWaalsContact C-N 3.32Å; Q314-K316 PolarHBondContact O-N 2.93Å; Q314-M317 PolarHBondContact O-N 2.91Å; Q314-D318 VanDerWaalsContact O-CG 3.29Å; Q314-D318 PolarHBondContact O-N 3.22Å
315	K	79.9	Confident	77.8	Confident	141 Å²	141	77.8 Å²	77.8	61%	0.613	37%	0.37	S	S	*	.	H	α-helix	trans	-60.6	-37.8	172.6	-75.8	173.4	-176.9	174.8	0	112.9	A311 E312 I313 K319	A311-K315 WeakPolarHBondContact O-CG 3.49Å; A311-K315 PolarHBondContact O-N 3.3Å; A311-K315 VanDerWaalsContact O-N 3.1Å; E312-K315 PolarHBondContact O-N 3.22Å; I313-K315 PolarHBondContact O-N 3.47Å; K315-K319 VanDerWaalsContact O-CG 3.32Å; K315-K319 WeakPolarHBondContact O-CG 3.34Å; K315-K319 PolarHBondContact O-N 3.01Å
316	K	76.3	Confident	77.3	Confident	78 Å²	78	84.6 Å²	84.6	34%	0.339	40%	0.399	S	S	.	.	H	α-helix	trans	-69.2	-42	174.2	-82.9	-172.3	175.9	-176.1	0	111.2	L308 E312 I313 Q314 K319 K320 D349	L308-K316 HydrophobicContact CD1-CD 3.96Å; E312-K316 PolarHBondContact O-N 3.47Å; I313-K316 CarbonylContact O-C 3.6Å; I313-K316 WeakPolarHBondContact O-CB 3.41Å; I313-K316 PolarHBondContact O-N 3.28Å; I313-K316 VanDerWaalsContact O-N 3.07Å; Q314-K316 VanDerWaalsContact C-N 3.32Å; Q314-K316 PolarHBondContact O-N 2.93Å; K316-K319 WeakPolarHBondContact O-CB 3.36Å; K316-K319 PolarHBondContact O-N 3.37Å; K316-K320 PolarHBondContact O-N 2.87Å; K316-D349 PolarHBondContact NZ-O 3.26Å
317	M	71.8	Confident	76.9	Confident	30 Å²	30	90.4 Å²	90.4	15%	0.148	42%	0.421	C	S	.	.	H	α-helix	trans	-61.2	-44.6	176.2	-70.8	-58.4	-73.7	0	0	111.2	I313 Q314 K319 K320 L321 V343 M345	I313-M317 HydrophobicContact CG2-CG 4.28Å; I313-M317 WeakPolarHBondContact O-CG 3.29Å; I313-M317 PolarHBondContact O-N 3.36Å; Q314-M317 PolarHBondContact O-N 2.91Å; M317-K319 VanDerWaalsContact C-N 3.29Å; M317-K319 PolarHBondContact O-N 3.03Å; M317-K320 CarbonylContact O-C 3.38Å; M317-K320 PolarHBondContact O-N 3.08Å; M317-K320 VanDerWaalsContact O-N 3.09Å; M317-L321 WeakPolarHBondContact O-CB 3.27Å; M317-L321 WeakPolarHBondContact O-CG 3.39Å; M317-L321 PolarHBondContact O-N 2.9Å; M317-V343 HydrophobicContact CE-CB 4.3Å; M317-V343 HydrophobicContact CE-CG1 4Å; M317-M345 HydrophobicContact CE-CG 4.14Å; M317-M345 HydrophobicContact SD-CG 4.39Å
318	D	79.4	Confident	76	Confident	75 Å²	75	91.9 Å²	91.9	40%	0.401	43%	0.434	S	S	.	.	H	α-helix	trans	-60.8	-39	174.8	-71.3	-20.6	0	0	0	112.1	Q314 K322	Q314-D318 VanDerWaalsContact O-CG 3.29Å; Q314-D318 PolarHBondContact O-N 3.22Å; D318-K322 VanDerWaalsContact O-CB 3.24Å; D318-K322 WeakPolarHBondContact O-CB 3.34Å; D318-K322 WeakPolarHBondContact O-CD 3.41Å; D318-K322 WeakPolarHBondContact O-CG 3.33Å; D318-K322 PolarHBondContact O-N 3.41Å
319	K	80.4	Confident	75.4	Confident	147 Å²	147	98.7 Å²	98.7	64%	0.639	46%	0.462	S	S	*	.	H	α-helix	trans	-66.5	-40.7	174.1	-75.1	175	-178.5	-179.2	0	111.6	K315 K316 M317 K323	K315-K319 VanDerWaalsContact O-CG 3.32Å; K315-K319 WeakPolarHBondContact O-CG 3.34Å; K315-K319 PolarHBondContact O-N 3.01Å; K316-K319 WeakPolarHBondContact O-CB 3.36Å; K316-K319 PolarHBondContact O-N 3.37Å; M317-K319 VanDerWaalsContact C-N 3.29Å; M317-K319 PolarHBondContact O-N 3.03Å; K319-K323 WeakPolarHBondContact O-CB 3.3Å; K319-K323 WeakPolarHBondContact O-CG 3.01Å; K319-K323 PolarHBondContact O-N 3.49Å
320	K	79	Confident	74.8	Confident	77 Å²	77	103.2 Å²	103.2	34%	0.335	48%	0.483	S	S	.	.	H	α-helix	trans	-67.8	-46.4	176.8	-78.1	-165.1	177	-166	0	111.7	K316 M317 K322 K323 A324 D349	K316-K320 PolarHBondContact O-N 2.87Å; M317-K320 CarbonylContact O-C 3.38Å; M317-K320 PolarHBondContact O-N 3.08Å; M317-K320 VanDerWaalsContact O-N 3.09Å; K320-K322 VanDerWaalsContact C-N 3.32Å; K320-K322 PolarHBondContact O-N 2.88Å; K320-K323 CarbonylContact O-C 3.58Å; K320-K323 PolarHBondContact O-N 3.36Å; K320-K323 VanDerWaalsContact O-N 3.09Å; K320-A324 WeakPolarHBondContact O-CB 3.42Å; K320-A324 PolarHBondContact O-N 3.37Å; K320-D349 WeakPolarHBondContact CE-OD1 3.23Å; K320-D349 WeakPolarHBondContact CE-OD2 3.26Å; K320-D349 IonicContact NZ-OD1 2.96Å; K320-D349 PolarHBondContact NZ-OD1 3.33Å; K320-D349 IonicContact NZ-OD2 2.75Å; K320-D349 PolarHBondContact NZ-OD2 3.03Å
321	L	77.2	Confident	74	Confident	52 Å²	52	101 Å²	101	27%	0.272	48%	0.479	S	S	.	.	H	α-helix	trans	-58.8	-42.5	173.5	-78.8	161.3	0	0	0	111.2	M317 K323 A324 R325 V343	M317-L321 WeakPolarHBondContact O-CB 3.27Å; M317-L321 WeakPolarHBondContact O-CG 3.39Å; M317-L321 PolarHBondContact O-N 2.9Å; L321-K323 PolarHBondContact O-N 3.27Å; L321-A324 PolarHBondContact O-N 2.93Å; L321-R325 VanDerWaalsContact O-CB 3.24Å; L321-R325 WeakPolarHBondContact O-CB 3.37Å; L321-R325 VanDerWaalsContact O-CG 3.22Å; L321-R325 WeakPolarHBondContact O-CG 3.38Å; L321-R325 PolarHBondContact O-N 3.07Å; L321-V343 HydrophobicContact CD2-CG2 4.12Å
322	K	80.3	Confident	72.9	Confident	142 Å²	142	102.2 Å²	102.2	62%	0.617	48%	0.484	S	S	*	.	H	α-helix	trans	-63.5	-39	173.5	-76	171.2	-175.8	177.8	0	112.5	D318 K320 K326	D318-K322 VanDerWaalsContact O-CB 3.24Å; D318-K322 WeakPolarHBondContact O-CB 3.34Å; D318-K322 WeakPolarHBondContact O-CD 3.41Å; D318-K322 WeakPolarHBondContact O-CG 3.33Å; D318-K322 PolarHBondContact O-N 3.41Å; K320-K322 VanDerWaalsContact C-N 3.32Å; K320-K322 PolarHBondContact O-N 2.88Å; K322-K326 WeakPolarHBondContact O-CB 3.18Å; K322-K326 VanDerWaalsContact O-CG 3.28Å; K322-K326 WeakPolarHBondContact O-CG 3.44Å; K322-K326 PolarHBondContact O-N 2.89Å
323	K	79.6	Confident	71.7	Confident	152 Å²	152	102.9 Å²	102.9	66%	0.661	50%	0.503	S	S	*	.	H	α-helix	trans	-70.7	-41.3	175.7	-78.3	-177.3	177.9	-173.9	0	112.4	K319 K320 L321 K326 K327	K319-K323 WeakPolarHBondContact O-CB 3.3Å; K319-K323 WeakPolarHBondContact O-CG 3.01Å; K319-K323 PolarHBondContact O-N 3.49Å; K320-K323 CarbonylContact O-C 3.58Å; K320-K323 PolarHBondContact O-N 3.36Å; K320-K323 VanDerWaalsContact O-N 3.09Å; L321-K323 PolarHBondContact O-N 3.27Å; K323-K326 PolarHBondContact O-N 3.45Å; K323-K327 PolarHBondContact O-N 3.12Å
324	A	73.9	Confident	70.4	Confident	28 Å²	28	106.7 Å²	106.7	23%	0.231	53%	0.531	C	S	.	.	H	α-helix	trans	-64.5	-46.6	176.3	0	0	0	0	0	110.5	K320 L321 K326 K327 A328	K320-A324 WeakPolarHBondContact O-CB 3.42Å; K320-A324 PolarHBondContact O-N 3.37Å; L321-A324 PolarHBondContact O-N 2.93Å; A324-K326 VanDerWaalsContact C-N 3.32Å; A324-K326 PolarHBondContact O-N 2.86Å; A324-K327 PolarHBondContact O-N 3.12Å; A324-K327 VanDerWaalsContact O-N 3.16Å; A324-A328 WeakPolarHBondContact O-CB 3.31Å; A324-A328 PolarHBondContact O-N 2.93Å
325	R	76.2	Confident	69	Low	164 Å²	164	103.5 Å²	103.5	62%	0.619	53%	0.534	S	S	*	.	H	α-helix	trans	-60.5	-37.4	172.1	-73.1	176.8	178.7	-176	0.3	112.6	L321 K329	L321-R325 VanDerWaalsContact O-CB 3.24Å; L321-R325 WeakPolarHBondContact O-CB 3.37Å; L321-R325 VanDerWaalsContact O-CG 3.22Å; L321-R325 WeakPolarHBondContact O-CG 3.38Å; L321-R325 PolarHBondContact O-N 3.07Å; R325-K329 WeakPolarHBondContact O-CB 3.36Å; R325-K329 VanDerWaalsContact O-CG 3.31Å; R325-K329 WeakPolarHBondContact O-CG 3.28Å; R325-K329 PolarHBondContact O-N 3.36Å
326	K	75.5	Confident	66.9	Low	151 Å²	151	106 Å²	106	66%	0.657	55%	0.548	S	S	*	.	H	α-helix	trans	-67.4	-40.7	173.4	-81.1	-177.6	178.7	-168.4	0	112.5	K322 K323 A324 L330	K322-K326 WeakPolarHBondContact O-CB 3.18Å; K322-K326 VanDerWaalsContact O-CG 3.28Å; K322-K326 WeakPolarHBondContact O-CG 3.44Å; K322-K326 PolarHBondContact O-N 2.89Å; K323-K326 PolarHBondContact O-N 3.45Å; A324-K326 VanDerWaalsContact C-N 3.32Å; A324-K326 PolarHBondContact O-N 2.86Å; K326-L330 PolarHBondContact O-N 2.84Å; K326-L330 VanDerWaalsContact O-N 3.12Å
327	K	73.8	Confident	65.2	Low	151 Å²	151	111.5 Å²	111.5	66%	0.657	58%	0.575	S	S	*	*	H	α-helix	trans	-67.8	-41.6	174.8	-81.8	-170.7	172.2	-169.4	0	112	K323 A324 K329 L330 N331	K323-K327 PolarHBondContact O-N 3.12Å; A324-K327 PolarHBondContact O-N 3.12Å; A324-K327 VanDerWaalsContact O-N 3.16Å; K327-K329 VanDerWaalsContact C-N 3.34Å; K327-K329 PolarHBondContact O-N 3.12Å; K327-L330 WeakPolarHBondContact O-CB 3.48Å; K327-L330 PolarHBondContact O-N 2.72Å; K327-L330 VanDerWaalsContact O-N 3.09Å; K327-N331 PolarHBondContact O-N 3.24Å
328	A	63.1	Low	63.9	Low	38 Å²	38	117.6 Å²	117.6	31%	0.314	61%	0.608	S	S	.	*	H	α-helix	trans	-60.9	-42.7	174.3	0	0	0	0	0	111.3	A324 L330 N331 S332	A324-A328 WeakPolarHBondContact O-CB 3.31Å; A324-A328 PolarHBondContact O-N 2.93Å; A328-L330 VanDerWaalsContact C-N 3.27Å; A328-L330 PolarHBondContact O-N 2.8Å; A328-N331 PolarHBondContact O-N 3.18Å; A328-S332 WeakPolarHBondContact O-CB 3.34Å; A328-S332 PolarHBondContact O-N 3.1Å; A328-S332 PolarHBondContact O-OG 3.16Å
329	K	67.3	Low	62.1	Low	163 Å²	163	118.9 Å²	118.9	71%	0.709	62%	0.621	S	S	*	*	H	α-helix	trans	-66.3	-22.5	172.8	-77.2	-174.9	177.3	-164.4	0	115	R325 K327 S332	R325-K329 WeakPolarHBondContact O-CB 3.36Å; R325-K329 VanDerWaalsContact O-CG 3.31Å; R325-K329 WeakPolarHBondContact O-CG 3.28Å; R325-K329 PolarHBondContact O-N 3.36Å; K327-K329 VanDerWaalsContact C-N 3.34Å; K327-K329 PolarHBondContact O-N 3.12Å; K329-S332 WeakPolarHBondContact CA-OG 3.34Å; K329-S332 PolarHBondContact O-OG 3.23Å
330	L	61.2	Low	60.3	Low	133 Å²	133	120.8 Å²	120.8	70%	0.696	63%	0.632	S	S	*	*	H	α-helix	trans	-82.6	-35.6	173.3	-95.5	148.2	0	0	0	111.1	K326 K327 A328	K326-L330 PolarHBondContact O-N 2.84Å; K326-L330 VanDerWaalsContact O-N 3.12Å; K327-L330 WeakPolarHBondContact O-CB 3.48Å; K327-L330 PolarHBondContact O-N 2.72Å; K327-L330 VanDerWaalsContact O-N 3.09Å; A328-L330 VanDerWaalsContact C-N 3.27Å; A328-L330 PolarHBondContact O-N 2.8Å
331	N	56.5	Low	58.7	Low	113 Å²	113	121 Å²	121	60%	0.604	64%	0.64	S	S	*	*	H	α-helix	trans	-78.6	-22.4	176.3	-70.1	3.4	0	0	0	113	K327 A328 A333 S334	K327-N331 PolarHBondContact O-N 3.24Å; A328-N331 PolarHBondContact O-N 3.18Å; N331-A333 PolarHBondContact O-N 3.26Å; N331-A333 VanDerWaalsContact O-N 3.08Å; N331-S334 PolarHBondContact O-N 3.15Å; N331-S334 PolarHBondContact O-OG 3.38Å
332	S	50.9	Low	57.1	Low	81 Å²	81	123.9 Å²	123.9	57%	0.566	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-1.7	174	65.9	0	0	0	0	113.8	A328 K329 S334	A328-S332 WeakPolarHBondContact O-CB 3.34Å; A328-S332 PolarHBondContact O-N 3.1Å; A328-S332 PolarHBondContact O-OG 3.16Å; K329-S332 WeakPolarHBondContact CA-OG 3.34Å; K329-S332 PolarHBondContact O-OG 3.23Å; S332-S334 VanDerWaalsContact C-N 3.33Å
333	A	52.7	Low	55.7	Low	95 Å²	95	119.6 Å²	119.6	79%	0.785	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-6	168.4	0	0	0	0	0	113.2	N331	N331-A333 PolarHBondContact O-N 3.26Å; N331-A333 VanDerWaalsContact O-N 3.08Å
334	S	47.1	Very low	54.3	Low	98 Å²	98	116.9 Å²	116.9	69%	0.685	65%	0.65	S	S	*	*	S	Bend	trans	-121.3	24.1	-179.4	63.3	0	0	0	0	114.8	N331 S332	N331-S334 PolarHBondContact O-N 3.15Å; N331-S334 PolarHBondContact O-OG 3.38Å; S332-S334 VanDerWaalsContact C-N 3.33Å
335	G	46.5	Very low	53.4	Low	65 Å²	65	120.8 Å²	120.8	67%	0.67	67%	0.665	S	S	*	*			trans	55.5	78.7	161.6	0	0	0	0	0	117.3
336	E	36.6	Very low	52.7	Low	194 Å²	194	116.1 Å²	116.1	91%	0.907	65%	0.654	S	S	*	*			trans	-155.7	144.2	152.1	-107.9	174.8	-163.4	0	0	108.8
337	E	41.1	Very low	52.4	Low	192 Å²	192	109.8 Å²	109.8	90%	0.897	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-67.4	155.3	-168.2	-69.1	-177.8	151.3	0	0	115	P339	E337-P339 WeakPolarHBondContact O-CD 3.48Å
338	D	43.6	Very low	52	Low	159 Å²	159	109 Å²	109	85%	0.85	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-59.1	122.5	-174.7	-71.5	-48.2	0	0	0	114.1
339	P	41.2	Very low	52.2	Low	102 Å²	102	108.6 Å²	108.6	66%	0.662	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-86.8	133.1	148.3	32	-25.5	0	0	0	108.5	E337 T341	E337-P339 WeakPolarHBondContact O-CD 3.48Å; P339-T341 PolarHBondContact O-N 3.17Å
340	E	43.7	Very low	52.5	Low	187 Å²	187	101.8 Å²	101.8	87%	0.874	59%	0.589	S	S	*	*			trans	-48	111.5	167.5	-74.6	-171.9	150.3	0	0	109.4	S342	E340-S342 PolarHBondContact O-N 3.38Å
341	T	44.2	Very low	53.4	Low	82 Å²	82	95.7 Å²	95.7	50%	0.503	56%	0.558	S	S	.	*			trans	-76.2	78.7	-178.5	29.8	0	0	0	0	109.5	P339 V343	P339-T341 PolarHBondContact O-N 3.17Å; T341-V343 PolarHBondContact O-N 3.37Å
342	S	43.8	Very low	54.6	Low	111 Å²	111	93 Å²	93	78%	0.776	54%	0.541	S	S	*	.			trans	-74.2	103.8	168.2	55.2	0	0	0	0	109	E340 S344	E340-S342 PolarHBondContact O-N 3.38Å; S342-S344 PolarHBondContact O-N 3.45Å
343	V	52.2	Low	55.9	Low	52 Å²	52	93.7 Å²	93.7	32%	0.315	53%	0.531	S	S	.	.			trans	-82	105.8	170.8	-178.3	0	0	0	0	107.4	M317 L321 T341	M317-V343 HydrophobicContact CE-CB 4.3Å; M317-V343 HydrophobicContact CE-CG1 4Å; L321-V343 HydrophobicContact CD2-CG2 4.12Å; T341-V343 PolarHBondContact O-N 3.37Å
344	S	48.9	Very low	57.2	Low	95 Å²	95	90.8 Å²	90.8	66%	0.664	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-71.7	140.2	172.3	55.6	0	0	0	0	110.8	S342 T346	S342-S344 PolarHBondContact O-N 3.45Å; S344-T346 PolarHBondContact O-N 3.44Å
345	M	55	Low	58.7	Low	111 Å²	111	86.8 Å²	86.8	55%	0.547	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-69.7	122.4	175.5	-74	-176.8	59.9	0	0	109.5	I313 M317	I313-M345 HydrophobicContact CG2-CE 3.85Å; M317-M345 HydrophobicContact CE-CG 4.14Å; M317-M345 HydrophobicContact SD-CG 4.39Å
346	T	62.5	Low	60.5	Low	65 Å²	65	86.3 Å²	86.3	40%	0.399	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-98.7	144.2	170.1	62.8	0	0	0	0	110.2	S344 Q348 D349	S344-T346 PolarHBondContact O-N 3.44Å; T346-Q348 PolarHBondContact O-N 3.07Å; T346-Q348 VanDerWaalsContact O-N 3.14Å; T346-D349 WeakPolarHBondContact O-CB 3.21Å; T346-D349 PolarHBondContact O-N 3.28Å; T346-D349 PolarHBondContact OG1-OD2 2.85Å
347	L	68.7	Low	62.9	Low	18 Å²	18	77.1 Å²	77.1	9%	0.094	42%	0.416	C	S	.	.	H	α-helix	trans	-55.8	-31.3	179.5	-105.1	154.4	0	0	0	114	A217 A270 D349 E350 I351	A217-L347 HydrophobicContact CB-CD1 3.83Å; A217-L347 HydrophobicContact CB-CD2 3.59Å; A217-L347 HydrophobicContact CB-CG 4.38Å; A270-L347 HydrophobicContact CB-CD1 3.84Å; A270-L347 WeakPolarHBondContact O-CD1 3.48Å; L347-D349 PolarHBondContact O-N 3.25Å; L347-E350 PolarHBondContact O-N 2.87Å; L347-I351 HydrophobicContact CD2-CD1 4.04Å; L347-I351 PolarHBondContact O-N 3Å
348	Q	66.3	Low	65.1	Low	134 Å²	134	75.4 Å²	75.4	63%	0.626	41%	0.406	S	S	*	.	H	α-helix	trans	-66.5	-20.7	177.7	-63.6	-179.1	-2.2	0	0	113.3	T346	T346-Q348 PolarHBondContact O-N 3.07Å; T346-Q348 VanDerWaalsContact O-N 3.14Å
349	D	66.3	Low	67.2	Low	31 Å²	31	68.2 Å²	68.2	17%	0.166	37%	0.367	C	S	.	.	H	α-helix	trans	-79.6	-27.9	176.7	-72.9	-33.8	0	0	0	113.1	K316 K320 T346 L347	K316-D349 PolarHBondContact NZ-O 3.26Å; K320-D349 WeakPolarHBondContact CE-OD1 3.23Å; K320-D349 WeakPolarHBondContact CE-OD2 3.26Å; K320-D349 IonicContact NZ-OD1 2.96Å; K320-D349 PolarHBondContact NZ-OD1 3.33Å; K320-D349 IonicContact NZ-OD2 2.75Å; K320-D349 PolarHBondContact NZ-OD2 3.03Å; T346-D349 WeakPolarHBondContact O-CB 3.21Å; T346-D349 PolarHBondContact O-N 3.28Å; T346-D349 PolarHBondContact OG1-OD2 2.85Å; L347-D349 PolarHBondContact O-N 3.25Å
350	E	74	Confident	69.3	Low	19 Å²	19	66.2 Å²	66.2	9%	0.089	36%	0.356	C	S	.	.	H	α-helix	trans	-91.8	-43.6	-176.8	-178.3	167.3	171.3	0	0	112.3	R205 L308 I313 L347	R205-E350 VanDerWaalsContact CZ-CD 3.45Å; R205-E350 IonicContact CZ-OE1 3.71Å; R205-E350 IonicContact CZ-OE2 3.58Å; R205-E350 IonicContact NH1-OE1 2.81Å; R205-E350 PolarHBondContact NH1-OE1 2.98Å; R205-E350 VanDerWaalsContact NH1-OE1 3.09Å; R205-E350 IonicContact NH1-OE2 3.24Å; R205-E350 PolarHBondContact NH1-OE2 3.31Å; R205-E350 IonicContact NH2-OE1 3.12Å; R205-E350 IonicContact NH2-OE2 3.78Å; R205-E350 PolarHBondContact NH2-OE2 2.94Å; L308-E350 PolarHBondContact N-O 3.11Å; I313-E350 HydrophobicContact CD1-CB 4.38Å; I313-E350 HydrophobicContact CD1-CG 3.7Å; I313-E350 HydrophobicContact CG1-CG 4.45Å; L347-E350 PolarHBondContact O-N 2.87Å
351	I	80.4	Confident	71.4	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.031	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	104.2	175.5	-57.1	-179.8	0	0	0	107.4	I207 I273 F305 V307 L347	I207-I351 HydrophobicContact CD1-CD1 3.79Å; I273-I351 HydrophobicContact CD1-CB 3.83Å; I273-I351 HydrophobicContact CD1-CD1 3.8Å; I273-I351 HydrophobicContact CD1-CG1 4.35Å; I273-I351 HydrophobicContact CD1-CG2 3.83Å; F305-I351 HydrophobicContact CB-CG2 3.77Å; F305-I351 HydrophobicContact CD1-CG2 4.15Å; F305-I351 HydrophobicContact CG-CG2 4.24Å; V307-I351 HydrophobicContact CG2-CG1 4.17Å; L347-I351 HydrophobicContact CD2-CD1 4.04Å; L347-I351 PolarHBondContact O-N 3Å
352	H	80.6	Confident	73.6	Confident	56 Å²	56	59.9 Å²	59.9	26%	0.259	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	143.9	176.9	76.1	91.2	0	0	0	110.9	F305 C306	F305-H352 CarbonylContact C-O 3.44Å; F305-H352 VanDerWaalsContact CA-O 3.3Å; F305-H352 WeakPolarHBondContact CA-O 3.49Å; C306-H352 VanDerWaalsContact CB-NE2 3.33Å; C306-H352 WeakPolarHBondContact CB-NE2 3.1Å; C306-H352 PolarHBondContact N-O 3.26Å; C306-H352 PolarHBondContact O-CD2 3.03Å; C306-H352 PolarHBondContact O-N 3.31Å; C306-H352 PolarHBondContact SG-NE2 2.98Å; C306-H352 VanDerWaalsContact SG-NE2 3.41Å
353	R	79.1	Confident	75.8	Confident	95 Å²	95	54.8 Å²	54.8	36%	0.358	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	135.8	167.8	-161.1	178	-171.7	178.8	11.5	109.4	E276 E303 F305 N356	E276-R353 IonicContact OE2-CZ 3.87Å; E276-R353 IonicContact OE2-NH1 3.48Å; E276-R353 PolarHBondContact OE2-NH1 3.46Å; E276-R353 IonicContact OE2-NH2 3.68Å; E276-R353 PolarHBondContact OE2-NH2 3.37Å; E303-R353 IonicContact OE1-NH2 3.3Å; E303-R353 PolarHBondContact OE1-NH2 2.94Å; F305-R353 HydrophobicContact CD1-CB 4.14Å; F305-R353 HydrophobicContact CD1-CG 4.31Å; F305-R353 HydrophobicContact CE1-CB 4.15Å; F305-R353 HydrophobicContact CE1-CG 4.09Å; R353-N356 PolarHBondContact NE-OD1 3.43Å; R353-N356 PolarHBondContact NH2-ND2 3.13Å; R353-N356 PolarHBondContact NH2-OD1 3.2Å
354	V	79.3	Confident	77.6	Confident	34 Å²	34	55.9 Å²	55.9	21%	0.206	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-65.8	-179.1	179.2	0	0	0	0	109.8	V304 C306 L392 P399	V304-V354 HydrophobicContact CG1-CB 4.41Å; V304-V354 PolarHBondContact O-N 2.96Å; C306-V354 HydrophobicContact CB-CG2 3.23Å; V354-L392 HydrophobicContact CG1-CD2 4.21Å; V354-P399 HydrophobicContact CG1-CG 3.28Å
355	A	78.7	Confident	79.5	Confident	15 Å²	15	51.6 Å²	51.6	12%	0.124	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	156.5	-175.1	0	0	0	0	0	110.8	V304 L392 P399	V304-A355 PolarHBondContact N-O 3.28Å; V304-A355 VanDerWaalsContact N-O 3.09Å; A355-L392 HydrophobicContact CB-CD1 4.09Å; A355-P399 HydrophobicContact CB-CG 4.33Å; A355-P399 WeakPolarHBondContact CB-O 3.42Å
356	N	84.6	Confident	81.3	Confident	54 Å²	54	46.4 Å²	46.4	29%	0.289	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128	170.4	-70	-11.5	0	0	0	109.3	E276 V301 L302 R353	E276-N356 PolarHBondContact OE2-ND2 3.09Å; V301-N356 HydrophobicContact CG1-CB 3.95Å; L302-N356 CarbonylContact O-C 3.35Å; L302-N356 WeakPolarHBondContact O-CA 3.45Å; R353-N356 PolarHBondContact NE-OD1 3.43Å; R353-N356 PolarHBondContact NH2-ND2 3.13Å; R353-N356 PolarHBondContact NH2-OD1 3.2Å
357	I	85.7	Confident	82.6	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	108.9	172.8	-48.8	-171.5	0	0	0	107.5	V301 L302 V304 A378 F380 Y390 P401	V301-I357 WeakPolarHBondContact CA-O 3.34Å; L302-I357 HydrophobicContact CB-CB 4.19Å; L302-I357 HydrophobicContact CD2-CD1 4.2Å; L302-I357 PolarHBondContact N-O 2.72Å; L302-I357 PolarHBondContact O-N 2.52Å; V304-I357 HydrophobicContact CG2-CD1 4.38Å; V304-I357 HydrophobicContact CG2-CG1 4.47Å; I357-A378 HydrophobicContact CD1-CB 4.35Å; I357-F380 HydrophobicContact CB-CZ 4.29Å; I357-F380 HydrophobicContact CD1-CZ 4.3Å; I357-F380 HydrophobicContact CG2-CE2 4Å; I357-F380 HydrophobicContact CG2-CZ 4.02Å; I357-Y390 HydrophobicContact CG2-CD1 3.55Å; I357-Y390 HydrophobicContact CG2-CD2 4.06Å; I357-Y390 HydrophobicContact CG2-CE1 3.76Å; I357-Y390 HydrophobicContact CG2-CE2 4.27Å; I357-Y390 HydrophobicContact CG2-CG 3.67Å; I357-P401 HydrophobicContact CB-CB 4.41Å; I357-P401 HydrophobicContact CD1-CB 4.19Å; I357-P401 HydrophobicContact CG1-CB 3.86Å; I357-P401 HydrophobicContact CG1-CG 4.3Å; I357-P401 HydrophobicContact CG2-CB 4.15Å
358	K	87.9	Confident	83.5	Confident	156 Å²	156	44.8 Å²	44.8	68%	0.678	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	117.8	172.7	-170.4	173.3	-178	176.3	0	109.3	V301 Y390	V301-K358 HydrophobicContact CG2-CG 4.49Å; K358-Y390 PolarHBondContact O-OH 3.15Å; K358-Y390 VanDerWaalsContact O-OH 3.13Å
359	T	87.6	Confident	84.3	Confident	8 Å²	8	39.7 Å²	39.7	5%	0.049	20%	0.196	C	C	.	.			trans	-91.2	168.8	178.4	59	0	0	0	0	111.2	S300 S361 I363 F380 L382 Y390	S300-T359 PolarHBondContact O-N 3.29Å; S300-T359 PolarHBondContact O-OG1 3.48Å; T359-S361 VanDerWaalsContact C-N 3.31Å; T359-S361 PolarHBondContact O-N 2.99Å; T359-S361 PolarHBondContact OG1-O 3.04Å; T359-I363 HydrophobicContact CG2-CD1 3.79Å; T359-I363 HydrophobicContact CG2-CG1 3.93Å; T359-I363 VanDerWaalsContact OG1-CG1 3.23Å; T359-I363 WeakPolarHBondContact OG1-CG1 3.45Å; T359-F380 HydrophobicContact CG2-CB 4.44Å; T359-F380 HydrophobicContact CG2-CD1 4.04Å; T359-F380 HydrophobicContact CG2-CD2 3.89Å; T359-F380 HydrophobicContact CG2-CE1 4.25Å; T359-F380 HydrophobicContact CG2-CE2 4.11Å; T359-F380 HydrophobicContact CG2-CG 3.84Å; T359-F380 HydrophobicContact CG2-CZ 4.27Å; T359-L382 HydrophobicContact CG2-CD2 4.42Å; T359-Y390 HydrophobicContact CG2-CE2 4.16Å
360	S	86.6	Confident	85	Confident	61 Å²	61	41.2 Å²	41.2	43%	0.427	20%	0.202	S	C	.	.	S	Bend	trans	-71	-21.8	-177.1	57.5	0	0	0	0	114.6	L382 E388	S360-L382 VanDerWaalsContact OG-CD1 3.24Å; S360-L382 WeakPolarHBondContact OG-CD1 2.88Å; S360-E388 PolarHBondContact N-OE2 2.96Å; S360-E388 VanDerWaalsContact OG-CD 3.22Å; S360-E388 PolarHBondContact OG-OE1 3.41Å; S360-E388 PolarHBondContact OG-OE2 2.72Å
361	S	87.4	Confident	85	Confident	23 Å²	23	41.2 Å²	41.2	16%	0.161	20%	0.204	C	C	.	.	S	Bend	trans	-154.4	-175.7	178.3	71.8	0	0	0	0	110.6	S300 T359 I363 L382 N384	S300-S361 VanDerWaalsContact CB-O 3.25Å; S300-S361 WeakPolarHBondContact CB-O 3.39Å; T359-S361 VanDerWaalsContact C-N 3.31Å; T359-S361 PolarHBondContact O-N 2.99Å; T359-S361 PolarHBondContact OG1-O 3.04Å; S361-I363 PolarHBondContact O-N 3.44Å; S361-L382 WeakPolarHBondContact OG-CB 3.08Å; S361-N384 WeakPolarHBondContact CB-ND2 3.45Å; S361-N384 PolarHBondContact OG-ND2 3.22Å; S361-N384 VanDerWaalsContact OG-ND2 3.16Å; S361-N384 PolarHBondContact OG-OD1 3.12Å
362	K	90.4	Very high	84.3	Confident	113 Å²	113	47.4 Å²	47.4	49%	0.491	25%	0.245	S	C	.	.			trans	-63	131.5	-177.5	-66	-176.8	179.1	-173.8	0	111.2	Q383	K362-Q383 HydrophobicContact CB-CG 4.16Å; K362-Q383 PolarHBondContact O-N 3.46Å
363	I	90.5	Very high	83.6	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.015	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	135.4	-179.2	-50.5	167.4	0	0	0	108.4	H296 D299 L302 T359 S361 F380 L382	H296-I363 VanDerWaalsContact CD2-CG2 3.46Å; H296-I363 WeakPolarHBondContact CD2-CG2 3.29Å; D299-I363 PolarHBondContact O-N 2.83Å; L302-I363 HydrophobicContact CB-CD1 4.2Å; T359-I363 HydrophobicContact CG2-CD1 3.79Å; T359-I363 HydrophobicContact CG2-CG1 3.93Å; T359-I363 VanDerWaalsContact OG1-CG1 3.23Å; T359-I363 WeakPolarHBondContact OG1-CG1 3.45Å; S361-I363 PolarHBondContact O-N 3.44Å; I363-F380 HydrophobicContact CD1-CD1 3.92Å; I363-F380 HydrophobicContact CD1-CE1 3.96Å; I363-F380 HydrophobicContact CG1-CD1 4.28Å; I363-F380 HydrophobicContact CG2-CD1 3.82Å; I363-L382 HydrophobicContact CB-CD2 4.37Å; I363-L382 HydrophobicContact CG1-CD2 3.98Å
364	K	89.1	Confident	83.1	Confident	75 Å²	75	48.9 Å²	48.9	33%	0.326	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-52.6	170.6	-179.5	51	177.3	159.2	0	110.8	Q22 H296 L381 Q383	Q22-K364 WeakPolarHBondContact O-CE 3.36Å; Q22-K364 VanDerWaalsContact O-CG 3.25Å; Q22-K364 WeakPolarHBondContact O-CG 3.32Å; H296-K364 PolarHBondContact NE2-O 2.72Å; H296-K364 VanDerWaalsContact NE2-O 3.11Å; K364-L381 PolarHBondContact N-O 3.03Å; K364-Q383 HydrophobicContact CB-CG 4.24Å
365	S	89.2	Confident	83.2	Confident	5 Å²	5	50 Å²	50	4%	0.035	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	157.9	178.2	60.1	0	0	0	0	110.7	G24 N25 I26 L381	G24-S365 PolarHBondContact O-OG 3.48Å; N25-S365 WeakPolarHBondContact CA-OG 3.45Å; I26-S365 PolarHBondContact N-OG 3.44Å; I26-S365 VanDerWaalsContact N-OG 3.09Å; S365-L381 PolarHBondContact N-O 3.24Å; S365-L381 PolarHBondContact O-N 3.18Å; S365-L381 WeakPolarHBondContact OG-CB 3.41Å
366	F	91.9	Very high	83.4	Confident	3 Å²	3	49.3 Å²	49.3	1%	0.013	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.9	176.5	75.6	-83.3	0	0	0	110.1	N283 T285 A294 H296 L302 L368 V379 F380	N283-F366 HydrophobicContact CB-CE1 4.2Å; T285-F366 HydrophobicContact CG2-CE2 4.5Å; T285-F366 HydrophobicContact CG2-CZ 4.32Å; T285-F366 WeakPolarHBondContact OG1-CE2 3.32Å; T285-F366 VanDerWaalsContact OG1-CZ 3.31Å; T285-F366 WeakPolarHBondContact OG1-CZ 3.42Å; A294-F366 HydrophobicContact CB-CE2 3.69Å; A294-F366 HydrophobicContact CB-CZ 3.95Å; H296-F366 HydrophobicContact CB-CD1 4.33Å; H296-F366 HydrophobicContact CB-CE1 4.13Å; H296-F366 AromaticContact CD2-CD1 3.39Å; H296-F366 WeakPolarHBondContact CD2-CD1 3.27Å; H296-F366 AromaticContact CD2-CE1 3.83Å; H296-F366 AromaticContact CG-CD1 3.67Å; H296-F366 AromaticContact CG-CE1 3.61Å; H296-F366 AromaticContact ND1-CE1 3.8Å; H296-F366 AromaticContact NE2-CD1 3.72Å; L302-F366 HydrophobicContact CD1-CD1 3.75Å; L302-F366 HydrophobicContact CD1-CD2 3.82Å; L302-F366 HydrophobicContact CD1-CE1 3.57Å; L302-F366 HydrophobicContact CD1-CE2 3.65Å; L302-F366 HydrophobicContact CD1-CG 3.88Å; L302-F366 HydrophobicContact CD1-CZ 3.53Å; L302-F366 HydrophobicContact CD2-CD2 4.29Å; L302-F366 HydrophobicContact CD2-CE2 4.42Å; F366-L368 HydrophobicContact CD2-CD2 4.35Å; F366-L368 HydrophobicContact CD2-CG 4.13Å; F366-L368 HydrophobicContact CE2-CD1 4.14Å; F366-L368 HydrophobicContact CE2-CG 4Å; F366-V379 CarbonylContact C-O 3.58Å; F366-V379 WeakPolarHBondContact CA-O 3.46Å; F366-V379 WeakPolarHBondContact CB-O 3.26Å; F366-F380 HydrophobicContact CB-CD1 3.55Å; F366-F380 HydrophobicContact CB-CE1 3.79Å; F366-F380 HydrophobicContact CB-CG 4.47Å; F366-F380 HydrophobicContact CG-CD1 4.49Å; F366-F380 HydrophobicContact CG-CE1 4.32Å
367	D	89.3	Confident	83.6	Confident	37 Å²	37	48.9 Å²	48.9	20%	0.198	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	154.7	172.6	-167.7	22	0	0	0	110.8	I26 V27 F28 A378 V379	I26-D367 WeakPolarHBondContact O-CB 3.16Å; V27-D367 WeakPolarHBondContact CA-OD2 3.48Å; F28-D367 HydrophobicContact CD2-CB 4.01Å; F28-D367 WeakPolarHBondContact CD2-OD2 3.38Å; F28-D367 PolarHBondContact N-OD2 3.18Å; D367-A378 WeakPolarHBondContact O-CA 3.14Å; D367-V379 PolarHBondContact N-O 3.04Å; D367-V379 PolarHBondContact O-N 2.86Å
368	L	87.9	Confident	83.7	Confident	11 Å²	11	48.9 Å²	48.9	6%	0.058	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.7	-174.1	-66.4	-178.8	0	0	0	111.5	A294 F366 L376 K377 A378	A294-L368 HydrophobicContact CB-CD1 3.5Å; A294-L368 VanDerWaalsContact CB-CD1 3.5Å; F366-L368 HydrophobicContact CD2-CD2 4.35Å; F366-L368 HydrophobicContact CD2-CG 4.13Å; F366-L368 HydrophobicContact CE2-CD1 4.14Å; F366-L368 HydrophobicContact CE2-CG 4Å; L368-L376 HydrophobicContact CB-CD1 4.37Å; L368-L376 HydrophobicContact CD2-CD1 4.37Å; L368-L376 HydrophobicContact CD2-CD2 4.42Å; L368-L376 HydrophobicContact CD2-CG 4.43Å; L368-K377 WeakPolarHBondContact CA-O 3.19Å; L368-A378 HydrophobicContact CD2-CB 3.4Å; L368-A378 VanDerWaalsContact CD2-CB 3.4Å
369	I	84	Confident	83.8	Confident	28 Å²	28	41.5 Å²	41.5	14%	0.144	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.7	167.8	-76.4	-171.7	0	0	0	110.2	F28 K377	F28-I369 HydrophobicContact CB-CD1 3.16Å; F28-I369 HydrophobicContact CB-CG1 3.89Å; F28-I369 HydrophobicContact CD1-CD1 4.04Å; F28-I369 HydrophobicContact CD2-CB 4.09Å; F28-I369 HydrophobicContact CD2-CD1 3.74Å; F28-I369 HydrophobicContact CD2-CG1 3.53Å; F28-I369 HydrophobicContact CE2-CB 4.12Å; F28-I369 HydrophobicContact CE2-CG1 4.08Å; F28-I369 HydrophobicContact CG-CD1 3.42Å; F28-I369 VanDerWaalsContact CG-CD1 3.42Å; F28-I369 HydrophobicContact CG-CG1 3.8Å; I369-K377 PolarHBondContact N-O 3.4Å; I369-K377 PolarHBondContact O-N 3.3Å
370	H	81.3	Confident	84	Confident	62 Å²	62	41.1 Å²	41.1	29%	0.287	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	120.8	164.4	-161.9	69.8	0	0	0	111.5	D287	D287-H370 WeakPolarHBondContact OD1-CB 3.49Å; D287-H370 PolarHBondContact OD1-N 3.01Å; D287-H370 WeakPolarHBondContact OD2-CB 3.36Å; D287-H370 IonicContact OD2-CG 3.12Å
371	S	74.1	Confident	84.2	Confident	19 Å²	19	38.2 Å²	38.2	13%	0.133	20%	0.2	C	C	.	.			trans	-72.8	144.8	170.5	-176.7	0	0	0	0	109.8	Q373 G374 E375	S371-Q373 PolarHBondContact O-N 3.34Å; S371-G374 PolarHBondContact O-N 3.44Å; S371-E375 VanDerWaalsContact CB-O 3.23Å; S371-E375 WeakPolarHBondContact CB-O 3.03Å; S371-E375 PolarHBondContact N-O 2.86Å
372	P	66	Low	84.3	Confident	136 Å²	136	37.2 Å²	37.2	88%	0.883	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-16.9	175.8	22.2	-33.1	0	0	0	114	G374	P372-G374 VanDerWaalsContact C-N 3.31Å
373	Q	64.5	Low	84.2	Confident	162 Å²	162	35.2 Å²	35.2	76%	0.757	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	1.8	176.5	-65.4	179.3	-12.8	0	0	114.1	S371	S371-Q373 PolarHBondContact O-N 3.34Å
374	G	68.6	Low	84	Confident	20 Å²	20	36.9 Å²	36.9	21%	0.206	19%	0.194	C	C	.	.	S	Bend	trans	88.9	7.3	-179.4	0	0	0	0	0	114.9	S371 P372 T394	S371-G374 PolarHBondContact O-N 3.44Å; P372-G374 VanDerWaalsContact C-N 3.31Å; G374-T394 PolarHBondContact O-OG1 3.47Å
375	E	81.9	Confident	84	Confident	57 Å²	57	33.4 Å²	33.4	27%	0.266	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.3	176	-48	-164.5	143.3	0	0	110.5	S371 N393	S371-E375 VanDerWaalsContact CB-O 3.23Å; S371-E375 WeakPolarHBondContact CB-O 3.03Å; S371-E375 PolarHBondContact N-O 2.86Å; E375-N393 WeakPolarHBondContact CB-OD1 3.46Å; E375-N393 WeakPolarHBondContact CG-OD1 3.06Å; E375-N393 PolarHBondContact OE1-OD1 3.08Å
376	L	83.6	Confident	84	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	121.6	169.5	-179.5	73.4	0	0	0	109.1	I292 V304 L368 S391 L392 T394	I292-L376 HydrophobicContact CD1-CD1 4.02Å; I292-L376 HydrophobicContact CD1-CD2 4.34Å; I292-L376 HydrophobicContact CG2-CD2 3.98Å; V304-L376 HydrophobicContact CG1-CD2 4.28Å; L368-L376 HydrophobicContact CB-CD1 4.37Å; L368-L376 HydrophobicContact CD2-CD1 4.37Å; L368-L376 HydrophobicContact CD2-CD2 4.42Å; L368-L376 HydrophobicContact CD2-CG 4.43Å; L376-S391 CarbonylContact O-C 3.6Å; L376-S391 WeakPolarHBondContact O-CA 3.34Å; L376-L392 HydrophobicContact CB-CB 4.31Å; L376-L392 WeakPolarHBondContact CB-O 3.36Å; L376-L392 HydrophobicContact CD2-CD2 4.08Å; L376-L392 PolarHBondContact N-O 3.12Å; L376-L392 PolarHBondContact O-N 3Å; L376-T394 HydrophobicContact CB-CG2 4.01Å
377	K	87.6	Confident	83.9	Confident	45 Å²	45	33.2 Å²	33.2	20%	0.196	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.1	173.2	-71.6	-178.4	-178.8	176.3	0	109.4	F28 L368 I369 L389 Y390	F28-K377 HydrophobicContact CZ-CB 4.11Å; L368-K377 WeakPolarHBondContact CA-O 3.19Å; I369-K377 PolarHBondContact N-O 3.4Å; I369-K377 PolarHBondContact O-N 3.3Å; K377-L389 HydrophobicContact CB-CD1 4.09Å; K377-Y390 WeakPolarHBondContact CA-O 3.41Å
378	A	88.8	Confident	83.9	Confident	2 Å²	2	31.4 Å²	31.4	2%	0.017	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.8	177.6	0	0	0	0	0	109.8	I357 D367 L368 F380 L389 Y390	I357-A378 HydrophobicContact CD1-CB 4.35Å; D367-A378 WeakPolarHBondContact O-CA 3.14Å; L368-A378 HydrophobicContact CD2-CB 3.4Å; L368-A378 VanDerWaalsContact CD2-CB 3.4Å; A378-F380 HydrophobicContact CB-CE2 3.88Å; A378-F380 HydrophobicContact CB-CZ 3.9Å; A378-L389 WeakPolarHBondContact O-CA 3.37Å; A378-Y390 PolarHBondContact N-O 3.24Å; A378-Y390 PolarHBondContact O-N 2.97Å
379	V	90.4	Very high	84	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	136.5	174.8	167.8	0	0	0	0	109.3	I26 F28 V39 L52 F366 D367 V387 E388 L389	I26-V379 HydrophobicContact CD1-CG1 3.44Å; I26-V379 VanDerWaalsContact CD1-CG1 3.44Å; I26-V379 HydrophobicContact CG1-CG1 3.87Å; F28-V379 HydrophobicContact CD1-CG2 4.37Å; F28-V379 HydrophobicContact CE1-CB 4.42Å; F28-V379 HydrophobicContact CE1-CG2 3.47Å; F28-V379 VanDerWaalsContact CE1-CG2 3.47Å; F28-V379 HydrophobicContact CE2-CB 4.03Å; F28-V379 HydrophobicContact CE2-CG2 3.82Å; F28-V379 HydrophobicContact CZ-CB 3.89Å; F28-V379 HydrophobicContact CZ-CG2 3.16Å; V39-V379 HydrophobicContact CG1-CG1 4.05Å; V39-V379 HydrophobicContact CG2-CG1 4.16Å; V39-V379 HydrophobicContact CG2-CG2 4Å; L52-V379 HydrophobicContact CD1-CG2 3.77Å; F366-V379 CarbonylContact C-O 3.58Å; F366-V379 WeakPolarHBondContact CA-O 3.46Å; F366-V379 WeakPolarHBondContact CB-O 3.26Å; D367-V379 PolarHBondContact N-O 3.04Å; D367-V379 PolarHBondContact O-N 2.86Å; V379-V387 HydrophobicContact CG1-CG1 3.9Å; V379-E388 WeakPolarHBondContact CA-O 3.4Å; V379-L389 HydrophobicContact CG2-CB 4.32Å; V379-L389 HydrophobicContact CG2-CD1 3.43Å; V379-L389 VanDerWaalsContact CG2-CD1 3.43Å; V379-L389 HydrophobicContact CG2-CG 4.45Å
380	F	91	Very high	84.3	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.9	-179.3	-59.5	-79.3	0	0	0	110.8	L302 I357 T359 I363 F366 A378 L382 V387 E388 Y390	L302-F380 HydrophobicContact CB-CE1 3.79Å; L302-F380 HydrophobicContact CB-CZ 4.02Å; L302-F380 HydrophobicContact CD1-CE1 4.23Å; L302-F380 HydrophobicContact CD2-CE1 3.64Å; L302-F380 HydrophobicContact CD2-CZ 3.53Å; L302-F380 HydrophobicContact CG-CE1 4.07Å; L302-F380 HydrophobicContact CG-CZ 4.3Å; I357-F380 HydrophobicContact CB-CZ 4.29Å; I357-F380 HydrophobicContact CD1-CZ 4.3Å; I357-F380 HydrophobicContact CG2-CE2 4Å; I357-F380 HydrophobicContact CG2-CZ 4.02Å; T359-F380 HydrophobicContact CG2-CB 4.44Å; T359-F380 HydrophobicContact CG2-CD1 4.04Å; T359-F380 HydrophobicContact CG2-CD2 3.89Å; T359-F380 HydrophobicContact CG2-CE1 4.25Å; T359-F380 HydrophobicContact CG2-CE2 4.11Å; T359-F380 HydrophobicContact CG2-CG 3.84Å; T359-F380 HydrophobicContact CG2-CZ 4.27Å; I363-F380 HydrophobicContact CD1-CD1 3.92Å; I363-F380 HydrophobicContact CD1-CE1 3.96Å; I363-F380 HydrophobicContact CG1-CD1 4.28Å; I363-F380 HydrophobicContact CG2-CD1 3.82Å; F366-F380 HydrophobicContact CB-CD1 3.55Å; F366-F380 HydrophobicContact CB-CE1 3.79Å; F366-F380 HydrophobicContact CB-CG 4.47Å; F366-F380 HydrophobicContact CG-CD1 4.49Å; F366-F380 HydrophobicContact CG-CE1 4.32Å; A378-F380 HydrophobicContact CB-CE2 3.88Å; A378-F380 HydrophobicContact CB-CZ 3.9Å; F380-L382 HydrophobicContact CB-CD2 4.14Å; F380-V387 VanDerWaalsContact O-CA 3.27Å; F380-V387 WeakPolarHBondContact O-CA 3.32Å; F380-E388 PolarHBondContact N-O 3.18Å; F380-E388 PolarHBondContact O-N 2.59Å; F380-E388 VanDerWaalsContact O-N 3.09Å; F380-Y390 AromaticContact CD2-CD2 3.58Å; F380-Y390 HydrophobicContact CD2-CD2 3.58Å; F380-Y390 HydrophobicContact CD2-CE2 4.04Å; F380-Y390 AromaticContact CE2-CD2 3.43Å; F380-Y390 HydrophobicContact CE2-CD2 3.43Å; F380-Y390 VanDerWaalsContact CE2-CD2 3.43Å; F380-Y390 HydrophobicContact CE2-CE2 4.12Å; F380-Y390 HydrophobicContact CE2-CG 4.02Å
381	L	90.5	Very high	84.6	Confident	1 Å²	1	29 Å²	29	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.3	160.7	-178.2	62.9	0	0	0	108.7	S21 I26 V41 P42 K364 S365 V387	S21-L381 WeakPolarHBondContact O-CD2 3.41Å; I26-L381 HydrophobicContact CB-CB 3.95Å; I26-L381 HydrophobicContact CD1-CB 3.83Å; I26-L381 HydrophobicContact CG2-CB 4.11Å; V41-L381 HydrophobicContact CG1-CD1 3.94Å; V41-L381 HydrophobicContact CG1-CD2 4.32Å; P42-L381 HydrophobicContact CG-CD2 4.44Å; K364-L381 PolarHBondContact N-O 3.03Å; S365-L381 PolarHBondContact N-O 3.24Å; S365-L381 PolarHBondContact O-N 3.18Å; S365-L381 WeakPolarHBondContact OG-CB 3.41Å; L381-V387 HydrophobicContact CD1-CG2 3.97Å
382	L	90.2	Very high	85.1	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	152.9	-176.7	-56.1	-179.2	0	0	0	111.4	T359 S360 S361 I363 F380 N384 N385 L386 E388	T359-L382 HydrophobicContact CG2-CD2 4.42Å; S360-L382 VanDerWaalsContact OG-CD1 3.24Å; S360-L382 WeakPolarHBondContact OG-CD1 2.88Å; S361-L382 WeakPolarHBondContact OG-CB 3.08Å; I363-L382 HydrophobicContact CB-CD2 4.37Å; I363-L382 HydrophobicContact CG1-CD2 3.98Å; F380-L382 HydrophobicContact CB-CD2 4.14Å; L382-N384 VanDerWaalsContact CB-OD1 3.3Å; L382-N384 WeakPolarHBondContact CB-OD1 3.44Å; L382-N384 PolarHBondContact O-N 2.94Å; L382-N384 VanDerWaalsContact O-N 3.13Å; L382-N385 PolarHBondContact O-N 3.02Å; L382-L386 HydrophobicContact CB-CB 4.12Å; L382-L386 HydrophobicContact CD1-CB 3.92Å; L382-L386 HydrophobicContact CD1-CD1 4.32Å; L382-L386 HydrophobicContact CG-CB 4.32Å; L382-L386 PolarHBondContact N-O 3.35Å; L382-E388 HydrophobicContact CD1-CG 4.05Å; L382-E388 WeakPolarHBondContact CD1-OE2 3.39Å
383	Q	87.4	Confident	85.7	Confident	71 Å²	71	24.4 Å²	24.4	33%	0.332	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.9	180	-68.9	-179.2	-5.4	0	0	113.2	Q22 K362 K364 N385 K695	Q22-Q383 PolarHBondContact NE2-O 3.46Å; K362-Q383 HydrophobicContact CB-CG 4.16Å; K362-Q383 PolarHBondContact O-N 3.46Å; K364-Q383 HydrophobicContact CB-CG 4.24Å; Q383-N385 VanDerWaalsContact C-N 3.26Å; Q383-N385 PolarHBondContact O-N 2.8Å; Q383-K695 PolarHBondContact O-NZ 3.42Å
384	N	87.3	Confident	85.9	Confident	37 Å²	37	19.2 Å²	19.2	20%	0.198	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	29.9	178.5	67.7	-6.3	0	0	0	113.8	S361 L382 L386 R413	S361-N384 WeakPolarHBondContact CB-ND2 3.45Å; S361-N384 PolarHBondContact OG-ND2 3.22Å; S361-N384 VanDerWaalsContact OG-ND2 3.16Å; S361-N384 PolarHBondContact OG-OD1 3.12Å; L382-N384 VanDerWaalsContact CB-OD1 3.3Å; L382-N384 WeakPolarHBondContact CB-OD1 3.44Å; L382-N384 PolarHBondContact O-N 2.94Å; L382-N384 VanDerWaalsContact O-N 3.13Å; N384-L386 WeakPolarHBondContact ND2-CD1 3.23Å; N384-L386 PolarHBondContact O-N 3.18Å; N384-L386 WeakPolarHBondContact OD1-CB 3.47Å; N384-L386 VanDerWaalsContact OD1-CD1 3.29Å; N384-L386 WeakPolarHBondContact OD1-CD1 3.31Å; N384-L386 WeakPolarHBondContact OD1-CG 3.17Å; N384-R413 HydrophobicContact CB-CB 4.42Å; N384-R413 WeakPolarHBondContact O-CA 3.37Å
385	N	88.3	Confident	85.8	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.011	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	43.2	173.9	-168.9	22.1	0	0	0	112.2	G17 I19 G20 L382 Q383 H412 K695	G17-N385 PolarHBondContact O-ND2 3.02Å; I19-N385 WeakPolarHBondContact CA-OD1 3.37Å; I19-N385 WeakPolarHBondContact CB-OD1 3.49Å; I19-N385 WeakPolarHBondContact CD1-O 3.25Å; I19-N385 PolarHBondContact N-OD1 2.82Å; G20-N385 PolarHBondContact N-OD1 3.17Å; G20-N385 PolarHBondContact O-OD1 3.03Å; L382-N385 PolarHBondContact O-N 3.02Å; Q383-N385 VanDerWaalsContact C-N 3.26Å; Q383-N385 PolarHBondContact O-N 2.8Å; N385-H412 WeakPolarHBondContact CB-O 3.33Å; N385-H412 PolarHBondContact ND2-O 2.72Å; N385-K695 HydrophobicContact CB-CD 3.95Å
386	L	88.8	Confident	85.1	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145.6	179.6	-72.5	176.3	0	0	0	110.7	L382 N384 I407 T408	L382-L386 HydrophobicContact CB-CB 4.12Å; L382-L386 HydrophobicContact CD1-CB 3.92Å; L382-L386 HydrophobicContact CD1-CD1 4.32Å; L382-L386 HydrophobicContact CG-CB 4.32Å; L382-L386 PolarHBondContact N-O 3.35Å; N384-L386 WeakPolarHBondContact ND2-CD1 3.23Å; N384-L386 PolarHBondContact O-N 3.18Å; N384-L386 WeakPolarHBondContact OD1-CB 3.47Å; N384-L386 VanDerWaalsContact OD1-CD1 3.29Å; N384-L386 WeakPolarHBondContact OD1-CD1 3.31Å; N384-L386 WeakPolarHBondContact OD1-CG 3.17Å; L386-I407 WeakPolarHBondContact CD2-O 3.19Å; L386-T408 HydrophobicContact CD2-CG2 3.83Å
387	V	90.4	Very high	84	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.6	169.2	177.3	0	0	0	0	109.2	I19 I26 V41 L52 V379 F380 L381 R406 I407	I19-V387 HydrophobicContact CG2-CB 4.43Å; I19-V387 HydrophobicContact CG2-CG2 3.75Å; I26-V387 HydrophobicContact CD1-CG1 3.98Å; I26-V387 HydrophobicContact CD1-CG2 3.95Å; V41-V387 HydrophobicContact CG2-CG2 4.18Å; L52-V387 HydrophobicContact CD2-CG1 4.18Å; V379-V387 HydrophobicContact CG1-CG1 3.9Å; F380-V387 VanDerWaalsContact O-CA 3.27Å; F380-V387 WeakPolarHBondContact O-CA 3.32Å; L381-V387 HydrophobicContact CD1-CG2 3.97Å; V387-R406 WeakPolarHBondContact O-CA 3.41Å; V387-I407 HydrophobicContact CB-CB 4.38Å; V387-I407 HydrophobicContact CB-CD1 4.39Å; V387-I407 HydrophobicContact CG1-CD1 4.47Å; V387-I407 PolarHBondContact O-N 2.84Å
388	E	90.1	Very high	82.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.9	177.4	-65.4	-166.9	129.8	0	0	110.4	S360 V379 F380 L382 Y390 R403 R406	S360-E388 PolarHBondContact N-OE2 2.96Å; S360-E388 VanDerWaalsContact OG-CD 3.22Å; S360-E388 PolarHBondContact OG-OE1 3.41Å; S360-E388 PolarHBondContact OG-OE2 2.72Å; V379-E388 WeakPolarHBondContact CA-O 3.4Å; F380-E388 PolarHBondContact N-O 3.18Å; F380-E388 PolarHBondContact O-N 2.59Å; F380-E388 VanDerWaalsContact O-N 3.09Å; L382-E388 HydrophobicContact CD1-CG 4.05Å; L382-E388 WeakPolarHBondContact CD1-OE2 3.39Å; E388-Y390 HydrophobicContact CB-CD2 4.34Å; E388-Y390 HydrophobicContact CB-CE2 3.88Å; E388-R403 IonicContact OE1-CZ 3.6Å; E388-R403 IonicContact OE1-NH1 3.75Å; E388-R403 PolarHBondContact OE1-NH1 2.94Å; E388-R406 HydrophobicContact CG-CG 4.08Å; E388-R406 IonicContact OE1-NE 2.74Å
389	L	90.1	Very high	82	Confident	9 Å²	9	35 Å²	35	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.2	172.7	174	70.8	0	0	0	109.2	F28 L52 K377 A378 V379 T404 S405	F28-L389 HydrophobicContact CZ-CD1 4.17Å; L52-L389 HydrophobicContact CD1-CB 4.36Å; L52-L389 HydrophobicContact CD1-CD1 4.09Å; L52-L389 HydrophobicContact CD1-CD2 3.94Å; L52-L389 HydrophobicContact CD1-CG 4.34Å; K377-L389 HydrophobicContact CB-CD1 4.09Å; A378-L389 WeakPolarHBondContact O-CA 3.37Å; V379-L389 HydrophobicContact CG2-CB 4.32Å; V379-L389 HydrophobicContact CG2-CD1 3.43Å; V379-L389 VanDerWaalsContact CG2-CD1 3.43Å; V379-L389 HydrophobicContact CG2-CG 4.45Å; L389-T404 HydrophobicContact CD2-CG2 4.11Å; L389-T404 PolarHBondContact O-N 2.91Å; L389-S405 WeakPolarHBondContact CB-OG 3.41Å; L389-S405 PolarHBondContact N-O 3.07Å; L389-S405 PolarHBondContact O-N 2.78Å
390	Y	89.6	Confident	81.3	Confident	20 Å²	20	43 Å²	43	8%	0.078	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.6	170.9	-73.1	-104.2	0	0	0	110.5	I357 K358 T359 K377 A378 F380 E388 P401 V402 R403	I357-Y390 HydrophobicContact CG2-CD1 3.55Å; I357-Y390 HydrophobicContact CG2-CD2 4.06Å; I357-Y390 HydrophobicContact CG2-CE1 3.76Å; I357-Y390 HydrophobicContact CG2-CE2 4.27Å; I357-Y390 HydrophobicContact CG2-CG 3.67Å; K358-Y390 PolarHBondContact O-OH 3.15Å; K358-Y390 VanDerWaalsContact O-OH 3.13Å; T359-Y390 HydrophobicContact CG2-CE2 4.16Å; K377-Y390 WeakPolarHBondContact CA-O 3.41Å; A378-Y390 PolarHBondContact N-O 3.24Å; A378-Y390 PolarHBondContact O-N 2.97Å; F380-Y390 AromaticContact CD2-CD2 3.58Å; F380-Y390 HydrophobicContact CD2-CD2 3.58Å; F380-Y390 HydrophobicContact CD2-CE2 4.04Å; F380-Y390 AromaticContact CE2-CD2 3.43Å; F380-Y390 HydrophobicContact CE2-CD2 3.43Å; F380-Y390 VanDerWaalsContact CE2-CD2 3.43Å; F380-Y390 HydrophobicContact CE2-CE2 4.12Å; F380-Y390 HydrophobicContact CE2-CG 4.02Å; E388-Y390 HydrophobicContact CB-CD2 4.34Å; E388-Y390 HydrophobicContact CB-CE2 3.88Å; Y390-P401 HydrophobicContact CD1-CB 4.09Å; Y390-V402 CarbonylContact C-O 3.51Å; Y390-V402 WeakPolarHBondContact CA-O 3.34Å; Y390-R403 HydrophobicContact CD1-CB 4.02Å; Y390-R403 HydrophobicContact CD1-CG 4.45Å; Y390-R403 HydrophobicContact CD2-CG 4.36Å; Y390-R403 HydrophobicContact CE1-CB 3.75Å; Y390-R403 HydrophobicContact CE1-CG 4.13Å; Y390-R403 HydrophobicContact CE2-CG 4.01Å
391	S	87.4	Confident	80.8	Confident	20 Å²	20	45 Å²	45	14%	0.14	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.2	172.1	56.7	0	0	0	0	109.9	L376 V402 T404	L376-S391 CarbonylContact O-C 3.6Å; L376-S391 WeakPolarHBondContact O-CA 3.34Å; S391-V402 PolarHBondContact N-O 3.36Å; S391-V402 PolarHBondContact O-N 2.74Å; S391-V402 PolarHBondContact OG-O 2.73Å; S391-T404 PolarHBondContact OG-OG1 2.8Å
392	L	84.4	Confident	80.6	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	123.7	179.8	-174.2	91.1	0	0	0	109.7	V354 A355 L376 T394 P399 P401	V354-L392 HydrophobicContact CG1-CD2 4.21Å; A355-L392 HydrophobicContact CB-CD1 4.09Å; L376-L392 HydrophobicContact CB-CB 4.31Å; L376-L392 WeakPolarHBondContact CB-O 3.36Å; L376-L392 HydrophobicContact CD2-CD2 4.08Å; L376-L392 PolarHBondContact N-O 3.12Å; L376-L392 PolarHBondContact O-N 3Å; L392-T394 HydrophobicContact CD2-CG2 4.07Å; L392-T394 PolarHBondContact O-N 3.34Å; L392-P399 HydrophobicContact CD1-CB 3.69Å; L392-P399 HydrophobicContact CD1-CG 4Å; L392-P399 HydrophobicContact CD2-CB 4.42Å; L392-P399 HydrophobicContact CD2-CG 4.21Å; L392-P399 HydrophobicContact CG-CB 3.86Å; L392-P399 HydrophobicContact CG-CG 4.17Å; L392-P401 HydrophobicContact CD1-CB 4.17Å
393	N	78.9	Confident	80.3	Confident	58 Å²	58	54.8 Å²	54.8	31%	0.31	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	102.2	178.7	-69.9	-6	0	0	0	110.2	E375 S395 L396 P399	E375-N393 WeakPolarHBondContact CB-OD1 3.46Å; E375-N393 WeakPolarHBondContact CG-OD1 3.06Å; E375-N393 PolarHBondContact OE1-OD1 3.08Å; N393-S395 PolarHBondContact O-N 2.98Å; N393-L396 HydrophobicContact CB-CD1 4.44Å; N393-L396 PolarHBondContact O-N 2.98Å; N393-P399 VanDerWaalsContact O-CB 3.27Å; N393-P399 WeakPolarHBondContact O-CB 3.39Å
394	T	69.4	Low	80.1	Confident	52 Å²	52	55.3 Å²	55.3	32%	0.319	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.6	-172.1	55.1	0	0	0	0	114.1	I292 G374 L376 L392 L396	I292-T394 HydrophobicContact CD1-CG2 3.78Å; G374-T394 PolarHBondContact O-OG1 3.47Å; L376-T394 HydrophobicContact CB-CG2 4.01Å; L392-T394 HydrophobicContact CD2-CG2 4.07Å; L392-T394 PolarHBondContact O-N 3.34Å; T394-L396 VanDerWaalsContact C-N 3.31Å
395	S	65.9	Low	79.9	Confident	104 Å²	104	54.7 Å²	54.7	73%	0.727	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-20.2	175	56	0	0	0	0	113.7	N393	N393-S395 PolarHBondContact O-N 2.98Å
396	L	67.9	Low	79.8	Confident	99 Å²	99	58.7 Å²	58.7	52%	0.518	33%	0.325	S	S	.	.	S	Bend	trans	-84.8	138.7	178.8	-69.2	170.3	0	0	0	110.9	N393 T394 T398 P399	N393-L396 HydrophobicContact CB-CD1 4.44Å; N393-L396 PolarHBondContact O-N 2.98Å; T394-L396 VanDerWaalsContact C-N 3.31Å; L396-T398 PolarHBondContact O-N 2.87Å; L396-P399 WeakPolarHBondContact O-CD 3.28Å
397	P	59.8	Low	79.6	Confident	127 Å²	127	59 Å²	59	83%	0.825	33%	0.326	S	S	*	.	S	Bend	trans	-65.6	-21.9	-177.9	23.5	-31.5	0	0	0	114.2
398	T	64.7	Low	79.2	Confident	117 Å²	117	61.1 Å²	61.1	72%	0.718	34%	0.339	S	S	*	.	S	Bend	trans	-134.4	83.2	171.4	52.5	0	0	0	0	109.5	L396 Q400	L396-T398 PolarHBondContact O-N 2.87Å; T398-Q400 PolarHBondContact O-N 2.87Å
399	P	70.6	Confident	78.5	Confident	11 Å²	11	66.4 Å²	66.4	7%	0.071	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-78.9	124.8	-173.9	33	-33.6	0	0	0	110.3	V354 A355 L392 N393 L396	V354-P399 HydrophobicContact CG1-CG 3.28Å; A355-P399 HydrophobicContact CB-CG 4.33Å; A355-P399 WeakPolarHBondContact CB-O 3.42Å; L392-P399 HydrophobicContact CD1-CB 3.69Å; L392-P399 HydrophobicContact CD1-CG 4Å; L392-P399 HydrophobicContact CD2-CB 4.42Å; L392-P399 HydrophobicContact CD2-CG 4.21Å; L392-P399 HydrophobicContact CG-CB 3.86Å; L392-P399 HydrophobicContact CG-CG 4.17Å; N393-P399 VanDerWaalsContact O-CB 3.27Å; N393-P399 WeakPolarHBondContact O-CB 3.39Å; L396-P399 WeakPolarHBondContact O-CD 3.28Å
400	Q	75.5	Confident	77.8	Confident	166 Å²	166	66.7 Å²	66.7	78%	0.776	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-89.3	131.1	172.3	-70.8	-172.5	-6.2	0	0	109.6	T398 V402	T398-Q400 PolarHBondContact O-N 2.87Å; Q400-V402 PolarHBondContact O-N 2.91Å
401	P	80.6	Confident	77.5	Confident	43 Å²	43	65.9 Å²	65.9	28%	0.279	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-72.7	122.5	178	29.3	-33.2	0	0	0	110.2	I357 Y390 L392	I357-P401 HydrophobicContact CB-CB 4.41Å; I357-P401 HydrophobicContact CD1-CB 4.19Å; I357-P401 HydrophobicContact CG1-CB 3.86Å; I357-P401 HydrophobicContact CG1-CG 4.3Å; I357-P401 HydrophobicContact CG2-CB 4.15Å; Y390-P401 HydrophobicContact CD1-CB 4.09Å; L392-P401 HydrophobicContact CD1-CB 4.17Å
402	V	84.9	Confident	77.5	Confident	88 Å²	88	65 Å²	65	53%	0.533	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.2	175.7	179.3	0	0	0	0	108.6	Y390 S391 Q400 T404	Y390-V402 CarbonylContact C-O 3.51Å; Y390-V402 WeakPolarHBondContact CA-O 3.34Å; S391-V402 PolarHBondContact N-O 3.36Å; S391-V402 PolarHBondContact O-N 2.74Å; S391-V402 PolarHBondContact OG-O 2.73Å; Q400-V402 PolarHBondContact O-N 2.91Å; V402-T404 PolarHBondContact O-N 2.7Å
403	R	84.1	Confident	77.7	Confident	121 Å²	121	69.1 Å²	69.1	46%	0.457	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	114.5	174	-167.2	179.6	73.3	-175.4	-6.2	109.4	E388 Y390	E388-R403 IonicContact OE1-CZ 3.6Å; E388-R403 IonicContact OE1-NH1 3.75Å; E388-R403 PolarHBondContact OE1-NH1 2.94Å; Y390-R403 HydrophobicContact CD1-CB 4.02Å; Y390-R403 HydrophobicContact CD1-CG 4.45Å; Y390-R403 HydrophobicContact CD2-CG 4.36Å; Y390-R403 HydrophobicContact CE1-CB 3.75Å; Y390-R403 HydrophobicContact CE1-CG 4.13Å; Y390-R403 HydrophobicContact CE2-CG 4.01Å
404	T	84.4	Confident	78.1	Confident	82 Å²	82	67.5 Å²	67.5	50%	0.503	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-48.8	-175.6	-41.4	0	0	0	0	112.2	L389 S391 V402	L389-T404 HydrophobicContact CD2-CG2 4.11Å; L389-T404 PolarHBondContact O-N 2.91Å; S391-T404 PolarHBondContact OG-OG1 2.8Å; V402-T404 PolarHBondContact O-N 2.7Å
405	S	81.6	Confident	79.1	Confident	24 Å²	24	66.2 Å²	66.2	17%	0.168	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	156.3	-176.9	70.8	0	0	0	0	112.7	L52 L389	L52-S405 WeakPolarHBondContact O-CB 3.46Å; L52-S405 PolarHBondContact O-OG 3.4Å; L389-S405 WeakPolarHBondContact CB-OG 3.41Å; L389-S405 PolarHBondContact N-O 3.07Å; L389-S405 PolarHBondContact O-N 2.78Å
406	R	86.1	Confident	80.3	Confident	86 Å²	86	61.2 Å²	61.2	33%	0.325	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	128.3	177.6	-176.7	-175	-179.6	-172.8	2.7	109.3	V387 E388 T408	V387-R406 WeakPolarHBondContact O-CA 3.41Å; E388-R406 HydrophobicContact CG-CG 4.08Å; E388-R406 IonicContact OE1-NE 2.74Å; R406-T408 HydrophobicContact CG-CG2 3.63Å; R406-T408 VanDerWaalsContact NE-CG2 3.27Å
407	I	85.4	Confident	81.5	Confident	7 Å²	7	58.8 Å²	58.8	4%	0.036	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.6	174.9	-56	178	0	0	0	108.4	I19 W50 L52 L386 V387	I19-I407 HydrophobicContact CD1-CG2 4.04Å; I19-I407 HydrophobicContact CG1-CG2 4.34Å; I19-I407 HydrophobicContact CG2-CB 4.47Å; I19-I407 HydrophobicContact CG2-CG2 4.05Å; W50-I407 HydrophobicContact CB-CD1 3.89Å; W50-I407 HydrophobicContact CD2-CD1 4.16Å; W50-I407 HydrophobicContact CE3-CD1 4.12Å; W50-I407 HydrophobicContact CE3-CG2 4.14Å; W50-I407 HydrophobicContact CG-CD1 4.11Å; W50-I407 HydrophobicContact CH2-CG2 4.29Å; W50-I407 HydrophobicContact CZ3-CG2 3.99Å; L52-I407 HydrophobicContact CD2-CD1 4.1Å; L386-I407 WeakPolarHBondContact CD2-O 3.19Å; V387-I407 HydrophobicContact CB-CB 4.38Å; V387-I407 HydrophobicContact CB-CD1 4.39Å; V387-I407 HydrophobicContact CG1-CD1 4.47Å; V387-I407 PolarHBondContact O-N 2.84Å
408	T	81.4	Confident	83	Confident	47 Å²	47	53.1 Å²	53.1	29%	0.288	28%	0.275	S	S	.	.			trans	-130.2	-25.4	-176.8	59.3	0	0	0	0	114.5	L386 R406 G410 K437	L386-T408 HydrophobicContact CD2-CG2 3.83Å; R406-T408 HydrophobicContact CG-CG2 3.63Å; R406-T408 VanDerWaalsContact NE-CG2 3.27Å; T408-G410 VanDerWaalsContact C-N 3.32Å; T408-G410 PolarHBondContact O-N 3.23Å; T408-K437 PolarHBondContact O-NZ 3.26Å
409	I	76.4	Confident	84.4	Confident	112 Å²	112	48 Å²	48	57%	0.574	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-36	-167.6	-63.9	165.3	0	0	0	110.2	G411 K437 C446	I409-G411 VanDerWaalsContact C-N 3.32Å; I409-G411 PolarHBondContact O-N 2.86Å; I409-K437 PolarHBondContact O-NZ 2.77Å; I409-C446 HydrophobicContact CG2-CB 3.97Å; I409-C446 WeakPolarHBondContact O-CB 3.48Å
410	G	74.2	Confident	85.4	Confident	14 Å²	14	48.5 Å²	48.5	14%	0.144	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-0.2	-172.6	0	0	0	0	0	117.6	G17 L18 T408	G17-G410 CarbonylContact C-O 3.56Å; G17-G410 VanDerWaalsContact C-O 3.26Å; G17-G410 WeakPolarHBondContact CA-O 3.39Å; L18-G410 PolarHBondContact N-O 3.13Å; T408-G410 VanDerWaalsContact C-N 3.32Å; T408-G410 PolarHBondContact O-N 3.23Å
411	G	83.1	Confident	86.3	Confident	4 Å²	4	41.3 Å²	41.3	4%	0.041	21%	0.214	C	C	.	.			trans	-167.1	161.8	-179.5	0	0	0	0	0	117.7	G17 I409 K437	G17-G411 WeakPolarHBondContact O-CA 3.17Å; I409-G411 VanDerWaalsContact C-N 3.32Å; I409-G411 PolarHBondContact O-N 2.86Å; G411-K437 WeakPolarHBondContact O-CE 3.34Å
412	H	88.9	Confident	86.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.			trans	-78.4	151.1	171.5	-75.5	-86.4	0	0	0	111.1	G17 N385 S414 V416 S430 S432 S435	G17-H412 PolarHBondContact O-N 2.73Å; N385-H412 WeakPolarHBondContact CB-O 3.33Å; N385-H412 PolarHBondContact ND2-O 2.72Å; H412-S414 WeakPolarHBondContact CB-O 3.47Å; H412-V416 HydrophobicContact CB-CG2 3.93Å; H412-V416 VanDerWaalsContact CD2-CG2 3.44Å; H412-V416 WeakPolarHBondContact CD2-CG2 3.47Å; H412-S430 PolarHBondContact CE1-O 2.82Å; H412-S430 PolarHBondContact CE1-OG 3.36Å; H412-S430 WeakPolarHBondContact NE2-CB 3.26Å; H412-S430 PolarHBondContact NE2-OG 3.5Å; H412-S432 WeakPolarHBondContact ND1-CB 3.25Å; H412-S432 PolarHBondContact ND1-OG 3.44Å; H412-S435 PolarHBondContact CE1-O 3.22Å; H412-S435 PolarHBondContact ND1-O 3.36Å
413	R	87	Confident	87	Confident	89 Å²	89	38.2 Å²	38.2	34%	0.336	20%	0.197	S	C	.	.	S	Bend	trans	-86.9	-41.9	-178.3	-64.6	171.6	-174.4	168.7	3.9	112.6	N384 D434 K695	N384-R413 HydrophobicContact CB-CB 4.42Å; N384-R413 WeakPolarHBondContact O-CA 3.37Å; R413-D434 WeakPolarHBondContact CD-OD2 3.32Å; R413-D434 IonicContact CZ-OD2 2.74Å; R413-D434 IonicContact NE-OD2 3.81Å; R413-D434 IonicContact NH1-OD1 2.9Å; R413-D434 IonicContact NH1-OD2 3.99Å; R413-D434 PolarHBondContact NH1-OD2 2.82Å; R413-K695 PolarHBondContact O-NZ 3.14Å
414	S	88.3	Confident	87.2	Confident	24 Å²	24	37.9 Å²	37.9	17%	0.168	20%	0.204	C	C	.	.	S	Bend	trans	-97.7	175.5	171	70.6	0	0	0	0	110	H412 S432 A433	H412-S414 WeakPolarHBondContact CB-O 3.47Å; S414-S432 VanDerWaalsContact OG-CB 3.23Å; S414-S432 WeakPolarHBondContact OG-CB 2.74Å; S414-S432 PolarHBondContact OG-OG 3.36Å; S414-A433 WeakPolarHBondContact OG-CB 3.27Å; S414-A433 PolarHBondContact OG-N 3.33Å
415	D	89.6	Confident	87.4	Confident	25 Å²	25	34.6 Å²	34.6	13%	0.134	18%	0.183	C	C	.	.			trans	-55	144	163.4	55	-28.3	0	0	0	111.6	R417 S432 H693	D415-R417 IonicContact OD2-NH1 3.91Å; D415-S432 VanDerWaalsContact O-CB 3.3Å; D415-S432 WeakPolarHBondContact O-CB 3.47Å; D415-H693 IonicContact OD2-ND1 2.99Å
416	V	92.4	Very high	87.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	122.9	176.2	176.4	0	0	0	0	107.6	H412 T418 L419 A691 L697	H412-V416 HydrophobicContact CB-CG2 3.93Å; H412-V416 VanDerWaalsContact CD2-CG2 3.44Å; H412-V416 WeakPolarHBondContact CD2-CG2 3.47Å; V416-T418 WeakPolarHBondContact CG1-O 3.32Å; V416-L419 HydrophobicContact CG1-CD2 4.36Å; V416-L419 HydrophobicContact CG1-CG 4.45Å; V416-A691 HydrophobicContact CB-CB 3.82Å; V416-A691 HydrophobicContact CG1-CB 3.79Å; V416-L697 HydrophobicContact CB-CD2 4.44Å; V416-L697 HydrophobicContact CG1-CD2 4.22Å; V416-L697 HydrophobicContact CG2-CD2 4.27Å
417	R	91.9	Very high	88.1	Confident	47 Å²	47	34.4 Å²	34.4	18%	0.177	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-26.3	-176.2	-64.3	-58.3	-58.5	-175.4	4.1	112.3	D415 A431 Y454 A455 W677 C678	D415-R417 IonicContact OD2-NH1 3.91Å; R417-A431 PolarHBondContact N-O 3.32Å; R417-Y454 HydrophobicContact CG-CE1 4.24Å; R417-A455 VanDerWaalsContact CB-O 3.3Å; R417-A455 WeakPolarHBondContact CB-O 3.37Å; R417-A455 WeakPolarHBondContact CG-O 3.41Å; R417-W677 VanDerWaalsContact NH1-CE2 3.28Å; R417-W677 VanDerWaalsContact NH1-CH2 3.28Å; R417-W677 VanDerWaalsContact NH2-CE3 3.34Å; R417-W677 VanDerWaalsContact NH2-CZ3 3.32Å; R417-C678 WeakPolarHBondContact O-CB 3.4Å
418	T	92.1	Very high	88.4	Confident	8 Å²	8	34.2 Å²	34.2	5%	0.049	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	148	-169.9	74.7	0	0	0	0	111.9	V416 S430 A431 L456 C457 S458 C678	V416-T418 WeakPolarHBondContact CG1-O 3.32Å; T418-S430 WeakPolarHBondContact O-CA 3.35Å; T418-A431 PolarHBondContact N-O 3.04Å; T418-A431 PolarHBondContact O-N 2.85Å; T418-A431 VanDerWaalsContact O-N 3.11Å; T418-A431 WeakPolarHBondContact OG1-CB 3.16Å; T418-L456 WeakPolarHBondContact CG2-O 3.16Å; T418-C457 VanDerWaalsContact CG2-N 3.33Å; T418-S458 VanDerWaalsContact CB-OG 3.23Å; T418-S458 WeakPolarHBondContact CB-OG 3.46Å; T418-S458 WeakPolarHBondContact OG1-CB 3.5Å; T418-S458 PolarHBondContact OG1-OG 3.41Å; T418-C678 VanDerWaalsContact C-SG 3.59Å
419	L	94	Very high	89	Confident	10 Å²	10	32 Å²	32	5%	0.052	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	145	174.5	-74	170.1	0	0	0	109.9	V416 V428 L429 C678 A680 V689 A691 L697	V416-L419 HydrophobicContact CG1-CD2 4.36Å; V416-L419 HydrophobicContact CG1-CG 4.45Å; L419-V428 HydrophobicContact CD2-CG1 4.22Å; L419-L429 VanDerWaalsContact CA-O 3.31Å; L419-L429 WeakPolarHBondContact CA-O 3.36Å; L419-L429 WeakPolarHBondContact CD2-O 3.17Å; L419-C678 VanDerWaalsContact CG-SG 3.57Å; L419-A680 HydrophobicContact CB-CB 3.83Å; L419-V689 HydrophobicContact CD1-CB 4.42Å; L419-V689 HydrophobicContact CD1-CG1 3.75Å; L419-V689 HydrophobicContact CD2-CG1 4.08Å; L419-A691 HydrophobicContact CD1-CB 3.66Å; L419-A691 HydrophobicContact CG-CB 4.15Å; L419-L697 HydrophobicContact CD1-CD2 4.38Å; L419-L697 HydrophobicContact CD2-CD2 3.86Å
420	S	92.6	Very high	89.8	Confident	22 Å²	22	26.6 Å²	26.6	15%	0.154	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	146.8	171.6	-168	0	0	0	0	110.1	L429 F460	S420-L429 PolarHBondContact N-O 3.41Å; S420-L429 PolarHBondContact O-N 3.11Å; S420-F460 WeakPolarHBondContact O-CE2 3.45Å
421	F	93.3	Very high	90.7	Very high	15 Å²	15	26 Å²	26	7%	0.066	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	142.6	171.6	-87.2	-79	0	0	0	110.1	V428 F460 A680 V681 V689	F421-V428 HydrophobicContact CD1-CG2 3.84Å; F421-V428 HydrophobicContact CE1-CG2 3.59Å; F421-V428 HydrophobicContact CZ-CG2 4.34Å; F421-F460 WeakPolarHBondContact O-CD2 2.91Å; F421-A680 HydrophobicContact CD2-CB 3.8Å; F421-A680 HydrophobicContact CE2-CB 4.13Å; F421-A680 WeakPolarHBondContact CE2-O 3.43Å; F421-V681 VanDerWaalsContact CD2-C 3.46Å; F421-V689 HydrophobicContact CE1-CG2 4.08Å; F421-V689 HydrophobicContact CE2-CB 4.12Å; F421-V689 HydrophobicContact CE2-CG2 3.92Å; F421-V689 HydrophobicContact CZ-CB 4.1Å; F421-V689 HydrophobicContact CZ-CG2 3.38Å
422	S	92.5	Very high	91.1	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.021	14%	0.137	C	C	.	.			trans	-61.7	149.6	165.8	63.9	0	0	0	0	110.1	D424 N425 I426 A427 F460 D464	S422-D424 PolarHBondContact O-N 2.84Å; S422-N425 PolarHBondContact O-N 3.04Å; S422-N425 PolarHBondContact OG-N 3.06Å; S422-I426 PolarHBondContact OG-N 3.02Å; S422-A427 WeakPolarHBondContact CB-O 3.42Å; S422-A427 PolarHBondContact N-O 2.89Å; S422-A427 PolarHBondContact OG-N 3.44Å; S422-A427 PolarHBondContact OG-O 3.36Å; S422-F460 VanDerWaalsContact N-CE2 3.32Å; S422-D464 WeakPolarHBondContact CB-OD2 3.27Å
423	S	87.8	Confident	91.1	Very high	63 Å²	63	26.9 Å²	26.9	44%	0.441	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-33.6	174.3	65.3	0	0	0	0	113.1	N425 D464	S423-N425 VanDerWaalsContact C-N 3.27Å; S423-N425 PolarHBondContact O-N 2.78Å; S423-D464 WeakPolarHBondContact CA-OD2 3.47Å; S423-D464 WeakPolarHBondContact CB-OD2 3.47Å; S423-D464 VanDerWaalsContact N-CG 3.34Å; S423-D464 PolarHBondContact N-OD1 2.89Å; S423-D464 PolarHBondContact N-OD2 2.88Å; S423-D464 PolarHBondContact OG-OD1 2.76Å; S423-D464 PolarHBondContact OG-OD2 3.25Å
424	D	87.7	Confident	91.1	Very high	114 Å²	114	25.8 Å²	25.8	61%	0.61	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-0.5	177.6	-69.2	-18.9	0	0	0	114.6	S422 I426 D464	S422-D424 PolarHBondContact O-N 2.84Å; D424-I426 HydrophobicContact CB-CD1 4.19Å; D424-I426 HydrophobicContact CB-CG1 4.29Å; D424-I426 PolarHBondContact O-N 3.45Å; D424-I426 VanDerWaalsContact O-N 3.13Å; D424-D464 PolarHBondContact N-OD2 3.27Å
425	N	88.4	Confident	91.3	Very high	12 Å²	12	25 Å²	25	6%	0.064	14%	0.142	C	C	.	.	S	Bend	trans	58	12.4	-171.9	-56.4	-58.8	0	0	0	115.7	S422 S423 R441 S682 P683 N684	S422-N425 PolarHBondContact O-N 3.04Å; S422-N425 PolarHBondContact OG-N 3.06Å; S423-N425 VanDerWaalsContact C-N 3.27Å; S423-N425 PolarHBondContact O-N 2.78Å; N425-R441 WeakPolarHBondContact O-CD 3.33Å; N425-R441 WeakPolarHBondContact O-CG 3.44Å; N425-R441 PolarHBondContact O-NE 2.8Å; N425-S682 WeakPolarHBondContact OD1-CB 3.41Å; N425-P683 WeakPolarHBondContact OD1-CD 3.46Å; N425-N684 PolarHBondContact ND2-ND2 3.49Å; N425-N684 VanDerWaalsContact ND2-ND2 3.19Å; N425-N684 PolarHBondContact ND2-OD1 2.81Å
426	I	90.3	Very high	91.4	Very high	92 Å²	92	23.9 Å²	23.9	47%	0.472	14%	0.136	S	C	.	.	S	Bend	trans	-87	-38.7	-178.1	-63.6	168.9	0	0	0	111.3	S422 D424 N440 R441	S422-I426 PolarHBondContact OG-N 3.02Å; D424-I426 HydrophobicContact CB-CD1 4.19Å; D424-I426 HydrophobicContact CB-CG1 4.29Å; D424-I426 PolarHBondContact O-N 3.45Å; D424-I426 VanDerWaalsContact O-N 3.13Å; I426-N440 PolarHBondContact O-OD1 3.09Å; I426-R441 WeakPolarHBondContact O-CG 3.49Å; I426-R441 PolarHBondContact O-N 3.02Å
427	A	92	Very high	91.4	Very high	15 Å²	15	24.1 Å²	24.1	12%	0.124	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	145.4	-174.3	0	0	0	0	0	111.8	S422 I438 W439 F460	S422-A427 WeakPolarHBondContact CB-O 3.42Å; S422-A427 PolarHBondContact N-O 2.89Å; S422-A427 PolarHBondContact OG-N 3.44Å; S422-A427 PolarHBondContact OG-O 3.36Å; A427-I438 HydrophobicContact CB-CG2 3.92Å; A427-W439 CarbonylContact C-O 3.52Å; A427-W439 VanDerWaalsContact CA-O 3.29Å; A427-W439 WeakPolarHBondContact CA-O 3.44Å; A427-F460 HydrophobicContact CB-CZ 4.3Å
428	V	93.3	Very high	91.5	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.012	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.3	171.8	-179.4	0	0	0	0	107.7	L419 F421 I438 W439 V689	L419-V428 HydrophobicContact CD2-CG1 4.22Å; F421-V428 HydrophobicContact CD1-CG2 3.84Å; F421-V428 HydrophobicContact CE1-CG2 3.59Å; F421-V428 HydrophobicContact CZ-CG2 4.34Å; V428-I438 CarbonylContact O-C 3.53Å; V428-I438 WeakPolarHBondContact O-CA 3.4Å; V428-W439 HydrophobicContact CB-CB 4.36Å; V428-W439 PolarHBondContact N-O 3.36Å; V428-W439 PolarHBondContact O-N 2.82Å; V428-V689 HydrophobicContact CG1-CB 4.47Å; V428-V689 HydrophobicContact CG1-CG1 4.17Å; V428-V689 HydrophobicContact CG1-CG2 4.3Å; V428-V689 HydrophobicContact CG2-CG2 4.11Å
429	L	93.4	Very high	91.5	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	133.3	170.3	-173.1	108.4	0	0	0	109.3	L419 S420 I436 I438 S458 F460 V467	L419-L429 VanDerWaalsContact CA-O 3.31Å; L419-L429 WeakPolarHBondContact CA-O 3.36Å; L419-L429 WeakPolarHBondContact CD2-O 3.17Å; S420-L429 PolarHBondContact N-O 3.41Å; S420-L429 PolarHBondContact O-N 3.11Å; L429-I436 HydrophobicContact CD1-CG2 3.76Å; L429-I436 HydrophobicContact CG-CG2 4.17Å; L429-I438 HydrophobicContact CD1-CG1 4.06Å; L429-S458 WeakPolarHBondContact CD2-OG 3.3Å; L429-F460 HydrophobicContact CB-CD2 4.17Å; L429-F460 HydrophobicContact CB-CE1 4.37Å; L429-F460 HydrophobicContact CB-CE2 3.39Å; L429-F460 HydrophobicContact CB-CZ 3.52Å; L429-F460 HydrophobicContact CD1-CE1 4.25Å; L429-F460 HydrophobicContact CD1-CZ 4.16Å; L429-F460 HydrophobicContact CG-CZ 4.5Å; L429-V467 HydrophobicContact CD1-CB 4.07Å; L429-V467 HydrophobicContact CD1-CG1 3.43Å; L429-V467 VanDerWaalsContact CD1-CG1 3.43Å; L429-V467 HydrophobicContact CD1-CG2 3.48Å; L429-V467 VanDerWaalsContact CD1-CG2 3.48Å; L429-V467 HydrophobicContact CD2-CG1 4.06Å; L429-V467 HydrophobicContact CG-CG1 4.4Å
430	S	93.9	Very high	91.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.6	165.7	57.9	0	0	0	0	110.2	H412 T418 I436 K437 W439	H412-S430 PolarHBondContact CE1-O 2.82Å; H412-S430 PolarHBondContact CE1-OG 3.36Å; H412-S430 WeakPolarHBondContact NE2-CB 3.26Å; H412-S430 PolarHBondContact NE2-OG 3.5Å; T418-S430 WeakPolarHBondContact O-CA 3.35Å; S430-I436 WeakPolarHBondContact O-CA 3.33Å; S430-K437 PolarHBondContact N-O 3.44Å; S430-K437 PolarHBondContact O-N 2.92Å; S430-K437 PolarHBondContact OG-O 3.02Å; S430-W439 PolarHBondContact OG-NE1 2.81Å
431	A	93.1	Very high	91.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	136.1	174.6	0	0	0	0	0	111	R417 T418 I436 A455	R417-A431 PolarHBondContact N-O 3.32Å; T418-A431 PolarHBondContact N-O 3.04Å; T418-A431 PolarHBondContact O-N 2.85Å; T418-A431 VanDerWaalsContact O-N 3.11Å; T418-A431 WeakPolarHBondContact OG1-CB 3.16Å; A431-I436 HydrophobicContact CB-CG1 4.33Å; A431-A455 HydrophobicContact CB-CB 3.62Å
432	S	91.8	Very high	91	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	177.6	175.5	83.7	0	0	0	0	109.5	H412 S414 D415 D434 S435	H412-S432 WeakPolarHBondContact ND1-CB 3.25Å; H412-S432 PolarHBondContact ND1-OG 3.44Å; S414-S432 VanDerWaalsContact OG-CB 3.23Å; S414-S432 WeakPolarHBondContact OG-CB 2.74Å; S414-S432 PolarHBondContact OG-OG 3.36Å; D415-S432 VanDerWaalsContact O-CB 3.3Å; D415-S432 WeakPolarHBondContact O-CB 3.47Å; S432-D434 PolarHBondContact O-N 3.09Å; S432-D434 VanDerWaalsContact O-N 3.08Å; S432-S435 PolarHBondContact N-O 3.49Å; S432-S435 PolarHBondContact OG-O 3.4Å; S432-S435 VanDerWaalsContact OG-O 3.1Å
433	A	88.9	Confident	90.8	Very high	23 Å²	23	32.9 Å²	32.9	19%	0.19	19%	0.189	C	C	.	.	S	Bend	trans	-61.5	-20.2	-174.7	0	0	0	0	0	115.6	S414 E453 Y454	S414-A433 WeakPolarHBondContact OG-CB 3.27Å; S414-A433 PolarHBondContact OG-N 3.33Å; A433-E453 CarbonylContact O-C 3.57Å; A433-Y454 HydrophobicContact CB-CD2 3.33Å; A433-Y454 HydrophobicContact CB-CE2 3.51Å; A433-Y454 HydrophobicContact CB-CG 3.95Å; A433-Y454 WeakPolarHBondContact O-CA 3.32Å; A433-Y454 PolarHBondContact O-N 3.16Å
434	D	86.6	Confident	90.8	Very high	66 Å²	66	32.1 Å²	32.1	35%	0.353	18%	0.18	S	C	.	.	S	Bend	trans	-122	-26.6	-172.6	-177.2	24.6	0	0	0	111.9	R413 S432 C452	R413-D434 WeakPolarHBondContact CD-OD2 3.32Å; R413-D434 IonicContact CZ-OD2 2.74Å; R413-D434 IonicContact NE-OD2 3.81Å; R413-D434 IonicContact NH1-OD1 2.9Å; R413-D434 IonicContact NH1-OD2 3.99Å; R413-D434 PolarHBondContact NH1-OD2 2.82Å; S432-D434 PolarHBondContact O-N 3.09Å; S432-D434 VanDerWaalsContact O-N 3.08Å; D434-C452 CarbonylContact C-O 3.58Å; D434-C452 PolarHBondContact O-N 2.91Å
435	S	91.2	Very high	90.8	Very high	8 Å²	8	32.8 Å²	32.8	6%	0.056	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	147.2	-171.7	66.1	0	0	0	0	113.3	H412 S432 M450	H412-S435 PolarHBondContact CE1-O 3.22Å; H412-S435 PolarHBondContact ND1-O 3.36Å; S432-S435 PolarHBondContact N-O 3.49Å; S432-S435 PolarHBondContact OG-O 3.4Å; S432-S435 VanDerWaalsContact OG-O 3.1Å; S435-M450 CarbonylContact C-O 3.59Å; S435-M450 VanDerWaalsContact CA-O 3.27Å; S435-M450 WeakPolarHBondContact CA-O 3.49Å
436	I	91.9	Very high	90.8	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.3	169.4	-51.5	143.2	0	0	0	107.1	L429 S430 A431 T449 M450 C452 I469 Y479	L429-I436 HydrophobicContact CD1-CG2 3.76Å; L429-I436 HydrophobicContact CG-CG2 4.17Å; S430-I436 WeakPolarHBondContact O-CA 3.33Å; A431-I436 HydrophobicContact CB-CG1 4.33Å; I436-T449 CarbonylContact O-C 3.58Å; I436-T449 VanDerWaalsContact O-CA 3.3Å; I436-T449 WeakPolarHBondContact O-CA 3.4Å; I436-M450 HydrophobicContact CB-CB 4.3Å; I436-M450 HydrophobicContact CD1-CB 4.07Å; I436-M450 PolarHBondContact N-O 3.24Å; I436-M450 PolarHBondContact O-N 3.25Å; I436-C452 HydrophobicContact CD1-CB 3.56Å; I436-C452 HydrophobicContact CG1-CB 3.67Å; I436-I469 HydrophobicContact CB-CD1 4.35Å; I436-I469 HydrophobicContact CD1-CD1 2.99Å; I436-I469 HydrophobicContact CD1-CG1 4.47Å; I436-I469 HydrophobicContact CG1-CD1 3.26Å; I436-I469 HydrophobicContact CG2-CD1 4.2Å; I436-Y479 HydrophobicContact CD1-CD1 4.41Å; I436-Y479 HydrophobicContact CD1-CD2 3.72Å; I436-Y479 HydrophobicContact CD1-CE1 4.14Å; I436-Y479 HydrophobicContact CD1-CE2 3.39Å; I436-Y479 HydrophobicContact CD1-CG 4.23Å
437	K	92.6	Very high	90.8	Very high	5 Å²	5	33.4 Å²	33.4	2%	0.022	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.8	173.9	-69.4	179.1	175	-95.7	0	110	T408 I409 G411 S430 W439 R448 T449	T408-K437 PolarHBondContact O-NZ 3.26Å; I409-K437 PolarHBondContact O-NZ 2.77Å; G411-K437 WeakPolarHBondContact O-CE 3.34Å; S430-K437 PolarHBondContact N-O 3.44Å; S430-K437 PolarHBondContact O-N 2.92Å; S430-K437 PolarHBondContact OG-O 3.02Å; K437-W439 HydrophobicContact CB-CZ2 4Å; K437-W439 HydrophobicContact CD-CH2 4.22Å; K437-W439 HydrophobicContact CD-CZ2 3.64Å; K437-W439 HydrophobicContact CG-CZ2 4.47Å; K437-R448 WeakPolarHBondContact CA-O 3.48Å; K437-T449 HydrophobicContact CG-CG2 4.06Å; K437-T449 PolarHBondContact NZ-OG1 2.99Å; K437-T449 VanDerWaalsContact NZ-OG1 3.08Å
438	I	93.4	Very high	90.6	Very high	7 Å²	7	38.4 Å²	38.4	4%	0.036	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.8	175.5	-61.3	167	0	0	0	107.4	A427 V428 L429 C446 I447 R448 M450 L481	A427-I438 HydrophobicContact CB-CG2 3.92Å; V428-I438 CarbonylContact O-C 3.53Å; V428-I438 WeakPolarHBondContact O-CA 3.4Å; L429-I438 HydrophobicContact CD1-CG1 4.06Å; I438-C446 CarbonylContact O-C 3.5Å; I438-C446 WeakPolarHBondContact O-CA 3.43Å; I438-I447 HydrophobicContact CG2-CD1 4.28Å; I438-I447 PolarHBondContact O-N 2.85Å; I438-R448 HydrophobicContact CD1-CB 4.42Å; I438-R448 PolarHBondContact N-O 2.8Å; I438-M450 HydrophobicContact CD1-CE 3.59Å; I438-L481 HydrophobicContact CD1-CD1 4.14Å; I438-L481 HydrophobicContact CD1-CD2 3.1Å; I438-L481 HydrophobicContact CD1-CG 4.15Å; I438-L481 HydrophobicContact CG1-CD2 4.46Å
439	W	92.6	Very high	90.5	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.015	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	138.5	-177	-51.8	86.4	0	0	0	108.8	F16 A427 V428 S430 K437 Q445 C446 L697	F16-W439 HydrophobicContact CD2-CB 4.5Å; F16-W439 AromaticContact CD2-CD2 3.74Å; F16-W439 HydrophobicContact CD2-CD2 3.74Å; F16-W439 AromaticContact CD2-CE3 3.67Å; F16-W439 HydrophobicContact CD2-CE3 3.67Å; F16-W439 HydrophobicContact CD2-CG 4.1Å; F16-W439 HydrophobicContact CD2-CZ3 4.17Å; F16-W439 HydrophobicContact CE2-CB 3.92Å; F16-W439 AromaticContact CE2-CD2 3.77Å; F16-W439 HydrophobicContact CE2-CD2 3.77Å; F16-W439 HydrophobicContact CE2-CE3 4.16Å; F16-W439 AromaticContact CE2-CG 3.63Å; F16-W439 HydrophobicContact CE2-CG 3.63Å; A427-W439 CarbonylContact C-O 3.52Å; A427-W439 VanDerWaalsContact CA-O 3.29Å; A427-W439 WeakPolarHBondContact CA-O 3.44Å; V428-W439 HydrophobicContact CB-CB 4.36Å; V428-W439 PolarHBondContact N-O 3.36Å; V428-W439 PolarHBondContact O-N 2.82Å; S430-W439 PolarHBondContact OG-NE1 2.81Å; K437-W439 HydrophobicContact CB-CZ2 4Å; K437-W439 HydrophobicContact CD-CH2 4.22Å; K437-W439 HydrophobicContact CD-CZ2 3.64Å; K437-W439 HydrophobicContact CG-CZ2 4.47Å; W439-Q445 WeakPolarHBondContact CA-O 3.46Å; W439-C446 HydrophobicContact CD2-CB 4.35Å; W439-C446 HydrophobicContact CE3-CB 3.85Å; W439-C446 HydrophobicContact CH2-CB 4.06Å; W439-C446 HydrophobicContact CZ3-CB 3.7Å; W439-L697 HydrophobicContact CZ2-CD1 4.28Å
440	N	92.4	Very high	90.4	Very high	32 Å²	32	41.9 Å²	41.9	17%	0.171	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.4	161.9	-172.4	-8.7	0	0	0	108	I426 S442 T443 L444 Q445 I447	I426-N440 PolarHBondContact O-OD1 3.09Å; N440-S442 VanDerWaalsContact C-N 3.3Å; N440-S442 PolarHBondContact ND2-OG 3.1Å; N440-S442 PolarHBondContact O-N 2.94Å; N440-S442 PolarHBondContact OD1-N 3.28Å; N440-S442 PolarHBondContact OD1-OG 2.66Å; N440-T443 WeakPolarHBondContact CB-OG1 3.43Å; N440-L444 WeakPolarHBondContact O-CA 3.45Å; N440-L444 PolarHBondContact O-N 3.4Å; N440-Q445 PolarHBondContact N-O 2.92Å; N440-I447 HydrophobicContact CB-CD1 3.92Å; N440-I447 HydrophobicContact CB-CG1 4.09Å
441	R	88.8	Confident	90.2	Very high	83 Å²	83	46.6 Å²	46.6	31%	0.313	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.5	178.4	71.3	157.5	175.7	110.3	5.8	113.3	N425 I426 L444 Y687	N425-R441 WeakPolarHBondContact O-CD 3.33Å; N425-R441 WeakPolarHBondContact O-CG 3.44Å; N425-R441 PolarHBondContact O-NE 2.8Å; I426-R441 WeakPolarHBondContact O-CG 3.49Å; I426-R441 PolarHBondContact O-N 3.02Å; R441-L444 VanDerWaalsContact O-CD2 3.23Å; R441-L444 WeakPolarHBondContact O-CD2 3.33Å; R441-Y687 PolarHBondContact NH1-OH 3.09Å
442	S	89.3	Confident	89.9	Confident	89 Å²	89	47.4 Å²	47.4	62%	0.622	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-40.9	-171.6	60.8	0	0	0	0	112.1	N440	N440-S442 VanDerWaalsContact C-N 3.3Å; N440-S442 PolarHBondContact ND2-OG 3.1Å; N440-S442 PolarHBondContact O-N 2.94Å; N440-S442 PolarHBondContact OD1-N 3.28Å; N440-S442 PolarHBondContact OD1-OG 2.66Å
443	T	88.1	Confident	89.7	Confident	75 Å²	75	51 Å²	51	46%	0.46	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-14.9	178.1	66	0	0	0	0	113.1	N440 Q445	N440-T443 WeakPolarHBondContact CB-OG1 3.43Å; T443-Q445 PolarHBondContact O-N 3.18Å
444	L	86.3	Confident	89.8	Confident	47 Å²	47	53.9 Å²	53.9	25%	0.246	28%	0.28	C	S	.	.			trans	57.4	16.4	-175.9	-52.4	168.3	0	0	0	113.6	A14 F16 N440 R441 L699	A14-L444 HydrophobicContact CB-CD1 3.24Å; A14-L444 HydrophobicContact CB-CD2 4.4Å; A14-L444 HydrophobicContact CB-CG 4.44Å; F16-L444 HydrophobicContact CB-CB 4.17Å; F16-L444 HydrophobicContact CD1-CD2 3.79Å; F16-L444 HydrophobicContact CE1-CD2 3.99Å; F16-L444 HydrophobicContact CG-CB 4.32Å; F16-L444 HydrophobicContact CG-CD2 4.25Å; N440-L444 WeakPolarHBondContact O-CA 3.45Å; N440-L444 PolarHBondContact O-N 3.4Å; R441-L444 VanDerWaalsContact O-CD2 3.23Å; R441-L444 WeakPolarHBondContact O-CD2 3.33Å; L444-L699 HydrophobicContact CD2-CD2 4.38Å
445	Q	87.8	Confident	90.1	Very high	127 Å²	127	50.7 Å²	50.7	59%	0.593	26%	0.263	S	S	*	.			trans	-90.9	145.3	177.4	-67.6	-172.3	-10.3	0	0	110.5	W439 N440 T443 I447	W439-Q445 WeakPolarHBondContact CA-O 3.46Å; N440-Q445 PolarHBondContact N-O 2.92Å; T443-Q445 PolarHBondContact O-N 3.18Å; Q445-I447 PolarHBondContact O-N 2.99Å
446	C	89.5	Confident	90.1	Very high	19 Å²	19	51.2 Å²	51.2	13%	0.128	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	117.2	173.2	-179.8	0	0	0	0	109.2	I409 I438 W439 R448 T449	I409-C446 HydrophobicContact CG2-CB 3.97Å; I409-C446 WeakPolarHBondContact O-CB 3.48Å; I438-C446 CarbonylContact O-C 3.5Å; I438-C446 WeakPolarHBondContact O-CA 3.43Å; W439-C446 HydrophobicContact CD2-CB 4.35Å; W439-C446 HydrophobicContact CE3-CB 3.85Å; W439-C446 HydrophobicContact CH2-CB 4.06Å; W439-C446 HydrophobicContact CZ3-CB 3.7Å; C446-R448 PolarHBondContact SG-O 2.89Å; C446-T449 PolarHBondContact SG-OG1 3.09Å; C446-T449 VanDerWaalsContact SG-OG1 3.34Å
447	I	89.4	Confident	90.1	Very high	98 Å²	98	51.7 Å²	51.7	50%	0.503	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-48.3	177.6	-52	171.7	0	0	0	109.5	I438 N440 Q445	I438-I447 HydrophobicContact CG2-CD1 4.28Å; I438-I447 PolarHBondContact O-N 2.85Å; N440-I447 HydrophobicContact CB-CD1 3.92Å; N440-I447 HydrophobicContact CB-CG1 4.09Å; Q445-I447 PolarHBondContact O-N 2.99Å
448	R	88.4	Confident	90.1	Very high	120 Å²	120	52.1 Å²	52.1	45%	0.453	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	143.5	-176	-68	-60.2	-166.7	-173	5.4	111	K437 I438 C446 M450 A482	K437-R448 WeakPolarHBondContact CA-O 3.48Å; I438-R448 HydrophobicContact CD1-CB 4.42Å; I438-R448 PolarHBondContact N-O 2.8Å; C446-R448 PolarHBondContact SG-O 2.89Å; R448-M450 HydrophobicContact CB-CE 4.16Å; R448-A482 PolarHBondContact NH2-O 2.86Å; R448-A482 VanDerWaalsContact NH2-O 3.08Å
449	T	91.4	Very high	90	Very high	73 Å²	73	52.6 Å²	52.6	45%	0.448	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.5	169.2	-59.4	0	0	0	0	108	I436 K437 C446	I436-T449 CarbonylContact O-C 3.58Å; I436-T449 VanDerWaalsContact O-CA 3.3Å; I436-T449 WeakPolarHBondContact O-CA 3.4Å; K437-T449 HydrophobicContact CG-CG2 4.06Å; K437-T449 PolarHBondContact NZ-OG1 2.99Å; K437-T449 VanDerWaalsContact NZ-OG1 3.08Å; C446-T449 PolarHBondContact SG-OG1 3.09Å; C446-T449 VanDerWaalsContact SG-OG1 3.34Å
450	M	90.6	Very high	90	Very high	2 Å²	2	53 Å²	53	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136	178.3	-54.3	170.8	-152	0	0	108.8	S435 I436 I438 R448 Y479 L481	S435-M450 CarbonylContact C-O 3.59Å; S435-M450 VanDerWaalsContact CA-O 3.27Å; S435-M450 WeakPolarHBondContact CA-O 3.49Å; I436-M450 HydrophobicContact CB-CB 4.3Å; I436-M450 HydrophobicContact CD1-CB 4.07Å; I436-M450 PolarHBondContact N-O 3.24Å; I436-M450 PolarHBondContact O-N 3.25Å; I438-M450 HydrophobicContact CD1-CE 3.59Å; R448-M450 HydrophobicContact CB-CE 4.16Å; M450-Y479 HydrophobicContact CB-CD1 4.1Å; M450-Y479 HydrophobicContact CB-CE1 4.14Å; M450-Y479 HydrophobicContact CG-CD1 4.39Å; M450-Y479 HydrophobicContact SD-CD1 3.68Å; M450-Y479 HydrophobicContact SD-CG 3.84Å; M450-L481 HydrophobicContact CE-CD2 3.69Å
451	P	90.3	Very high	89.9	Confident	100 Å²	100	52 Å²	52	65%	0.649	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	140.9	174.7	31.2	-32.9	0	0	0	109.6	Y479	P451-Y479 PolarHBondContact O-OH 3.31Å
452	C	87.3	Confident	89.7	Confident	16 Å²	16	49.9 Å²	49.9	11%	0.108	27%	0.268	C	S	.	.			trans	-141.8	157.6	-179	-173.4	0	0	0	0	110.1	D434 I436 Q477	D434-C452 CarbonylContact C-O 3.58Å; D434-C452 PolarHBondContact O-N 2.91Å; I436-C452 HydrophobicContact CD1-CB 3.56Å; I436-C452 HydrophobicContact CG1-CB 3.67Å; C452-Q477 PolarHBondContact SG-OE1 2.93Å
453	E	87.3	Confident	89.4	Confident	77 Å²	77	48.7 Å²	48.7	36%	0.36	27%	0.269	S	S	.	.	S	Bend	trans	-69.8	178.8	161.6	-71.3	177.7	-158.3	0	0	110.4	A433 A455 T471 T473 N475	A433-E453 CarbonylContact O-C 3.57Å; E453-A455 PolarHBondContact O-N 2.87Å; E453-T471 HydrophobicContact CB-CG2 3.8Å; E453-T473 PolarHBondContact OE2-OG1 3.44Å; E453-N475 PolarHBondContact OE2-ND2 3.21Å
454	Y	91.7	Very high	89.2	Confident	82 Å²	82	46.3 Å²	46.3	32%	0.322	25%	0.254	S	S	.	.			trans	-59.3	99.9	-177.1	-166.2	-69.5	0	0	0	111.5	R417 A433 L456 T471 K472	R417-Y454 HydrophobicContact CG-CE1 4.24Å; A433-Y454 HydrophobicContact CB-CD2 3.33Å; A433-Y454 HydrophobicContact CB-CE2 3.51Å; A433-Y454 HydrophobicContact CB-CG 3.95Å; A433-Y454 WeakPolarHBondContact O-CA 3.32Å; A433-Y454 PolarHBondContact O-N 3.16Å; Y454-L456 HydrophobicContact CD1-CD2 4.11Å; Y454-L456 HydrophobicContact CD1-CG 4.24Å; Y454-L456 HydrophobicContact CE1-CD2 3.7Å; Y454-L456 HydrophobicContact CE1-CG 4.34Å; Y454-T471 CarbonylContact O-C 3.57Å; Y454-T471 WeakPolarHBondContact O-CA 3.38Å; Y454-K472 HydrophobicContact CD1-CB 3.79Å; Y454-K472 HydrophobicContact CD1-CD 4.13Å; Y454-K472 HydrophobicContact CE1-CD 4.41Å; Y454-K472 HydrophobicContact CG-CB 4.13Å; Y454-K472 HydrophobicContact CG-CD 4.34Å; Y454-K472 PolarHBondContact O-N 3.4Å
455	A	92.1	Very high	89.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	132.3	-176.8	0	0	0	0	0	111.7	R417 A431 E453 I469	R417-A455 VanDerWaalsContact CB-O 3.3Å; R417-A455 WeakPolarHBondContact CB-O 3.37Å; R417-A455 WeakPolarHBondContact CG-O 3.41Å; A431-A455 HydrophobicContact CB-CB 3.62Å; E453-A455 PolarHBondContact O-N 2.87Å; A455-I469 HydrophobicContact CB-CG2 3.6Å
456	L	92	Very high	89.4	Confident	18 Å²	18	46.4 Å²	46.4	9%	0.094	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	-31.3	178.7	-76.2	178.1	0	0	0	113.8	T418 Y454 G470 K472 A496 L497 W498	T418-L456 WeakPolarHBondContact CG2-O 3.16Å; Y454-L456 HydrophobicContact CD1-CD2 4.11Å; Y454-L456 HydrophobicContact CD1-CG 4.24Å; Y454-L456 HydrophobicContact CE1-CD2 3.7Å; Y454-L456 HydrophobicContact CE1-CG 4.34Å; L456-G470 PolarHBondContact N-O 2.93Å; L456-K472 HydrophobicContact CD1-CB 3.91Å; L456-K472 HydrophobicContact CD1-CG 4.25Å; L456-K472 HydrophobicContact CG-CB 4.21Å; L456-A496 HydrophobicContact CD1-CB 3.86Å; L456-L497 WeakPolarHBondContact CB-O 3.19Å; L456-L497 WeakPolarHBondContact CD1-O 3.47Å; L456-W498 HydrophobicContact CD1-CE3 4.16Å; L456-W498 HydrophobicContact CD1-CZ3 4.32Å; L456-W498 HydrophobicContact CD2-CE3 4.43Å; L456-W498 HydrophobicContact CD2-CZ3 4.1Å
457	C	91.1	Very high	89.5	Confident	12 Å²	12	45.5 Å²	45.5	8%	0.081	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	153	174.8	54.8	0	0	0	0	110.5	T418 I469 G470 L497 M500	T418-C457 VanDerWaalsContact CG2-N 3.33Å; C457-I469 WeakPolarHBondContact O-CA 3.42Å; C457-G470 PolarHBondContact N-O 3.43Å; C457-G470 PolarHBondContact O-N 3.08Å; C457-L497 WeakPolarHBondContact SG-CD2 3.4Å; C457-M500 HydrophobicContact CB-CE 4.48Å; C457-M500 HydrophobicContact CB-CG 3.69Å; C457-M500 HydrophobicContact CB-SD 4.12Å; C457-M500 VanDerWaalsContact SG-CE 3.51Å; C457-M500 VanDerWaalsContact SG-CG 3.6Å
458	S	93.2	Very high	89.7	Confident	14 Å²	14	41 Å²	41	10%	0.098	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	146.9	-174.8	63.9	0	0	0	0	111.9	T418 L429 V468 M500	T418-S458 VanDerWaalsContact CB-OG 3.23Å; T418-S458 WeakPolarHBondContact CB-OG 3.46Å; T418-S458 WeakPolarHBondContact OG1-CB 3.5Å; T418-S458 PolarHBondContact OG1-OG 3.41Å; L429-S458 WeakPolarHBondContact CD2-OG 3.3Å; S458-V468 WeakPolarHBondContact CA-O 3.46Å; S458-M500 WeakPolarHBondContact CA-SD 3.09Å; S458-M500 PolarHBondContact N-SD 2.8Å; S458-M500 VanDerWaalsContact N-SD 3.39Å
459	F	91.3	Very high	89.9	Confident	17 Å²	17	35.2 Å²	35.2	8%	0.075	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	157.6	168.7	67.9	-95.3	0	0	0	112.1	V461 V468 M500 L502 F509 F523	F459-V461 HydrophobicContact CE2-CG2 4.2Å; F459-V468 HydrophobicContact CD1-CB 4.38Å; F459-V468 HydrophobicContact CE1-CB 3.75Å; F459-V468 HydrophobicContact CE1-CG1 3.82Å; F459-V468 HydrophobicContact CE1-CG2 4.43Å; F459-V468 HydrophobicContact CE2-CB 4.07Å; F459-V468 HydrophobicContact CE2-CG2 4.12Å; F459-V468 HydrophobicContact CZ-CB 3.56Å; F459-V468 HydrophobicContact CZ-CG1 3.93Å; F459-V468 HydrophobicContact CZ-CG2 3.76Å; F459-V468 PolarHBondContact N-O 2.78Å; F459-V468 VanDerWaalsContact N-O 3.09Å; F459-V468 PolarHBondContact O-N 2.78Å; F459-V468 VanDerWaalsContact O-N 3.13Å; F459-M500 HydrophobicContact CD1-CB 4.26Å; F459-M500 HydrophobicContact CD1-CG 3.76Å; F459-M500 HydrophobicContact CD1-SD 3.31Å; F459-M500 WeakPolarHBondContact CD1-SD 3.35Å; F459-M500 HydrophobicContact CE1-CB 4.34Å; F459-M500 HydrophobicContact CE1-CG 4.25Å; F459-M500 HydrophobicContact CE1-SD 3.71Å; F459-M500 HydrophobicContact CG-SD 4.41Å; F459-L502 HydrophobicContact CD2-CD1 4.31Å; F459-L502 HydrophobicContact CE2-CD1 3.95Å; F459-F509 HydrophobicContact CE1-CB 4.11Å; F459-F509 HydrophobicContact CE1-CD1 4.37Å; F459-F509 AromaticContact CE1-CD2 3.75Å; F459-F509 HydrophobicContact CE1-CD2 3.75Å; F459-F509 HydrophobicContact CE1-CE2 4.19Å; F459-F509 AromaticContact CE1-CG 3.83Å; F459-F509 HydrophobicContact CE1-CG 3.83Å; F459-F509 HydrophobicContact CZ-CB 3.9Å; F459-F509 AromaticContact CZ-CD1 3.69Å; F459-F509 HydrophobicContact CZ-CD1 3.69Å; F459-F509 AromaticContact CZ-CD2 3.92Å; F459-F509 HydrophobicContact CZ-CD2 3.92Å; F459-F509 HydrophobicContact CZ-CE1 4.09Å; F459-F509 HydrophobicContact CZ-CE2 4.31Å; F459-F509 AromaticContact CZ-CG 3.57Å; F459-F509 HydrophobicContact CZ-CG 3.57Å; F459-F509 HydrophobicContact CZ-CZ 4.38Å; F459-F523 AromaticContact CE2-CZ 3.82Å; F459-F523 HydrophobicContact CE2-CZ 3.82Å; F459-F523 AromaticContact CZ-CZ 3.92Å; F459-F523 HydrophobicContact CZ-CZ 3.92Å
460	F	92.4	Very high	90	Very high	12 Å²	12	31.8 Å²	31.8	5%	0.053	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	128.4	168.4	-77.9	-77.7	0	0	0	110.9	S420 F421 S422 A427 L429 V467 L481	S420-F460 WeakPolarHBondContact O-CE2 3.45Å; F421-F460 WeakPolarHBondContact O-CD2 2.91Å; S422-F460 VanDerWaalsContact N-CE2 3.32Å; A427-F460 HydrophobicContact CB-CZ 4.3Å; L429-F460 HydrophobicContact CB-CD2 4.17Å; L429-F460 HydrophobicContact CB-CE1 4.37Å; L429-F460 HydrophobicContact CB-CE2 3.39Å; L429-F460 HydrophobicContact CB-CZ 3.52Å; L429-F460 HydrophobicContact CD1-CE1 4.25Å; L429-F460 HydrophobicContact CD1-CZ 4.16Å; L429-F460 HydrophobicContact CG-CZ 4.5Å; F460-V467 HydrophobicContact CD1-CG2 3.65Å; F460-V467 HydrophobicContact CE1-CG2 3.77Å; F460-L481 HydrophobicContact CD1-CD1 4.2Å; F460-L481 HydrophobicContact CE1-CD1 3.73Å
461	V	90.1	Very high	90.1	Very high	10 Å²	10	31.7 Å²	31.7	6%	0.061	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-65.5	141.9	171.7	179.5	0	0	0	0	108.4	F459 G463 D464 Q466 V468 L478 F523 L536	F459-V461 HydrophobicContact CE2-CG2 4.2Å; V461-G463 PolarHBondContact O-N 2.85Å; V461-D464 WeakPolarHBondContact O-CA 3.23Å; V461-D464 PolarHBondContact O-N 3.34Å; V461-Q466 HydrophobicContact CB-CB 4.05Å; V461-Q466 WeakPolarHBondContact CB-O 3.28Å; V461-Q466 HydrophobicContact CG2-CB 3.94Å; V461-Q466 PolarHBondContact N-O 3.34Å; V461-V468 HydrophobicContact CG2-CG2 3.68Å; V461-L478 HydrophobicContact CG2-CD1 4.25Å; V461-F523 HydrophobicContact CG1-CE1 4.24Å; V461-F523 HydrophobicContact CG1-CE2 4.45Å; V461-F523 HydrophobicContact CG1-CZ 4.19Å; V461-F523 HydrophobicContact CG2-CE1 4.13Å; V461-F523 HydrophobicContact CG2-CZ 4.23Å; V461-L536 HydrophobicContact CG1-CD2 3.77Å
462	P	84.1	Confident	90.3	Very high	40 Å²	40	32.6 Å²	32.6	26%	0.26	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	131.7	178.8	-29.4	40.3	0	0	0	112.3	L502 Q506	P462-L502 HydrophobicContact CG-CD1 3.95Å; P462-L502 HydrophobicContact CG-CD2 3.83Å; P462-L502 HydrophobicContact CG-CG 4.49Å; P462-Q506 HydrophobicContact CB-CB 3.81Å; P462-Q506 HydrophobicContact CB-CG 4.28Å; P462-Q506 HydrophobicContact CG-CB 3.64Å; P462-Q506 HydrophobicContact CG-CG 4.22Å
463	G	82.6	Confident	90.5	Very high	63 Å²	63	35.6 Å²	35.6	65%	0.649	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.3	8.4	-169.9	0	0	0	0	0	114.3	V461 R465	V461-G463 PolarHBondContact O-N 2.85Å; G463-R465 PolarHBondContact O-N 2.96Å
464	D	85.3	Confident	90.6	Very high	26 Å²	26	32 Å²	32	14%	0.139	17%	0.168	C	C	.	.	S	Bend	trans	51.1	16.2	167.6	-65.4	-30	0	0	0	115.7	S422 S423 D424 V461 L481	S422-D464 WeakPolarHBondContact CB-OD2 3.27Å; S423-D464 WeakPolarHBondContact CA-OD2 3.47Å; S423-D464 WeakPolarHBondContact CB-OD2 3.47Å; S423-D464 VanDerWaalsContact N-CG 3.34Å; S423-D464 PolarHBondContact N-OD1 2.89Å; S423-D464 PolarHBondContact N-OD2 2.88Å; S423-D464 PolarHBondContact OG-OD1 2.76Å; S423-D464 PolarHBondContact OG-OD2 3.25Å; D424-D464 PolarHBondContact N-OD2 3.27Å; V461-D464 WeakPolarHBondContact O-CA 3.23Å; V461-D464 PolarHBondContact O-N 3.34Å; D464-L481 WeakPolarHBondContact O-CD1 3.44Å
465	R	87.4	Confident	90.7	Very high	156 Å²	156	29.6 Å²	29.6	59%	0.589	16%	0.161	S	C	*	.	S	Bend	trans	-84.6	-27.2	-179.4	-176.4	173.3	175	168.2	-0.3	112.4	G463 D480 L481	G463-R465 PolarHBondContact O-N 2.96Å; R465-D480 IonicContact NE-OD1 3.05Å; R465-L481 WeakPolarHBondContact O-CB 3.39Å; R465-L481 VanDerWaalsContact O-CG 3.31Å; R465-L481 WeakPolarHBondContact O-CG 3.31Å; R465-L481 PolarHBondContact O-N 3.04Å
466	Q	90.4	Very high	90.7	Very high	19 Å²	19	29.9 Å²	29.9	9%	0.089	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	160.9	-172.8	-64.5	178.1	-1.8	0	0	111.3	V461 L478 Y479 L487	V461-Q466 HydrophobicContact CB-CB 4.05Å; V461-Q466 WeakPolarHBondContact CB-O 3.28Å; V461-Q466 HydrophobicContact CG2-CB 3.94Å; V461-Q466 PolarHBondContact N-O 3.34Å; Q466-L478 HydrophobicContact CB-CD1 4.25Å; Q466-Y479 CarbonylContact C-O 3.53Å; Q466-Y479 WeakPolarHBondContact CA-O 3.44Å; Q466-Y479 WeakPolarHBondContact CB-O 3.37Å; Q466-L487 HydrophobicContact CG-CD1 4.34Å
467	V	92	Very high	90.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135.9	-178.9	172	0	0	0	0	109	L429 F460 I469 L478 Y479 L481	L429-V467 HydrophobicContact CD1-CB 4.07Å; L429-V467 HydrophobicContact CD1-CG1 3.43Å; L429-V467 VanDerWaalsContact CD1-CG1 3.43Å; L429-V467 HydrophobicContact CD1-CG2 3.48Å; L429-V467 VanDerWaalsContact CD1-CG2 3.48Å; L429-V467 HydrophobicContact CD2-CG1 4.06Å; L429-V467 HydrophobicContact CG-CG1 4.4Å; F460-V467 HydrophobicContact CD1-CG2 3.65Å; F460-V467 HydrophobicContact CE1-CG2 3.77Å; V467-I469 HydrophobicContact CG1-CD1 4.02Å; V467-I469 HydrophobicContact CG1-CG1 4.02Å; V467-L478 WeakPolarHBondContact O-CA 3.31Å; V467-Y479 PolarHBondContact N-O 3.18Å; V467-Y479 PolarHBondContact O-N 2.88Å; V467-L481 HydrophobicContact CB-CD2 4.32Å; V467-L481 HydrophobicContact CG2-CD1 4.42Å; V467-L481 HydrophobicContact CG2-CD2 3.38Å; V467-L481 HydrophobicContact CG2-CG 4.16Å
468	V	92.8	Very high	90.8	Very high	2 Å²	2	29 Å²	29	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.9	172.5	176.3	0	0	0	0	109.4	S458 F459 V461 L476 L478 M500 F509 F523	S458-V468 WeakPolarHBondContact CA-O 3.46Å; F459-V468 HydrophobicContact CD1-CB 4.38Å; F459-V468 HydrophobicContact CE1-CB 3.75Å; F459-V468 HydrophobicContact CE1-CG1 3.82Å; F459-V468 HydrophobicContact CE1-CG2 4.43Å; F459-V468 HydrophobicContact CE2-CB 4.07Å; F459-V468 HydrophobicContact CE2-CG2 4.12Å; F459-V468 HydrophobicContact CZ-CB 3.56Å; F459-V468 HydrophobicContact CZ-CG1 3.93Å; F459-V468 HydrophobicContact CZ-CG2 3.76Å; F459-V468 PolarHBondContact N-O 2.78Å; F459-V468 VanDerWaalsContact N-O 3.09Å; F459-V468 PolarHBondContact O-N 2.78Å; F459-V468 VanDerWaalsContact O-N 3.13Å; V461-V468 HydrophobicContact CG2-CG2 3.68Å; V468-L476 HydrophobicContact CG1-CD2 3.99Å; V468-L478 HydrophobicContact CG2-CD1 3.42Å; V468-L478 VanDerWaalsContact CG2-CD1 3.42Å; V468-M500 HydrophobicContact CG1-CE 4.19Å; V468-F509 HydrophobicContact CG1-CE2 4.22Å; V468-F509 HydrophobicContact CG1-CZ 4.02Å; V468-F523 HydrophobicContact CG2-CE1 4.3Å
469	I	92.6	Very high	90.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.6	178.3	-69.5	152.2	0	0	0	110.6	I436 A455 C457 V467 L476 Q477 Y479	I436-I469 HydrophobicContact CB-CD1 4.35Å; I436-I469 HydrophobicContact CD1-CD1 2.99Å; I436-I469 HydrophobicContact CD1-CG1 4.47Å; I436-I469 HydrophobicContact CG1-CD1 3.26Å; I436-I469 HydrophobicContact CG2-CD1 4.2Å; A455-I469 HydrophobicContact CB-CG2 3.6Å; C457-I469 WeakPolarHBondContact O-CA 3.42Å; V467-I469 HydrophobicContact CG1-CD1 4.02Å; V467-I469 HydrophobicContact CG1-CG1 4.02Å; I469-L476 CarbonylContact O-C 3.53Å; I469-L476 WeakPolarHBondContact O-CA 3.38Å; I469-Q477 PolarHBondContact N-O 3.26Å; I469-Q477 PolarHBondContact O-N 3.22Å; I469-Y479 HydrophobicContact CD1-CD2 3.85Å; I469-Y479 HydrophobicContact CD1-CE2 3.84Å
470	G	93.5	Very high	90.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.2	170.9	0	0	0	0	0	110.2	L456 C457	L456-G470 PolarHBondContact N-O 2.93Å; C457-G470 PolarHBondContact N-O 3.43Å; C457-G470 PolarHBondContact O-N 3.08Å
471	T	93.3	Very high	90.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	162.2	-178	70.1	0	0	0	0	111.8	E453 Y454 T473 G474 N475 Q477 L497	E453-T471 HydrophobicContact CB-CG2 3.8Å; Y454-T471 CarbonylContact O-C 3.57Å; Y454-T471 WeakPolarHBondContact O-CA 3.38Å; T471-T473 WeakPolarHBondContact CB-OG1 3.28Å; T471-T473 PolarHBondContact O-N 2.86Å; T471-T473 PolarHBondContact OG1-N 3.13Å; T471-T473 PolarHBondContact OG1-OG1 2.86Å; T471-G474 PolarHBondContact O-N 3.47Å; T471-G474 VanDerWaalsContact O-N 3.16Å; T471-N475 HydrophobicContact CG2-CB 4.4Å; T471-N475 PolarHBondContact N-O 2.77Å; T471-N475 WeakPolarHBondContact OG1-CA 3.11Å; T471-N475 WeakPolarHBondContact OG1-CB 3.44Å; T471-N475 PolarHBondContact OG1-N 3.44Å; T471-N475 PolarHBondContact OG1-O 2.67Å; T471-N475 VanDerWaalsContact OG1-O 3.12Å; T471-Q477 HydrophobicContact CG2-CG 4.2Å; T471-L497 PolarHBondContact O-N 3.16Å
472	K	93.2	Very high	90.2	Very high	120 Å²	120	32.1 Å²	32.1	52%	0.522	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-22.9	171.3	-173.4	174.6	178.7	178.4	0	113.3	Y454 L456 G474 A496	Y454-K472 HydrophobicContact CD1-CB 3.79Å; Y454-K472 HydrophobicContact CD1-CD 4.13Å; Y454-K472 HydrophobicContact CE1-CD 4.41Å; Y454-K472 HydrophobicContact CG-CB 4.13Å; Y454-K472 HydrophobicContact CG-CD 4.34Å; Y454-K472 PolarHBondContact O-N 3.4Å; L456-K472 HydrophobicContact CD1-CB 3.91Å; L456-K472 HydrophobicContact CD1-CG 4.25Å; L456-K472 HydrophobicContact CG-CB 4.21Å; K472-G474 PolarHBondContact O-N 3.27Å; K472-A496 HydrophobicContact CG-CB 4.11Å; K472-A496 WeakPolarHBondContact O-CA 3.33Å; K472-A496 WeakPolarHBondContact O-CB 3.29Å
473	T	91.8	Very high	90.2	Very high	79 Å²	79	32.7 Å²	32.7	49%	0.485	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-7.1	175.7	45.3	0	0	0	0	113	E453 T471 N475	E453-T473 PolarHBondContact OE2-OG1 3.44Å; T471-T473 WeakPolarHBondContact CB-OG1 3.28Å; T471-T473 PolarHBondContact O-N 2.86Å; T471-T473 PolarHBondContact OG1-N 3.13Å; T471-T473 PolarHBondContact OG1-OG1 2.86Å; T473-N475 PolarHBondContact OG1-ND2 2.82Å
474	G	90	Very high	90.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	88.2	9.4	-177.1	0	0	0	0	0	114	T471 K472 A492 H493 G495	T471-G474 PolarHBondContact O-N 3.47Å; T471-G474 VanDerWaalsContact O-N 3.16Å; K472-G474 PolarHBondContact O-N 3.27Å; G474-A492 WeakPolarHBondContact O-CA 3.5Å; G474-A492 WeakPolarHBondContact O-CB 3.41Å; G474-A492 PolarHBondContact O-N 2.66Å; G474-H493 WeakPolarHBondContact CA-O 3.24Å; G474-H493 PolarHBondContact O-N 2.84Å; G474-G495 WeakPolarHBondContact CA-O 3.43Å; G474-G495 PolarHBondContact N-O 2.77Å
475	N	93.6	Very high	90.3	Very high	32 Å²	32	34.2 Å²	34.2	17%	0.171	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	145.1	177.2	-60.6	-31.2	0	0	0	111.1	E453 T471 T473 T489 I490	E453-N475 PolarHBondContact OE2-ND2 3.21Å; T471-N475 HydrophobicContact CG2-CB 4.4Å; T471-N475 PolarHBondContact N-O 2.77Å; T471-N475 WeakPolarHBondContact OG1-CA 3.11Å; T471-N475 WeakPolarHBondContact OG1-CB 3.44Å; T471-N475 PolarHBondContact OG1-N 3.44Å; T471-N475 PolarHBondContact OG1-O 2.67Å; T471-N475 VanDerWaalsContact OG1-O 3.12Å; T473-N475 PolarHBondContact OG1-ND2 2.82Å; N475-T489 HydrophobicContact CB-CG2 4.11Å; N475-I490 CarbonylContact C-O 3.56Å; N475-I490 VanDerWaalsContact CA-O 3.31Å; N475-I490 WeakPolarHBondContact CA-O 3.48Å
476	L	92.8	Very high	90.3	Very high	6 Å²	6	30.7 Å²	30.7	3%	0.031	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.6	163.4	-74.8	170.4	0	0	0	108.9	V468 I469 T489 I490 A492 L497 M500 F509 T511 W521	V468-L476 HydrophobicContact CG1-CD2 3.99Å; I469-L476 CarbonylContact O-C 3.53Å; I469-L476 WeakPolarHBondContact O-CA 3.38Å; L476-T489 CarbonylContact O-C 3.52Å; L476-T489 WeakPolarHBondContact O-CA 3.35Å; L476-I490 HydrophobicContact CB-CB 4.39Å; L476-I490 PolarHBondContact N-O 2.75Å; L476-I490 PolarHBondContact O-N 2.96Å; L476-A492 HydrophobicContact CB-CB 4.29Å; L476-A492 HydrophobicContact CD1-CB 3.55Å; L476-A492 HydrophobicContact CG-CB 3.59Å; L476-L497 HydrophobicContact CD2-CD1 3.6Å; L476-L497 HydrophobicContact CG-CD1 3.87Å; L476-M500 HydrophobicContact CD2-CE 3.74Å; L476-F509 HydrophobicContact CD1-CE2 4Å; L476-F509 HydrophobicContact CD1-CZ 4.09Å; L476-F509 HydrophobicContact CD2-CE2 4.23Å; L476-T511 HydrophobicContact CD1-CG2 4.08Å; L476-T511 HydrophobicContact CD2-CG2 4.01Å; L476-W521 HydrophobicContact CD1-CD2 4.07Å; L476-W521 HydrophobicContact CD1-CH2 4.39Å; L476-W521 HydrophobicContact CD1-CZ2 3.92Å
477	Q	92.4	Very high	90.2	Very high	7 Å²	7	32.8 Å²	32.8	3%	0.033	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.8	176.7	-67.2	-176.1	-12.9	0	0	109.7	C452 I469 T471 Y479 L486 T489	C452-Q477 PolarHBondContact SG-OE1 2.93Å; I469-Q477 PolarHBondContact N-O 3.26Å; I469-Q477 PolarHBondContact O-N 3.22Å; T471-Q477 HydrophobicContact CG2-CG 4.2Å; Q477-Y479 HydrophobicContact CB-CD2 4.38Å; Q477-Y479 HydrophobicContact CB-CE2 3.61Å; Q477-Y479 PolarHBondContact OE1-OH 3.36Å; Q477-L486 HydrophobicContact CB-CD1 3.81Å; Q477-L486 HydrophobicContact CG-CD1 4.13Å; Q477-T489 HydrophobicContact CG-CG2 4.17Å
478	L	92.2	Very high	89.9	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128	177.1	-176.2	73.7	0	0	0	109.7	V461 Q466 V467 V468 L487 E488 L536	V461-L478 HydrophobicContact CG2-CD1 4.25Å; Q466-L478 HydrophobicContact CB-CD1 4.25Å; V467-L478 WeakPolarHBondContact O-CA 3.31Å; V468-L478 HydrophobicContact CG2-CD1 3.42Å; V468-L478 VanDerWaalsContact CG2-CD1 3.42Å; L478-L487 HydrophobicContact CB-CB 4.45Å; L478-L487 HydrophobicContact CD2-CB 4.13Å; L478-L487 HydrophobicContact CD2-CD1 3.82Å; L478-L487 HydrophobicContact CG-CB 4.31Å; L478-L487 HydrophobicContact CG-CD1 4.09Å; L478-L487 PolarHBondContact O-N 3.06Å; L478-E488 PolarHBondContact N-O 3.03Å; L478-L536 HydrophobicContact CD2-CB 4.36Å; L478-L536 WeakPolarHBondContact CD2-O 3.44Å
479	Y	91.4	Very high	89.8	Confident	7 Å²	7	37.6 Å²	37.6	3%	0.027	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144.9	178.8	-67.5	-92.5	0	0	0	111.4	I436 M450 P451 Q466 V467 I469 Q477 N485 L486	I436-Y479 HydrophobicContact CD1-CD1 4.41Å; I436-Y479 HydrophobicContact CD1-CD2 3.72Å; I436-Y479 HydrophobicContact CD1-CE1 4.14Å; I436-Y479 HydrophobicContact CD1-CE2 3.39Å; I436-Y479 HydrophobicContact CD1-CG 4.23Å; M450-Y479 HydrophobicContact CB-CD1 4.1Å; M450-Y479 HydrophobicContact CB-CE1 4.14Å; M450-Y479 HydrophobicContact CG-CD1 4.39Å; M450-Y479 HydrophobicContact SD-CD1 3.68Å; M450-Y479 HydrophobicContact SD-CG 3.84Å; P451-Y479 PolarHBondContact O-OH 3.31Å; Q466-Y479 CarbonylContact C-O 3.53Å; Q466-Y479 WeakPolarHBondContact CA-O 3.44Å; Q466-Y479 WeakPolarHBondContact CB-O 3.37Å; V467-Y479 PolarHBondContact N-O 3.18Å; V467-Y479 PolarHBondContact O-N 2.88Å; I469-Y479 HydrophobicContact CD1-CD2 3.85Å; I469-Y479 HydrophobicContact CD1-CE2 3.84Å; Q477-Y479 HydrophobicContact CB-CD2 4.38Å; Q477-Y479 HydrophobicContact CB-CE2 3.61Å; Q477-Y479 PolarHBondContact OE1-OH 3.36Å; Y479-N485 WeakPolarHBondContact CA-O 3.43Å; Y479-L486 HydrophobicContact CD1-CB 4.15Å; Y479-L486 HydrophobicContact CD1-CD1 4.27Å; Y479-L486 HydrophobicContact CD2-CD1 4.37Å; Y479-L486 HydrophobicContact CE1-CB 3.79Å; Y479-L486 HydrophobicContact CE1-CD1 3.72Å; Y479-L486 HydrophobicContact CE1-CG 4.37Å; Y479-L486 HydrophobicContact CE2-CD1 3.84Å; Y479-L486 VanDerWaalsContact CZ-CD1 3.47Å
480	D	90.1	Very high	89.7	Confident	16 Å²	16	39.4 Å²	39.4	9%	0.086	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.6	169.4	175.8	55	0	0	0	110.8	R465 S483 G484 N485 L487	R465-D480 IonicContact NE-OD1 3.05Å; D480-S483 WeakPolarHBondContact CB-OG 3.43Å; D480-S483 WeakPolarHBondContact OD2-CB 3.22Å; D480-S483 PolarHBondContact OD2-N 2.79Å; D480-S483 PolarHBondContact OD2-OG 3.49Å; D480-G484 VanDerWaalsContact O-CA 3.23Å; D480-G484 WeakPolarHBondContact O-CA 3.38Å; D480-G484 PolarHBondContact O-N 3.16Å; D480-N485 PolarHBondContact N-O 3.11Å; D480-N485 VanDerWaalsContact N-O 3.1Å; D480-L487 HydrophobicContact CB-CD1 3.96Å; D480-L487 HydrophobicContact CB-CD2 4.12Å; D480-L487 HydrophobicContact CB-CG 4.02Å
481	L	86.8	Confident	89.6	Confident	29 Å²	29	43.3 Å²	43.3	15%	0.152	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-35.7	-172.5	-63.7	-164	0	0	0	113.7	I438 M450 F460 D464 R465 V467	I438-L481 HydrophobicContact CD1-CD1 4.14Å; I438-L481 HydrophobicContact CD1-CD2 3.1Å; I438-L481 HydrophobicContact CD1-CG 4.15Å; I438-L481 HydrophobicContact CG1-CD2 4.46Å; M450-L481 HydrophobicContact CE-CD2 3.69Å; F460-L481 HydrophobicContact CD1-CD1 4.2Å; F460-L481 HydrophobicContact CE1-CD1 3.73Å; D464-L481 WeakPolarHBondContact O-CD1 3.44Å; R465-L481 WeakPolarHBondContact O-CB 3.39Å; R465-L481 VanDerWaalsContact O-CG 3.31Å; R465-L481 WeakPolarHBondContact O-CG 3.31Å; R465-L481 PolarHBondContact O-N 3.04Å; V467-L481 HydrophobicContact CB-CD2 4.32Å; V467-L481 HydrophobicContact CG2-CD1 4.42Å; V467-L481 HydrophobicContact CG2-CD2 3.38Å; V467-L481 HydrophobicContact CG2-CG 4.16Å
482	A	86.4	Confident	89.3	Confident	67 Å²	67	43.4 Å²	43.4	55%	0.554	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-47.4	-177.5	0	0	0	0	0	110.7	R448	R448-A482 PolarHBondContact NH2-O 2.86Å; R448-A482 VanDerWaalsContact NH2-O 3.08Å
483	S	83.9	Confident	89.3	Confident	52 Å²	52	38 Å²	38	36%	0.364	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-28.6	179.5	61	0	0	0	0	113.7	D480 N485	D480-S483 WeakPolarHBondContact CB-OG 3.43Å; D480-S483 WeakPolarHBondContact OD2-CB 3.22Å; D480-S483 PolarHBondContact OD2-N 2.79Å; D480-S483 PolarHBondContact OD2-OG 3.49Å; S483-N485 PolarHBondContact O-N 3.47Å; S483-N485 PolarHBondContact OG-N 3.19Å
484	G	82.9	Confident	89.1	Confident	20 Å²	20	41.8 Å²	41.8	21%	0.206	25%	0.252	C	S	.	.			trans	70	14.6	-171.8	0	0	0	0	0	113.6	D480	D480-G484 VanDerWaalsContact O-CA 3.23Å; D480-G484 WeakPolarHBondContact O-CA 3.38Å; D480-G484 PolarHBondContact O-N 3.16Å
485	N	87.2	Confident	89.1	Confident	101 Å²	101	42.8 Å²	42.8	54%	0.54	26%	0.262	S	S	.	.			trans	-92.6	146.8	-178.8	-67.3	-21.8	0	0	0	111	Y479 D480 S483 L487	Y479-N485 WeakPolarHBondContact CA-O 3.43Å; D480-N485 PolarHBondContact N-O 3.11Å; D480-N485 VanDerWaalsContact N-O 3.1Å; S483-N485 PolarHBondContact O-N 3.47Å; S483-N485 PolarHBondContact OG-N 3.19Å; N485-L487 PolarHBondContact O-N 2.59Å
486	L	87.9	Confident	89	Confident	82 Å²	82	41.9 Å²	41.9	43%	0.429	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	121.6	165.1	179.4	77.6	0	0	0	108.5	Q477 Y479 T489	Q477-L486 HydrophobicContact CB-CD1 3.81Å; Q477-L486 HydrophobicContact CG-CD1 4.13Å; Y479-L486 HydrophobicContact CD1-CB 4.15Å; Y479-L486 HydrophobicContact CD1-CD1 4.27Å; Y479-L486 HydrophobicContact CD2-CD1 4.37Å; Y479-L486 HydrophobicContact CE1-CB 3.79Å; Y479-L486 HydrophobicContact CE1-CD1 3.72Å; Y479-L486 HydrophobicContact CE1-CG 4.37Å; Y479-L486 HydrophobicContact CE2-CD1 3.84Å; Y479-L486 VanDerWaalsContact CZ-CD1 3.47Å; L486-T489 WeakPolarHBondContact CD2-OG1 3.49Å
487	L	86.4	Confident	89.1	Confident	63 Å²	63	41.6 Å²	41.6	33%	0.33	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-56.7	178	-67.5	179.4	0	0	0	111.1	Q466 L478 D480 N485	Q466-L487 HydrophobicContact CG-CD1 4.34Å; L478-L487 HydrophobicContact CB-CB 4.45Å; L478-L487 HydrophobicContact CD2-CB 4.13Å; L478-L487 HydrophobicContact CD2-CD1 3.82Å; L478-L487 HydrophobicContact CG-CB 4.31Å; L478-L487 HydrophobicContact CG-CD1 4.09Å; L478-L487 PolarHBondContact O-N 3.06Å; D480-L487 HydrophobicContact CB-CD1 3.96Å; D480-L487 HydrophobicContact CB-CD2 4.12Å; D480-L487 HydrophobicContact CB-CG 4.02Å; N485-L487 PolarHBondContact O-N 2.59Å
488	E	86.1	Confident	89.1	Confident	37 Å²	37	46.1 Å²	46.1	17%	0.173	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	142.2	-175.3	-68.8	-173.5	169.2	0	0	110.5	L478 R535 S537	L478-E488 PolarHBondContact N-O 3.03Å; E488-R535 IonicContact OE1-CZ 3.3Å; E488-R535 IonicContact OE1-NE 3.49Å; E488-R535 PolarHBondContact OE1-NE 2.73Å; E488-R535 VanDerWaalsContact OE1-NE 3.11Å; E488-R535 IonicContact OE1-NH2 2.68Å; E488-R535 PolarHBondContact OE1-NH2 3.13Å; E488-S537 WeakPolarHBondContact OE1-CB 3.41Å; E488-S537 WeakPolarHBondContact OE2-CA 3.39Å; E488-S537 WeakPolarHBondContact OE2-CB 3.5Å
489	T	91.7	Very high	89	Confident	67 Å²	67	46.4 Å²	46.4	41%	0.411	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.2	167.5	-60.4	0	0	0	0	108	N475 L476 Q477 L486	N475-T489 HydrophobicContact CB-CG2 4.11Å; L476-T489 CarbonylContact O-C 3.52Å; L476-T489 WeakPolarHBondContact O-CA 3.35Å; Q477-T489 HydrophobicContact CG-CG2 4.17Å; L486-T489 WeakPolarHBondContact CD2-OG1 3.49Å
490	I	90.7	Very high	89.1	Confident	39 Å²	39	47.3 Å²	47.3	20%	0.2	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125	-176.5	-59.7	167.6	0	0	0	108.1	N475 L476 A492 W521 V538	N475-I490 CarbonylContact C-O 3.56Å; N475-I490 VanDerWaalsContact CA-O 3.31Å; N475-I490 WeakPolarHBondContact CA-O 3.48Å; L476-I490 HydrophobicContact CB-CB 4.39Å; L476-I490 PolarHBondContact N-O 2.75Å; L476-I490 PolarHBondContact O-N 2.96Å; I490-A492 PolarHBondContact O-N 3.23Å; I490-W521 HydrophobicContact CG2-CH2 4.1Å; I490-W521 HydrophobicContact CG2-CZ3 4.08Å; I490-V538 HydrophobicContact CD1-CB 3.9Å
491	A	90.2	Very high	89.1	Confident	82 Å²	82	47.5 Å²	47.5	68%	0.678	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	98.4	171.1	0	0	0	0	0	108.7
492	A	88.6	Confident	89.3	Confident	2 Å²	2	48.1 Å²	48.1	2%	0.017	29%	0.288	C	S	.	.			trans	-89.4	-41.4	-171.3	0	0	0	0	0	111.9	G474 L476 I490 L497 K519 W521	G474-A492 WeakPolarHBondContact O-CA 3.5Å; G474-A492 WeakPolarHBondContact O-CB 3.41Å; G474-A492 PolarHBondContact O-N 2.66Å; L476-A492 HydrophobicContact CB-CB 4.29Å; L476-A492 HydrophobicContact CD1-CB 3.55Å; L476-A492 HydrophobicContact CG-CB 3.59Å; I490-A492 PolarHBondContact O-N 3.23Å; A492-L497 HydrophobicContact CB-CD1 4.31Å; A492-K519 WeakPolarHBondContact O-CD 2.94Å; A492-K519 WeakPolarHBondContact O-CE 3.28Å; A492-K519 PolarHBondContact O-NZ 3.18Å; A492-W521 HydrophobicContact CB-CH2 4Å; A492-W521 HydrophobicContact CB-CZ2 3.58Å
493	H	91.5	Very high	89.5	Confident	7 Å²	7	45.2 Å²	45.2	3%	0.032	26%	0.264	C	S	.	.			trans	-137.1	156.4	-176.7	-70.3	-92	0	0	0	110.4	G474 G495 T511 D515 A517	G474-H493 WeakPolarHBondContact CA-O 3.24Å; G474-H493 PolarHBondContact O-N 2.84Å; H493-G495 VanDerWaalsContact C-N 3.29Å; H493-T511 PolarHBondContact NE2-OG1 3.18Å; H493-D515 WeakPolarHBondContact CA-OD2 3.48Å; H493-D515 WeakPolarHBondContact CB-OD2 3.14Å; H493-D515 IonicContact CE1-OD1 2.73Å; H493-D515 IonicContact CG-OD1 3.24Å; H493-D515 IonicContact CG-OD2 3.62Å; H493-D515 IonicContact ND1-OD1 3.67Å; H493-D515 PolarHBondContact ND1-OD1 3.41Å; H493-D515 IonicContact ND1-OD2 3.44Å; H493-D515 PolarHBondContact ND1-OD2 3.42Å; H493-A517 PolarHBondContact CE1-O 2.98Å; H493-A517 VanDerWaalsContact CE1-O 3.27Å
494	D	88.5	Confident	89.6	Confident	158 Å²	158	44.8 Å²	44.8	85%	0.845	26%	0.26	S	S	*	.	S	Bend	trans	-79.4	-17.5	176.6	-65.2	-28	0	0	0	112.2	D515	D494-D515 HydrophobicContact CB-CB 4.35Å; D494-D515 PolarHBondContact N-OD2 3.02Å
495	G	89.8	Confident	89.6	Confident	20 Å²	20	47.8 Å²	47.8	21%	0.206	27%	0.271	C	S	.	.	S	Bend	trans	-121.7	-175.9	179	0	0	0	0	0	113.1	G474 H493 L497	G474-G495 WeakPolarHBondContact CA-O 3.43Å; G474-G495 PolarHBondContact N-O 2.77Å; H493-G495 VanDerWaalsContact C-N 3.29Å; G495-L497 PolarHBondContact O-N 3.41Å
496	A	92.6	Very high	89.5	Confident	14 Å²	14	47.5 Å²	47.5	12%	0.116	27%	0.266	C	S	.	.			trans	-61.1	136.1	-179	0	0	0	0	0	112.7	L456 K472 W498 G513 A514	L456-A496 HydrophobicContact CD1-CB 3.86Å; K472-A496 HydrophobicContact CG-CB 4.11Å; K472-A496 WeakPolarHBondContact O-CA 3.33Å; K472-A496 WeakPolarHBondContact O-CB 3.29Å; A496-W498 PolarHBondContact O-N 3.35Å; A496-G513 WeakPolarHBondContact O-CA 3.36Å; A496-A514 PolarHBondContact O-N 3.36Å
497	L	93.5	Very high	89.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	99.4	177.7	-156.7	160.8	0	0	0	109.2	L456 C457 T471 L476 A492 G495 S499 M500 T511	L456-L497 WeakPolarHBondContact CB-O 3.19Å; L456-L497 WeakPolarHBondContact CD1-O 3.47Å; C457-L497 WeakPolarHBondContact SG-CD2 3.4Å; T471-L497 PolarHBondContact O-N 3.16Å; L476-L497 HydrophobicContact CD2-CD1 3.6Å; L476-L497 HydrophobicContact CG-CD1 3.87Å; A492-L497 HydrophobicContact CB-CD1 4.31Å; G495-L497 PolarHBondContact O-N 3.41Å; L497-S499 WeakPolarHBondContact CD2-O 3.28Å; L497-M500 HydrophobicContact CD2-CE 4.06Å; L497-T511 HydrophobicContact CD1-CG2 4.01Å; L497-T511 HydrophobicContact CD2-CG2 4.21Å
498	W	92.1	Very high	89.6	Confident	102 Å²	102	49.6 Å²	49.6	39%	0.386	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-38.4	-172.4	-73.2	116.8	0	0	0	113.4	L456 A496 G512 V550 L551	L456-W498 HydrophobicContact CD1-CE3 4.16Å; L456-W498 HydrophobicContact CD1-CZ3 4.32Å; L456-W498 HydrophobicContact CD2-CE3 4.43Å; L456-W498 HydrophobicContact CD2-CZ3 4.1Å; A496-W498 PolarHBondContact O-N 3.35Å; W498-G512 PolarHBondContact N-O 3.41Å; W498-V550 VanDerWaalsContact CD1-O 3.31Å; W498-L551 WeakPolarHBondContact CB-O 3.38Å
499	S	91	Very high	90	Very high	10 Å²	10	47.9 Å²	47.9	7%	0.07	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	151.7	-174.9	55.8	0	0	0	0	113	L497 T511 G512 L551 C552 V553	L497-S499 WeakPolarHBondContact CD2-O 3.28Å; S499-T511 WeakPolarHBondContact O-CA 3.43Å; S499-G512 PolarHBondContact N-O 3.23Å; S499-G512 PolarHBondContact O-N 3.17Å; S499-L551 WeakPolarHBondContact CB-O 3.34Å; S499-L551 PolarHBondContact OG-O 3.25Å; S499-L551 VanDerWaalsContact OG-O 3.14Å; S499-C552 VanDerWaalsContact OG-CA 3.32Å; S499-C552 WeakPolarHBondContact OG-CA 3.48Å; S499-V553 PolarHBondContact OG-N 3.45Å
500	M	92.3	Very high	90.1	Very high	26 Å²	26	44.7 Å²	44.7	13%	0.128	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.4	172.2	55.5	-177.2	42.8	0	0	109.6	C457 S458 F459 V468 L476 L497 V510 T511	C457-M500 HydrophobicContact CB-CE 4.48Å; C457-M500 HydrophobicContact CB-CG 3.69Å; C457-M500 HydrophobicContact CB-SD 4.12Å; C457-M500 VanDerWaalsContact SG-CE 3.51Å; C457-M500 VanDerWaalsContact SG-CG 3.6Å; S458-M500 WeakPolarHBondContact CA-SD 3.09Å; S458-M500 PolarHBondContact N-SD 2.8Å; S458-M500 VanDerWaalsContact N-SD 3.39Å; F459-M500 HydrophobicContact CD1-CB 4.26Å; F459-M500 HydrophobicContact CD1-CG 3.76Å; F459-M500 HydrophobicContact CD1-SD 3.31Å; F459-M500 WeakPolarHBondContact CD1-SD 3.35Å; F459-M500 HydrophobicContact CE1-CB 4.34Å; F459-M500 HydrophobicContact CE1-CG 4.25Å; F459-M500 HydrophobicContact CE1-SD 3.71Å; F459-M500 HydrophobicContact CG-SD 4.41Å; V468-M500 HydrophobicContact CG1-CE 4.19Å; L476-M500 HydrophobicContact CD2-CE 3.74Å; L497-M500 HydrophobicContact CD2-CE 4.06Å; M500-V510 CarbonylContact C-O 3.52Å; M500-V510 WeakPolarHBondContact CA-O 3.46Å; M500-T511 HydrophobicContact CB-CG2 4.39Å
501	S	91.1	Very high	90.3	Very high	20 Å²	20	42.9 Å²	42.9	14%	0.14	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	126.8	179.9	-167	0	0	0	0	109.7	F509 V510 Y555	S501-F509 CarbonylContact O-C 3.56Å; S501-F509 VanDerWaalsContact O-CA 3.28Å; S501-F509 WeakPolarHBondContact O-CA 3.4Å; S501-F509 WeakPolarHBondContact O-CB 3.27Å; S501-V510 PolarHBondContact N-O 2.82Å; S501-V510 PolarHBondContact O-N 2.92Å; S501-Y555 PolarHBondContact OG-N 2.82Å
502	L	91	Very high	90.4	Very high	41 Å²	41	39 Å²	39	22%	0.215	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	138.2	175.9	-177.2	74.6	0	0	0	109.6	F459 P462 G508 F509 F523	F459-L502 HydrophobicContact CD2-CD1 4.31Å; F459-L502 HydrophobicContact CE2-CD1 3.95Å; P462-L502 HydrophobicContact CG-CD1 3.95Å; P462-L502 HydrophobicContact CG-CD2 3.83Å; P462-L502 HydrophobicContact CG-CG 4.49Å; L502-G508 WeakPolarHBondContact CD1-O 3.43Å; L502-F509 HydrophobicContact CD1-CB 4.46Å; L502-F523 HydrophobicContact CD1-CE2 3.84Å; L502-F523 HydrophobicContact CD1-CZ 4.27Å
503	S	89.7	Confident	90.6	Very high	7 Å²	7	38.9 Å²	38.9	5%	0.049	19%	0.194	C	C	.	.			trans	-68.9	141.2	172.2	72.6	0	0	0	0	110.3	D505 Q506 G508	S503-D505 PolarHBondContact O-N 3.41Å; S503-D505 VanDerWaalsContact O-N 3.1Å; S503-Q506 PolarHBondContact O-N 3.37Å; S503-G508 WeakPolarHBondContact CB-O 3.36Å; S503-G508 PolarHBondContact N-O 2.85Å; S503-G508 PolarHBondContact OG-N 3.47Å; S503-G508 PolarHBondContact OG-O 2.78Å
504	P	85.9	Confident	90.6	Very high	43 Å²	43	39.8 Å²	39.8	28%	0.279	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-30.4	178	-25.7	33.2	0	0	0	113.3	Q506 S556 P557 Q559	P504-Q506 PolarHBondContact O-N 3.41Å; P504-Q506 VanDerWaalsContact O-N 3.15Å; P504-Q506 PolarHBondContact O-NE2 3.36Å; P504-S556 WeakPolarHBondContact CG-O 3.49Å; P504-P557 VanDerWaalsContact CB-O 3.22Å; P504-P557 WeakPolarHBondContact CB-O 3.08Å; P504-P557 WeakPolarHBondContact CG-O 3.39Å; P504-Q559 HydrophobicContact CG-CB 4.2Å
505	D	83.5	Confident	90.8	Very high	82 Å²	82	33.9 Å²	33.9	44%	0.439	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-9.3	174.6	-88.5	1.1	0	0	0	115.2	S503 R507 Q559	S503-D505 PolarHBondContact O-N 3.41Å; S503-D505 VanDerWaalsContact O-N 3.1Å; D505-R507 PolarHBondContact O-N 2.95Å; D505-Q559 VanDerWaalsContact CG-CD 3.41Å; D505-Q559 PolarHBondContact OD1-OE1 2.98Å; D505-Q559 VanDerWaalsContact OD2-CD 3.23Å; D505-Q559 PolarHBondContact OD2-NE2 3.07Å; D505-Q559 PolarHBondContact OD2-OE1 2.93Å
506	Q	85.8	Confident	90.9	Very high	95 Å²	95	36.4 Å²	36.4	44%	0.444	18%	0.177	S	C	.	.	S	Bend	trans	62.4	5.9	-178.7	-50.2	-69.4	-55.1	0	0	114.3	P462 S503 P504	P462-Q506 HydrophobicContact CB-CB 3.81Å; P462-Q506 HydrophobicContact CB-CG 4.28Å; P462-Q506 HydrophobicContact CG-CB 3.64Å; P462-Q506 HydrophobicContact CG-CG 4.22Å; S503-Q506 PolarHBondContact O-N 3.37Å; P504-Q506 PolarHBondContact O-N 3.41Å; P504-Q506 VanDerWaalsContact O-N 3.15Å; P504-Q506 PolarHBondContact O-NE2 3.36Å
507	R	86.9	Confident	90.9	Very high	188 Å²	188	36.1 Å²	36.1	71%	0.709	18%	0.175	S	C	*	.	S	Bend	trans	-93.4	-19	-176.3	-71.7	-178.4	-178.2	-169.5	1.9	114.2	D505 F523	D505-R507 PolarHBondContact O-N 2.95Å; R507-F523 WeakPolarHBondContact O-CD2 3.44Å; R507-F523 PolarHBondContact O-N 2.81Å
508	G	90.1	Very high	90.9	Very high	2 Å²	2	36.1 Å²	36.1	2%	0.021	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	-176.5	-175.7	0	0	0	0	0	112.2	L502 S503 W521	L502-G508 WeakPolarHBondContact CD1-O 3.43Å; S503-G508 WeakPolarHBondContact CB-O 3.36Å; S503-G508 PolarHBondContact N-O 2.85Å; S503-G508 PolarHBondContact OG-N 3.47Å; S503-G508 PolarHBondContact OG-O 2.78Å; G508-W521 CarbonylContact C-O 3.59Å; G508-W521 WeakPolarHBondContact CA-O 3.49Å
509	F	93.6	Very high	91	Very high	1 Å²	1	32.8 Å²	32.8	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	166.5	178.3	65.4	-83.4	0	0	0	110.6	F459 V468 L476 S501 L502 T511 W521 F523 V538	F459-F509 HydrophobicContact CE1-CB 4.11Å; F459-F509 HydrophobicContact CE1-CD1 4.37Å; F459-F509 AromaticContact CE1-CD2 3.75Å; F459-F509 HydrophobicContact CE1-CD2 3.75Å; F459-F509 HydrophobicContact CE1-CE2 4.19Å; F459-F509 AromaticContact CE1-CG 3.83Å; F459-F509 HydrophobicContact CE1-CG 3.83Å; F459-F509 HydrophobicContact CZ-CB 3.9Å; F459-F509 AromaticContact CZ-CD1 3.69Å; F459-F509 HydrophobicContact CZ-CD1 3.69Å; F459-F509 AromaticContact CZ-CD2 3.92Å; F459-F509 HydrophobicContact CZ-CD2 3.92Å; F459-F509 HydrophobicContact CZ-CE1 4.09Å; F459-F509 HydrophobicContact CZ-CE2 4.31Å; F459-F509 AromaticContact CZ-CG 3.57Å; F459-F509 HydrophobicContact CZ-CG 3.57Å; F459-F509 HydrophobicContact CZ-CZ 4.38Å; V468-F509 HydrophobicContact CG1-CE2 4.22Å; V468-F509 HydrophobicContact CG1-CZ 4.02Å; L476-F509 HydrophobicContact CD1-CE2 4Å; L476-F509 HydrophobicContact CD1-CZ 4.09Å; L476-F509 HydrophobicContact CD2-CE2 4.23Å; S501-F509 CarbonylContact O-C 3.56Å; S501-F509 VanDerWaalsContact O-CA 3.28Å; S501-F509 WeakPolarHBondContact O-CA 3.4Å; S501-F509 WeakPolarHBondContact O-CB 3.27Å; L502-F509 HydrophobicContact CD1-CB 4.46Å; F509-T511 HydrophobicContact CD2-CG2 3.87Å; F509-T511 HydrophobicContact CE2-CG2 3.61Å; F509-W521 HydrophobicContact CD1-CB 3.92Å; F509-W521 HydrophobicContact CD2-CB 4.23Å; F509-W521 HydrophobicContact CD2-CG 4.4Å; F509-W521 HydrophobicContact CE1-CB 3.66Å; F509-W521 HydrophobicContact CE1-CG 4.37Å; F509-W521 HydrophobicContact CE2-CB 3.98Å; F509-W521 AromaticContact CE2-CD1 3.71Å; F509-W521 AromaticContact CE2-CG 3.9Å; F509-W521 HydrophobicContact CE2-CG 3.9Å; F509-W521 HydrophobicContact CG-CB 4.22Å; F509-W521 HydrophobicContact CZ-CB 3.7Å; F509-W521 AromaticContact CZ-CG 3.9Å; F509-W521 HydrophobicContact CZ-CG 3.9Å; F509-W521 PolarHBondContact N-O 2.85Å; F509-W521 PolarHBondContact O-N 2.95Å; F509-F523 AromaticContact CD1-CE1 3.68Å; F509-F523 HydrophobicContact CD1-CE1 3.68Å; F509-F523 HydrophobicContact CD1-CE2 4.03Å; F509-F523 AromaticContact CD1-CZ 3.36Å; F509-F523 HydrophobicContact CD1-CZ 3.36Å; F509-F523 HydrophobicContact CE1-CD1 4.31Å; F509-F523 AromaticContact CE1-CE1 3.53Å; F509-F523 HydrophobicContact CE1-CE1 3.53Å; F509-F523 AromaticContact CE1-CZ 3.74Å; F509-F523 HydrophobicContact CE1-CZ 3.74Å; F509-F523 HydrophobicContact CG-CZ 4.41Å; F509-V538 HydrophobicContact CE1-CB 4.46Å; F509-V538 HydrophobicContact CE1-CG1 3.49Å; F509-V538 VanDerWaalsContact CE1-CG1 3.49Å; F509-V538 HydrophobicContact CE1-CG2 4.06Å; F509-V538 HydrophobicContact CZ-CG1 3.64Å; F509-V538 HydrophobicContact CZ-CG2 4.33Å
510	V	93.7	Very high	91.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.9	177.5	169.3	0	0	0	0	110.1	M500 S501 V518 K519 F520 V553 Y555	M500-V510 CarbonylContact C-O 3.52Å; M500-V510 WeakPolarHBondContact CA-O 3.46Å; S501-V510 PolarHBondContact N-O 2.82Å; S501-V510 PolarHBondContact O-N 2.92Å; V510-V518 HydrophobicContact CG1-CG1 3.2Å; V510-K519 WeakPolarHBondContact CA-O 3.44Å; V510-F520 HydrophobicContact CG2-CB 4.49Å; V510-F520 HydrophobicContact CG2-CD1 3.2Å; V510-F520 HydrophobicContact CG2-CE1 3.34Å; V510-F520 HydrophobicContact CG2-CG 3.85Å; V510-F520 HydrophobicContact CG2-CZ 4.08Å; V510-V553 HydrophobicContact CB-CG1 4.42Å; V510-V553 HydrophobicContact CG1-CB 4.46Å; V510-V553 HydrophobicContact CG1-CG1 3.64Å; V510-Y555 HydrophobicContact CB-CE2 3.77Å; V510-Y555 HydrophobicContact CG2-CE1 4.5Å; V510-Y555 HydrophobicContact CG2-CE2 3.38Å; V510-Y555 WeakPolarHBondContact CG2-OH 3.33Å
511	T	94.3	Very high	91.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.5	173.1	59.2	0	0	0	0	110.7	L476 H493 L497 S499 M500 F509 V518 K519 W521	L476-T511 HydrophobicContact CD1-CG2 4.08Å; L476-T511 HydrophobicContact CD2-CG2 4.01Å; H493-T511 PolarHBondContact NE2-OG1 3.18Å; L497-T511 HydrophobicContact CD1-CG2 4.01Å; L497-T511 HydrophobicContact CD2-CG2 4.21Å; S499-T511 WeakPolarHBondContact O-CA 3.43Å; M500-T511 HydrophobicContact CB-CG2 4.39Å; F509-T511 HydrophobicContact CD2-CG2 3.87Å; F509-T511 HydrophobicContact CE2-CG2 3.61Å; T511-V518 CarbonylContact O-C 3.47Å; T511-V518 VanDerWaalsContact O-CA 3.29Å; T511-V518 WeakPolarHBondContact O-CA 3.49Å; T511-K519 PolarHBondContact N-O 3.03Å; T511-K519 PolarHBondContact O-N 3Å; T511-K519 PolarHBondContact OG1-O 3.09Å; T511-W521 PolarHBondContact OG1-NE1 2.83Å
512	G	93.8	Very high	91.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	126.6	170.7	0	0	0	0	0	110.4	W498 S499	W498-G512 PolarHBondContact N-O 3.41Å; S499-G512 PolarHBondContact N-O 3.23Å; S499-G512 PolarHBondContact O-N 3.17Å
513	G	92.3	Very high	91.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	162.6	-178.2	0	0	0	0	0	113.8	A496 D515 A517 V550	A496-G513 WeakPolarHBondContact O-CA 3.36Å; G513-D515 PolarHBondContact O-N 2.77Å; G513-A517 PolarHBondContact N-O 2.98Å; G513-V550 PolarHBondContact O-N 3.01Å
514	A	92.1	Very high	91	Very high	27 Å²	27	37.2 Å²	37.2	22%	0.223	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	1.4	169.7	0	0	0	0	0	113.6	A496 K516	A496-A514 PolarHBondContact O-N 3.36Å; A514-K516 PolarHBondContact O-N 3.19Å
515	D	91.1	Very high	90.8	Very high	33 Å²	33	40.7 Å²	40.7	18%	0.176	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	20.3	174.7	65.2	-13.5	0	0	0	112.3	H493 D494 G513 A517 K519	H493-D515 WeakPolarHBondContact CA-OD2 3.48Å; H493-D515 WeakPolarHBondContact CB-OD2 3.14Å; H493-D515 IonicContact CE1-OD1 2.73Å; H493-D515 IonicContact CG-OD1 3.24Å; H493-D515 IonicContact CG-OD2 3.62Å; H493-D515 IonicContact ND1-OD1 3.67Å; H493-D515 PolarHBondContact ND1-OD1 3.41Å; H493-D515 IonicContact ND1-OD2 3.44Å; H493-D515 PolarHBondContact ND1-OD2 3.42Å; D494-D515 HydrophobicContact CB-CB 4.35Å; D494-D515 PolarHBondContact N-OD2 3.02Å; G513-D515 PolarHBondContact O-N 2.77Å; D515-A517 PolarHBondContact O-N 2.9Å; D515-A517 VanDerWaalsContact O-N 3.11Å; D515-A517 PolarHBondContact OD1-N 2.9Å; D515-K519 IonicContact OD2-NZ 3.6Å
516	K	91.6	Very high	90.7	Very high	74 Å²	74	39.1 Å²	39.1	32%	0.322	19%	0.189	S	C	.	.	S	Bend	trans	60	17.3	-178.6	-46.6	-176.7	168.8	-147.6	0	114	A514 L546 D547 E548 D549	A514-K516 PolarHBondContact O-N 3.19Å; K516-L546 WeakPolarHBondContact CB-O 3.24Å; K516-L546 PolarHBondContact O-N 2.9Å; K516-D547 WeakPolarHBondContact CD-O 3.48Å; K516-D547 PolarHBondContact NZ-O 3.19Å; K516-E548 IonicContact NZ-OE2 2.92Å; K516-E548 PolarHBondContact NZ-OE2 3.2Å; K516-D549 WeakPolarHBondContact CG-OD1 3.34Å
517	A	92.9	Very high	90	Very high	8 Å²	8	38.8 Å²	38.8	7%	0.066	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	143	-177.9	0	0	0	0	0	111.7	H493 G513 D515 L544	H493-A517 PolarHBondContact CE1-O 2.98Å; H493-A517 VanDerWaalsContact CE1-O 3.27Å; G513-A517 PolarHBondContact N-O 2.98Å; D515-A517 PolarHBondContact O-N 2.9Å; D515-A517 VanDerWaalsContact O-N 3.11Å; D515-A517 PolarHBondContact OD1-N 2.9Å; A517-L544 WeakPolarHBondContact CA-O 3.29Å
518	V	94.1	Very high	89.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.4	165.4	-179.9	0	0	0	0	107.7	V510 T511 F520 L544 L546 V550 V553 L562 V564	V510-V518 HydrophobicContact CG1-CG1 3.2Å; T511-V518 CarbonylContact O-C 3.47Å; T511-V518 VanDerWaalsContact O-CA 3.29Å; T511-V518 WeakPolarHBondContact O-CA 3.49Å; V518-F520 HydrophobicContact CG1-CE2 4.41Å; V518-L544 HydrophobicContact CB-CB 4.23Å; V518-L544 PolarHBondContact N-O 2.87Å; V518-L544 PolarHBondContact O-N 3.28Å; V518-L546 HydrophobicContact CG2-CD1 3.88Å; V518-V550 HydrophobicContact CG2-CB 4.47Å; V518-V550 HydrophobicContact CG2-CG1 4.16Å; V518-V550 HydrophobicContact CG2-CG2 3.78Å; V518-V553 HydrophobicContact CG1-CG2 4.47Å; V518-V553 HydrophobicContact CG2-CG2 4.29Å; V518-L562 HydrophobicContact CG1-CD2 4.4Å; V518-V564 HydrophobicContact CG2-CG1 4.1Å; V518-V564 HydrophobicContact CG2-CG2 4.27Å
519	K	94.3	Very high	87.7	Confident	32 Å²	32	43 Å²	43	14%	0.139	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140.1	-176.5	-62.8	-179.9	-174.5	174.5	0	110.2	A492 V510 T511 D515 W521 T543	A492-K519 WeakPolarHBondContact O-CD 2.94Å; A492-K519 WeakPolarHBondContact O-CE 3.28Å; A492-K519 PolarHBondContact O-NZ 3.18Å; V510-K519 WeakPolarHBondContact CA-O 3.44Å; T511-K519 PolarHBondContact N-O 3.03Å; T511-K519 PolarHBondContact O-N 3Å; T511-K519 PolarHBondContact OG1-O 3.09Å; D515-K519 IonicContact OD2-NZ 3.6Å; K519-W521 HydrophobicContact CB-CZ2 4.07Å; K519-W521 HydrophobicContact CD-CZ2 4.22Å; K519-T543 HydrophobicContact CG-CG2 4.13Å
520	F	93.8	Very high	86.1	Confident	9 Å²	9	51 Å²	51	4%	0.039	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.9	179.2	-65.5	-102.7	0	0	0	109.7	V510 V518 Q540 T541 R542 L544 Y555 L562 L579	V510-F520 HydrophobicContact CG2-CB 4.49Å; V510-F520 HydrophobicContact CG2-CD1 3.2Å; V510-F520 HydrophobicContact CG2-CE1 3.34Å; V510-F520 HydrophobicContact CG2-CG 3.85Å; V510-F520 HydrophobicContact CG2-CZ 4.08Å; V518-F520 HydrophobicContact CG1-CE2 4.41Å; F520-Q540 WeakPolarHBondContact O-CA 3.47Å; F520-T541 WeakPolarHBondContact CB-OG1 3.3Å; F520-T541 PolarHBondContact O-N 3.11Å; F520-T541 PolarHBondContact O-OG1 2.81Å; F520-R542 HydrophobicContact CB-CB 4.11Å; F520-R542 HydrophobicContact CD2-CB 3.83Å; F520-R542 HydrophobicContact CG-CB 4.18Å; F520-R542 PolarHBondContact N-O 3.44Å; F520-L544 HydrophobicContact CE2-CB 4.36Å; F520-Y555 WeakPolarHBondContact CD1-OH 3.45Å; F520-Y555 WeakPolarHBondContact CE1-OH 3.34Å; F520-L562 HydrophobicContact CE1-CD2 4.19Å; F520-L562 HydrophobicContact CZ-CD2 3.66Å; F520-L579 HydrophobicContact CE1-CD2 4.27Å; F520-L579 HydrophobicContact CE2-CD1 4.12Å; F520-L579 HydrophobicContact CE2-CD2 3.78Å; F520-L579 HydrophobicContact CZ-CD2 3.4Å; F520-L579 VanDerWaalsContact CZ-CD2 3.4Å
521	W	93.2	Very high	84.5	Confident	6 Å²	6	53.7 Å²	53.7	2%	0.023	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	132.2	-171.7	-59.3	95.4	0	0	0	110.3	L476 I490 A492 G508 F509 T511 K519 V538 R539 Q540	L476-W521 HydrophobicContact CD1-CD2 4.07Å; L476-W521 HydrophobicContact CD1-CH2 4.39Å; L476-W521 HydrophobicContact CD1-CZ2 3.92Å; I490-W521 HydrophobicContact CG2-CH2 4.1Å; I490-W521 HydrophobicContact CG2-CZ3 4.08Å; A492-W521 HydrophobicContact CB-CH2 4Å; A492-W521 HydrophobicContact CB-CZ2 3.58Å; G508-W521 CarbonylContact C-O 3.59Å; G508-W521 WeakPolarHBondContact CA-O 3.49Å; F509-W521 HydrophobicContact CD1-CB 3.92Å; F509-W521 HydrophobicContact CD2-CB 4.23Å; F509-W521 HydrophobicContact CD2-CG 4.4Å; F509-W521 HydrophobicContact CE1-CB 3.66Å; F509-W521 HydrophobicContact CE1-CG 4.37Å; F509-W521 HydrophobicContact CE2-CB 3.98Å; F509-W521 AromaticContact CE2-CD1 3.71Å; F509-W521 AromaticContact CE2-CG 3.9Å; F509-W521 HydrophobicContact CE2-CG 3.9Å; F509-W521 HydrophobicContact CG-CB 4.22Å; F509-W521 HydrophobicContact CZ-CB 3.7Å; F509-W521 AromaticContact CZ-CG 3.9Å; F509-W521 HydrophobicContact CZ-CG 3.9Å; F509-W521 PolarHBondContact N-O 2.85Å; F509-W521 PolarHBondContact O-N 2.95Å; T511-W521 PolarHBondContact OG1-NE1 2.83Å; K519-W521 HydrophobicContact CB-CZ2 4.07Å; K519-W521 HydrophobicContact CD-CZ2 4.22Å; W521-V538 HydrophobicContact CB-CG1 3.53Å; W521-V538 HydrophobicContact CD2-CG1 4.09Å; W521-V538 HydrophobicContact CE3-CG1 3.71Å; W521-V538 HydrophobicContact CG-CG1 4.06Å; W521-R539 CarbonylContact C-O 3.55Å; W521-R539 WeakPolarHBondContact CA-O 3.27Å; W521-Q540 HydrophobicContact CD2-CB 4.47Å; W521-Q540 HydrophobicContact CE3-CB 3.76Å; W521-Q540 HydrophobicContact CE3-CG 4.24Å; W521-Q540 HydrophobicContact CH2-CB 3.97Å; W521-Q540 HydrophobicContact CH2-CG 4.05Å; W521-Q540 HydrophobicContact CZ2-CG 4.29Å; W521-Q540 HydrophobicContact CZ3-CB 3.51Å; W521-Q540 HydrophobicContact CZ3-CG 4.04Å
522	D	92.1	Very high	82.8	Confident	73 Å²	73	60.8 Å²	60.8	39%	0.39	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	145.9	174	-73.9	-1.1	0	0	0	110.2	R539 T541	D522-R539 PolarHBondContact N-O 2.83Å; D522-R539 PolarHBondContact O-N 2.91Å; D522-T541 HydrophobicContact CB-CG2 3.98Å; D522-T541 VanDerWaalsContact CG-CG2 3.5Å; D522-T541 VanDerWaalsContact OD2-CG2 3.29Å; D522-T541 WeakPolarHBondContact OD2-CG2 3.47Å
523	F	89.9	Confident	81.3	Confident	35 Å²	35	67.4 Å²	67.4	15%	0.154	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121.4	174.9	-64.5	-60.9	0	0	0	110.5	F459 V461 V468 L502 R507 F509 L536 V538	F459-F523 AromaticContact CE2-CZ 3.82Å; F459-F523 HydrophobicContact CE2-CZ 3.82Å; F459-F523 AromaticContact CZ-CZ 3.92Å; F459-F523 HydrophobicContact CZ-CZ 3.92Å; V461-F523 HydrophobicContact CG1-CE1 4.24Å; V461-F523 HydrophobicContact CG1-CE2 4.45Å; V461-F523 HydrophobicContact CG1-CZ 4.19Å; V461-F523 HydrophobicContact CG2-CE1 4.13Å; V461-F523 HydrophobicContact CG2-CZ 4.23Å; V468-F523 HydrophobicContact CG2-CE1 4.3Å; L502-F523 HydrophobicContact CD1-CE2 3.84Å; L502-F523 HydrophobicContact CD1-CZ 4.27Å; R507-F523 WeakPolarHBondContact O-CD2 3.44Å; R507-F523 PolarHBondContact O-N 2.81Å; F509-F523 AromaticContact CD1-CE1 3.68Å; F509-F523 HydrophobicContact CD1-CE1 3.68Å; F509-F523 HydrophobicContact CD1-CE2 4.03Å; F509-F523 AromaticContact CD1-CZ 3.36Å; F509-F523 HydrophobicContact CD1-CZ 3.36Å; F509-F523 HydrophobicContact CE1-CD1 4.31Å; F509-F523 AromaticContact CE1-CE1 3.53Å; F509-F523 HydrophobicContact CE1-CE1 3.53Å; F509-F523 AromaticContact CE1-CZ 3.74Å; F509-F523 HydrophobicContact CE1-CZ 3.74Å; F509-F523 HydrophobicContact CG-CZ 4.41Å; F523-L536 HydrophobicContact CB-CD1 4.11Å; F523-L536 HydrophobicContact CB-CD2 4.33Å; F523-L536 HydrophobicContact CB-CG 4.43Å; F523-L536 HydrophobicContact CD1-CD2 3.65Å; F523-L536 HydrophobicContact CD1-CG 4.32Å; F523-L536 HydrophobicContact CE1-CD2 4.27Å; F523-L536 HydrophobicContact CG-CD2 4.18Å; F523-V538 HydrophobicContact CD1-CG2 4.15Å; F523-V538 HydrophobicContact CE1-CG2 4.24Å
524	E	86.4	Confident	80.2	Confident	74 Å²	74	74.3 Å²	74.3	35%	0.346	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.4	175	-72.3	-173.4	169	0	0	110.3	L536 S537 R539	E524-L536 CarbonylContact O-C 3.5Å; E524-L536 WeakPolarHBondContact O-CA 3.37Å; E524-S537 PolarHBondContact N-O 2.68Å; E524-S537 PolarHBondContact O-N 2.84Å; E524-S537 VanDerWaalsContact O-O 3.06Å; E524-S537 PolarHBondContact O-OG 2.88Å; E524-R539 VanDerWaalsContact CD-CD 3.47Å; E524-R539 HydrophobicContact CG-CB 4.3Å; E524-R539 WeakPolarHBondContact OE1-CD 3.41Å; E524-R539 IonicContact OE1-CZ 2.89Å; E524-R539 IonicContact OE1-NE 3.95Å; E524-R539 IonicContact OE1-NH1 2.73Å; E524-R539 PolarHBondContact OE1-NH1 2.68Å
525	L	82.1	Confident	79.3	Confident	115 Å²	115	77.2 Å²	77.2	60%	0.602	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	103	173.5	-79.2	155.7	0	0	0	109.3	K534 R535 L536	L525-K534 HydrophobicContact CD2-CB 4.07Å; L525-R535 CarbonylContact C-O 3.53Å; L525-R535 WeakPolarHBondContact CA-O 3.33Å; L525-L536 HydrophobicContact CD2-CD1 3.87Å; L525-L536 HydrophobicContact CG-CD1 3.81Å
526	V	80.8	Confident	78.9	Confident	50 Å²	50	76.5 Å²	76.5	30%	0.303	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.7	176.7	175	0	0	0	0	109.7	R535 S537	V526-R535 HydrophobicContact CB-CG 4.25Å; V526-R535 PolarHBondContact N-O 3.3Å; V526-R535 VanDerWaalsContact O-CG 3.32Å; V526-R535 WeakPolarHBondContact O-CG 3.47Å; V526-R535 PolarHBondContact O-N 2.83Å; V526-R535 VanDerWaalsContact O-O 3.1Å; V526-S537 WeakPolarHBondContact CG2-OG 3.36Å
527	T	70.9	Confident	78.5	Confident	88 Å²	88	73.6 Å²	73.6	54%	0.54	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	122.6	168.6	47.7	0	0	0	0	109.6	K534	T527-K534 HydrophobicContact CG2-CD 4.47Å; T527-K534 HydrophobicContact CG2-CG 3.64Å
528	D	67.9	Low	78.3	Confident	71 Å²	71	74 Å²	74	38%	0.38	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-72.8	138.6	173.1	-107.8	-31.4	0	0	0	111.1	N530 S531 R535	D528-N530 PolarHBondContact O-N 2.81Å; D528-S531 PolarHBondContact O-N 3.16Å; D528-R535 IonicContact OD1-CZ 3.1Å; D528-R535 IonicContact OD1-NH1 2.73Å; D528-R535 PolarHBondContact OD1-NH1 2.96Å; D528-R535 IonicContact OD2-CZ 2.78Å; D528-R535 IonicContact OD2-NE 3.88Å; D528-R535 IonicContact OD2-NH1 3.11Å; D528-R535 PolarHBondContact OD2-NH1 3.19Å
529	K	60.5	Low	78	Confident	208 Å²	208	81 Å²	81	90%	0.904	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.4	-173.3	-66.8	-178.3	179.8	178.2	0	114.4
530	N	59.7	Low	77.8	Confident	169 Å²	169	83.4 Å²	83.4	90%	0.904	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	2.1	-177.2	-71.3	-7.9	0	0	0	114.1	D528	D528-N530 PolarHBondContact O-N 2.81Å
531	S	60.4	Low	77.6	Confident	56 Å²	56	85.9 Å²	85.9	39%	0.392	43%	0.432	S	S	.	.			trans	-144.1	143	179.6	175.2	0	0	0	0	111	D528 Q533	D528-S531 PolarHBondContact O-N 3.16Å; S531-Q533 PolarHBondContact O-N 2.86Å; S531-Q533 PolarHBondContact OG-N 3.4Å
532	T	59.5	Low	77.5	Confident	149 Å²	149	91.4 Å²	91.4	91%	0.914	45%	0.452	S	S	*	.	S	Bend	trans	-71.6	-1.6	173.5	49.2	0	0	0	0	113.4
533	Q	61	Low	77.5	Confident	138 Å²	138	91.9 Å²	91.9	65%	0.645	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-82.2	123.4	178	-64.9	-173.7	-9.8	0	0	111.3	S531 R535	S531-Q533 PolarHBondContact O-N 2.86Å; S531-Q533 PolarHBondContact OG-N 3.4Å; Q533-R535 PolarHBondContact O-N 2.94Å
534	K	70.2	Confident	77.6	Confident	145 Å²	145	91.3 Å²	91.3	63%	0.63	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	118.5	167.1	-66.1	179.4	179.7	-175.4	0	108.3	L525 T527	L525-K534 HydrophobicContact CD2-CB 4.07Å; T527-K534 HydrophobicContact CG2-CD 4.47Å; T527-K534 HydrophobicContact CG2-CG 3.64Å
535	R	72.9	Confident	77.9	Confident	88 Å²	88	95.2 Å²	95.2	33%	0.332	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	145.7	169.8	69.8	174.1	-162.7	-138.7	-1.2	109.5	E488 L525 V526 D528 Q533	E488-R535 IonicContact OE1-CZ 3.3Å; E488-R535 IonicContact OE1-NE 3.49Å; E488-R535 PolarHBondContact OE1-NE 2.73Å; E488-R535 VanDerWaalsContact OE1-NE 3.11Å; E488-R535 IonicContact OE1-NH2 2.68Å; E488-R535 PolarHBondContact OE1-NH2 3.13Å; L525-R535 CarbonylContact C-O 3.53Å; L525-R535 WeakPolarHBondContact CA-O 3.33Å; V526-R535 HydrophobicContact CB-CG 4.25Å; V526-R535 PolarHBondContact N-O 3.3Å; V526-R535 VanDerWaalsContact O-CG 3.32Å; V526-R535 WeakPolarHBondContact O-CG 3.47Å; V526-R535 PolarHBondContact O-N 2.83Å; V526-R535 VanDerWaalsContact O-O 3.1Å; D528-R535 IonicContact OD1-CZ 3.1Å; D528-R535 IonicContact OD1-NH1 2.73Å; D528-R535 PolarHBondContact OD1-NH1 2.96Å; D528-R535 IonicContact OD2-CZ 2.78Å; D528-R535 IonicContact OD2-NE 3.88Å; D528-R535 IonicContact OD2-NH1 3.11Å; D528-R535 PolarHBondContact OD2-NH1 3.19Å; Q533-R535 PolarHBondContact O-N 2.94Å
536	L	81.8	Confident	78.3	Confident	19 Å²	19	90.5 Å²	90.5	10%	0.099	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	133.3	168.7	-161	73.9	0	0	0	107.5	V461 L478 F523 E524 L525	V461-L536 HydrophobicContact CG1-CD2 3.77Å; L478-L536 HydrophobicContact CD2-CB 4.36Å; L478-L536 WeakPolarHBondContact CD2-O 3.44Å; F523-L536 HydrophobicContact CB-CD1 4.11Å; F523-L536 HydrophobicContact CB-CD2 4.33Å; F523-L536 HydrophobicContact CB-CG 4.43Å; F523-L536 HydrophobicContact CD1-CD2 3.65Å; F523-L536 HydrophobicContact CD1-CG 4.32Å; F523-L536 HydrophobicContact CE1-CD2 4.27Å; F523-L536 HydrophobicContact CG-CD2 4.18Å; E524-L536 CarbonylContact O-C 3.5Å; E524-L536 WeakPolarHBondContact O-CA 3.37Å; L525-L536 HydrophobicContact CD2-CD1 3.87Å; L525-L536 HydrophobicContact CG-CD1 3.81Å
537	S	84.1	Confident	78.7	Confident	12 Å²	12	93.4 Å²	93.4	8%	0.084	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	160.4	169.5	58.4	0	0	0	0	108.8	E488 E524 V526	E488-S537 WeakPolarHBondContact OE1-CB 3.41Å; E488-S537 WeakPolarHBondContact OE2-CA 3.39Å; E488-S537 WeakPolarHBondContact OE2-CB 3.5Å; E524-S537 PolarHBondContact N-O 2.68Å; E524-S537 PolarHBondContact O-N 2.84Å; E524-S537 VanDerWaalsContact O-O 3.06Å; E524-S537 PolarHBondContact O-OG 2.88Å; V526-S537 WeakPolarHBondContact CG2-OG 3.36Å
538	V	87.8	Confident	79.8	Confident	18 Å²	18	92.8 Å²	92.8	11%	0.109	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.9	179.5	-173.5	0	0	0	0	109.3	I490 F509 W521 F523	I490-V538 HydrophobicContact CD1-CB 3.9Å; F509-V538 HydrophobicContact CE1-CB 4.46Å; F509-V538 HydrophobicContact CE1-CG1 3.49Å; F509-V538 VanDerWaalsContact CE1-CG1 3.49Å; F509-V538 HydrophobicContact CE1-CG2 4.06Å; F509-V538 HydrophobicContact CZ-CG1 3.64Å; F509-V538 HydrophobicContact CZ-CG2 4.33Å; W521-V538 HydrophobicContact CB-CG1 3.53Å; W521-V538 HydrophobicContact CD2-CG1 4.09Å; W521-V538 HydrophobicContact CE3-CG1 3.71Å; W521-V538 HydrophobicContact CG-CG1 4.06Å; F523-V538 HydrophobicContact CD1-CG2 4.15Å; F523-V538 HydrophobicContact CE1-CG2 4.24Å
539	R	89.6	Confident	81	Confident	146 Å²	146	91.5 Å²	91.5	55%	0.551	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.6	178.2	-176.1	-179.4	175.6	-179.1	-0.5	111.3	W521 D522 E524	W521-R539 CarbonylContact C-O 3.55Å; W521-R539 WeakPolarHBondContact CA-O 3.27Å; D522-R539 PolarHBondContact N-O 2.83Å; D522-R539 PolarHBondContact O-N 2.91Å; E524-R539 VanDerWaalsContact CD-CD 3.47Å; E524-R539 HydrophobicContact CG-CB 4.3Å; E524-R539 WeakPolarHBondContact OE1-CD 3.41Å; E524-R539 IonicContact OE1-CZ 2.89Å; E524-R539 IonicContact OE1-NE 3.95Å; E524-R539 IonicContact OE1-NH1 2.73Å; E524-R539 PolarHBondContact OE1-NH1 2.68Å
540	Q	90.1	Very high	82.6	Confident	83 Å²	83	81.6 Å²	81.6	39%	0.388	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	127.5	173.8	-163.1	-179.5	-19.3	0	0	110.7	F520 W521	F520-Q540 WeakPolarHBondContact O-CA 3.47Å; W521-Q540 HydrophobicContact CD2-CB 4.47Å; W521-Q540 HydrophobicContact CE3-CB 3.76Å; W521-Q540 HydrophobicContact CE3-CG 4.24Å; W521-Q540 HydrophobicContact CH2-CB 3.97Å; W521-Q540 HydrophobicContact CH2-CG 4.05Å; W521-Q540 HydrophobicContact CZ2-CG 4.29Å; W521-Q540 HydrophobicContact CZ3-CB 3.51Å; W521-Q540 HydrophobicContact CZ3-CG 4.04Å
541	T	89.1	Confident	84.2	Confident	61 Å²	61	75.1 Å²	75.1	37%	0.374	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-48.8	179.5	50.6	0	0	0	0	113.2	F520 D522	F520-T541 WeakPolarHBondContact CB-OG1 3.3Å; F520-T541 PolarHBondContact O-N 3.11Å; F520-T541 PolarHBondContact O-OG1 2.81Å; D522-T541 HydrophobicContact CB-CG2 3.98Å; D522-T541 VanDerWaalsContact CG-CG2 3.5Å; D522-T541 VanDerWaalsContact OD2-CG2 3.29Å; D522-T541 WeakPolarHBondContact OD2-CG2 3.47Å
542	R	89.9	Confident	85.7	Confident	121 Å²	121	73.4 Å²	73.4	46%	0.457	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.8	-173.6	-52.2	-179	-158.9	173.7	3.9	111.7	F520 V576 D577 L579	F520-R542 HydrophobicContact CB-CB 4.11Å; F520-R542 HydrophobicContact CD2-CB 3.83Å; F520-R542 HydrophobicContact CG-CB 4.18Å; F520-R542 PolarHBondContact N-O 3.44Å; R542-V576 PolarHBondContact NH1-O 3.46Å; R542-D577 PolarHBondContact NH1-O 2.84Å; R542-L579 HydrophobicContact CB-CD1 4.5Å
543	T	92.1	Very high	87.3	Confident	84 Å²	84	66.5 Å²	66.5	52%	0.515	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	130.7	173.5	62.8	0	0	0	0	110	K519	K519-T543 HydrophobicContact CG-CG2 4.13Å
544	L	92.5	Very high	88.8	Confident	22 Å²	22	60.3 Å²	60.3	12%	0.115	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.9	171.4	175.9	68.4	0	0	0	107.9	A517 V518 F520 L546 F574 L579	A517-L544 WeakPolarHBondContact CA-O 3.29Å; V518-L544 HydrophobicContact CB-CB 4.23Å; V518-L544 PolarHBondContact N-O 2.87Å; V518-L544 PolarHBondContact O-N 3.28Å; F520-L544 HydrophobicContact CE2-CB 4.36Å; L544-L546 HydrophobicContact CD2-CD2 4.29Å; L544-L546 HydrophobicContact CG-CD2 4.21Å; L544-L546 HydrophobicContact CG-CG 4.43Å; L544-F574 HydrophobicContact CD2-CD1 4.32Å; L544-F574 HydrophobicContact CD2-CD2 3.94Å; L544-F574 HydrophobicContact CD2-CE1 4.33Å; L544-F574 HydrophobicContact CD2-CE2 3.95Å; L544-F574 HydrophobicContact CD2-CG 4.13Å; L544-F574 HydrophobicContact CD2-CZ 4.15Å; L544-L579 HydrophobicContact CB-CD1 4.49Å; L544-L579 HydrophobicContact CD1-CB 4.43Å
545	Q	92.4	Very high	89.9	Confident	157 Å²	157	54.4 Å²	54.4	73%	0.734	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	135.2	179	-164.6	144.9	1.4	0	0	110.1
546	L	91.8	Very high	90.8	Very high	16 Å²	16	50.3 Å²	50.3	8%	0.084	25%	0.246	C	C	.	.			trans	-123.2	169.9	-175.3	-61.1	171.8	0	0	0	110.1	K516 V518 L544 V550 V564 L566 F574	K516-L546 WeakPolarHBondContact CB-O 3.24Å; K516-L546 PolarHBondContact O-N 2.9Å; V518-L546 HydrophobicContact CG2-CD1 3.88Å; L544-L546 HydrophobicContact CD2-CD2 4.29Å; L544-L546 HydrophobicContact CG-CD2 4.21Å; L544-L546 HydrophobicContact CG-CG 4.43Å; L546-V550 HydrophobicContact CD1-CG2 3.66Å; L546-V564 HydrophobicContact CD1-CB 4.5Å; L546-V564 HydrophobicContact CD1-CG1 3.68Å; L546-L566 HydrophobicContact CB-CD2 4.23Å; L546-L566 HydrophobicContact CD1-CD2 3.91Å; L546-F574 HydrophobicContact CD2-CE2 4.03Å; L546-F574 HydrophobicContact CD2-CZ 3.62Å
547	D	89.4	Confident	91.1	Very high	111 Å²	111	51.4 Å²	51.4	59%	0.594	25%	0.254	S	S	*	.	S	Bend	trans	-77.5	-26.6	-174.6	-49.6	-52.4	0	0	0	112.3	K516 K572	K516-D547 WeakPolarHBondContact CD-O 3.48Å; K516-D547 PolarHBondContact NZ-O 3.19Å; D547-K572 IonicContact OD2-NZ 3.66Å; D547-K572 PolarHBondContact OD2-NZ 3.4Å
548	E	93	Very high	91.2	Very high	75 Å²	75	56.1 Å²	56.1	35%	0.35	28%	0.279	S	S	.	.	S	Bend	trans	-139.6	171.6	-173.3	-66.2	-61.9	174.5	0	0	112.4	K516 D568	K516-E548 IonicContact NZ-OE2 2.92Å; K516-E548 PolarHBondContact NZ-OE2 3.2Å; E548-D568 HydrophobicContact CG-CB 4.27Å
549	D	93.6	Very high	91.1	Very high	44 Å²	44	57.8 Å²	57.8	24%	0.235	29%	0.285	C	S	.	.			trans	-64.9	139.5	-177.6	-62.3	0.1	0	0	0	111.5	K516 L566 L567	K516-D549 WeakPolarHBondContact CG-OD1 3.34Å; D549-L566 WeakPolarHBondContact O-CA 3.47Å; D549-L567 HydrophobicContact CB-CB 4.24Å; D549-L567 HydrophobicContact CB-CD2 4.39Å; D549-L567 PolarHBondContact O-N 2.86Å
550	V	94	Very high	91.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.2	-178.6	178.2	0	0	0	0	109.8	W498 G513 V518 L546 V553 V564 L566	W498-V550 VanDerWaalsContact CD1-O 3.31Å; G513-V550 PolarHBondContact O-N 3.01Å; V518-V550 HydrophobicContact CG2-CB 4.47Å; V518-V550 HydrophobicContact CG2-CG1 4.16Å; V518-V550 HydrophobicContact CG2-CG2 3.78Å; L546-V550 HydrophobicContact CD1-CG2 3.66Å; V550-V553 HydrophobicContact CG1-CG2 3.49Å; V550-V553 VanDerWaalsContact CG1-CG2 3.49Å; V550-V564 HydrophobicContact CB-CG1 4.35Å; V550-V564 HydrophobicContact CG1-CG1 3.57Å; V550-V564 HydrophobicContact CG2-CG1 3.91Å; V550-L566 HydrophobicContact CG2-CD2 3.94Å
551	L	92.3	Very high	91.3	Very high	32 Å²	32	53.5 Å²	53.5	17%	0.168	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-54.4	179.1	-63.5	175.9	0	0	0	111.2	W498 S499 S565 L567 P591	W498-L551 WeakPolarHBondContact CB-O 3.38Å; S499-L551 WeakPolarHBondContact CB-O 3.34Å; S499-L551 PolarHBondContact OG-O 3.25Å; S499-L551 VanDerWaalsContact OG-O 3.14Å; L551-S565 PolarHBondContact N-O 3.45Å; L551-L567 HydrophobicContact CD1-CD1 4.26Å; L551-P591 HydrophobicContact CD1-CB 3.76Å
552	C	92.4	Very high	91.5	Very high	20 Å²	20	50.6 Å²	50.6	14%	0.135	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	138.6	-176	-165.1	0	0	0	0	111.3	S499 S565	S499-C552 VanDerWaalsContact OG-CA 3.32Å; S499-C552 WeakPolarHBondContact OG-CA 3.48Å; C552-S565 WeakPolarHBondContact CA-OG 3.4Å; C552-S565 WeakPolarHBondContact CB-OG 3.42Å; C552-S565 PolarHBondContact N-OG 3.21Å; C552-S565 PolarHBondContact O-N 3.31Å; C552-S565 PolarHBondContact O-OG 2.83Å
553	V	93.8	Very high	91.7	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.03	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134	173.7	-176.9	0	0	0	0	108.8	S499 V510 V518 V550 L562 A563 V564	S499-V553 PolarHBondContact OG-N 3.45Å; V510-V553 HydrophobicContact CB-CG1 4.42Å; V510-V553 HydrophobicContact CG1-CB 4.46Å; V510-V553 HydrophobicContact CG1-CG1 3.64Å; V518-V553 HydrophobicContact CG1-CG2 4.47Å; V518-V553 HydrophobicContact CG2-CG2 4.29Å; V550-V553 HydrophobicContact CG1-CG2 3.49Å; V550-V553 VanDerWaalsContact CG1-CG2 3.49Å; V553-L562 HydrophobicContact CG1-CD1 3.56Å; V553-L562 HydrophobicContact CG1-CG 4.15Å; V553-A563 WeakPolarHBondContact CA-O 3.38Å; V553-V564 HydrophobicContact CG1-CG2 4.42Å; V553-V564 HydrophobicContact CG2-CG1 4.33Å; V553-V564 HydrophobicContact CG2-CG2 4.42Å
554	S	92.8	Very high	91.8	Very high	7 Å²	7	40.9 Å²	40.9	5%	0.049	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	134.4	175.8	-167	0	0	0	0	111.5	A563	S554-A563 PolarHBondContact N-O 2.88Å; S554-A563 PolarHBondContact O-N 2.88Å
555	Y	92.7	Very high	91.9	Very high	21 Å²	21	39.8 Å²	39.8	8%	0.082	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	143.7	170.7	-89	-69.5	0	0	0	111.4	S501 V510 F520 L562 V576	S501-Y555 PolarHBondContact OG-N 2.82Å; V510-Y555 HydrophobicContact CB-CE2 3.77Å; V510-Y555 HydrophobicContact CG2-CE1 4.5Å; V510-Y555 HydrophobicContact CG2-CE2 3.38Å; V510-Y555 WeakPolarHBondContact CG2-OH 3.33Å; F520-Y555 WeakPolarHBondContact CD1-OH 3.45Å; F520-Y555 WeakPolarHBondContact CE1-OH 3.34Å; Y555-L562 HydrophobicContact CD1-CD1 3.87Å; Y555-L562 HydrophobicContact CD2-CD1 4.37Å; Y555-L562 HydrophobicContact CE1-CD1 3.92Å; Y555-L562 HydrophobicContact CE2-CD1 4.41Å; Y555-L562 HydrophobicContact CG-CD1 4.12Å; Y555-V576 HydrophobicContact CD1-CG2 3.89Å; Y555-V576 HydrophobicContact CE1-CB 4.43Å; Y555-V576 HydrophobicContact CE1-CG1 3.88Å; Y555-V576 HydrophobicContact CE1-CG2 3.59Å
556	S	91.3	Very high	92	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.021	17%	0.166	C	C	.	.			trans	-69.4	141.8	162.7	76.1	0	0	0	0	109.7	P504 N558 Q559 K560 L561	P504-S556 WeakPolarHBondContact CG-O 3.49Å; S556-N558 PolarHBondContact O-N 2.83Å; S556-N558 VanDerWaalsContact O-N 3.14Å; S556-Q559 WeakPolarHBondContact O-CA 3.45Å; S556-Q559 PolarHBondContact O-N 2.86Å; S556-Q559 PolarHBondContact OG-N 2.97Å; S556-K560 PolarHBondContact OG-N 3.18Å; S556-L561 WeakPolarHBondContact CB-O 3.39Å; S556-L561 PolarHBondContact N-O 2.92Å; S556-L561 PolarHBondContact OG-N 2.67Å; S556-L561 PolarHBondContact OG-O 2.88Å
557	P	87.9	Confident	92	Very high	41 Å²	41	35.2 Å²	35.2	27%	0.266	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-26	178.7	-29.7	39.1	0	0	0	114.1	P504 Q559 S598 H599	P504-P557 VanDerWaalsContact CB-O 3.22Å; P504-P557 WeakPolarHBondContact CB-O 3.08Å; P504-P557 WeakPolarHBondContact CG-O 3.39Å; P557-Q559 VanDerWaalsContact C-N 3.25Å; P557-Q559 PolarHBondContact O-N 3.36Å; P557-S598 WeakPolarHBondContact CD-O 3.02Å; P557-S598 WeakPolarHBondContact CG-O 3.12Å; P557-H599 WeakPolarHBondContact CB-O 3.33Å
558	N	86.7	Confident	92.1	Very high	111 Å²	111	33 Å²	33	59%	0.594	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	5.7	174.7	-61.4	-27.4	0	0	0	113.3	S556 K560 D600	S556-N558 PolarHBondContact O-N 2.83Å; S556-N558 VanDerWaalsContact O-N 3.14Å; N558-K560 PolarHBondContact O-N 3.46Å; N558-D600 PolarHBondContact ND2-O 3.08Å
559	Q	86.8	Confident	92.1	Very high	54 Å²	54	30.7 Å²	30.7	25%	0.252	16%	0.161	S	C	.	.	S	Bend	trans	58.9	-2	-177.8	-163	-175.5	9.5	0	0	116.1	P504 D505 S556 P557 L561 V576	P504-Q559 HydrophobicContact CG-CB 4.2Å; D505-Q559 VanDerWaalsContact CG-CD 3.41Å; D505-Q559 PolarHBondContact OD1-OE1 2.98Å; D505-Q559 VanDerWaalsContact OD2-CD 3.23Å; D505-Q559 PolarHBondContact OD2-NE2 3.07Å; D505-Q559 PolarHBondContact OD2-OE1 2.93Å; S556-Q559 WeakPolarHBondContact O-CA 3.45Å; S556-Q559 PolarHBondContact O-N 2.86Å; S556-Q559 PolarHBondContact OG-N 2.97Å; P557-Q559 VanDerWaalsContact C-N 3.25Å; P557-Q559 PolarHBondContact O-N 3.36Å; Q559-L561 PolarHBondContact O-N 3.3Å; Q559-V576 WeakPolarHBondContact O-CB 3Å; Q559-V576 WeakPolarHBondContact O-CG2 3.37Å
560	K	89.9	Confident	92.1	Very high	123 Å²	123	29.1 Å²	29.1	54%	0.535	15%	0.153	S	C	.	.	S	Bend	trans	-68.7	-36.7	-177.1	-173.7	176.8	174.4	-176.2	0	113.2	S556 N558 Y575 V576	S556-K560 PolarHBondContact OG-N 3.18Å; N558-K560 PolarHBondContact O-N 3.46Å; K560-Y575 HydrophobicContact CG-CD1 4.26Å; K560-Y575 HydrophobicContact CG-CE1 4.27Å; K560-V576 PolarHBondContact O-N 2.85Å; K560-V576 VanDerWaalsContact O-N 3.1Å
561	L	92.8	Very high	92.2	Very high	16 Å²	16	29.1 Å²	29.1	8%	0.084	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.8	-168.7	-59.9	173	0	0	0	110.8	S556 Q559 I573 F574 Y575 F582 L618	S556-L561 WeakPolarHBondContact CB-O 3.39Å; S556-L561 PolarHBondContact N-O 2.92Å; S556-L561 PolarHBondContact OG-N 2.67Å; S556-L561 PolarHBondContact OG-O 2.88Å; Q559-L561 PolarHBondContact O-N 3.3Å; L561-I573 HydrophobicContact CB-CG2 4.13Å; L561-I573 HydrophobicContact CD1-CG2 4.44Å; L561-I573 HydrophobicContact CD2-CG2 4.16Å; L561-I573 HydrophobicContact CG-CG2 4.48Å; L561-F574 CarbonylContact C-O 3.56Å; L561-F574 WeakPolarHBondContact CA-O 3.44Å; L561-Y575 HydrophobicContact CD2-CD1 3.73Å; L561-Y575 HydrophobicContact CD2-CE1 3.65Å; L561-Y575 HydrophobicContact CD2-CG 4.39Å; L561-F582 HydrophobicContact CD1-CE1 4.48Å; L561-F582 HydrophobicContact CD2-CD1 3.9Å; L561-F582 HydrophobicContact CD2-CE1 4.39Å; L561-L618 HydrophobicContact CD1-CD2 3.66Å
562	L	93.4	Very high	92.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.9	172.4	-176.8	73.3	0	0	0	107.9	V518 F520 V553 Y555 V564 I573 F574 V576	V518-L562 HydrophobicContact CG1-CD2 4.4Å; F520-L562 HydrophobicContact CE1-CD2 4.19Å; F520-L562 HydrophobicContact CZ-CD2 3.66Å; V553-L562 HydrophobicContact CG1-CD1 3.56Å; V553-L562 HydrophobicContact CG1-CG 4.15Å; Y555-L562 HydrophobicContact CD1-CD1 3.87Å; Y555-L562 HydrophobicContact CD2-CD1 4.37Å; Y555-L562 HydrophobicContact CE1-CD1 3.92Å; Y555-L562 HydrophobicContact CE2-CD1 4.41Å; Y555-L562 HydrophobicContact CG-CD1 4.12Å; L562-V564 HydrophobicContact CD2-CG2 4.15Å; L562-V564 HydrophobicContact CG-CG2 4.18Å; L562-I573 CarbonylContact O-C 3.59Å; L562-I573 WeakPolarHBondContact O-CA 3.31Å; L562-F574 HydrophobicContact CB-CB 4.49Å; L562-F574 PolarHBondContact N-O 3.15Å; L562-F574 PolarHBondContact O-N 3.48Å; L562-V576 HydrophobicContact CB-CG2 3.93Å
563	A	94.4	Very high	92.4	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	133.5	173.3	0	0	0	0	0	109.9	V553 S554 V571 I573 M595 I597 I604	V553-A563 WeakPolarHBondContact CA-O 3.38Å; S554-A563 PolarHBondContact N-O 2.88Å; S554-A563 PolarHBondContact O-N 2.88Å; A563-V571 HydrophobicContact CB-CG1 4.45Å; A563-I573 HydrophobicContact CB-CG1 4.33Å; A563-M595 VanDerWaalsContact C-CE 3.43Å; A563-M595 HydrophobicContact CB-CE 3.44Å; A563-M595 VanDerWaalsContact CB-CE 3.44Å; A563-M595 HydrophobicContact CB-SD 3.67Å; A563-M595 WeakPolarHBondContact O-CE 3.05Å; A563-I597 HydrophobicContact CB-CD1 4.01Å; A563-I604 HydrophobicContact CB-CD1 3.56Å
564	V	94.3	Very high	92.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.7	-179.9	-176.9	0	0	0	0	108.8	V518 L546 V550 V553 L562 L566 V571 K572 F574	V518-V564 HydrophobicContact CG2-CG1 4.1Å; V518-V564 HydrophobicContact CG2-CG2 4.27Å; L546-V564 HydrophobicContact CD1-CB 4.5Å; L546-V564 HydrophobicContact CD1-CG1 3.68Å; V550-V564 HydrophobicContact CB-CG1 4.35Å; V550-V564 HydrophobicContact CG1-CG1 3.57Å; V550-V564 HydrophobicContact CG2-CG1 3.91Å; V553-V564 HydrophobicContact CG1-CG2 4.42Å; V553-V564 HydrophobicContact CG2-CG1 4.33Å; V553-V564 HydrophobicContact CG2-CG2 4.42Å; L562-V564 HydrophobicContact CD2-CG2 4.15Å; L562-V564 HydrophobicContact CG-CG2 4.18Å; V564-L566 HydrophobicContact CG1-CD2 4.44Å; V564-V571 CarbonylContact O-C 3.55Å; V564-V571 WeakPolarHBondContact O-CA 3.26Å; V564-K572 PolarHBondContact N-O 3.31Å; V564-K572 PolarHBondContact O-N 3.44Å; V564-F574 HydrophobicContact CB-CE2 4.45Å; V564-F574 HydrophobicContact CG2-CD2 4.13Å; V564-F574 HydrophobicContact CG2-CE2 4.27Å
565	S	94.3	Very high	92.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	136.3	171	76.3	0	0	0	0	111.1	L551 C552 V592	L551-S565 PolarHBondContact N-O 3.45Å; C552-S565 WeakPolarHBondContact CA-OG 3.4Å; C552-S565 WeakPolarHBondContact CB-OG 3.42Å; C552-S565 PolarHBondContact N-OG 3.21Å; C552-S565 PolarHBondContact O-N 3.31Å; C552-S565 PolarHBondContact O-OG 2.83Å; S565-V592 PolarHBondContact OG-O 2.78Å
566	L	94.1	Very high	92.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	160.3	-176.7	-70.6	178.9	0	0	0	111.2	L546 D549 V550 V564 D568 C569 T570 K572	L546-L566 HydrophobicContact CB-CD2 4.23Å; L546-L566 HydrophobicContact CD1-CD2 3.91Å; D549-L566 WeakPolarHBondContact O-CA 3.47Å; V550-L566 HydrophobicContact CG2-CD2 3.94Å; V564-L566 HydrophobicContact CG1-CD2 4.44Å; L566-D568 WeakPolarHBondContact CB-OD1 3.37Å; L566-D568 PolarHBondContact O-N 2.83Å; L566-C569 PolarHBondContact O-N 2.87Å; L566-T570 PolarHBondContact N-O 2.86Å; L566-K572 HydrophobicContact CD1-CD 3.67Å; L566-K572 HydrophobicContact CD1-CG 4.06Å
567	L	93.4	Very high	92.2	Very high	77 Å²	77	36.5 Å²	36.5	40%	0.403	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.9	174	-169.2	65.3	0	0	0	112.8	D549 L551 C569 P591	D549-L567 HydrophobicContact CB-CB 4.24Å; D549-L567 HydrophobicContact CB-CD2 4.39Å; D549-L567 PolarHBondContact O-N 2.86Å; L551-L567 HydrophobicContact CD1-CD1 4.26Å; L567-C569 PolarHBondContact O-N 2.78Å; L567-P591 HydrophobicContact CD1-CB 4.26Å; L567-P591 HydrophobicContact CD1-CG 4Å; L567-P591 WeakPolarHBondContact O-CG 3.49Å
568	D	91.6	Very high	92.2	Very high	64 Å²	64	38.5 Å²	38.5	34%	0.342	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	13.8	176	69.8	2.2	0	0	0	114.5	E548 L566 T570	E548-D568 HydrophobicContact CG-CB 4.27Å; L566-D568 WeakPolarHBondContact CB-OD1 3.37Å; L566-D568 PolarHBondContact O-N 2.83Å; D568-T570 VanDerWaalsContact CG-OG1 3.25Å; D568-T570 PolarHBondContact O-N 2.95Å; D568-T570 VanDerWaalsContact OD1-CB 3.29Å; D568-T570 WeakPolarHBondContact OD1-CB 3.39Å; D568-T570 WeakPolarHBondContact OD1-CG2 3.23Å; D568-T570 PolarHBondContact OD1-N 3.32Å; D568-T570 PolarHBondContact OD1-OG1 2.87Å; D568-T570 PolarHBondContact OD2-OG1 3.12Å
569	C	92.5	Very high	92.4	Very high	26 Å²	26	34.8 Å²	34.8	18%	0.176	18%	0.177	C	C	.	.	S	Bend	trans	67.1	6.5	-177.4	-45.5	0	0	0	0	114.9	L566 L567	L566-C569 PolarHBondContact O-N 2.87Å; L567-C569 PolarHBondContact O-N 2.78Å
570	T	93.4	Very high	92.6	Very high	11 Å²	11	39 Å²	39	7%	0.067	19%	0.194	C	C	.	.			trans	-98.6	155.6	178.2	76.3	0	0	0	0	111.7	L566 D568 Y586	L566-T570 PolarHBondContact N-O 2.86Å; D568-T570 VanDerWaalsContact CG-OG1 3.25Å; D568-T570 PolarHBondContact O-N 2.95Å; D568-T570 VanDerWaalsContact OD1-CB 3.29Å; D568-T570 WeakPolarHBondContact OD1-CB 3.39Å; D568-T570 WeakPolarHBondContact OD1-CG2 3.23Å; D568-T570 PolarHBondContact OD1-N 3.32Å; D568-T570 PolarHBondContact OD1-OG1 2.87Å; D568-T570 PolarHBondContact OD2-OG1 3.12Å; T570-Y586 HydrophobicContact CG2-CD1 3.59Å; T570-Y586 HydrophobicContact CG2-CE1 3.46Å; T570-Y586 VanDerWaalsContact CG2-CE1 3.46Å
571	V	94.8	Very high	92.8	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.4	167.3	176.2	0	0	0	0	108	A563 V564 S584 L585 V592 M595 T606	A563-V571 HydrophobicContact CB-CG1 4.45Å; V564-V571 CarbonylContact O-C 3.55Å; V564-V571 WeakPolarHBondContact O-CA 3.26Å; V571-S584 WeakPolarHBondContact O-CA 3.32Å; V571-L585 HydrophobicContact CB-CB 4.16Å; V571-L585 HydrophobicContact CB-CD1 4.15Å; V571-L585 HydrophobicContact CB-CG 4.39Å; V571-L585 HydrophobicContact CG1-CD1 4.13Å; V571-L585 PolarHBondContact N-O 2.85Å; V571-L585 PolarHBondContact O-N 3.29Å; V571-V592 HydrophobicContact CG2-CB 4.23Å; V571-V592 HydrophobicContact CG2-CG1 4.13Å; V571-V592 HydrophobicContact CG2-CG2 4.08Å; V571-M595 HydrophobicContact CB-SD 4.45Å; V571-M595 HydrophobicContact CG1-CE 4.19Å; V571-M595 HydrophobicContact CG1-SD 3.42Å; V571-M595 WeakPolarHBondContact CG1-SD 3.49Å; V571-M595 HydrophobicContact CG2-SD 4.17Å; V571-T606 HydrophobicContact CG2-CG2 4Å
572	K	94.7	Very high	92.8	Very high	28 Å²	28	40.2 Å²	40.2	12%	0.122	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.8	176.3	-64.6	-174.2	-176.7	169.8	0	109.3	D547 V564 L566 F574 F581	D547-K572 IonicContact OD2-NZ 3.66Å; D547-K572 PolarHBondContact OD2-NZ 3.4Å; V564-K572 PolarHBondContact N-O 3.31Å; V564-K572 PolarHBondContact O-N 3.44Å; L566-K572 HydrophobicContact CD1-CD 3.67Å; L566-K572 HydrophobicContact CD1-CG 4.06Å; K572-F574 HydrophobicContact CB-CD2 4.47Å; K572-F574 HydrophobicContact CB-CE2 3.62Å; K572-F574 HydrophobicContact CB-CZ 3.95Å; K572-F574 HydrophobicContact CD-CZ 4.28Å; K572-F581 HydrophobicContact CB-CE2 4.28Å; K572-F581 HydrophobicContact CD-CE2 4.46Å; K572-F581 HydrophobicContact CG-CE2 4.2Å
573	I	94.9	Very high	92.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	131.2	178.2	-55.1	176.5	0	0	0	108.6	L561 L562 A563 F582 L583 L585 L618	L561-I573 HydrophobicContact CB-CG2 4.13Å; L561-I573 HydrophobicContact CD1-CG2 4.44Å; L561-I573 HydrophobicContact CD2-CG2 4.16Å; L561-I573 HydrophobicContact CG-CG2 4.48Å; L562-I573 CarbonylContact O-C 3.59Å; L562-I573 WeakPolarHBondContact O-CA 3.31Å; A563-I573 HydrophobicContact CB-CG1 4.33Å; I573-F582 HydrophobicContact CG2-CD1 4.05Å; I573-F582 WeakPolarHBondContact O-CB 3.39Å; I573-F582 PolarHBondContact O-N 3.17Å; I573-L583 HydrophobicContact CB-CB 4.42Å; I573-L583 HydrophobicContact CD1-CB 4.4Å; I573-L583 PolarHBondContact N-O 3.46Å; I573-L583 PolarHBondContact O-N 3.35Å; I573-L585 HydrophobicContact CD1-CD1 4.18Å; I573-L585 HydrophobicContact CD1-CG 4.36Å; I573-L618 HydrophobicContact CD1-CD2 3.77Å; I573-L618 HydrophobicContact CG2-CD2 4.44Å
574	F	94.8	Very high	92.7	Very high	13 Å²	13	43.6 Å²	43.6	6%	0.057	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	152.2	-178.8	-63.4	-85.1	0	0	0	111	L544 L546 L561 L562 V564 K572 K580 F581	L544-F574 HydrophobicContact CD2-CD1 4.32Å; L544-F574 HydrophobicContact CD2-CD2 3.94Å; L544-F574 HydrophobicContact CD2-CE1 4.33Å; L544-F574 HydrophobicContact CD2-CE2 3.95Å; L544-F574 HydrophobicContact CD2-CG 4.13Å; L544-F574 HydrophobicContact CD2-CZ 4.15Å; L546-F574 HydrophobicContact CD2-CE2 4.03Å; L546-F574 HydrophobicContact CD2-CZ 3.62Å; L561-F574 CarbonylContact C-O 3.56Å; L561-F574 WeakPolarHBondContact CA-O 3.44Å; L562-F574 HydrophobicContact CB-CB 4.49Å; L562-F574 PolarHBondContact N-O 3.15Å; L562-F574 PolarHBondContact O-N 3.48Å; V564-F574 HydrophobicContact CB-CE2 4.45Å; V564-F574 HydrophobicContact CG2-CD2 4.13Å; V564-F574 HydrophobicContact CG2-CE2 4.27Å; K572-F574 HydrophobicContact CB-CD2 4.47Å; K572-F574 HydrophobicContact CB-CE2 3.62Å; K572-F574 HydrophobicContact CB-CZ 3.95Å; K572-F574 HydrophobicContact CD-CZ 4.28Å; F574-K580 WeakPolarHBondContact CA-O 3.34Å; F574-F581 HydrophobicContact CD1-CB 4.28Å; F574-F581 HydrophobicContact CE1-CB 4.03Å; F574-F581 HydrophobicContact CE1-CD2 4.14Å; F574-F581 HydrophobicContact CZ-CD2 4.39Å
575	Y	94.1	Very high	92.7	Very high	71 Å²	71	43.8 Å²	43.8	28%	0.278	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	130.1	164.5	-74.8	-74.1	0	0	0	110.4	K560 L561 D577 L579 K580 F582	K560-Y575 HydrophobicContact CG-CD1 4.26Å; K560-Y575 HydrophobicContact CG-CE1 4.27Å; L561-Y575 HydrophobicContact CD2-CD1 3.73Å; L561-Y575 HydrophobicContact CD2-CE1 3.65Å; L561-Y575 HydrophobicContact CD2-CG 4.39Å; Y575-D577 PolarHBondContact O-N 2.78Å; Y575-L579 WeakPolarHBondContact O-CA 3.49Å; Y575-L579 PolarHBondContact O-N 2.94Å; Y575-K580 PolarHBondContact N-O 3.41Å; Y575-F582 HydrophobicContact CD2-CB 4Å; Y575-F582 HydrophobicContact CD2-CG 4.44Å; Y575-F582 HydrophobicContact CE2-CB 3.68Å; Y575-F582 AromaticContact CE2-CD2 3.48Å; Y575-F582 HydrophobicContact CE2-CD2 3.48Å; Y575-F582 VanDerWaalsContact CE2-CD2 3.48Å; Y575-F582 HydrophobicContact CE2-CE2 4.3Å; Y575-F582 AromaticContact CE2-CG 3.67Å; Y575-F582 HydrophobicContact CE2-CG 3.67Å; Y575-F582 AromaticContact CZ-CD2 3.65Å; Y575-F582 AromaticContact CZ-CG 3.88Å; Y575-F582 VanDerWaalsContact OH-CD2 3.25Å; Y575-F582 WeakPolarHBondContact OH-CD2 3.41Å; Y575-F582 WeakPolarHBondContact OH-CE2 3.22Å
576	V	89.6	Confident	92.6	Very high	9 Å²	9	50.9 Å²	50.9	6%	0.055	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-39.8	-177	174.9	0	0	0	0	111.9	R542 Y555 Q559 K560 L562	R542-V576 PolarHBondContact NH1-O 3.46Å; Y555-V576 HydrophobicContact CD1-CG2 3.89Å; Y555-V576 HydrophobicContact CE1-CB 4.43Å; Y555-V576 HydrophobicContact CE1-CG1 3.88Å; Y555-V576 HydrophobicContact CE1-CG2 3.59Å; Q559-V576 WeakPolarHBondContact O-CB 3Å; Q559-V576 WeakPolarHBondContact O-CG2 3.37Å; K560-V576 PolarHBondContact O-N 2.85Å; K560-V576 VanDerWaalsContact O-N 3.1Å; L562-V576 HydrophobicContact CB-CG2 3.93Å
577	D	87.9	Confident	92.3	Very high	121 Å²	121	53.1 Å²	53.1	65%	0.647	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-47.6	-175	-62.8	-24.9	0	0	0	112.4	R542 Y575	R542-D577 PolarHBondContact NH1-O 2.84Å; Y575-D577 PolarHBondContact O-N 2.78Å
578	T	88.6	Confident	92.3	Very high	83 Å²	83	50.3 Å²	50.3	51%	0.509	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-10.5	-171.3	60.1	0	0	0	0	114	K580	T578-K580 PolarHBondContact O-N 3.28Å; T578-K580 VanDerWaalsContact O-N 3.07Å; T578-K580 WeakPolarHBondContact OG1-CB 3.41Å; T578-K580 WeakPolarHBondContact OG1-CG 3.4Å; T578-K580 PolarHBondContact OG1-N 3.05Å
579	L	89.3	Confident	92.3	Very high	34 Å²	34	56.1 Å²	56.1	18%	0.178	28%	0.278	C	S	.	.			trans	53.6	20.7	-170.4	-56.3	178.6	0	0	0	113.8	F520 R542 L544 Y575	F520-L579 HydrophobicContact CE1-CD2 4.27Å; F520-L579 HydrophobicContact CE2-CD1 4.12Å; F520-L579 HydrophobicContact CE2-CD2 3.78Å; F520-L579 HydrophobicContact CZ-CD2 3.4Å; F520-L579 VanDerWaalsContact CZ-CD2 3.4Å; R542-L579 HydrophobicContact CB-CD1 4.5Å; L544-L579 HydrophobicContact CB-CD1 4.49Å; L544-L579 HydrophobicContact CD1-CB 4.43Å; Y575-L579 WeakPolarHBondContact O-CA 3.49Å; Y575-L579 PolarHBondContact O-N 2.94Å
580	K	92.1	Very high	92.4	Very high	141 Å²	141	58.7 Å²	58.7	61%	0.613	29%	0.29	S	S	*	.			trans	-71.3	137	173.8	-72.5	-179.4	179.2	-177.8	0	109.5	F574 Y575 T578 F582	F574-K580 WeakPolarHBondContact CA-O 3.34Å; Y575-K580 PolarHBondContact N-O 3.41Å; T578-K580 PolarHBondContact O-N 3.28Å; T578-K580 VanDerWaalsContact O-N 3.07Å; T578-K580 WeakPolarHBondContact OG1-CB 3.41Å; T578-K580 WeakPolarHBondContact OG1-CG 3.4Å; T578-K580 PolarHBondContact OG1-N 3.05Å; K580-F582 PolarHBondContact O-N 3.41Å
581	F	93.3	Very high	92.4	Very high	106 Å²	106	59.6 Å²	59.6	47%	0.465	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	132.1	171	175.7	-100.1	0	0	0	110.2	K572 F574 L583	K572-F581 HydrophobicContact CB-CE2 4.28Å; K572-F581 HydrophobicContact CD-CE2 4.46Å; K572-F581 HydrophobicContact CG-CE2 4.2Å; F574-F581 HydrophobicContact CD1-CB 4.28Å; F574-F581 HydrophobicContact CE1-CB 4.03Å; F574-F581 HydrophobicContact CE1-CD2 4.14Å; F574-F581 HydrophobicContact CZ-CD2 4.39Å; F581-L583 WeakPolarHBondContact CE2-O 3.34Å; F581-L583 VanDerWaalsContact CZ-C 3.41Å
582	F	93.1	Very high	92.4	Very high	59 Å²	59	59.6 Å²	59.6	26%	0.259	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-63.2	179.1	179.7	-133.8	0	0	0	111.4	L561 I573 Y575 K580	L561-F582 HydrophobicContact CD1-CE1 4.48Å; L561-F582 HydrophobicContact CD2-CD1 3.9Å; L561-F582 HydrophobicContact CD2-CE1 4.39Å; I573-F582 HydrophobicContact CG2-CD1 4.05Å; I573-F582 WeakPolarHBondContact O-CB 3.39Å; I573-F582 PolarHBondContact O-N 3.17Å; Y575-F582 HydrophobicContact CD2-CB 4Å; Y575-F582 HydrophobicContact CD2-CG 4.44Å; Y575-F582 HydrophobicContact CE2-CB 3.68Å; Y575-F582 AromaticContact CE2-CD2 3.48Å; Y575-F582 HydrophobicContact CE2-CD2 3.48Å; Y575-F582 VanDerWaalsContact CE2-CD2 3.48Å; Y575-F582 HydrophobicContact CE2-CE2 4.3Å; Y575-F582 AromaticContact CE2-CG 3.67Å; Y575-F582 HydrophobicContact CE2-CG 3.67Å; Y575-F582 AromaticContact CZ-CD2 3.65Å; Y575-F582 AromaticContact CZ-CG 3.88Å; Y575-F582 VanDerWaalsContact OH-CD2 3.25Å; Y575-F582 WeakPolarHBondContact OH-CD2 3.41Å; Y575-F582 WeakPolarHBondContact OH-CE2 3.22Å; K580-F582 PolarHBondContact O-N 3.41Å
583	L	92.9	Very high	92.3	Very high	35 Å²	35	61 Å²	61	18%	0.183	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151.3	-175	-65.8	169.3	0	0	0	110.7	I573 F581	I573-L583 HydrophobicContact CB-CB 4.42Å; I573-L583 HydrophobicContact CD1-CB 4.4Å; I573-L583 PolarHBondContact N-O 3.46Å; I573-L583 PolarHBondContact O-N 3.35Å; F581-L583 WeakPolarHBondContact CE2-O 3.34Å; F581-L583 VanDerWaalsContact CZ-C 3.41Å
584	S	93.7	Very high	92.2	Very high	36 Å²	36	61.2 Å²	61.2	25%	0.252	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.4	166.4	45.1	0	0	0	0	110.3	V571 Y586	V571-S584 WeakPolarHBondContact O-CA 3.32Å; S584-Y586 WeakPolarHBondContact OG-CE2 3.44Å; S584-Y586 PolarHBondContact OG-OH 3.18Å
585	L	93.8	Very high	92.1	Very high	4 Å²	4	61 Å²	61	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123.8	177.9	-49.3	176.8	0	0	0	109	V571 I573 I604 W616	V571-L585 HydrophobicContact CB-CB 4.16Å; V571-L585 HydrophobicContact CB-CD1 4.15Å; V571-L585 HydrophobicContact CB-CG 4.39Å; V571-L585 HydrophobicContact CG1-CD1 4.13Å; V571-L585 PolarHBondContact N-O 2.85Å; V571-L585 PolarHBondContact O-N 3.29Å; I573-L585 HydrophobicContact CD1-CD1 4.18Å; I573-L585 HydrophobicContact CD1-CG 4.36Å; L585-I604 HydrophobicContact CD1-CG2 4.03Å; L585-W616 HydrophobicContact CB-CD2 4.25Å; L585-W616 HydrophobicContact CB-CE3 4.27Å; L585-W616 HydrophobicContact CB-CH2 4.36Å; L585-W616 HydrophobicContact CB-CZ2 4.28Å; L585-W616 HydrophobicContact CB-CZ3 4.31Å; L585-W616 HydrophobicContact CD1-CB 4.23Å; L585-W616 HydrophobicContact CD1-CD2 3.96Å; L585-W616 HydrophobicContact CD1-CG 3.79Å; L585-W616 HydrophobicContact CD2-CD2 4.13Å; L585-W616 HydrophobicContact CD2-CE3 3.86Å; L585-W616 HydrophobicContact CD2-CG 4.43Å; L585-W616 HydrophobicContact CD2-CZ3 4.44Å; L585-W616 HydrophobicContact CG-CD2 4.35Å; L585-W616 HydrophobicContact CG-CE3 4.44Å
586	Y	92.1	Very high	92.1	Very high	150 Å²	150	58 Å²	58	59%	0.588	29%	0.293	S	S	*	.			trans	-121	147.5	-178.6	-62.5	-83.3	0	0	0	112.1	T570 S584 W616	T570-Y586 HydrophobicContact CG2-CD1 3.59Å; T570-Y586 HydrophobicContact CG2-CE1 3.46Å; T570-Y586 VanDerWaalsContact CG2-CE1 3.46Å; S584-Y586 WeakPolarHBondContact OG-CE2 3.44Å; S584-Y586 PolarHBondContact OG-OH 3.18Å; Y586-W616 WeakPolarHBondContact O-CH2 3.34Å
587	G	87.8	Confident	92.3	Very high	46 Å²	46	57.9 Å²	57.9	47%	0.474	29%	0.293	S	S	.	.			trans	131.1	1.8	166.1	0	0	0	0	0	115.2	K614	G587-K614 WeakPolarHBondContact O-CE 3.04Å; G587-K614 PolarHBondContact O-NZ 2.64Å
588	H	92.9	Very high	92.6	Very high	19 Å²	19	52.1 Å²	52.1	9%	0.088	26%	0.262	C	S	.	.			trans	-73.9	144.8	159.6	-68.5	-71.9	0	0	0	109.1	V592 T606 K614	H588-V592 HydrophobicContact CB-CG2 4.18Å; H588-V592 WeakPolarHBondContact CD2-CG2 3.26Å; H588-T606 PolarHBondContact NE2-OG1 3.34Å; H588-K614 VanDerWaalsContact CE1-CG 3.5Å; H588-K614 WeakPolarHBondContact CE1-CG 3.25Å
589	K	92.3	Very high	92.5	Very high	186 Å²	186	52.8 Å²	52.8	81%	0.809	26%	0.259	S	S	*	.	S	Bend	trans	-89.8	-30.4	177.6	-54.3	175.6	177.5	179.1	0	111.7	D610	K589-D610 VanDerWaalsContact CA-OD2 3.28Å; K589-D610 WeakPolarHBondContact CA-OD2 3.16Å; K589-D610 WeakPolarHBondContact CB-OD1 3.13Å; K589-D610 WeakPolarHBondContact CB-OD2 3.47Å; K589-D610 PolarHBondContact N-OD2 3.25Å
590	L	94.3	Very high	92.5	Very high	80 Å²	80	54.6 Å²	54.6	42%	0.419	27%	0.269	S	S	.	.	S	Bend	trans	-120.6	163.8	175.7	-68.3	174.5	0	0	0	111.3	S608 A609 D610	L590-S608 PolarHBondContact O-OG 2.82Å; L590-A609 HydrophobicContact CB-CB 3.95Å; L590-A609 HydrophobicContact CD1-CB 4.02Å; L590-D610 WeakPolarHBondContact CB-OD1 3.14Å; L590-D610 VanDerWaalsContact CD1-OD1 3.26Å; L590-D610 WeakPolarHBondContact CD1-OD1 3.02Å; L590-D610 WeakPolarHBondContact CG-OD1 3.48Å; L590-D610 PolarHBondContact N-OD1 3.34Å; L590-D610 VanDerWaalsContact N-OD1 3.09Å; L590-D610 PolarHBondContact N-OD2 2.94Å
591	P	93.5	Very high	92.3	Very high	30 Å²	30	48.6 Å²	48.6	20%	0.195	25%	0.247	C	C	.	.			trans	-57.9	142.8	-174.7	-26.3	35.1	0	0	0	113.7	L551 L567 I593 S608 A609	L551-P591 HydrophobicContact CD1-CB 3.76Å; L567-P591 HydrophobicContact CD1-CB 4.26Å; L567-P591 HydrophobicContact CD1-CG 4Å; L567-P591 WeakPolarHBondContact O-CG 3.49Å; P591-I593 PolarHBondContact O-N 3.37Å; P591-S608 PolarHBondContact O-OG 3.15Å; P591-A609 PolarHBondContact O-N 2.76Å
592	V	94.5	Very high	92.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	105.6	176.9	179.6	0	0	0	0	108.8	S565 V571 H588 C594 T606	S565-V592 PolarHBondContact OG-O 2.78Å; V571-V592 HydrophobicContact CG2-CB 4.23Å; V571-V592 HydrophobicContact CG2-CG1 4.13Å; V571-V592 HydrophobicContact CG2-CG2 4.08Å; H588-V592 HydrophobicContact CB-CG2 4.18Å; H588-V592 WeakPolarHBondContact CD2-CG2 3.26Å; V592-C594 WeakPolarHBondContact CG1-O 3.36Å; V592-T606 HydrophobicContact CG1-CG2 4.34Å
593	I	93.1	Very high	92.2	Very high	57 Å²	57	43 Å²	43	29%	0.292	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-42	-176.3	-62.7	173	0	0	0	110.7	P591 G607 A609 M635	P591-I593 PolarHBondContact O-N 3.37Å; I593-G607 PolarHBondContact N-O 2.98Å; I593-A609 HydrophobicContact CD1-CB 3.83Å; I593-A609 HydrophobicContact CG1-CB 4.47Å; I593-M635 HydrophobicContact CD1-SD 4.32Å
594	C	92.2	Very high	92.2	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.034	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	150.9	-173.8	60.1	0	0	0	0	111.9	V592 G607 L637	V592-C594 WeakPolarHBondContact CG1-O 3.36Å; C594-G607 PolarHBondContact N-O 3.21Å; C594-G607 PolarHBondContact O-N 2.82Å; C594-L637 HydrophobicContact CB-CB 4.2Å
595	M	94	Very high	92.3	Very high	9 Å²	9	39.6 Å²	39.6	4%	0.044	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	144.7	-176.8	177.7	171.5	59.9	0	0	110	A563 V571 I604 V605 T606	A563-M595 VanDerWaalsContact C-CE 3.43Å; A563-M595 HydrophobicContact CB-CE 3.44Å; A563-M595 VanDerWaalsContact CB-CE 3.44Å; A563-M595 HydrophobicContact CB-SD 3.67Å; A563-M595 WeakPolarHBondContact O-CE 3.05Å; V571-M595 HydrophobicContact CB-SD 4.45Å; V571-M595 HydrophobicContact CG1-CE 4.19Å; V571-M595 HydrophobicContact CG1-SD 3.42Å; V571-M595 WeakPolarHBondContact CG1-SD 3.49Å; V571-M595 HydrophobicContact CG2-SD 4.17Å; M595-I604 HydrophobicContact CG-CD1 3.82Å; M595-I604 HydrophobicContact CG-CG1 3.87Å; M595-I604 HydrophobicContact SD-CD1 3.44Å; M595-I604 WeakPolarHBondContact SD-CD1 3.38Å; M595-I604 HydrophobicContact SD-CG1 4.14Å; M595-V605 VanDerWaalsContact CA-O 3.32Å; M595-V605 WeakPolarHBondContact CA-O 3.32Å; M595-T606 HydrophobicContact CG-CG2 4.11Å; M595-T606 HydrophobicContact SD-CG2 4.15Å
596	D	94.3	Very high	92.4	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.037	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	153.5	170.6	-156	12.7	0	0	0	111.8	I604 V605 L637 R638 F639	D596-I604 WeakPolarHBondContact O-CG1 3.17Å; D596-V605 PolarHBondContact N-O 3.08Å; D596-V605 PolarHBondContact O-N 2.8Å; D596-L637 HydrophobicContact CB-CD2 3.52Å; D596-R638 IonicContact OD1-CZ 3.09Å; D596-R638 IonicContact OD1-NH1 4Å; D596-R638 PolarHBondContact OD1-NH1 3.5Å; D596-R638 WeakPolarHBondContact OD2-CA 3.49Å; D596-R638 VanDerWaalsContact OD2-CD 3.3Å; D596-R638 WeakPolarHBondContact OD2-CD 3.31Å; D596-R638 IonicContact OD2-CZ 3.35Å; D596-R638 IonicContact OD2-NE 3.73Å; D596-R638 IonicContact OD2-NH1 3.76Å; D596-R638 PolarHBondContact OD2-NH1 2.78Å; D596-F639 HydrophobicContact CB-CD2 3.9Å; D596-F639 PolarHBondContact OD2-N 2.91Å
597	I	93.6	Very high	92.5	Very high	7 Å²	7	32.2 Å²	32.2	4%	0.036	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.1	179.3	-62.5	170.8	0	0	0	108.4	A563 I604 L618	A563-I597 HydrophobicContact CB-CD1 4.01Å; I597-I604 HydrophobicContact CD1-CD1 4.33Å; I597-I604 HydrophobicContact CG1-CB 4.31Å; I597-I604 HydrophobicContact CG1-CD1 3.86Å; I597-I604 HydrophobicContact CG1-CG1 3.87Å; I597-L618 HydrophobicContact CG1-CD1 4.39Å; I597-L618 HydrophobicContact CG2-CD1 3.63Å
598	S	92.6	Very high	92.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.			trans	-58.4	155.5	174.2	52.3	0	0	0	0	112.7	P557 D600 G601 A602 L603	P557-S598 WeakPolarHBondContact CD-O 3.02Å; P557-S598 WeakPolarHBondContact CG-O 3.12Å; S598-D600 VanDerWaalsContact C-N 3.3Å; S598-D600 VanDerWaalsContact CB-OD1 3.26Å; S598-D600 WeakPolarHBondContact CB-OD1 3.35Å; S598-D600 PolarHBondContact O-N 3.41Å; S598-D600 PolarHBondContact OG-OD1 3.38Å; S598-G601 PolarHBondContact O-N 2.85Å; S598-A602 PolarHBondContact OG-N 3.37Å; S598-L603 WeakPolarHBondContact CB-O 3.47Å; S598-L603 PolarHBondContact N-O 3.35Å; S598-L603 WeakPolarHBondContact OG-CA 3.34Å; S598-L603 PolarHBondContact OG-N 3.23Å; S598-L603 PolarHBondContact OG-O 3.23Å
599	H	87.4	Confident	92.8	Very high	98 Å²	98	30.4 Å²	30.4	45%	0.454	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-32.2	-175.7	-168.9	64.5	0	0	0	113.9	P557 G601	P557-H599 WeakPolarHBondContact CB-O 3.33Å; H599-G601 VanDerWaalsContact C-N 3.33Å
600	D	89.1	Confident	92.8	Very high	72 Å²	72	22.9 Å²	22.9	39%	0.385	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-17.8	176.4	64.6	-13.7	0	0	0	112.7	N558 S598 A602 H644	N558-D600 PolarHBondContact ND2-O 3.08Å; S598-D600 VanDerWaalsContact C-N 3.3Å; S598-D600 VanDerWaalsContact CB-OD1 3.26Å; S598-D600 WeakPolarHBondContact CB-OD1 3.35Å; S598-D600 PolarHBondContact O-N 3.41Å; S598-D600 PolarHBondContact OG-OD1 3.38Å; D600-A602 PolarHBondContact OD1-N 2.99Å; D600-A602 VanDerWaalsContact OD1-N 3.08Å; D600-A602 VanDerWaalsContact OD2-CB 3.27Å; D600-A602 WeakPolarHBondContact OD2-CB 3.27Å; D600-H644 IonicContact OD1-NE2 2.95Å; D600-H644 IonicContact OD2-CE1 2.64Å; D600-H644 PolarHBondContact OD2-CE1 3.19Å; D600-H644 VanDerWaalsContact OD2-CE1 3.32Å; D600-H644 IonicContact OD2-NE2 3.89Å; D600-H644 PolarHBondContact OD2-NE2 2.81Å; D600-H644 VanDerWaalsContact OD2-NE2 3.12Å
601	G	87.6	Confident	92.8	Very high	14 Å²	14	24.7 Å²	24.7	14%	0.144	13%	0.133	C	C	.	.	S	Bend	trans	80	16.5	-177.1	0	0	0	0	0	113.8	S598 H599 L618	S598-G601 PolarHBondContact O-N 2.85Å; H599-G601 VanDerWaalsContact C-N 3.33Å; G601-L618 VanDerWaalsContact O-CD1 3.28Å; G601-L618 WeakPolarHBondContact O-CD1 3.22Å
602	A	90.8	Very high	92.8	Very high	32 Å²	32	25.3 Å²	25.3	26%	0.264	13%	0.134	S	C	.	.	S	Bend	trans	-90.1	-35.4	-179.2	0	0	0	0	0	112.9	S598 D600 L618	S598-A602 PolarHBondContact OG-N 3.37Å; D600-A602 PolarHBondContact OD1-N 2.99Å; D600-A602 VanDerWaalsContact OD1-N 3.08Å; D600-A602 VanDerWaalsContact OD2-CB 3.27Å; D600-A602 WeakPolarHBondContact OD2-CB 3.27Å; A602-L618 WeakPolarHBondContact O-CB 3.43Å; A602-L618 PolarHBondContact O-N 2.85Å
603	L	93.3	Very high	92.8	Very high	15 Å²	15	25.4 Å²	25.4	8%	0.079	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	143.6	-177.6	-60.7	173.4	0	0	0	112.1	S598 I615 W616 A660	S598-L603 WeakPolarHBondContact CB-O 3.47Å; S598-L603 PolarHBondContact N-O 3.35Å; S598-L603 WeakPolarHBondContact OG-CA 3.34Å; S598-L603 PolarHBondContact OG-N 3.23Å; S598-L603 PolarHBondContact OG-O 3.23Å; L603-I615 HydrophobicContact CD2-CG2 4.27Å; L603-W616 WeakPolarHBondContact CA-O 3.41Å; L603-A660 HydrophobicContact CD1-CB 3.91Å
604	I	94.4	Very high	92.9	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136	168	-171.8	170.6	0	0	0	109.6	A563 L585 M595 D596 I597 W616 L618	A563-I604 HydrophobicContact CB-CD1 3.56Å; L585-I604 HydrophobicContact CD1-CG2 4.03Å; M595-I604 HydrophobicContact CG-CD1 3.82Å; M595-I604 HydrophobicContact CG-CG1 3.87Å; M595-I604 HydrophobicContact SD-CD1 3.44Å; M595-I604 WeakPolarHBondContact SD-CD1 3.38Å; M595-I604 HydrophobicContact SD-CG1 4.14Å; D596-I604 WeakPolarHBondContact O-CG1 3.17Å; I597-I604 HydrophobicContact CD1-CD1 4.33Å; I597-I604 HydrophobicContact CG1-CB 4.31Å; I597-I604 HydrophobicContact CG1-CD1 3.86Å; I597-I604 HydrophobicContact CG1-CG1 3.87Å; I604-W616 HydrophobicContact CG2-CB 3.59Å; I604-W616 HydrophobicContact CG2-CG 4.13Å; I604-W616 PolarHBondContact N-O 2.85Å; I604-W616 PolarHBondContact O-N 3.09Å; I604-L618 HydrophobicContact CB-CD1 3.95Å; I604-L618 HydrophobicContact CB-CG 4.11Å; I604-L618 HydrophobicContact CG2-CD1 4.47Å; I604-L618 HydrophobicContact CG2-CG 4.09Å
605	V	95.2	Very high	93.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134	179.1	-173.1	0	0	0	0	108.8	M595 D596 V613 K614 I615 L637 F639 F646	M595-V605 VanDerWaalsContact CA-O 3.32Å; M595-V605 WeakPolarHBondContact CA-O 3.32Å; D596-V605 PolarHBondContact N-O 3.08Å; D596-V605 PolarHBondContact O-N 2.8Å; V605-V613 HydrophobicContact CG1-CG1 3.19Å; V605-K614 WeakPolarHBondContact CA-O 3.31Å; V605-I615 HydrophobicContact CG1-CG1 4.31Å; V605-I615 HydrophobicContact CG2-CB 4.41Å; V605-I615 HydrophobicContact CG2-CD1 4.31Å; V605-I615 HydrophobicContact CG2-CG1 4.05Å; V605-I615 HydrophobicContact CG2-CG2 4.1Å; V605-L637 HydrophobicContact CB-CD1 4.07Å; V605-L637 HydrophobicContact CB-CD2 3.98Å; V605-L637 HydrophobicContact CG1-CD1 3.37Å; V605-L637 HydrophobicContact CG1-CD2 4.19Å; V605-L637 HydrophobicContact CG1-CG 4.4Å; V605-F639 HydrophobicContact CB-CE2 4.07Å; V605-F639 HydrophobicContact CB-CZ 4.24Å; V605-F639 HydrophobicContact CG2-CE1 4.34Å; V605-F639 HydrophobicContact CG2-CE2 3.62Å; V605-F639 HydrophobicContact CG2-CZ 3.31Å; V605-F646 HydrophobicContact CG1-CD2 4.3Å; V605-F646 HydrophobicContact CG1-CE2 3.96Å; V605-F646 HydrophobicContact CG1-CZ 4.15Å; V605-F646 HydrophobicContact CG2-CD1 4.39Å; V605-F646 HydrophobicContact CG2-CE1 4.36Å
606	T	95.1	Very high	93.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.2	-174.1	54.1	0	0	0	0	109.4	V571 H588 V592 M595 V613 K614 W616	V571-T606 HydrophobicContact CG2-CG2 4Å; H588-T606 PolarHBondContact NE2-OG1 3.34Å; V592-T606 HydrophobicContact CG1-CG2 4.34Å; M595-T606 HydrophobicContact CG-CG2 4.11Å; M595-T606 HydrophobicContact SD-CG2 4.15Å; T606-V613 CarbonylContact O-C 3.56Å; T606-V613 WeakPolarHBondContact O-CA 3.43Å; T606-K614 PolarHBondContact N-O 2.95Å; T606-K614 PolarHBondContact O-N 3.18Å; T606-K614 PolarHBondContact OG1-O 2.9Å; T606-K614 VanDerWaalsContact OG1-O 3.05Å; T606-W616 PolarHBondContact OG1-NE1 3.42Å
607	G	94.3	Very high	93.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.5	176	0	0	0	0	0	110.9	I593 C594	I593-G607 PolarHBondContact N-O 2.98Å; C594-G607 PolarHBondContact N-O 3.21Å; C594-G607 PolarHBondContact O-N 2.82Å
608	S	94.4	Very high	92.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	161.8	-177.1	173.2	0	0	0	0	112.1	L590 P591 D610 R611 N612 V634	L590-S608 PolarHBondContact O-OG 2.82Å; P591-S608 PolarHBondContact O-OG 3.15Å; S608-D610 PolarHBondContact O-N 2.93Å; S608-D610 PolarHBondContact OG-N 3.43Å; S608-D610 VanDerWaalsContact OG-N 3.09Å; S608-D610 PolarHBondContact OG-OD2 3.35Å; S608-R611 PolarHBondContact O-N 2.83Å; S608-N612 PolarHBondContact N-O 2.75Å; S608-V634 PolarHBondContact O-N 2.96Å
609	A	93.6	Very high	92.8	Very high	27 Å²	27	29.1 Å²	29.1	22%	0.223	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.6	164.9	0	0	0	0	0	113	L590 P591 I593 R611	L590-A609 HydrophobicContact CB-CB 3.95Å; L590-A609 HydrophobicContact CD1-CB 4.02Å; P591-A609 PolarHBondContact O-N 2.76Å; I593-A609 HydrophobicContact CD1-CB 3.83Å; I593-A609 HydrophobicContact CG1-CB 4.47Å; A609-R611 PolarHBondContact O-N 3.05Å
610	D	91.8	Very high	92.8	Very high	28 Å²	28	32.5 Å²	32.5	15%	0.15	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	0.6	173.1	-74.2	-32.3	0	0	0	115.2	K589 L590 S608 N612	K589-D610 VanDerWaalsContact CA-OD2 3.28Å; K589-D610 WeakPolarHBondContact CA-OD2 3.16Å; K589-D610 WeakPolarHBondContact CB-OD1 3.13Å; K589-D610 WeakPolarHBondContact CB-OD2 3.47Å; K589-D610 PolarHBondContact N-OD2 3.25Å; L590-D610 WeakPolarHBondContact CB-OD1 3.14Å; L590-D610 VanDerWaalsContact CD1-OD1 3.26Å; L590-D610 WeakPolarHBondContact CD1-OD1 3.02Å; L590-D610 WeakPolarHBondContact CG-OD1 3.48Å; L590-D610 PolarHBondContact N-OD1 3.34Å; L590-D610 VanDerWaalsContact N-OD1 3.09Å; L590-D610 PolarHBondContact N-OD2 2.94Å; S608-D610 PolarHBondContact O-N 2.93Å; S608-D610 PolarHBondContact OG-N 3.43Å; S608-D610 VanDerWaalsContact OG-N 3.09Å; S608-D610 PolarHBondContact OG-OD2 3.35Å; D610-N612 HydrophobicContact CB-CB 4.5Å; D610-N612 PolarHBondContact O-N 3.22Å; D610-N612 VanDerWaalsContact O-N 3.07Å
611	R	93.6	Very high	92.8	Very high	118 Å²	118	29.9 Å²	29.9	45%	0.445	16%	0.157	S	C	.	.	S	Bend	trans	71.5	-7.1	-176.6	-40.3	167.9	177.3	171	0	113.9	S608 A609 F628 A629 H630 D631	S608-R611 PolarHBondContact O-N 2.83Å; A609-R611 PolarHBondContact O-N 3.05Å; R611-F628 HydrophobicContact CB-CE2 4.21Å; R611-A629 PolarHBondContact O-N 3.13Å; R611-H630 WeakPolarHBondContact CB-O 3.4Å; R611-H630 PolarHBondContact O-N 3.2Å; R611-D631 VanDerWaalsContact CD-O 3.22Å; R611-D631 WeakPolarHBondContact CD-O 3.44Å; R611-D631 PolarHBondContact NE-O 3.26Å
612	N	93.9	Very high	93	Very high	43 Å²	43	32.7 Å²	32.7	23%	0.23	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	150.5	179	-70.9	-9.9	0	0	0	112	S608 D610 L627 F628	S608-N612 PolarHBondContact N-O 2.75Å; D610-N612 HydrophobicContact CB-CB 4.5Å; D610-N612 PolarHBondContact O-N 3.22Å; D610-N612 VanDerWaalsContact O-N 3.07Å; N612-L627 WeakPolarHBondContact CA-O 3.27Å; N612-F628 VanDerWaalsContact OD1-CD2 3.27Å; N612-F628 WeakPolarHBondContact OD1-CD2 3.41Å
613	V	95.3	Very high	93.1	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.2	169.6	176.1	0	0	0	0	108.3	V605 T606 L627 A629 V634 L637 F646 T648	V605-V613 HydrophobicContact CG1-CG1 3.19Å; T606-V613 CarbonylContact O-C 3.56Å; T606-V613 WeakPolarHBondContact O-CA 3.43Å; V613-L627 PolarHBondContact N-O 3Å; V613-L627 PolarHBondContact O-N 3.43Å; V613-A629 HydrophobicContact CB-CB 4.19Å; V613-A629 HydrophobicContact CG2-CB 3.62Å; V613-V634 HydrophobicContact CG2-CG1 4.26Å; V613-V634 HydrophobicContact CG2-CG2 4.01Å; V613-L637 HydrophobicContact CG1-CD1 4.03Å; V613-F646 HydrophobicContact CG1-CE2 4.07Å; V613-F646 HydrophobicContact CG1-CZ 4.38Å; V613-T648 HydrophobicContact CG2-CG2 3.97Å
614	K	95.1	Very high	93	Very high	29 Å²	29	37.5 Å²	37.5	13%	0.126	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	135.1	176.3	-66.3	-171.8	-178.4	-156	0	110.8	G587 H588 V605 T606 W616	G587-K614 WeakPolarHBondContact O-CE 3.04Å; G587-K614 PolarHBondContact O-NZ 2.64Å; H588-K614 VanDerWaalsContact CE1-CG 3.5Å; H588-K614 WeakPolarHBondContact CE1-CG 3.25Å; V605-K614 WeakPolarHBondContact CA-O 3.31Å; T606-K614 PolarHBondContact N-O 2.95Å; T606-K614 PolarHBondContact O-N 3.18Å; T606-K614 PolarHBondContact OG1-O 2.9Å; T606-K614 VanDerWaalsContact OG1-O 3.05Å; K614-W616 HydrophobicContact CB-CZ2 3.99Å; K614-W616 HydrophobicContact CD-CH2 4.23Å; K614-W616 HydrophobicContact CD-CZ2 3.59Å; K614-W616 HydrophobicContact CG-CZ2 4.47Å
615	I	95.7	Very high	92.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.2	176.4	-47.5	-163.4	0	0	0	108.4	L603 V605 H624 R625 L627 F646 A660 F663	L603-I615 HydrophobicContact CD2-CG2 4.27Å; V605-I615 HydrophobicContact CG1-CG1 4.31Å; V605-I615 HydrophobicContact CG2-CB 4.41Å; V605-I615 HydrophobicContact CG2-CD1 4.31Å; V605-I615 HydrophobicContact CG2-CG1 4.05Å; V605-I615 HydrophobicContact CG2-CG2 4.1Å; I615-H624 PolarHBondContact O-N 3.09Å; I615-R625 PolarHBondContact N-O 2.97Å; I615-L627 HydrophobicContact CD1-CD1 4.13Å; I615-F646 HydrophobicContact CD1-CE1 3.68Å; I615-F646 HydrophobicContact CD1-CZ 3.87Å; I615-A660 HydrophobicContact CD1-CB 3.94Å; I615-F663 HydrophobicContact CB-CE1 4.07Å; I615-F663 HydrophobicContact CD1-CD1 3.72Å; I615-F663 HydrophobicContact CD1-CE1 3.87Å; I615-F663 HydrophobicContact CG1-CD1 4.41Å; I615-F663 HydrophobicContact CG1-CE1 4.37Å; I615-F663 HydrophobicContact CG2-CE1 4.12Å
616	W	95.1	Very high	92.8	Very high	11 Å²	11	46.5 Å²	46.5	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.8	-178.1	-44.3	80	0	0	0	111.5	L585 Y586 L603 I604 T606 K614 D622 C623	L585-W616 HydrophobicContact CB-CD2 4.25Å; L585-W616 HydrophobicContact CB-CE3 4.27Å; L585-W616 HydrophobicContact CB-CH2 4.36Å; L585-W616 HydrophobicContact CB-CZ2 4.28Å; L585-W616 HydrophobicContact CB-CZ3 4.31Å; L585-W616 HydrophobicContact CD1-CB 4.23Å; L585-W616 HydrophobicContact CD1-CD2 3.96Å; L585-W616 HydrophobicContact CD1-CG 3.79Å; L585-W616 HydrophobicContact CD2-CD2 4.13Å; L585-W616 HydrophobicContact CD2-CE3 3.86Å; L585-W616 HydrophobicContact CD2-CG 4.43Å; L585-W616 HydrophobicContact CD2-CZ3 4.44Å; L585-W616 HydrophobicContact CG-CD2 4.35Å; L585-W616 HydrophobicContact CG-CE3 4.44Å; Y586-W616 WeakPolarHBondContact O-CH2 3.34Å; L603-W616 WeakPolarHBondContact CA-O 3.41Å; I604-W616 HydrophobicContact CG2-CB 3.59Å; I604-W616 HydrophobicContact CG2-CG 4.13Å; I604-W616 PolarHBondContact N-O 2.85Å; I604-W616 PolarHBondContact O-N 3.09Å; T606-W616 PolarHBondContact OG1-NE1 3.42Å; K614-W616 HydrophobicContact CB-CZ2 3.99Å; K614-W616 HydrophobicContact CD-CH2 4.23Å; K614-W616 HydrophobicContact CD-CZ2 3.59Å; K614-W616 HydrophobicContact CG-CZ2 4.47Å; W616-D622 CarbonylContact C-O 3.26Å; W616-D622 WeakPolarHBondContact CA-O 3.44Å; W616-C623 HydrophobicContact CD2-CB 4.3Å; W616-C623 HydrophobicContact CE3-CB 3.63Å; W616-C623 HydrophobicContact CH2-CB 3.94Å; W616-C623 HydrophobicContact CZ3-CB 3.45Å; W616-C623 VanDerWaalsContact CZ3-CB 3.45Å
617	G	93.8	Very high	92.7	Very high	5 Å²	5	47.2 Å²	47.2	5%	0.052	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.7	165.1	0	0	0	0	0	110.3	D619 G621 D622 H624	G617-D619 VanDerWaalsContact C-N 3.32Å; G617-G621 WeakPolarHBondContact O-CA 3.32Å; G617-G621 PolarHBondContact O-N 2.84Å; G617-D622 PolarHBondContact N-O 2.72Å; G617-H624 PolarHBondContact N-CD2 2.94Å
618	L	89.7	Confident	92.6	Very high	3 Å²	3	53 Å²	53	2%	0.016	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-20.7	179.1	-95.9	150.3	0	0	0	113.2	L561 I573 I597 G601 A602 I604	L561-L618 HydrophobicContact CD1-CD2 3.66Å; I573-L618 HydrophobicContact CD1-CD2 3.77Å; I573-L618 HydrophobicContact CG2-CD2 4.44Å; I597-L618 HydrophobicContact CG1-CD1 4.39Å; I597-L618 HydrophobicContact CG2-CD1 3.63Å; G601-L618 VanDerWaalsContact O-CD1 3.28Å; G601-L618 WeakPolarHBondContact O-CD1 3.22Å; A602-L618 WeakPolarHBondContact O-CB 3.43Å; A602-L618 PolarHBondContact O-N 2.85Å; I604-L618 HydrophobicContact CB-CD1 3.95Å; I604-L618 HydrophobicContact CB-CG 4.11Å; I604-L618 HydrophobicContact CG2-CD1 4.47Å; I604-L618 HydrophobicContact CG2-CG 4.09Å
619	D	89.3	Confident	92.4	Very high	116 Å²	116	53 Å²	53	62%	0.62	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-43.2	-177.9	-69.6	-29.8	0	0	0	112.2	G617	G617-D619 VanDerWaalsContact C-N 3.32Å
620	F	88	Confident	92.4	Very high	169 Å²	169	51.7 Å²	51.7	74%	0.741	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-10.6	-176.1	-56.8	-72	0	0	0	114.1
621	G	88.6	Confident	92.3	Very high	16 Å²	16	55 Å²	55	17%	0.165	27%	0.27	C	S	.	.			trans	76.8	23.6	-176.3	0	0	0	0	0	113.5	G617	G617-G621 WeakPolarHBondContact O-CA 3.32Å; G617-G621 PolarHBondContact O-N 2.84Å
622	D	92.5	Very high	92.3	Very high	74 Å²	74	51.9 Å²	51.9	40%	0.396	26%	0.262	S	S	.	.			trans	-78.5	140.8	177.6	60.4	-40.4	0	0	0	111.7	W616 G617 H624	W616-D622 CarbonylContact C-O 3.26Å; W616-D622 WeakPolarHBondContact CA-O 3.44Å; G617-D622 PolarHBondContact N-O 2.72Å; D622-H624 PolarHBondContact O-N 2.8Å; D622-H624 IonicContact OD2-CE1 3.23Å
623	C	92.4	Very high	92.3	Very high	56 Å²	56	50.5 Å²	50.5	38%	0.378	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	108.8	174.9	-173.6	0	0	0	0	109	W616	W616-C623 HydrophobicContact CD2-CB 4.3Å; W616-C623 HydrophobicContact CE3-CB 3.63Å; W616-C623 HydrophobicContact CH2-CB 3.94Å; W616-C623 HydrophobicContact CZ3-CB 3.45Å; W616-C623 VanDerWaalsContact CZ3-CB 3.45Å
624	H	92	Very high	92.3	Very high	91 Å²	91	50.5 Å²	50.5	42%	0.421	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	-51.8	173.9	-74.7	-63.6	0	0	0	111.3	I615 G617 D622 F663	I615-H624 PolarHBondContact O-N 3.09Å; G617-H624 PolarHBondContact N-CD2 2.94Å; D622-H624 PolarHBondContact O-N 2.8Å; D622-H624 IonicContact OD2-CE1 3.23Å; H624-F663 HydrophobicContact CB-CE1 3.77Å; H624-F663 HydrophobicContact CB-CZ 3.58Å
625	R	92.4	Very high	92.3	Very high	131 Å²	131	50.4 Å²	50.4	49%	0.494	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	147	179.8	-153.5	168.8	-177.7	173.1	-2	112.4	I615 L627 F663	I615-R625 PolarHBondContact N-O 2.97Å; R625-L627 HydrophobicContact CG-CD2 4.23Å; R625-F663 HydrophobicContact CB-CD1 3.71Å; R625-F663 HydrophobicContact CB-CE1 4.03Å; R625-F663 HydrophobicContact CB-CG 4.11Å
626	S	93.1	Very high	92.1	Very high	58 Å²	58	54.4 Å²	54.4	41%	0.406	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.6	166	-172.4	0	0	0	0	108.6
627	L	92.9	Very high	92.1	Very high	15 Å²	15	54.1 Å²	54.1	8%	0.079	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.7	-179.6	-62.6	173.9	0	0	0	109.4	N612 V613 I615 R625 A629 W658 F663	N612-L627 WeakPolarHBondContact CA-O 3.27Å; V613-L627 PolarHBondContact N-O 3Å; V613-L627 PolarHBondContact O-N 3.43Å; I615-L627 HydrophobicContact CD1-CD1 4.13Å; R625-L627 HydrophobicContact CG-CD2 4.23Å; L627-A629 PolarHBondContact O-N 3.26Å; L627-W658 HydrophobicContact CD1-CE3 3.98Å; L627-W658 HydrophobicContact CD1-CZ3 4.31Å; L627-F663 HydrophobicContact CD2-CB 4.32Å
628	F	92.3	Very high	92.1	Very high	121 Å²	121	58.8 Å²	58.8	53%	0.531	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	101.6	166.3	-176.3	-95.8	0	0	0	107.5	R611 N612 H630	R611-F628 HydrophobicContact CB-CE2 4.21Å; N612-F628 VanDerWaalsContact OD1-CD2 3.27Å; N612-F628 WeakPolarHBondContact OD1-CD2 3.41Å; F628-H630 WeakPolarHBondContact CE1-O 3.29Å; F628-H630 WeakPolarHBondContact CZ-O 3.4Å
629	A	89.3	Confident	92.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.289	C	S	.	.			trans	-92.5	-46.3	-168.5	0	0	0	0	0	111.9	R611 V613 L627 K656 W658	R611-A629 PolarHBondContact O-N 3.13Å; V613-A629 HydrophobicContact CB-CB 4.19Å; V613-A629 HydrophobicContact CG2-CB 3.62Å; L627-A629 PolarHBondContact O-N 3.26Å; A629-K656 WeakPolarHBondContact O-CD 3.49Å; A629-K656 VanDerWaalsContact O-CE 3.24Å; A629-K656 WeakPolarHBondContact O-CE 2.96Å; A629-K656 PolarHBondContact O-NZ 2.93Å; A629-W658 HydrophobicContact CB-CZ2 3.78Å
630	H	92.9	Very high	92.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.261	C	S	.	.			trans	-132.1	162	-170.7	-74	-85.8	0	0	0	111.6	R611 F628 D632 V634 T648 D652 K654	R611-H630 WeakPolarHBondContact CB-O 3.4Å; R611-H630 PolarHBondContact O-N 3.2Å; F628-H630 WeakPolarHBondContact CE1-O 3.29Å; F628-H630 WeakPolarHBondContact CZ-O 3.4Å; H630-D632 VanDerWaalsContact C-N 3.3Å; H630-D632 VanDerWaalsContact CB-O 3.28Å; H630-D632 WeakPolarHBondContact CB-O 3.46Å; H630-V634 HydrophobicContact CB-CG2 4.3Å; H630-T648 WeakPolarHBondContact NE2-CB 3.31Å; H630-T648 PolarHBondContact NE2-O 3.5Å; H630-T648 PolarHBondContact NE2-OG1 3.09Å; H630-D652 WeakPolarHBondContact CA-OD2 3.31Å; H630-D652 VanDerWaalsContact CB-OD2 3.28Å; H630-D652 WeakPolarHBondContact CB-OD2 3.36Å; H630-D652 IonicContact CE1-OD1 2.85Å; H630-D652 IonicContact CG-OD1 3.46Å; H630-D652 IonicContact CG-OD2 2.71Å; H630-D652 VanDerWaalsContact ND1-CG 3.27Å; H630-D652 IonicContact ND1-OD1 2.72Å; H630-D652 PolarHBondContact ND1-OD1 3.2Å; H630-D652 IonicContact ND1-OD2 2.7Å; H630-D652 PolarHBondContact ND1-OD2 3.34Å; H630-K654 PolarHBondContact CE1-O 3.05Å; H630-K654 VanDerWaalsContact CE1-O 3.23Å
631	D	91.1	Very high	92.6	Very high	98 Å²	98	47.7 Å²	47.7	52%	0.524	24%	0.238	S	C	.	.	S	Bend	trans	-80.7	-17.5	176.1	-63.7	-36.6	0	0	0	112.3	R611 D652	R611-D631 VanDerWaalsContact CD-O 3.22Å; R611-D631 WeakPolarHBondContact CD-O 3.44Å; R611-D631 PolarHBondContact NE-O 3.26Å; D631-D652 HydrophobicContact CB-CB 4.32Å; D631-D652 PolarHBondContact N-OD2 3.01Å
632	D	94	Very high	92.5	Very high	52 Å²	52	55.4 Å²	55.4	28%	0.278	27%	0.266	S	S	.	.	S	Bend	trans	-133.8	179.7	175.8	-157.3	0.3	0	0	0	110.9	H630 K651 D652	H630-D632 VanDerWaalsContact C-N 3.3Å; H630-D632 VanDerWaalsContact CB-O 3.28Å; H630-D632 WeakPolarHBondContact CB-O 3.46Å; D632-K651 HydrophobicContact CB-CB 4Å; D632-K651 VanDerWaalsContact OD2-CD 3.24Å; D632-K651 WeakPolarHBondContact OD2-CD 3.35Å; D632-K651 WeakPolarHBondContact OD2-CG 3.23Å; D632-K651 IonicContact OD2-NZ 3.52Å; D632-D652 HydrophobicContact CB-CB 4.23Å
633	S	93.8	Very high	92.3	Very high	15 Å²	15	53.4 Å²	53.4	11%	0.105	26%	0.259	C	S	.	.			trans	-54.4	138.6	-172.5	58.4	0	0	0	0	113.6	M635 K651	S633-M635 PolarHBondContact O-N 3.16Å; S633-M635 PolarHBondContact OG-SD 2.97Å; S633-K651 WeakPolarHBondContact O-CB 3.38Å; S633-K651 PolarHBondContact O-N 2.85Å; S633-K651 WeakPolarHBondContact OG-CB 3.4Å; S633-K651 WeakPolarHBondContact OG-CD 3.22Å
634	V	95.3	Very high	92.3	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	114.8	175.2	-172.1	0	0	0	0	109.2	S608 V613 H630	S608-V634 PolarHBondContact O-N 2.96Å; V613-V634 HydrophobicContact CG2-CG1 4.26Å; V613-V634 HydrophobicContact CG2-CG2 4.01Å; H630-V634 HydrophobicContact CB-CG2 4.3Å
635	M	93.5	Very high	92.3	Very high	27 Å²	27	50.2 Å²	50.2	13%	0.133	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-37.2	-171.3	-62.1	-53	-57.1	0	0	112.7	I593 S633 A649 K651 I676 W677	I593-M635 HydrophobicContact CD1-SD 4.32Å; S633-M635 PolarHBondContact O-N 3.16Å; S633-M635 PolarHBondContact OG-SD 2.97Å; M635-A649 PolarHBondContact N-O 2.81Å; M635-K651 HydrophobicContact CG-CB 4.26Å; M635-I676 VanDerWaalsContact CB-O 3.31Å; M635-I676 WeakPolarHBondContact CB-O 3.5Å; M635-I676 WeakPolarHBondContact CG-O 3.39Å; M635-W677 HydrophobicContact CE-CE3 3.57Å; M635-W677 HydrophobicContact CE-CH2 4.2Å; M635-W677 HydrophobicContact CE-CZ3 3.25Å
636	Y	93.2	Very high	92.4	Very high	84 Å²	84	44 Å²	44	33%	0.329	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	150.5	-176.5	-148.3	-92.4	0	0	0	111.9	A649 C678 L679	Y636-A649 PolarHBondContact N-O 2.78Å; Y636-A649 PolarHBondContact O-N 2.86Å; Y636-C678 HydrophobicContact CD2-CB 4.27Å; Y636-C678 HydrophobicContact CE2-CB 4.48Å; Y636-L679 HydrophobicContact CD1-CB 3.94Å; Y636-L679 WeakPolarHBondContact CD1-O 3.49Å; Y636-L679 WeakPolarHBondContact CE1-O 3.48Å
637	L	94.6	Very high	92.5	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	137.2	-178.6	-168.7	146.3	0	0	0	110	C594 D596 V605 V613 F646 F647 T648	C594-L637 HydrophobicContact CB-CB 4.2Å; D596-L637 HydrophobicContact CB-CD2 3.52Å; V605-L637 HydrophobicContact CB-CD1 4.07Å; V605-L637 HydrophobicContact CB-CD2 3.98Å; V605-L637 HydrophobicContact CG1-CD1 3.37Å; V605-L637 HydrophobicContact CG1-CD2 4.19Å; V605-L637 HydrophobicContact CG1-CG 4.4Å; V613-L637 HydrophobicContact CG1-CD1 4.03Å; L637-F646 HydrophobicContact CD1-CD2 4.23Å; L637-F646 HydrophobicContact CD1-CE2 4.41Å; L637-F646 HydrophobicContact CG-CD2 4.32Å; L637-F647 WeakPolarHBondContact CA-O 3.5Å; L637-T648 HydrophobicContact CD1-CG2 3.99Å; L637-T648 HydrophobicContact CG-CG2 4.39Å
638	R	94.4	Very high	92.6	Very high	103 Å²	103	40.5 Å²	40.5	39%	0.389	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	135.2	174.8	-162	73.8	-177.2	145.8	-8.2	112.1	D596 F646 F647 L679 V681	D596-R638 IonicContact OD1-CZ 3.09Å; D596-R638 IonicContact OD1-NH1 4Å; D596-R638 PolarHBondContact OD1-NH1 3.5Å; D596-R638 WeakPolarHBondContact OD2-CA 3.49Å; D596-R638 VanDerWaalsContact OD2-CD 3.3Å; D596-R638 WeakPolarHBondContact OD2-CD 3.31Å; D596-R638 IonicContact OD2-CZ 3.35Å; D596-R638 IonicContact OD2-NE 3.73Å; D596-R638 IonicContact OD2-NH1 3.76Å; D596-R638 PolarHBondContact OD2-NH1 2.78Å; R638-F646 WeakPolarHBondContact O-CA 3.49Å; R638-F647 PolarHBondContact N-O 2.93Å; R638-F647 VanDerWaalsContact N-O 3.11Å; R638-F647 PolarHBondContact O-N 2.83Å; R638-L679 HydrophobicContact CB-CD2 3.93Å; R638-V681 HydrophobicContact CB-CG2 3.91Å; R638-V681 HydrophobicContact CG-CB 4.15Å; R638-V681 HydrophobicContact CG-CG2 3.81Å
639	F	94.6	Very high	92.8	Very high	11 Å²	11	34.7 Å²	34.7	5%	0.048	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	147.5	168.8	-86.9	-77.2	0	0	0	112	D596 V605 L645 F646 A660	D596-F639 HydrophobicContact CB-CD2 3.9Å; D596-F639 PolarHBondContact OD2-N 2.91Å; V605-F639 HydrophobicContact CB-CE2 4.07Å; V605-F639 HydrophobicContact CB-CZ 4.24Å; V605-F639 HydrophobicContact CG2-CE1 4.34Å; V605-F639 HydrophobicContact CG2-CE2 3.62Å; V605-F639 HydrophobicContact CG2-CZ 3.31Å; F639-L645 WeakPolarHBondContact CD1-O 3.36Å; F639-F646 HydrophobicContact CD1-CB 3.76Å; F639-F646 HydrophobicContact CE1-CB 3.97Å; F639-F646 HydrophobicContact CE1-CD1 4.07Å; F639-F646 HydrophobicContact CE1-CG 4.39Å; F639-F646 HydrophobicContact CG-CB 4.14Å; F639-A660 HydrophobicContact CE1-CB 4.28Å
640	V	92.7	Very high	93	Very high	6 Å²	6	34.7 Å²	34.7	4%	0.036	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-80.5	122.7	167.3	177.4	0	0	0	0	108.5	S643 L645 F647 V681	V640-S643 WeakPolarHBondContact CB-OG 3.25Å; V640-S643 PolarHBondContact O-N 2.91Å; V640-S643 VanDerWaalsContact O-O 3.06Å; V640-S643 PolarHBondContact O-OG 3.05Å; V640-L645 HydrophobicContact CB-CB 4.3Å; V640-L645 HydrophobicContact CG2-CB 4.26Å; V640-L645 PolarHBondContact N-O 2.86Å; V640-F647 HydrophobicContact CG2-CD2 3.85Å; V640-F647 HydrophobicContact CG2-CE2 3.52Å; V640-V681 HydrophobicContact CG2-CG1 4.32Å
641	P	88.7	Confident	93	Very high	39 Å²	39	38 Å²	38	25%	0.253	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	145.1	-178	-27.2	35	0	0	0	113	S643 P683	P641-S643 PolarHBondContact O-N 2.68Å; P641-S643 VanDerWaalsContact O-N 3.12Å; P641-P683 WeakPolarHBondContact CB-O 3.49Å
642	K	87.1	Confident	93	Very high	177 Å²	177	34.1 Å²	34.1	77%	0.77	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.1	6.5	-179.2	-51.9	175.9	-180	174	0	115.8
643	S	88.8	Confident	92.9	Very high	33 Å²	33	38 Å²	38	23%	0.231	17%	0.171	C	C	.	.	S	Bend	trans	-137	165.9	178.8	76.7	0	0	0	0	111.6	V640 P641 L645	V640-S643 WeakPolarHBondContact CB-OG 3.25Å; V640-S643 PolarHBondContact O-N 2.91Å; V640-S643 VanDerWaalsContact O-O 3.06Å; V640-S643 PolarHBondContact O-OG 3.05Å; P641-S643 PolarHBondContact O-N 2.68Å; P641-S643 VanDerWaalsContact O-N 3.12Å; S643-L645 VanDerWaalsContact C-N 3.29Å; S643-L645 PolarHBondContact OG-N 3.18Å
644	H	91.3	Very high	92.8	Very high	44 Å²	44	40.3 Å²	40.3	20%	0.204	18%	0.18	C	C	.	.	S	Bend	trans	-94.9	17.7	173.9	-65.6	-175.8	0	0	0	112.3	D600 A660 D661	D600-H644 IonicContact OD1-NE2 2.95Å; D600-H644 IonicContact OD2-CE1 2.64Å; D600-H644 PolarHBondContact OD2-CE1 3.19Å; D600-H644 VanDerWaalsContact OD2-CE1 3.32Å; D600-H644 IonicContact OD2-NE2 3.89Å; D600-H644 PolarHBondContact OD2-NE2 2.81Å; D600-H644 VanDerWaalsContact OD2-NE2 3.12Å; H644-A660 HydrophobicContact CB-CB 4.28Å; H644-A660 WeakPolarHBondContact O-CB 3.39Å; H644-A660 PolarHBondContact O-N 2.74Å; H644-D661 IonicContact CE1-OD1 2.58Å; H644-D661 IonicContact CG-OD1 2.72Å; H644-D661 IonicContact ND1-OD1 3.93Å; H644-D661 PolarHBondContact ND1-OD1 3.23Å; H644-D661 IonicContact ND1-OD2 2.67Å
645	L	92.6	Very high	92.8	Very high	35 Å²	35	40.4 Å²	40.4	18%	0.183	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	140.3	174	-56.7	179.7	0	0	0	109.3	Y7 F639 V640 S643 W658 D659 I666	Y7-L645 HydrophobicContact CD1-CD2 4.45Å; Y7-L645 HydrophobicContact CE1-CD2 4.1Å; F639-L645 WeakPolarHBondContact CD1-O 3.36Å; V640-L645 HydrophobicContact CB-CB 4.3Å; V640-L645 HydrophobicContact CG2-CB 4.26Å; V640-L645 PolarHBondContact N-O 2.86Å; S643-L645 VanDerWaalsContact C-N 3.29Å; S643-L645 PolarHBondContact OG-N 3.18Å; L645-W658 WeakPolarHBondContact CA-O 3.28Å; L645-D659 HydrophobicContact CD2-CB 4.03Å; L645-I666 HydrophobicContact CD2-CD1 3.62Å
646	F	94.6	Very high	92.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	155.1	176.3	66.9	-85	0	0	0	112	V605 V613 I615 L637 R638 F639 T648 W658 A660	V605-F646 HydrophobicContact CG1-CD2 4.3Å; V605-F646 HydrophobicContact CG1-CE2 3.96Å; V605-F646 HydrophobicContact CG1-CZ 4.15Å; V605-F646 HydrophobicContact CG2-CD1 4.39Å; V605-F646 HydrophobicContact CG2-CE1 4.36Å; V613-F646 HydrophobicContact CG1-CE2 4.07Å; V613-F646 HydrophobicContact CG1-CZ 4.38Å; I615-F646 HydrophobicContact CD1-CE1 3.68Å; I615-F646 HydrophobicContact CD1-CZ 3.87Å; L637-F646 HydrophobicContact CD1-CD2 4.23Å; L637-F646 HydrophobicContact CD1-CE2 4.41Å; L637-F646 HydrophobicContact CG-CD2 4.32Å; R638-F646 WeakPolarHBondContact O-CA 3.49Å; F639-F646 HydrophobicContact CD1-CB 3.76Å; F639-F646 HydrophobicContact CE1-CB 3.97Å; F639-F646 HydrophobicContact CE1-CD1 4.07Å; F639-F646 HydrophobicContact CE1-CG 4.39Å; F639-F646 HydrophobicContact CG-CB 4.14Å; F646-T648 HydrophobicContact CD2-CG2 3.77Å; F646-T648 HydrophobicContact CE2-CG2 3.58Å; F646-W658 HydrophobicContact CD1-CB 3.93Å; F646-W658 HydrophobicContact CD2-CB 4.1Å; F646-W658 HydrophobicContact CD2-CG 4.41Å; F646-W658 HydrophobicContact CE1-CB 3.41Å; F646-W658 VanDerWaalsContact CE1-CB 3.41Å; F646-W658 HydrophobicContact CE1-CG 4.33Å; F646-W658 HydrophobicContact CE2-CB 3.59Å; F646-W658 AromaticContact CE2-CD1 3.56Å; F646-W658 AromaticContact CE2-CG 3.69Å; F646-W658 HydrophobicContact CE2-CG 3.69Å; F646-W658 HydrophobicContact CG-CB 4.26Å; F646-W658 HydrophobicContact CZ-CB 3.23Å; F646-W658 AromaticContact CZ-CG 3.66Å; F646-W658 HydrophobicContact CZ-CG 3.66Å; F646-W658 PolarHBondContact N-O 2.83Å; F646-W658 PolarHBondContact O-N 2.76Å; F646-A660 HydrophobicContact CD1-CB 4.01Å; F646-A660 HydrophobicContact CE1-CB 3.89Å
647	F	95.8	Very high	92.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	141.3	174.2	-71.1	-76.5	0	0	0	110.7	Y10 L637 R638 V640 I655 K656 Q657 L669 L679 V681 V688	Y10-F647 HydrophobicContact CD1-CZ 4.23Å; Y10-F647 HydrophobicContact CD2-CE1 4.39Å; Y10-F647 AromaticContact CD2-CZ 3.76Å; Y10-F647 HydrophobicContact CD2-CZ 3.76Å; Y10-F647 HydrophobicContact CE1-CE2 4.43Å; Y10-F647 HydrophobicContact CE1-CZ 4.06Å; Y10-F647 HydrophobicContact CE2-CE2 4.29Å; Y10-F647 AromaticContact CE2-CZ 3.57Å; Y10-F647 HydrophobicContact CE2-CZ 3.57Å; Y10-F647 HydrophobicContact CG-CZ 4.08Å; Y10-F647 AromaticContact CZ-CZ 3.71Å; L637-F647 WeakPolarHBondContact CA-O 3.5Å; R638-F647 PolarHBondContact N-O 2.93Å; R638-F647 VanDerWaalsContact N-O 3.11Å; R638-F647 PolarHBondContact O-N 2.83Å; V640-F647 HydrophobicContact CG2-CD2 3.85Å; V640-F647 HydrophobicContact CG2-CE2 3.52Å; F647-I655 HydrophobicContact CB-CG2 4.5Å; F647-I655 HydrophobicContact CD1-CG2 4.06Å; F647-K656 WeakPolarHBondContact CA-O 3.33Å; F647-Q657 HydrophobicContact CD1-CB 3.86Å; F647-Q657 HydrophobicContact CD1-CG 4.02Å; F647-Q657 HydrophobicContact CE1-CB 3.57Å; F647-Q657 HydrophobicContact CE1-CG 3.57Å; F647-Q657 HydrophobicContact CZ-CB 4.41Å; F647-Q657 HydrophobicContact CZ-CG 3.92Å; F647-L669 HydrophobicContact CE1-CD1 4.05Å; F647-L679 HydrophobicContact CB-CD1 3.92Å; F647-L679 HydrophobicContact CB-CD2 4.04Å; F647-V681 HydrophobicContact CD2-CG2 4Å; F647-V688 HydrophobicContact CD2-CG2 4.04Å; F647-V688 HydrophobicContact CE2-CG2 3.54Å; F647-V688 HydrophobicContact CZ-CG2 3.94Å
648	T	95.1	Very high	92.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134	171.8	59.8	0	0	0	0	109.2	V613 H630 L637 F646 I655 K656 W658	V613-T648 HydrophobicContact CG2-CG2 3.97Å; H630-T648 WeakPolarHBondContact NE2-CB 3.31Å; H630-T648 PolarHBondContact NE2-O 3.5Å; H630-T648 PolarHBondContact NE2-OG1 3.09Å; L637-T648 HydrophobicContact CD1-CG2 3.99Å; L637-T648 HydrophobicContact CG-CG2 4.39Å; F646-T648 HydrophobicContact CD2-CG2 3.77Å; F646-T648 HydrophobicContact CE2-CG2 3.58Å; T648-I655 CarbonylContact O-C 3.55Å; T648-I655 VanDerWaalsContact O-CA 3.31Å; T648-I655 WeakPolarHBondContact O-CA 3.3Å; T648-K656 PolarHBondContact N-O 3.32Å; T648-K656 PolarHBondContact O-N 2.78Å; T648-K656 PolarHBondContact OG1-O 2.94Å; T648-W658 PolarHBondContact OG1-NE1 3.4Å
649	A	94.9	Very high	92.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.7	175.2	0	0	0	0	0	109.7	M635 Y636 I676 L679	M635-A649 PolarHBondContact N-O 2.81Å; Y636-A649 PolarHBondContact N-O 2.78Å; Y636-A649 PolarHBondContact O-N 2.86Å; A649-I676 HydrophobicContact CB-CB 4.25Å; A649-I676 HydrophobicContact CB-CG2 3.71Å; A649-L679 HydrophobicContact CB-CB 4.33Å; A649-L679 HydrophobicContact CB-CD1 4.33Å
650	G	93.6	Very high	92.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	158.6	-177.3	0	0	0	0	0	113.6	D652 R653 K654 I676	G650-D652 WeakPolarHBondContact CA-OD1 3.24Å; G650-D652 PolarHBondContact O-N 3.19Å; G650-R653 PolarHBondContact O-N 2.87Å; G650-K654 PolarHBondContact N-O 2.75Å; G650-K654 VanDerWaalsContact N-O 3.12Å; G650-I676 PolarHBondContact O-N 3.12Å
651	K	93.6	Very high	92.3	Very high	68 Å²	68	35 Å²	35	30%	0.296	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.1	167	-168.2	175.8	171.7	-152.9	0	112.3	D632 S633 M635 R653 E675	D632-K651 HydrophobicContact CB-CB 4Å; D632-K651 VanDerWaalsContact OD2-CD 3.24Å; D632-K651 WeakPolarHBondContact OD2-CD 3.35Å; D632-K651 WeakPolarHBondContact OD2-CG 3.23Å; D632-K651 IonicContact OD2-NZ 3.52Å; S633-K651 WeakPolarHBondContact O-CB 3.38Å; S633-K651 PolarHBondContact O-N 2.85Å; S633-K651 WeakPolarHBondContact OG-CB 3.4Å; S633-K651 WeakPolarHBondContact OG-CD 3.22Å; M635-K651 HydrophobicContact CG-CB 4.26Å; K651-R653 PolarHBondContact O-N 2.86Å; K651-R653 VanDerWaalsContact O-N 3.08Å; K651-E675 HydrophobicContact CD-CG 4.41Å; K651-E675 WeakPolarHBondContact CE-OE1 3.41Å; K651-E675 WeakPolarHBondContact CE-OE2 3.49Å; K651-E675 HydrophobicContact CG-CB 3.9Å; K651-E675 HydrophobicContact CG-CG 3.48Å; K651-E675 VanDerWaalsContact CG-CG 3.48Å; K651-E675 IonicContact NZ-OE1 3.88Å
652	D	90.6	Very high	92.3	Very high	18 Å²	18	37.8 Å²	37.8	10%	0.096	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	3	172.7	67.1	-3.8	0	0	0	114.8	H630 D631 D632 G650 K654	H630-D652 WeakPolarHBondContact CA-OD2 3.31Å; H630-D652 VanDerWaalsContact CB-OD2 3.28Å; H630-D652 WeakPolarHBondContact CB-OD2 3.36Å; H630-D652 IonicContact CE1-OD1 2.85Å; H630-D652 IonicContact CG-OD1 3.46Å; H630-D652 IonicContact CG-OD2 2.71Å; H630-D652 VanDerWaalsContact ND1-CG 3.27Å; H630-D652 IonicContact ND1-OD1 2.72Å; H630-D652 PolarHBondContact ND1-OD1 3.2Å; H630-D652 IonicContact ND1-OD2 2.7Å; H630-D652 PolarHBondContact ND1-OD2 3.34Å; D631-D652 HydrophobicContact CB-CB 4.32Å; D631-D652 PolarHBondContact N-OD2 3.01Å; D632-D652 HydrophobicContact CB-CB 4.23Å; G650-D652 WeakPolarHBondContact CA-OD1 3.24Å; G650-D652 PolarHBondContact O-N 3.19Å; D652-K654 PolarHBondContact O-N 2.94Å; D652-K654 PolarHBondContact OD1-N 3.23Å; D652-K654 VanDerWaalsContact OD1-N 3.08Å
653	R	91.4	Very high	92.4	Very high	133 Å²	133	31.4 Å²	31.4	50%	0.502	14%	0.143	S	C	.	.	S	Bend	trans	75.2	4.7	179.1	-42	164.1	-75.2	-175	1	114.3	G650 K651 H672 H673 I676	G650-R653 PolarHBondContact O-N 2.87Å; K651-R653 PolarHBondContact O-N 2.86Å; K651-R653 VanDerWaalsContact O-N 3.08Å; R653-H672 WeakPolarHBondContact CB-O 3.46Å; R653-H673 VanDerWaalsContact CD-C 3.43Å; R653-H673 WeakPolarHBondContact CD-O 3.23Å; R653-I676 WeakPolarHBondContact O-CD1 3.32Å
654	K	92.1	Very high	92.3	Very high	64 Å²	64	32.8 Å²	32.8	28%	0.278	15%	0.146	S	C	.	.			trans	-100.7	147.9	179.6	-55	-166.7	-173.9	-153.9	0	110.6	H630 G650 D652 E670	H630-K654 PolarHBondContact CE1-O 3.05Å; H630-K654 VanDerWaalsContact CE1-O 3.23Å; G650-K654 PolarHBondContact N-O 2.75Å; G650-K654 VanDerWaalsContact N-O 3.12Å; D652-K654 PolarHBondContact O-N 2.94Å; D652-K654 PolarHBondContact OD1-N 3.23Å; D652-K654 VanDerWaalsContact OD1-N 3.08Å; K654-E670 HydrophobicContact CD-CG 4.43Å; K654-E670 VanDerWaalsContact CE-OE1 3.27Å; K654-E670 WeakPolarHBondContact CE-OE1 3.39Å; K654-E670 HydrophobicContact CG-CG 4.48Å; K654-E670 IonicContact NZ-OE1 3.44Å; K654-E670 PolarHBondContact NZ-OE1 3.3Å
655	I	95	Very high	92.2	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	131	164.6	-57.8	167.8	0	0	0	106.5	F647 T648 L669 I676 L679 S690 W700	F647-I655 HydrophobicContact CB-CG2 4.5Å; F647-I655 HydrophobicContact CD1-CG2 4.06Å; T648-I655 CarbonylContact O-C 3.55Å; T648-I655 VanDerWaalsContact O-CA 3.31Å; T648-I655 WeakPolarHBondContact O-CA 3.3Å; I655-L669 HydrophobicContact CB-CB 4.06Å; I655-L669 HydrophobicContact CG2-CD1 4.24Å; I655-L669 PolarHBondContact N-O 2.92Å; I655-L669 VanDerWaalsContact N-O 3.09Å; I655-L669 PolarHBondContact O-N 3.22Å; I655-I676 HydrophobicContact CD1-CD1 4.12Å; I655-I676 HydrophobicContact CG1-CD1 3.49Å; I655-I676 VanDerWaalsContact CG1-CD1 3.49Å; I655-L679 HydrophobicContact CD1-CD1 4.22Å; I655-L679 HydrophobicContact CG1-CD1 4.43Å; I655-L679 HydrophobicContact CG2-CD1 3.67Å; I655-S690 VanDerWaalsContact CD1-CB 3.46Å; I655-W700 HydrophobicContact CD1-CZ2 4.31Å
656	K	93.8	Very high	92.1	Very high	32 Å²	32	31 Å²	31	14%	0.139	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.2	179	-64.9	-173.8	-173.4	-177.3	0	110.6	A629 F647 T648 W658 Q667 T668	A629-K656 WeakPolarHBondContact O-CD 3.49Å; A629-K656 VanDerWaalsContact O-CE 3.24Å; A629-K656 WeakPolarHBondContact O-CE 2.96Å; A629-K656 PolarHBondContact O-NZ 2.93Å; F647-K656 WeakPolarHBondContact CA-O 3.33Å; T648-K656 PolarHBondContact N-O 3.32Å; T648-K656 PolarHBondContact O-N 2.78Å; T648-K656 PolarHBondContact OG1-O 2.94Å; K656-W658 HydrophobicContact CB-CZ2 4.2Å; K656-W658 HydrophobicContact CD-CZ2 3.92Å; K656-Q667 CarbonylContact C-O 3.57Å; K656-Q667 WeakPolarHBondContact CA-O 3.37Å; K656-T668 HydrophobicContact CD-CG2 4.17Å; K656-T668 HydrophobicContact CG-CG2 3.87Å
657	Q	94.1	Very high	91.8	Very high	3 Å²	3	31.2 Å²	31.2	1%	0.014	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.2	175.1	-167.9	-176.4	-0.1	0	0	109.8	F647 I666 Q667	F647-Q657 HydrophobicContact CD1-CB 3.86Å; F647-Q657 HydrophobicContact CD1-CG 4.02Å; F647-Q657 HydrophobicContact CE1-CB 3.57Å; F647-Q657 HydrophobicContact CE1-CG 3.57Å; F647-Q657 HydrophobicContact CZ-CB 4.41Å; F647-Q657 HydrophobicContact CZ-CG 3.92Å; Q657-I666 HydrophobicContact CB-CB 4.34Å; Q657-I666 HydrophobicContact CG-CB 4.4Å; Q657-I666 HydrophobicContact CG-CD1 4.19Å; Q657-I666 PolarHBondContact O-N 3.4Å; Q657-Q667 HydrophobicContact CB-CB 4.3Å; Q657-Q667 PolarHBondContact N-O 3.45Å
658	W	93.5	Very high	91.6	Very high	18 Å²	18	32.9 Å²	32.9	7%	0.068	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.4	-175.4	-59.7	91.3	0	0	0	111.3	L627 A629 L645 F646 T648 K656 H665	L627-W658 HydrophobicContact CD1-CE3 3.98Å; L627-W658 HydrophobicContact CD1-CZ3 4.31Å; A629-W658 HydrophobicContact CB-CZ2 3.78Å; L645-W658 WeakPolarHBondContact CA-O 3.28Å; F646-W658 HydrophobicContact CD1-CB 3.93Å; F646-W658 HydrophobicContact CD2-CB 4.1Å; F646-W658 HydrophobicContact CD2-CG 4.41Å; F646-W658 HydrophobicContact CE1-CB 3.41Å; F646-W658 VanDerWaalsContact CE1-CB 3.41Å; F646-W658 HydrophobicContact CE1-CG 4.33Å; F646-W658 HydrophobicContact CE2-CB 3.59Å; F646-W658 AromaticContact CE2-CD1 3.56Å; F646-W658 AromaticContact CE2-CG 3.69Å; F646-W658 HydrophobicContact CE2-CG 3.69Å; F646-W658 HydrophobicContact CG-CB 4.26Å; F646-W658 HydrophobicContact CZ-CB 3.23Å; F646-W658 AromaticContact CZ-CG 3.66Å; F646-W658 HydrophobicContact CZ-CG 3.66Å; F646-W658 PolarHBondContact N-O 2.83Å; F646-W658 PolarHBondContact O-N 2.76Å; T648-W658 PolarHBondContact OG1-NE1 3.4Å; K656-W658 HydrophobicContact CB-CZ2 4.2Å; K656-W658 HydrophobicContact CD-CZ2 3.92Å; W658-H665 AromaticContact CE2-CD2 3.98Å; W658-H665 HydrophobicContact CE3-CB 3.88Å; W658-H665 HydrophobicContact CH2-CB 3.9Å; W658-H665 AromaticContact CH2-CD2 3.86Å; W658-H665 AromaticContact CZ2-CD2 3.75Å; W658-H665 HydrophobicContact CZ3-CB 3.51Å
659	D	92.4	Very high	91.3	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119.7	166.4	-166	-19.5	0	0	0	109.7	Y7 L645 D661 K662 F663 E664 I666	Y7-D659 HydrophobicContact CE1-CB 4.41Å; Y7-D659 WeakPolarHBondContact CE1-OD2 3.16Å; Y7-D659 PolarHBondContact OH-OD2 2.83Å; L645-D659 HydrophobicContact CD2-CB 4.03Å; D659-D661 VanDerWaalsContact C-N 3.33Å; D659-D661 PolarHBondContact OD1-N 2.92Å; D659-K662 HydrophobicContact CB-CB 4.48Å; D659-F663 WeakPolarHBondContact O-CA 3.48Å; D659-F663 PolarHBondContact O-N 3Å; D659-E664 PolarHBondContact N-O 3.17Å; D659-I666 HydrophobicContact CB-CD1 4.09Å; D659-I666 HydrophobicContact CB-CG1 4.45Å
660	A	90.6	Very high	90.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-18.8	178	0	0	0	0	0	113.6	L603 I615 F639 H644 F646 F663	L603-A660 HydrophobicContact CD1-CB 3.91Å; I615-A660 HydrophobicContact CD1-CB 3.94Å; F639-A660 HydrophobicContact CE1-CB 4.28Å; H644-A660 HydrophobicContact CB-CB 4.28Å; H644-A660 WeakPolarHBondContact O-CB 3.39Å; H644-A660 PolarHBondContact O-N 2.74Å; F646-A660 HydrophobicContact CD1-CB 4.01Å; F646-A660 HydrophobicContact CE1-CB 3.89Å; A660-F663 WeakPolarHBondContact O-CE1 3.36Å; A660-F663 WeakPolarHBondContact O-CZ 3.38Å
661	D	90.1	Very high	90.5	Very high	69 Å²	69	38.6 Å²	38.6	37%	0.369	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-45.9	179.5	-66.5	-27.1	0	0	0	111.4	K5 H644 D659 F663	K5-D661 IonicContact NZ-OD2 3.85Å; K5-D661 PolarHBondContact NZ-OD2 3.02Å; H644-D661 IonicContact CE1-OD1 2.58Å; H644-D661 IonicContact CG-OD1 2.72Å; H644-D661 IonicContact ND1-OD1 3.93Å; H644-D661 PolarHBondContact ND1-OD1 3.23Å; H644-D661 IonicContact ND1-OD2 2.67Å; D659-D661 VanDerWaalsContact C-N 3.33Å; D659-D661 PolarHBondContact OD1-N 2.92Å; D661-F663 WeakPolarHBondContact O-CE2 3.14Å
662	K	88	Confident	90.4	Very high	97 Å²	97	35.8 Å²	35.8	42%	0.422	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-16.2	-179.2	-62.1	-173.4	-169.6	163	0	113.4	Y7 D659 E664	Y7-K662 WeakPolarHBondContact OH-CD 3.41Å; Y7-K662 WeakPolarHBondContact OH-CE 3.29Å; Y7-K662 PolarHBondContact OH-NZ 3.12Å; D659-K662 HydrophobicContact CB-CB 4.48Å; K662-E664 HydrophobicContact CB-CB 4.43Å; K662-E664 HydrophobicContact CB-CG 4.06Å; K662-E664 PolarHBondContact O-N 2.64Å
663	F	88.9	Confident	90.3	Very high	44 Å²	44	35.8 Å²	35.8	19%	0.193	17%	0.166	C	C	.	.			trans	58.5	32.7	-173.1	-47.4	-81.4	0	0	0	113.4	I615 H624 R625 L627 D659 A660 D661	I615-F663 HydrophobicContact CB-CE1 4.07Å; I615-F663 HydrophobicContact CD1-CD1 3.72Å; I615-F663 HydrophobicContact CD1-CE1 3.87Å; I615-F663 HydrophobicContact CG1-CD1 4.41Å; I615-F663 HydrophobicContact CG1-CE1 4.37Å; I615-F663 HydrophobicContact CG2-CE1 4.12Å; H624-F663 HydrophobicContact CB-CE1 3.77Å; H624-F663 HydrophobicContact CB-CZ 3.58Å; R625-F663 HydrophobicContact CB-CD1 3.71Å; R625-F663 HydrophobicContact CB-CE1 4.03Å; R625-F663 HydrophobicContact CB-CG 4.11Å; L627-F663 HydrophobicContact CD2-CB 4.32Å; D659-F663 WeakPolarHBondContact O-CA 3.48Å; D659-F663 PolarHBondContact O-N 3Å; A660-F663 WeakPolarHBondContact O-CE1 3.36Å; A660-F663 WeakPolarHBondContact O-CZ 3.38Å; D661-F663 WeakPolarHBondContact O-CE2 3.14Å
664	E	86.9	Confident	90.3	Very high	61 Å²	61	31.7 Å²	31.7	29%	0.285	15%	0.152	S	C	.	.			trans	-101.7	144.7	178.6	-66.6	-171.6	128.8	0	0	110.6	D659 K662 R713	D659-E664 PolarHBondContact N-O 3.17Å; K662-E664 HydrophobicContact CB-CB 4.43Å; K662-E664 HydrophobicContact CB-CG 4.06Å; K662-E664 PolarHBondContact O-N 2.64Å; E664-R713 IonicContact OE1-NH2 3.69Å; E664-R713 PolarHBondContact OE1-NH2 2.97Å
665	H	89.4	Confident	90.3	Very high	39 Å²	39	31.6 Å²	31.6	18%	0.181	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	125.3	165.9	178.8	-95.7	0	0	0	108.7	W658 Q667 T668 Q716	W658-H665 AromaticContact CE2-CD2 3.98Å; W658-H665 HydrophobicContact CE3-CB 3.88Å; W658-H665 HydrophobicContact CH2-CB 3.9Å; W658-H665 AromaticContact CH2-CD2 3.86Å; W658-H665 AromaticContact CZ2-CD2 3.75Å; W658-H665 HydrophobicContact CZ3-CB 3.51Å; H665-Q667 PolarHBondContact NE2-O 2.73Å; H665-T668 PolarHBondContact CE1-N 2.9Å; H665-Q716 PolarHBondContact CE1-NE2 3.27Å
666	I	89.1	Confident	90.3	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-80.7	175	-57.3	165	0	0	0	106.9	Y7 L645 Q657 D659 L707 L709	Y7-I666 HydrophobicContact CD1-CD1 3.48Å; Y7-I666 VanDerWaalsContact CD1-CD1 3.48Å; Y7-I666 HydrophobicContact CD1-CG1 4.06Å; Y7-I666 HydrophobicContact CD1-CG2 4.4Å; Y7-I666 HydrophobicContact CE1-CD1 3.54Å; Y7-I666 HydrophobicContact CE1-CG1 4.08Å; Y7-I666 HydrophobicContact CG-CD1 4.25Å; Y7-I666 HydrophobicContact CG-CG1 4.41Å; Y7-I666 HydrophobicContact CG-CG2 4.15Å; L645-I666 HydrophobicContact CD2-CD1 3.62Å; Q657-I666 HydrophobicContact CB-CB 4.34Å; Q657-I666 HydrophobicContact CG-CB 4.4Å; Q657-I666 HydrophobicContact CG-CD1 4.19Å; Q657-I666 PolarHBondContact O-N 3.4Å; D659-I666 HydrophobicContact CB-CD1 4.09Å; D659-I666 HydrophobicContact CB-CG1 4.45Å; I666-L707 HydrophobicContact CG2-CD1 4.09Å; I666-L707 HydrophobicContact CG2-CD2 4.21Å; I666-L709 HydrophobicContact CB-CD2 4.28Å; I666-L709 HydrophobicContact CG1-CD2 4.35Å; I666-L709 HydrophobicContact CG2-CD2 4.06Å
667	Q	88.8	Confident	90.3	Very high	6 Å²	6	32.4 Å²	32.4	3%	0.028	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.6	-166.5	-168.5	-179.9	11.2	0	0	113.1	Y10 K656 Q657 H665 L669 L707 E712	Y10-Q667 PolarHBondContact O-NE2 3.31Å; Y10-Q667 PolarHBondContact O-OE1 3.21Å; K656-Q667 CarbonylContact C-O 3.57Å; K656-Q667 WeakPolarHBondContact CA-O 3.37Å; Q657-Q667 HydrophobicContact CB-CB 4.3Å; Q657-Q667 PolarHBondContact N-O 3.45Å; H665-Q667 PolarHBondContact NE2-O 2.73Å; Q667-L669 HydrophobicContact CG-CD2 4.14Å; Q667-L707 HydrophobicContact CB-CD1 4.05Å; Q667-L707 HydrophobicContact CG-CD1 4.19Å; Q667-E712 VanDerWaalsContact CA-OE2 3.25Å; Q667-E712 WeakPolarHBondContact CA-OE2 3.42Å
668	T	90.8	Very high	90.1	Very high	34 Å²	34	32.3 Å²	32.3	21%	0.209	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116.8	164.8	37.2	0	0	0	0	110	K656 H665 Q716	K656-T668 HydrophobicContact CD-CG2 4.17Å; K656-T668 HydrophobicContact CG-CG2 3.87Å; H665-T668 PolarHBondContact CE1-N 2.9Å; T668-Q716 PolarHBondContact OG1-NE2 2.74Å
669	L	90.4	Very high	90.2	Very high	5 Å²	5	31.5 Å²	31.5	3%	0.026	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	104.9	171.5	-60	175.9	0	0	0	108.8	Y10 F647 I655 Q667 W700	Y10-L669 WeakPolarHBondContact O-CD2 3.24Å; F647-L669 HydrophobicContact CE1-CD1 4.05Å; I655-L669 HydrophobicContact CB-CB 4.06Å; I655-L669 HydrophobicContact CG2-CD1 4.24Å; I655-L669 PolarHBondContact N-O 2.92Å; I655-L669 VanDerWaalsContact N-O 3.09Å; I655-L669 PolarHBondContact O-N 3.22Å; Q667-L669 HydrophobicContact CG-CD2 4.14Å; L669-W700 HydrophobicContact CB-CD2 4.46Å; L669-W700 HydrophobicContact CB-CE3 4.12Å; L669-W700 HydrophobicContact CB-CH2 3.92Å; L669-W700 HydrophobicContact CB-CZ2 4.26Å; L669-W700 HydrophobicContact CB-CZ3 3.82Å; L669-W700 HydrophobicContact CD1-CD2 3.98Å; L669-W700 HydrophobicContact CD1-CE3 4.02Å; L669-W700 HydrophobicContact CD1-CG 4.22Å; L669-W700 HydrophobicContact CD2-CE3 3.83Å; L669-W700 HydrophobicContact CD2-CZ3 3.95Å; L669-W700 HydrophobicContact CG-CE3 4.21Å; L669-W700 HydrophobicContact CG-CZ3 4.32Å
670	E	86.7	Confident	90.3	Very high	100 Å²	100	31.9 Å²	31.9	47%	0.467	16%	0.155	S	C	.	.			trans	-102.4	141.2	176.6	-61.8	-171.3	160.9	0	0	110.4	K654	K654-E670 HydrophobicContact CD-CG 4.43Å; K654-E670 VanDerWaalsContact CE-OE1 3.27Å; K654-E670 WeakPolarHBondContact CE-OE1 3.39Å; K654-E670 HydrophobicContact CG-CG 4.48Å; K654-E670 IonicContact NZ-OE1 3.44Å; K654-E670 PolarHBondContact NZ-OE1 3.3Å
671	G	84.7	Confident	90.4	Very high	15 Å²	15	32.5 Å²	32.5	16%	0.155	16%	0.159	C	C	.	.			trans	172	-44.9	176.2	0	0	0	0	0	112.1	H673 R698	G671-H673 PolarHBondContact O-CE1 2.94Å; G671-H673 PolarHBondContact O-ND1 3.4Å; G671-R698 PolarHBondContact O-NH1 3.44Å; G671-R698 VanDerWaalsContact O-NH1 3.12Å; G671-R698 PolarHBondContact O-NH2 2.97Å
672	H	90.7	Very high	90.5	Very high	10 Å²	10	29.2 Å²	29.2	5%	0.046	14%	0.141	C	C	.	.			trans	-61.4	142.3	178.1	-73.1	-68	0	0	0	111.7	R653 I676 S690 S692 D694 S696 R698	R653-H672 WeakPolarHBondContact CB-O 3.46Å; H672-I676 HydrophobicContact CB-CD1 4.17Å; H672-I676 HydrophobicContact CB-CG1 3.93Å; H672-S690 WeakPolarHBondContact NE2-CB 2.94Å; H672-S690 PolarHBondContact NE2-OG 3.4Å; H672-S692 WeakPolarHBondContact ND1-CB 3.39Å; H672-D694 IonicContact ND1-OD2 3.89Å; H672-S696 PolarHBondContact ND1-OG 2.59Å; H672-R698 VanDerWaalsContact CE1-CD 3.5Å; H672-R698 WeakPolarHBondContact CE1-CD 3.47Å; H672-R698 VanDerWaalsContact CE1-CG 3.44Å; H672-R698 WeakPolarHBondContact CE1-CG 3.25Å
673	H	88.9	Confident	90.5	Very high	17 Å²	17	27.1 Å²	27.1	8%	0.079	14%	0.138	C	C	.	.	S	Bend	trans	-102.4	-16	-176.1	-60.1	101.8	0	0	0	113.2	C44 E45 K65 E67 R653 G671 D694 R698	C44-H673 WeakPolarHBondContact CB-ND1 3.43Å; E45-H673 IonicContact OE2-CE1 3.96Å; E45-H673 PolarHBondContact OE2-CE1 2.81Å; E45-H673 VanDerWaalsContact OE2-CE1 3.3Å; E45-H673 IonicContact OE2-NE2 3.35Å; K65-H673 PolarHBondContact O-NE2 2.65Å; E67-H673 HydrophobicContact CG-CB 3.48Å; E67-H673 VanDerWaalsContact CG-CB 3.48Å; E67-H673 WeakPolarHBondContact CG-CD2 3.47Å; E67-H673 WeakPolarHBondContact CG-ND1 3.32Å; E67-H673 WeakPolarHBondContact OE1-CB 3.24Å; E67-H673 IonicContact OE1-CG 2.64Å; E67-H673 IonicContact OE1-ND1 3.11Å; R653-H673 VanDerWaalsContact CD-C 3.43Å; R653-H673 WeakPolarHBondContact CD-O 3.23Å; G671-H673 PolarHBondContact O-CE1 2.94Å; G671-H673 PolarHBondContact O-ND1 3.4Å; H673-D694 PolarHBondContact N-OD2 3.09Å; H673-R698 PolarHBondContact CE1-NH2 3.31Å; H673-R698 VanDerWaalsContact CE1-NH2 3.27Å; H673-R698 PolarHBondContact ND1-NH2 3.22Å
674	Q	90.8	Very high	90.5	Very high	47 Å²	47	29.9 Å²	29.9	22%	0.22	15%	0.154	C	C	.	.	S	Bend	trans	-129	175	174.2	-58.2	-177.5	10.8	0	0	111	I676 S692 H693 D694	Q674-I676 PolarHBondContact O-N 2.87Å; Q674-S692 PolarHBondContact O-OG 3.43Å; Q674-H693 HydrophobicContact CB-CB 3.91Å; Q674-H693 PolarHBondContact OE1-CD2 3.44Å; Q674-H693 PolarHBondContact OE1-O 2.98Å; Q674-D694 HydrophobicContact CB-CB 4.15Å; Q674-D694 HydrophobicContact CG-CB 3.98Å
675	E	92.9	Very high	90.6	Very high	63 Å²	63	27 Å²	27	29%	0.294	14%	0.141	S	C	.	.			trans	-52.6	134.6	-175.8	-51.7	177.8	-178.2	0	0	111.9	K651 S692 H693	K651-E675 HydrophobicContact CD-CG 4.41Å; K651-E675 WeakPolarHBondContact CE-OE1 3.41Å; K651-E675 WeakPolarHBondContact CE-OE2 3.49Å; K651-E675 HydrophobicContact CG-CB 3.9Å; K651-E675 HydrophobicContact CG-CG 3.48Å; K651-E675 VanDerWaalsContact CG-CG 3.48Å; K651-E675 IonicContact NZ-OE1 3.88Å; E675-S692 CarbonylContact O-C 3.44Å; E675-S692 VanDerWaalsContact O-CA 3.3Å; E675-S692 WeakPolarHBondContact O-CA 3.3Å; E675-S692 PolarHBondContact O-OG 3.37Å; E675-S692 VanDerWaalsContact O-OG 3.1Å; E675-H693 HydrophobicContact CB-CB 4.48Å; E675-H693 PolarHBondContact O-N 3.31Å
676	I	94.9	Very high	90.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.9	179.4	-59.1	157.2	0	0	0	108.5	M635 A649 G650 R653 I655 H672 Q674 A691	M635-I676 VanDerWaalsContact CB-O 3.31Å; M635-I676 WeakPolarHBondContact CB-O 3.5Å; M635-I676 WeakPolarHBondContact CG-O 3.39Å; A649-I676 HydrophobicContact CB-CB 4.25Å; A649-I676 HydrophobicContact CB-CG2 3.71Å; G650-I676 PolarHBondContact O-N 3.12Å; R653-I676 WeakPolarHBondContact O-CD1 3.32Å; I655-I676 HydrophobicContact CD1-CD1 4.12Å; I655-I676 HydrophobicContact CG1-CD1 3.49Å; I655-I676 VanDerWaalsContact CG1-CD1 3.49Å; H672-I676 HydrophobicContact CB-CD1 4.17Å; H672-I676 HydrophobicContact CB-CG1 3.93Å; Q674-I676 PolarHBondContact O-N 2.87Å; I676-A691 WeakPolarHBondContact CG2-O 3.38Å
677	W	92.8	Very high	90.8	Very high	50 Å²	50	29.3 Å²	29.3	19%	0.189	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-38.2	-176.5	-77.2	106.5	0	0	0	113.2	R417 M635 A691 H693	R417-W677 VanDerWaalsContact NH1-CE2 3.28Å; R417-W677 VanDerWaalsContact NH1-CH2 3.28Å; R417-W677 VanDerWaalsContact NH2-CE3 3.34Å; R417-W677 VanDerWaalsContact NH2-CZ3 3.32Å; M635-W677 HydrophobicContact CE-CE3 3.57Å; M635-W677 HydrophobicContact CE-CH2 4.2Å; M635-W677 HydrophobicContact CE-CZ3 3.25Å; W677-A691 PolarHBondContact N-O 2.56Å; W677-H693 AromaticContact NE1-CG 3.9Å; W677-H693 AromaticContact NE1-ND1 3.53Å
678	C	91.8	Very high	91.1	Very high	1 Å²	1	29 Å²	29	1%	0.007	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	155	-176.8	58.4	0	0	0	0	112.1	R417 T418 L419 Y636 A691	R417-C678 WeakPolarHBondContact O-CB 3.4Å; T418-C678 VanDerWaalsContact C-SG 3.59Å; L419-C678 VanDerWaalsContact CG-SG 3.57Å; Y636-C678 HydrophobicContact CD2-CB 4.27Å; Y636-C678 HydrophobicContact CE2-CB 4.48Å; C678-A691 PolarHBondContact O-N 2.93Å; C678-A691 VanDerWaalsContact SG-CB 3.56Å
679	L	94.6	Very high	91.3	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.4	179.3	-179.3	150.5	0	0	0	108.2	Y636 R638 F647 A649 I655 V681 V688 V689	Y636-L679 HydrophobicContact CD1-CB 3.94Å; Y636-L679 WeakPolarHBondContact CD1-O 3.49Å; Y636-L679 WeakPolarHBondContact CE1-O 3.48Å; R638-L679 HydrophobicContact CB-CD2 3.93Å; F647-L679 HydrophobicContact CB-CD1 3.92Å; F647-L679 HydrophobicContact CB-CD2 4.04Å; A649-L679 HydrophobicContact CB-CB 4.33Å; A649-L679 HydrophobicContact CB-CD1 4.33Å; I655-L679 HydrophobicContact CD1-CD1 4.22Å; I655-L679 HydrophobicContact CG1-CD1 4.43Å; I655-L679 HydrophobicContact CG2-CD1 3.67Å; L679-V681 HydrophobicContact CD2-CG2 3.76Å; L679-V688 HydrophobicContact CD1-CG1 3.93Å; L679-V688 HydrophobicContact CD2-CG1 3.84Å; L679-V688 HydrophobicContact CG-CG1 3.72Å; L679-V689 CarbonylContact C-O 3.55Å; L679-V689 WeakPolarHBondContact CA-O 3.49Å
680	A	93.6	Very high	91.5	Very high	8 Å²	8	27.2 Å²	27.2	7%	0.066	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140	172.9	0	0	0	0	0	108.9	L419 F421 V688 V689	L419-A680 HydrophobicContact CB-CB 3.83Å; F421-A680 HydrophobicContact CD2-CB 3.8Å; F421-A680 HydrophobicContact CE2-CB 4.13Å; F421-A680 WeakPolarHBondContact CE2-O 3.43Å; A680-V688 CarbonylContact O-C 3.48Å; A680-V688 WeakPolarHBondContact O-CA 3.37Å; A680-V688 WeakPolarHBondContact O-CG1 3.31Å; A680-V689 PolarHBondContact N-O 3.29Å; A680-V689 PolarHBondContact O-N 3.06Å
681	V	93.9	Very high	91.8	Very high	14 Å²	14	22.4 Å²	22.4	9%	0.085	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	137.5	174.3	-177.4	0	0	0	0	107.9	F421 R638 V640 F647 L679 V688	F421-V681 VanDerWaalsContact CD2-C 3.46Å; R638-V681 HydrophobicContact CB-CG2 3.91Å; R638-V681 HydrophobicContact CG-CB 4.15Å; R638-V681 HydrophobicContact CG-CG2 3.81Å; V640-V681 HydrophobicContact CG2-CG1 4.32Å; F647-V681 HydrophobicContact CD2-CG2 4Å; L679-V681 HydrophobicContact CD2-CG2 3.76Å; V681-V688 HydrophobicContact CG1-CG2 4.43Å; V681-V688 HydrophobicContact CG2-CG1 4.47Å; V681-V688 HydrophobicContact CG2-CG2 4.23Å
682	S	92.3	Very high	92.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.			trans	-61.2	143.2	174.9	56.8	0	0	0	0	111.2	N425 N684 G685 D686 Y687	N425-S682 WeakPolarHBondContact OD1-CB 3.41Å; S682-N684 PolarHBondContact O-N 3.5Å; S682-G685 PolarHBondContact O-N 3.05Å; S682-G685 PolarHBondContact OG-N 3.49Å; S682-D686 PolarHBondContact OG-N 3.32Å; S682-Y687 WeakPolarHBondContact CB-O 3.44Å; S682-Y687 PolarHBondContact N-O 2.76Å; S682-Y687 PolarHBondContact OG-N 2.85Å; S682-Y687 PolarHBondContact OG-O 2.77Å
683	P	88.4	Confident	92.2	Very high	53 Å²	53	25.1 Å²	25.1	34%	0.344	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46	-29.3	169.4	-31.6	26.6	0	0	0	115.9	N425 P641	N425-P683 WeakPolarHBondContact OD1-CD 3.46Å; P641-P683 WeakPolarHBondContact CB-O 3.49Å
684	N	88.4	Confident	92.1	Very high	101 Å²	101	24.8 Å²	24.8	54%	0.54	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-21	176.4	-71.3	2.7	0	0	0	113.9	N425 S682 D686	N425-N684 PolarHBondContact ND2-ND2 3.49Å; N425-N684 VanDerWaalsContact ND2-ND2 3.19Å; N425-N684 PolarHBondContact ND2-OD1 2.81Å; S682-N684 PolarHBondContact O-N 3.5Å; N684-D686 VanDerWaalsContact C-N 3.35Å
685	G	88.4	Confident	92	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	85.8	-5.5	-175.4	0	0	0	0	0	115.3	Y10 S682	Y10-G685 PolarHBondContact OH-O 2.92Å; S682-G685 PolarHBondContact O-N 3.05Å; S682-G685 PolarHBondContact OG-N 3.49Å
686	D	90.5	Very high	91.9	Very high	50 Å²	50	20.6 Å²	20.6	27%	0.267	10%	0.104	S	C	.	.	S	Bend	trans	-76.1	-29.2	-177.2	-65.7	-41.4	0	0	0	113.6	S682 N684 R702	S682-D686 PolarHBondContact OG-N 3.32Å; N684-D686 VanDerWaalsContact C-N 3.35Å; D686-R702 VanDerWaalsContact O-CB 3.29Å; D686-R702 WeakPolarHBondContact O-CB 3.45Å; D686-R702 PolarHBondContact O-N 3.31Å; D686-R702 IonicContact OD1-CZ 3.89Å; D686-R702 VanDerWaalsContact OD1-CZ 3.24Å; D686-R702 IonicContact OD1-NE 3.56Å; D686-R702 PolarHBondContact OD1-NE 2.81Å; D686-R702 VanDerWaalsContact OD1-NE 3.11Å; D686-R702 IonicContact OD1-NH2 2.73Å; D686-R702 PolarHBondContact OD1-NH2 3.15Å
687	Y	93	Very high	91.8	Very high	41 Å²	41	20.6 Å²	20.6	16%	0.161	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.1	-176.7	-59.4	-76.1	0	0	0	111.8	R441 S682 L699 W700 E701	R441-Y687 PolarHBondContact NH1-OH 3.09Å; S682-Y687 WeakPolarHBondContact CB-O 3.44Å; S682-Y687 PolarHBondContact N-O 2.76Å; S682-Y687 PolarHBondContact OG-N 2.85Å; S682-Y687 PolarHBondContact OG-O 2.77Å; Y687-L699 HydrophobicContact CD1-CD1 4.14Å; Y687-L699 HydrophobicContact CD1-CG 4.48Å; Y687-L699 HydrophobicContact CG-CD1 4.46Å; Y687-W700 WeakPolarHBondContact CA-O 3.38Å; Y687-E701 HydrophobicContact CD1-CB 4.02Å; Y687-E701 HydrophobicContact CD1-CG 4.1Å; Y687-E701 HydrophobicContact CE1-CB 3.88Å; Y687-E701 VanDerWaalsContact CE1-CD 3.48Å; Y687-E701 HydrophobicContact CE1-CG 3.53Å; Y687-E701 VanDerWaalsContact CE1-OE1 3.28Å; Y687-E701 WeakPolarHBondContact CE1-OE1 3.44Å; Y687-E701 PolarHBondContact OH-OE1 3.32Å
688	V	94.8	Very high	91.8	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.5	171.7	-177.1	0	0	0	0	108.6	Y10 F647 L679 A680 V681 W700	Y10-V688 HydrophobicContact CD1-CG2 4.2Å; Y10-V688 HydrophobicContact CE1-CG2 3.82Å; F647-V688 HydrophobicContact CD2-CG2 4.04Å; F647-V688 HydrophobicContact CE2-CG2 3.54Å; F647-V688 HydrophobicContact CZ-CG2 3.94Å; L679-V688 HydrophobicContact CD1-CG1 3.93Å; L679-V688 HydrophobicContact CD2-CG1 3.84Å; L679-V688 HydrophobicContact CG-CG1 3.72Å; A680-V688 CarbonylContact O-C 3.48Å; A680-V688 WeakPolarHBondContact O-CA 3.37Å; A680-V688 WeakPolarHBondContact O-CG1 3.31Å; V681-V688 HydrophobicContact CG1-CG2 4.43Å; V681-V688 HydrophobicContact CG2-CG1 4.47Å; V681-V688 HydrophobicContact CG2-CG2 4.23Å; V688-W700 HydrophobicContact CB-CB 4.19Å; V688-W700 PolarHBondContact N-O 2.98Å; V688-W700 PolarHBondContact O-N 3.46Å
689	V	94.4	Very high	91.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.8	171.5	177.6	0	0	0	0	108.8	F16 L419 F421 V428 L679 A680 R698 L699	F16-V689 HydrophobicContact CZ-CG1 4.34Å; L419-V689 HydrophobicContact CD1-CB 4.42Å; L419-V689 HydrophobicContact CD1-CG1 3.75Å; L419-V689 HydrophobicContact CD2-CG1 4.08Å; F421-V689 HydrophobicContact CE1-CG2 4.08Å; F421-V689 HydrophobicContact CE2-CB 4.12Å; F421-V689 HydrophobicContact CE2-CG2 3.92Å; F421-V689 HydrophobicContact CZ-CB 4.1Å; F421-V689 HydrophobicContact CZ-CG2 3.38Å; V428-V689 HydrophobicContact CG1-CB 4.47Å; V428-V689 HydrophobicContact CG1-CG1 4.17Å; V428-V689 HydrophobicContact CG1-CG2 4.3Å; V428-V689 HydrophobicContact CG2-CG2 4.11Å; L679-V689 CarbonylContact C-O 3.55Å; L679-V689 WeakPolarHBondContact CA-O 3.49Å; A680-V689 PolarHBondContact N-O 3.29Å; A680-V689 PolarHBondContact O-N 3.06Å; V689-R698 VanDerWaalsContact CA-O 3.32Å; V689-R698 WeakPolarHBondContact CA-O 3.39Å; V689-L699 HydrophobicContact CG2-CD1 3.53Å
690	S	94.4	Very high	91.9	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.1	-179.6	51.7	0	0	0	0	110.2	I655 H672 L697 R698 W700	I655-S690 VanDerWaalsContact CD1-CB 3.46Å; H672-S690 WeakPolarHBondContact NE2-CB 2.94Å; H672-S690 PolarHBondContact NE2-OG 3.4Å; S690-L697 WeakPolarHBondContact O-CA 3.37Å; S690-R698 PolarHBondContact N-O 2.71Å; S690-R698 PolarHBondContact O-N 3.1Å; S690-R698 PolarHBondContact OG-O 3.02Å; S690-W700 PolarHBondContact OG-NE1 3.48Å
691	A	93.8	Very high	91.8	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.6	176.9	0	0	0	0	0	111.8	V416 L419 I676 W677 C678 L697	V416-A691 HydrophobicContact CB-CB 3.82Å; V416-A691 HydrophobicContact CG1-CB 3.79Å; L419-A691 HydrophobicContact CD1-CB 3.66Å; L419-A691 HydrophobicContact CG-CB 4.15Å; I676-A691 WeakPolarHBondContact CG2-O 3.38Å; W677-A691 PolarHBondContact N-O 2.56Å; C678-A691 PolarHBondContact O-N 2.93Å; C678-A691 VanDerWaalsContact SG-CB 3.56Å; A691-L697 HydrophobicContact CB-CD2 3.38Å
692	S	92.4	Very high	91.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	165.1	-179.9	172.2	0	0	0	0	112.5	H672 Q674 E675 D694 K695 S696	H672-S692 WeakPolarHBondContact ND1-CB 3.39Å; Q674-S692 PolarHBondContact O-OG 3.43Å; E675-S692 CarbonylContact O-C 3.44Å; E675-S692 VanDerWaalsContact O-CA 3.3Å; E675-S692 WeakPolarHBondContact O-CA 3.3Å; E675-S692 PolarHBondContact O-OG 3.37Å; E675-S692 VanDerWaalsContact O-OG 3.1Å; S692-D694 VanDerWaalsContact CB-OD1 3.23Å; S692-D694 WeakPolarHBondContact CB-OD1 3.46Å; S692-D694 PolarHBondContact O-N 3.03Å; S692-D694 PolarHBondContact OG-N 3.18Å; S692-D694 PolarHBondContact OG-OD1 3.35Å; S692-K695 PolarHBondContact O-N 2.82Å; S692-S696 PolarHBondContact N-O 3.23Å
693	H	91.4	Very high	91.6	Very high	82 Å²	82	27.7 Å²	27.7	38%	0.38	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.1	172.3	-164.5	64.5	0	0	0	112.9	D415 Q674 E675 W677 K695	D415-H693 IonicContact OD2-ND1 2.99Å; Q674-H693 HydrophobicContact CB-CB 3.91Å; Q674-H693 PolarHBondContact OE1-CD2 3.44Å; Q674-H693 PolarHBondContact OE1-O 2.98Å; E675-H693 HydrophobicContact CB-CB 4.48Å; E675-H693 PolarHBondContact O-N 3.31Å; W677-H693 AromaticContact NE1-CG 3.9Å; W677-H693 AromaticContact NE1-ND1 3.53Å; H693-K695 PolarHBondContact O-N 2.97Å
694	D	86.4	Confident	91.4	Very high	9 Å²	9	36.4 Å²	36.4	5%	0.048	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-3.1	170.3	64.9	16.7	0	0	0	113.2	H672 H673 Q674 S692 S696	H672-D694 IonicContact ND1-OD2 3.89Å; H673-D694 PolarHBondContact N-OD2 3.09Å; Q674-D694 HydrophobicContact CB-CB 4.15Å; Q674-D694 HydrophobicContact CG-CB 3.98Å; S692-D694 VanDerWaalsContact CB-OD1 3.23Å; S692-D694 WeakPolarHBondContact CB-OD1 3.46Å; S692-D694 PolarHBondContact O-N 3.03Å; S692-D694 PolarHBondContact OG-N 3.18Å; S692-D694 PolarHBondContact OG-OD1 3.35Å; D694-S696 VanDerWaalsContact CG-OG 3.24Å; D694-S696 PolarHBondContact O-N 3.21Å; D694-S696 WeakPolarHBondContact OD1-CA 3.42Å; D694-S696 WeakPolarHBondContact OD1-CB 3.4Å; D694-S696 PolarHBondContact OD1-N 2.79Å; D694-S696 PolarHBondContact OD1-OG 3.29Å; D694-S696 PolarHBondContact OD2-OG 3.19Å
695	K	89.3	Confident	91.3	Very high	22 Å²	22	37.1 Å²	37.1	10%	0.096	16%	0.162	C	C	.	.	S	Bend	trans	70.3	7.9	-178.9	-47.6	171.2	-171.1	-172.7	0	113.3	Q383 N385 R413 S692 H693	Q383-K695 PolarHBondContact O-NZ 3.42Å; N385-K695 HydrophobicContact CB-CD 3.95Å; R413-K695 PolarHBondContact O-NZ 3.14Å; S692-K695 PolarHBondContact O-N 2.82Å; H693-K695 PolarHBondContact O-N 2.97Å
696	S	90.7	Very high	91.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.188	C	C	.	.			trans	-81.5	147.6	174.1	81.3	0	0	0	0	111	H672 S692 D694	H672-S696 PolarHBondContact ND1-OG 2.59Å; S692-S696 PolarHBondContact N-O 3.23Å; D694-S696 VanDerWaalsContact CG-OG 3.24Å; D694-S696 PolarHBondContact O-N 3.21Å; D694-S696 WeakPolarHBondContact OD1-CA 3.42Å; D694-S696 WeakPolarHBondContact OD1-CB 3.4Å; D694-S696 PolarHBondContact OD1-N 2.79Å; D694-S696 PolarHBondContact OD1-OG 3.29Å; D694-S696 PolarHBondContact OD2-OG 3.19Å
697	L	93	Very high	90.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.8	167.8	-62.4	177.7	0	0	0	107.4	V15 F16 V416 L419 W439 S690 A691	V15-L697 WeakPolarHBondContact CA-O 3.36Å; F16-L697 HydrophobicContact CD1-CB 4.16Å; F16-L697 WeakPolarHBondContact CD1-O 3.47Å; F16-L697 HydrophobicContact CD2-CB 3.96Å; F16-L697 HydrophobicContact CD2-CD1 4.01Å; F16-L697 HydrophobicContact CE1-CB 3.93Å; F16-L697 HydrophobicContact CE2-CB 3.72Å; F16-L697 HydrophobicContact CE2-CD1 3.54Å; F16-L697 HydrophobicContact CE2-CG 4.28Å; F16-L697 HydrophobicContact CG-CB 4.18Å; F16-L697 HydrophobicContact CZ-CB 3.71Å; F16-L697 HydrophobicContact CZ-CD1 4.18Å; F16-L697 PolarHBondContact N-O 2.87Å; F16-L697 PolarHBondContact O-N 2.98Å; V416-L697 HydrophobicContact CB-CD2 4.44Å; V416-L697 HydrophobicContact CG1-CD2 4.22Å; V416-L697 HydrophobicContact CG2-CD2 4.27Å; L419-L697 HydrophobicContact CD1-CD2 4.38Å; L419-L697 HydrophobicContact CD2-CD2 3.86Å; W439-L697 HydrophobicContact CZ2-CD1 4.28Å; S690-L697 WeakPolarHBondContact O-CA 3.37Å; A691-L697 HydrophobicContact CB-CD2 3.38Å
698	R	92.7	Very high	90.1	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.015	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.6	176.7	-63.6	-173.6	-175.1	-133.4	-3.2	110.4	A14 V15 E45 G671 H672 H673 V689 S690 W700	A14-R698 WeakPolarHBondContact O-CA 3.5Å; V15-R698 HydrophobicContact CG1-CG 4.37Å; V15-R698 HydrophobicContact CG2-CG 4.15Å; E45-R698 IonicContact OE1-CZ 3.32Å; E45-R698 IonicContact OE1-NH1 2.76Å; E45-R698 PolarHBondContact OE1-NH1 3.45Å; E45-R698 IonicContact OE1-NH2 3.84Å; E45-R698 IonicContact OE2-CZ 3.2Å; E45-R698 IonicContact OE2-NH1 3.9Å; E45-R698 PolarHBondContact OE2-NH1 2.94Å; E45-R698 IonicContact OE2-NH2 3.46Å; E45-R698 PolarHBondContact OE2-NH2 2.9Å; G671-R698 PolarHBondContact O-NH1 3.44Å; G671-R698 VanDerWaalsContact O-NH1 3.12Å; G671-R698 PolarHBondContact O-NH2 2.97Å; H672-R698 VanDerWaalsContact CE1-CD 3.5Å; H672-R698 WeakPolarHBondContact CE1-CD 3.47Å; H672-R698 VanDerWaalsContact CE1-CG 3.44Å; H672-R698 WeakPolarHBondContact CE1-CG 3.25Å; H673-R698 PolarHBondContact CE1-NH2 3.31Å; H673-R698 VanDerWaalsContact CE1-NH2 3.27Å; H673-R698 PolarHBondContact ND1-NH2 3.22Å; V689-R698 VanDerWaalsContact CA-O 3.32Å; V689-R698 WeakPolarHBondContact CA-O 3.39Å; S690-R698 PolarHBondContact N-O 2.71Å; S690-R698 PolarHBondContact O-N 3.1Å; S690-R698 PolarHBondContact OG-O 3.02Å; R698-W700 HydrophobicContact CB-CZ2 4.37Å
699	L	93.8	Very high	89.3	Confident	10 Å²	10	43.1 Å²	43.1	5%	0.052	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.8	171.3	-179.7	68.6	0	0	0	109.1	S13 A14 F16 L444 Y687 V689	S13-L699 PolarHBondContact N-O 3.47Å; A14-L699 PolarHBondContact N-O 3.22Å; A14-L699 PolarHBondContact O-N 3.46Å; F16-L699 HydrophobicContact CE1-CB 4.16Å; L444-L699 HydrophobicContact CD2-CD2 4.38Å; Y687-L699 HydrophobicContact CD1-CD1 4.14Å; Y687-L699 HydrophobicContact CD1-CG 4.48Å; Y687-L699 HydrophobicContact CG-CD1 4.46Å; V689-L699 HydrophobicContact CG2-CD1 3.53Å
700	W	94	Very high	88.5	Confident	5 Å²	5	50 Å²	50	2%	0.019	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.7	173.6	-49.3	88.6	0	0	0	108.8	Y10 V11 A12 I655 L669 Y687 V688 S690 R698	Y10-W700 HydrophobicContact CD1-CB 4.5Å; V11-W700 CarbonylContact O-C 3.57Å; V11-W700 VanDerWaalsContact O-CA 3.31Å; V11-W700 WeakPolarHBondContact O-CA 3.28Å; A12-W700 HydrophobicContact CB-CE3 3.81Å; A12-W700 HydrophobicContact CB-CH2 4.14Å; A12-W700 HydrophobicContact CB-CZ3 3.54Å; I655-W700 HydrophobicContact CD1-CZ2 4.31Å; L669-W700 HydrophobicContact CB-CD2 4.46Å; L669-W700 HydrophobicContact CB-CE3 4.12Å; L669-W700 HydrophobicContact CB-CH2 3.92Å; L669-W700 HydrophobicContact CB-CZ2 4.26Å; L669-W700 HydrophobicContact CB-CZ3 3.82Å; L669-W700 HydrophobicContact CD1-CD2 3.98Å; L669-W700 HydrophobicContact CD1-CE3 4.02Å; L669-W700 HydrophobicContact CD1-CG 4.22Å; L669-W700 HydrophobicContact CD2-CE3 3.83Å; L669-W700 HydrophobicContact CD2-CZ3 3.95Å; L669-W700 HydrophobicContact CG-CE3 4.21Å; L669-W700 HydrophobicContact CG-CZ3 4.32Å; Y687-W700 WeakPolarHBondContact CA-O 3.38Å; V688-W700 HydrophobicContact CB-CB 4.19Å; V688-W700 PolarHBondContact N-O 2.98Å; V688-W700 PolarHBondContact O-N 3.46Å; S690-W700 PolarHBondContact OG-NE1 3.48Å; R698-W700 HydrophobicContact CB-CZ2 4.37Å
701	E	92.6	Very high	87.7	Confident	72 Å²	72	55.4 Å²	55.4	34%	0.336	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.6	179.7	178.2	164.4	-146.4	0	0	110.1	Y10 V11 Y687 T703	Y10-E701 CarbonylContact C-O 3.54Å; Y10-E701 WeakPolarHBondContact CA-O 3.29Å; V11-E701 PolarHBondContact N-O 3.44Å; V11-E701 PolarHBondContact O-N 3.48Å; Y687-E701 HydrophobicContact CD1-CB 4.02Å; Y687-E701 HydrophobicContact CD1-CG 4.1Å; Y687-E701 HydrophobicContact CE1-CB 3.88Å; Y687-E701 VanDerWaalsContact CE1-CD 3.48Å; Y687-E701 HydrophobicContact CE1-CG 3.53Å; Y687-E701 VanDerWaalsContact CE1-OE1 3.28Å; Y687-E701 WeakPolarHBondContact CE1-OE1 3.44Å; Y687-E701 PolarHBondContact OH-OE1 3.32Å; E701-T703 PolarHBondContact O-N 2.89Å
702	R	91.6	Very high	86.7	Confident	93 Å²	93	56.2 Å²	56.2	35%	0.351	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	114	174.1	-169.5	172.5	69.8	155.1	0.3	110.1	L8 R9 Y10 D686	L8-R702 HydrophobicContact CB-CG 3.75Å; L8-R702 HydrophobicContact CD1-CG 4.24Å; R9-R702 CarbonylContact O-C 3.58Å; R9-R702 WeakPolarHBondContact O-CA 3.47Å; Y10-R702 HydrophobicContact CD1-CB 4.02Å; Y10-R702 HydrophobicContact CE1-CB 3.67Å; Y10-R702 HydrophobicContact CE1-CG 4.27Å; Y10-R702 HydrophobicContact CE2-CB 4.38Å; Y10-R702 HydrophobicContact CE2-CG 4.09Å; D686-R702 VanDerWaalsContact O-CB 3.29Å; D686-R702 WeakPolarHBondContact O-CB 3.45Å; D686-R702 PolarHBondContact O-N 3.31Å; D686-R702 IonicContact OD1-CZ 3.89Å; D686-R702 VanDerWaalsContact OD1-CZ 3.24Å; D686-R702 IonicContact OD1-NE 3.56Å; D686-R702 PolarHBondContact OD1-NE 2.81Å; D686-R702 VanDerWaalsContact OD1-NE 3.11Å; D686-R702 IonicContact OD1-NH2 2.73Å; D686-R702 PolarHBondContact OD1-NH2 3.15Å
703	T	89.2	Confident	85.9	Confident	39 Å²	39	61.8 Å²	61.8	24%	0.239	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	167.6	175.1	67.3	0	0	0	0	110.8	R9 V11 E701 E705	R9-T703 PolarHBondContact O-N 3.46Å; R9-T703 PolarHBondContact O-OG1 3.48Å; V11-T703 HydrophobicContact CB-CG2 4.1Å; V11-T703 HydrophobicContact CG2-CG2 3.68Å; E701-T703 PolarHBondContact O-N 2.89Å; T703-E705 PolarHBondContact O-N 2.87Å
704	R	85.6	Confident	85.2	Confident	237 Å²	237	62.7 Å²	62.7	89%	0.894	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	3.3	176	-63.9	-176.8	-176.8	174.6	1.6	113	P706	R704-P706 WeakPolarHBondContact O-CD 3.37Å
705	E	85.3	Confident	84.7	Confident	115 Å²	115	67 Å²	67	54%	0.537	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	121.9	-178.1	-67.1	174.1	169.7	0	0	109.2	R9 T703	R9-E705 PolarHBondContact N-O 2.88Å; T703-E705 PolarHBondContact O-N 2.87Å
706	P	84.6	Confident	83.9	Confident	84 Å²	84	68.6 Å²	68.6	55%	0.545	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	133.9	173.6	29.8	-32.6	0	0	0	109.1	Y7 R704	Y7-P706 CarbonylContact O-C 3.54Å; Y7-P706 WeakPolarHBondContact O-CA 3.22Å; R704-P706 WeakPolarHBondContact O-CD 3.37Å
707	L	80.6	Confident	83.2	Confident	17 Å²	17	75.8 Å²	75.8	9%	0.089	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.9	-179.9	-172.4	165.6	0	0	0	109.1	Y7 R9 I666 Q667 L709 E712	Y7-L707 PolarHBondContact O-N 3.05Å; R9-L707 HydrophobicContact CB-CD1 4.27Å; R9-L707 HydrophobicContact CG-CD1 4.36Å; I666-L707 HydrophobicContact CG2-CD1 4.09Å; I666-L707 HydrophobicContact CG2-CD2 4.21Å; Q667-L707 HydrophobicContact CB-CD1 4.05Å; Q667-L707 HydrophobicContact CG-CD1 4.19Å; L707-L709 HydrophobicContact CD2-CD2 3.96Å; L707-E712 VanDerWaalsContact CD1-CD 3.44Å; L707-E712 HydrophobicContact CD1-CG 4.45Å; L707-E712 WeakPolarHBondContact CD1-OE1 3.5Å; L707-E712 VanDerWaalsContact CD2-CD 3.48Å; L707-E712 HydrophobicContact CD2-CG 3.75Å; L707-E712 HydrophobicContact CG-CG 4.02Å; L707-E712 WeakPolarHBondContact CG-OE1 3.23Å
708	I	81.4	Confident	82.3	Confident	86 Å²	86	81.2 Å²	81.2	44%	0.441	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-97.6	117.1	175.3	-59.8	169.5	0	0	0	107.8	E710 E711 E712	I708-E710 HydrophobicContact CG2-CB 4.33Å; I708-E710 PolarHBondContact O-N 3.43Å; I708-E710 VanDerWaalsContact O-N 3.17Å; I708-E711 HydrophobicContact CB-CB 4.44Å; I708-E711 HydrophobicContact CB-CG 4.03Å; I708-E711 HydrophobicContact CG2-CG 4.13Å; I708-E711 PolarHBondContact O-N 2.85Å; I708-E712 PolarHBondContact O-N 3.27Å
709	L	77.9	Confident	81.2	Confident	31 Å²	31	83 Å²	83	16%	0.162	38%	0.384	C	S	.	.	H	α-helix	trans	-61.3	-27.2	-173.4	-63.3	176.8	0	0	0	113.5	Y7 I666 L707 R713	Y7-L709 HydrophobicContact CD2-CD1 4.28Å; Y7-L709 HydrophobicContact CD2-CD2 4.05Å; Y7-L709 HydrophobicContact CD2-CG 4.15Å; Y7-L709 HydrophobicContact CE2-CD1 3.81Å; Y7-L709 HydrophobicContact CE2-CD2 4.28Å; Y7-L709 HydrophobicContact CE2-CG 4.2Å; I666-L709 HydrophobicContact CB-CD2 4.28Å; I666-L709 HydrophobicContact CG1-CD2 4.35Å; I666-L709 HydrophobicContact CG2-CD2 4.06Å; L707-L709 HydrophobicContact CD2-CD2 3.96Å; L709-R713 WeakPolarHBondContact O-CG 3.06Å; L709-R713 PolarHBondContact O-N 3.27Å
710	E	77.7	Confident	80.1	Confident	145 Å²	145	88.9 Å²	88.9	68%	0.678	41%	0.411	S	S	*	.	H	α-helix	trans	-70.4	-42.7	178.2	-67.1	178.8	173.1	0	0	111.7	I708 E712 R713 E714	I708-E710 HydrophobicContact CG2-CB 4.33Å; I708-E710 PolarHBondContact O-N 3.43Å; I708-E710 VanDerWaalsContact O-N 3.17Å; E710-E712 VanDerWaalsContact C-N 3.32Å; E710-E712 PolarHBondContact O-N 3.08Å; E710-R713 PolarHBondContact O-N 2.83Å; E710-E714 PolarHBondContact O-N 2.68Å
711	E	77	Confident	79	Confident	112 Å²	112	96 Å²	96	52%	0.523	44%	0.439	S	S	.	.	H	α-helix	trans	-63	-38	178	-65.5	179.4	167.8	0	0	111.7	I708 E714 M715	I708-E711 HydrophobicContact CB-CB 4.44Å; I708-E711 HydrophobicContact CB-CG 4.03Å; I708-E711 HydrophobicContact CG2-CG 4.13Å; I708-E711 PolarHBondContact O-N 2.85Å; E711-E714 PolarHBondContact O-N 2.99Å; E711-M715 WeakPolarHBondContact O-CB 3.41Å; E711-M715 PolarHBondContact O-N 3.03Å
712	E	74.1	Confident	77.8	Confident	17 Å²	17	96.9 Å²	96.9	8%	0.079	44%	0.443	C	S	.	.	H	α-helix	trans	-70.8	-33.8	177.2	-67.8	-153.4	150.9	0	0	112.8	Q667 L707 I708 E710 E714 M715 Q716	Q667-E712 VanDerWaalsContact CA-OE2 3.25Å; Q667-E712 WeakPolarHBondContact CA-OE2 3.42Å; L707-E712 VanDerWaalsContact CD1-CD 3.44Å; L707-E712 HydrophobicContact CD1-CG 4.45Å; L707-E712 WeakPolarHBondContact CD1-OE1 3.5Å; L707-E712 VanDerWaalsContact CD2-CD 3.48Å; L707-E712 HydrophobicContact CD2-CG 3.75Å; L707-E712 HydrophobicContact CG-CG 4.02Å; L707-E712 WeakPolarHBondContact CG-OE1 3.23Å; I708-E712 PolarHBondContact O-N 3.27Å; E710-E712 VanDerWaalsContact C-N 3.32Å; E710-E712 PolarHBondContact O-N 3.08Å; E712-E714 VanDerWaalsContact C-N 3.31Å; E712-M715 PolarHBondContact O-N 3.34Å; E712-Q716 WeakPolarHBondContact O-CB 3.35Å; E712-Q716 WeakPolarHBondContact O-CG 3.38Å; E712-Q716 PolarHBondContact O-N 3.27Å
713	R	75.9	Confident	76.5	Confident	118 Å²	118	97.2 Å²	97.2	45%	0.445	45%	0.452	S	S	.	.	H	α-helix	trans	-68.1	-32.7	172.2	-72.3	177.7	-176	163.7	5.4	111.9	E664 L709 E710 R717	E664-R713 IonicContact OE1-NH2 3.69Å; E664-R713 PolarHBondContact OE1-NH2 2.97Å; L709-R713 WeakPolarHBondContact O-CG 3.06Å; L709-R713 PolarHBondContact O-N 3.27Å; E710-R713 PolarHBondContact O-N 2.83Å; R713-R717 WeakPolarHBondContact O-CG 2.82Å; R713-R717 PolarHBondContact O-N 3.27Å; R713-R717 VanDerWaalsContact O-N 3.15Å; R713-R717 PolarHBondContact O-NE 2.98Å
714	E	75.6	Confident	75.5	Confident	100 Å²	100	97.6 Å²	97.6	47%	0.467	46%	0.456	S	S	.	.	H	α-helix	trans	-68.9	-47.9	172	-76.2	-179.7	172.8	0	0	111.1	E710 E711 E712 Q716 R717 E718	E710-E714 PolarHBondContact O-N 2.68Å; E711-E714 PolarHBondContact O-N 2.99Å; E712-E714 VanDerWaalsContact C-N 3.31Å; E714-Q716 VanDerWaalsContact C-N 3.3Å; E714-Q716 PolarHBondContact O-N 2.82Å; E714-R717 PolarHBondContact O-N 3.38Å; E714-R717 VanDerWaalsContact O-N 3.08Å; E714-R717 IonicContact OE1-NH2 3.79Å; E714-E718 WeakPolarHBondContact O-CG 2.95Å; E714-E718 PolarHBondContact O-N 3.29Å
715	M	77.1	Confident	74.6	Confident	101 Å²	101	88.2 Å²	88.2	50%	0.498	43%	0.425	S	S	.	.	H	α-helix	trans	-59.1	-39	176.7	-171.1	179.9	-62	0	0	112.6	E711 E712 E718 A719	E711-M715 WeakPolarHBondContact O-CB 3.41Å; E711-M715 PolarHBondContact O-N 3.03Å; E712-M715 PolarHBondContact O-N 3.34Å; M715-E718 PolarHBondContact O-N 2.99Å; M715-A719 WeakPolarHBondContact O-CB 3.1Å; M715-A719 PolarHBondContact O-N 3.49Å
716	Q	72.5	Confident	73.4	Confident	55 Å²	55	84.8 Å²	84.8	26%	0.257	42%	0.417	S	S	.	.	H	α-helix	trans	-66.1	-43.7	174.1	-77.1	176.5	-1.8	0	0	112	H665 T668 E712 E714 E718 A719 E720	H665-Q716 PolarHBondContact CE1-NE2 3.27Å; T668-Q716 PolarHBondContact OG1-NE2 2.74Å; E712-Q716 WeakPolarHBondContact O-CB 3.35Å; E712-Q716 WeakPolarHBondContact O-CG 3.38Å; E712-Q716 PolarHBondContact O-N 3.27Å; E714-Q716 VanDerWaalsContact C-N 3.3Å; E714-Q716 PolarHBondContact O-N 2.82Å; Q716-E718 VanDerWaalsContact C-N 3.32Å; Q716-E718 PolarHBondContact O-N 3.09Å; Q716-A719 PolarHBondContact O-N 2.88Å; Q716-E720 WeakPolarHBondContact O-CG 3.44Å; Q716-E720 PolarHBondContact O-N 3.27Å
717	R	75.6	Confident	72.2	Confident	150 Å²	150	88.8 Å²	88.8	57%	0.566	43%	0.425	S	S	*	.	H	α-helix	trans	-62.9	-39	175.3	-80.2	-176	-72.1	163.8	-1.7	112	R713 E714 E720 Y721	R713-R717 WeakPolarHBondContact O-CG 2.82Å; R713-R717 PolarHBondContact O-N 3.27Å; R713-R717 VanDerWaalsContact O-N 3.15Å; R713-R717 PolarHBondContact O-NE 2.98Å; E714-R717 PolarHBondContact O-N 3.38Å; E714-R717 VanDerWaalsContact O-N 3.08Å; E714-R717 IonicContact OE1-NH2 3.79Å; R717-E720 PolarHBondContact O-N 3.43Å; R717-Y721 VanDerWaalsContact O-CB 3.29Å; R717-Y721 WeakPolarHBondContact O-CB 2.99Å; R717-Y721 PolarHBondContact O-N 2.74Å
718	E	72.6	Confident	71	Confident	115 Å²	115	95.1 Å²	95.1	54%	0.537	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-41.7	173.9	-73.4	-177	179.3	0	0	111.8	E714 M715 Q716 Y721 E722	E714-E718 WeakPolarHBondContact O-CG 2.95Å; E714-E718 PolarHBondContact O-N 3.29Å; M715-E718 PolarHBondContact O-N 2.99Å; Q716-E718 VanDerWaalsContact C-N 3.32Å; Q716-E718 PolarHBondContact O-N 3.09Å; E718-Y721 CarbonylContact O-C 3.58Å; E718-Y721 WeakPolarHBondContact O-CB 3.16Å; E718-Y721 PolarHBondContact O-N 2.82Å; E718-E722 PolarHBondContact O-N 3.44Å
719	A	70.4	Confident	69.7	Low	41 Å²	41	97.5 Å²	97.5	34%	0.339	47%	0.468	S	S	.	.	H	α-helix	trans	-69.2	-39	177.1	0	0	0	0	0	112.6	M715 Q716 Y721 E722 D723	M715-A719 WeakPolarHBondContact O-CB 3.1Å; M715-A719 PolarHBondContact O-N 3.49Å; Q716-A719 PolarHBondContact O-N 2.88Å; A719-Y721 VanDerWaalsContact C-N 3.3Å; A719-E722 VanDerWaalsContact O-CB 3.27Å; A719-E722 WeakPolarHBondContact O-CB 3.42Å; A719-E722 PolarHBondContact O-N 2.95Å; A719-D723 PolarHBondContact O-N 3.18Å
720	E	71	Confident	68.6	Low	134 Å²	134	100 Å²	100	63%	0.626	48%	0.479	S	S	*	.	H	α-helix	trans	-64.4	-38.8	172.6	-73.1	175.4	-177.9	0	0	111.2	Q716 R717 D723 S724	Q716-E720 WeakPolarHBondContact O-CG 3.44Å; Q716-E720 PolarHBondContact O-N 3.27Å; R717-E720 PolarHBondContact O-N 3.43Å; E720-D723 PolarHBondContact O-N 2.88Å; E720-S724 PolarHBondContact O-N 3.13Å
721	Y	71.1	Confident	67.1	Low	153 Å²	153	96.3 Å²	96.3	60%	0.6	47%	0.467	S	S	*	.	H	α-helix	trans	-64.6	-39.5	172.1	-174.1	-106.2	0	0	0	111.4	R717 E718 A719 D723 S724 V725	R717-Y721 VanDerWaalsContact O-CB 3.29Å; R717-Y721 WeakPolarHBondContact O-CB 2.99Å; R717-Y721 PolarHBondContact O-N 2.74Å; E718-Y721 CarbonylContact O-C 3.58Å; E718-Y721 WeakPolarHBondContact O-CB 3.16Å; E718-Y721 PolarHBondContact O-N 2.82Å; A719-Y721 VanDerWaalsContact C-N 3.3Å; Y721-D723 PolarHBondContact O-N 3.09Å; Y721-S724 WeakPolarHBondContact CA-OG 3.3Å; Y721-S724 CarbonylContact O-C 3.52Å; Y721-S724 WeakPolarHBondContact O-CA 3.41Å; Y721-S724 WeakPolarHBondContact O-CB 3.38Å; Y721-S724 PolarHBondContact O-N 2.82Å; Y721-S724 VanDerWaalsContact O-N 3.08Å; Y721-S724 PolarHBondContact O-OG 2.91Å; Y721-V725 HydrophobicContact CD1-CG2 3.86Å; Y721-V725 HydrophobicContact CD2-CG2 4.39Å; Y721-V725 HydrophobicContact CE1-CG2 3.44Å; Y721-V725 VanDerWaalsContact CE1-CG2 3.44Å; Y721-V725 HydrophobicContact CE2-CG2 4.02Å; Y721-V725 HydrophobicContact CG-CG2 4.31Å; Y721-V725 WeakPolarHBondContact O-CG2 3.38Å; Y721-V725 PolarHBondContact O-N 2.91Å
722	E	66.3	Low	65.5	Low	91 Å²	91	95.3 Å²	95.3	43%	0.425	48%	0.478	S	S	.	.	H	α-helix	trans	-56.1	-51.1	173.4	-170.2	176	-175.6	0	0	111.5	E718 A719 S724 V725 A726 I749	E718-E722 PolarHBondContact O-N 3.44Å; A719-E722 VanDerWaalsContact O-CB 3.27Å; A719-E722 WeakPolarHBondContact O-CB 3.42Å; A719-E722 PolarHBondContact O-N 2.95Å; E722-S724 PolarHBondContact O-N 2.64Å; E722-V725 PolarHBondContact O-N 2.81Å; E722-A726 VanDerWaalsContact O-CB 3.27Å; E722-A726 WeakPolarHBondContact O-CB 3.35Å; E722-A726 PolarHBondContact O-N 3.02Å; E722-I749 HydrophobicContact CB-CD1 3.46Å; E722-I749 VanDerWaalsContact CB-CD1 3.46Å; E722-I749 HydrophobicContact CG-CD1 3.46Å; E722-I749 VanDerWaalsContact CG-CD1 3.46Å; E722-I749 HydrophobicContact CG-CG1 4.14Å
723	D	65.5	Low	64.3	Low	101 Å²	101	96.7 Å²	96.7	54%	0.54	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-29.8	177.6	-86.3	-10.2	0	0	0	112.1	A719 E720 Y721 K727	A719-D723 PolarHBondContact O-N 3.18Å; E720-D723 PolarHBondContact O-N 2.88Å; Y721-D723 PolarHBondContact O-N 3.09Å; D723-K727 VanDerWaalsContact O-CD 3.31Å; D723-K727 WeakPolarHBondContact O-CD 3.39Å; D723-K727 VanDerWaalsContact O-CG 3.25Å; D723-K727 WeakPolarHBondContact O-CG 3.49Å
724	S	68.8	Low	62.4	Low	46 Å²	46	95.9 Å²	95.9	32%	0.322	51%	0.507	S	S	.	.	H	α-helix	trans	-75.8	-45.4	175.3	79.6	0	0	0	0	112.4	E720 Y721 E722 A726 K727 E728	E720-S724 PolarHBondContact O-N 3.13Å; Y721-S724 WeakPolarHBondContact CA-OG 3.3Å; Y721-S724 CarbonylContact O-C 3.52Å; Y721-S724 WeakPolarHBondContact O-CA 3.41Å; Y721-S724 WeakPolarHBondContact O-CB 3.38Å; Y721-S724 PolarHBondContact O-N 2.82Å; Y721-S724 VanDerWaalsContact O-N 3.08Å; Y721-S724 PolarHBondContact O-OG 2.91Å; E722-S724 PolarHBondContact O-N 2.64Å; S724-A726 VanDerWaalsContact C-N 3.32Å; S724-A726 PolarHBondContact O-N 2.85Å; S724-K727 WeakPolarHBondContact O-CA 3.44Å; S724-K727 WeakPolarHBondContact O-CB 3.31Å; S724-K727 PolarHBondContact O-N 2.58Å; S724-E728 PolarHBondContact O-N 3.26Å
725	V	64.9	Low	61.1	Low	40 Å²	40	94.9 Å²	94.9	24%	0.242	52%	0.523	C	S	.	.	H	α-helix	trans	-65.4	-36.8	177.6	172.6	0	0	0	0	110.9	Y721 E722 K727 E728	Y721-V725 HydrophobicContact CD1-CG2 3.86Å; Y721-V725 HydrophobicContact CD2-CG2 4.39Å; Y721-V725 HydrophobicContact CE1-CG2 3.44Å; Y721-V725 VanDerWaalsContact CE1-CG2 3.44Å; Y721-V725 HydrophobicContact CE2-CG2 4.02Å; Y721-V725 HydrophobicContact CG-CG2 4.31Å; Y721-V725 WeakPolarHBondContact O-CG2 3.38Å; Y721-V725 PolarHBondContact O-N 2.91Å; E722-V725 PolarHBondContact O-N 2.81Å; V725-K727 PolarHBondContact O-N 3.08Å; V725-E728 PolarHBondContact O-N 3.26Å
726	A	59.9	Low	59.6	Low	44 Å²	44	94.4 Å²	94.4	36%	0.364	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.2	174.4	0	0	0	0	0	113.4	E722 S724	E722-A726 VanDerWaalsContact O-CB 3.27Å; E722-A726 WeakPolarHBondContact O-CB 3.35Å; E722-A726 PolarHBondContact O-N 3.02Å; S724-A726 VanDerWaalsContact C-N 3.32Å; S724-A726 PolarHBondContact O-N 2.85Å
727	K	59.6	Low	57.9	Low	167 Å²	167	98.2 Å²	98.2	73%	0.726	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-24.8	177.5	-72.7	170.3	-171.7	160.8	0	113.1	D723 S724 V725	D723-K727 VanDerWaalsContact O-CD 3.31Å; D723-K727 WeakPolarHBondContact O-CD 3.39Å; D723-K727 VanDerWaalsContact O-CG 3.25Å; D723-K727 WeakPolarHBondContact O-CG 3.49Å; S724-K727 WeakPolarHBondContact O-CA 3.44Å; S724-K727 WeakPolarHBondContact O-CB 3.31Å; S724-K727 PolarHBondContact O-N 2.58Å; V725-K727 PolarHBondContact O-N 3.08Å
728	E	55.1	Low	56.1	Low	150 Å²	150	99.7 Å²	99.7	70%	0.701	56%	0.56	S	S	*	*	S	Bend	trans	-70.5	133.2	175.4	-74.8	-171	167.9	0	0	111.5	S724 V725	S724-E728 PolarHBondContact O-N 3.26Å; V725-E728 PolarHBondContact O-N 3.26Å
729	D	54.6	Low	54.4	Low	136 Å²	136	96.2 Å²	96.2	73%	0.727	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-69.9	154.8	-174.4	-96.5	-37	0	0	0	113.4	K107	K107-D729 IonicContact NZ-OD1 2.86Å; K107-D729 PolarHBondContact NZ-OD1 2.9Å
730	Q	54.6	Low	53.1	Low	85 Å²	85	100.2 Å²	100.2	40%	0.397	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-54.4	142.3	-173.9	-69.1	172.1	-25.1	0	0	112.9	A732	Q730-A732 PolarHBondContact O-N 3.17Å
731	P	47.8	Very low	51.9	Low	66 Å²	66	98.6 Å²	98.6	43%	0.429	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-64.7	122.3	162.3	31.1	-35.4	0	0	0	108.5	V733	P731-V733 PolarHBondContact O-N 2.87Å
732	A	43.4	Very low	51.2	Low	92 Å²	92	95.7 Å²	95.7	76%	0.76	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-60.8	122.1	163.6	0	0	0	0	0	108.1	Q730 A734	Q730-A732 PolarHBondContact O-N 3.17Å; A732-A734 PolarHBondContact O-N 2.9Å
733	V	48.2	Very low	50.7	Low	46 Å²	46	93.6 Å²	93.6	28%	0.279	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-64.3	117.1	170.3	-178.4	0	0	0	0	107	P731 G735 L823 I860	P731-V733 PolarHBondContact O-N 2.87Å; V733-G735 PolarHBondContact O-N 2.76Å; V733-L823 HydrophobicContact CG2-CD1 4.12Å; V733-I860 HydrophobicContact CG1-CG2 4.47Å
734	A	36.6	Very low	50.2	Low	101 Å²	101	89.1 Å²	89.1	84%	0.835	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	100	-178.6	0	0	0	0	0	110.2	A732	A732-A734 PolarHBondContact O-N 2.9Å
735	G	47.1	Very low	49.8	Very low	78 Å²	78	87.5 Å²	87.5	80%	0.804	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	140.1	-14.3	173.5	0	0	0	0	0	115.9	V733	V733-G735 PolarHBondContact O-N 2.76Å
736	E	45.8	Very low	49.9	Very low	92 Å²	92	88.5 Å²	88.5	43%	0.43	51%	0.513	S	S	.	.			trans	-89.8	114.9	173	-74.8	-178.6	163.2	0	0	110.3
737	T	36.8	Very low	50.1	Low	135 Å²	135	90.6 Å²	90.6	83%	0.828	51%	0.513	S	S	*	.			trans	-56.5	144.5	159.6	31	0	0	0	0	109.5	G739	T737-G739 PolarHBondContact O-N 2.96Å
738	Q	37.3	Very low	50.6	Low	181 Å²	181	84 Å²	84	85%	0.846	49%	0.487	S	S	*	.	S	Bend	trans	-59.2	62.5	179.2	-60.7	177.3	-10.7	0	0	113.4
739	G	38.1	Very low	51.4	Low	42 Å²	42	79.2 Å²	79.2	43%	0.433	47%	0.466	S	S	.	.			trans	-99.9	157.2	167.1	0	0	0	0	0	110	T737 N741	T737-G739 PolarHBondContact O-N 2.96Å; G739-N741 PolarHBondContact O-N 2.89Å
740	D	42.4	Very low	52.5	Low	124 Å²	124	77.1 Å²	77.1	66%	0.663	45%	0.452	S	S	*	.	S	Bend	trans	-56.9	5.6	-166	-70.4	-41.9	0	0	0	118
741	N	47	Very low	53.7	Low	101 Å²	101	73 Å²	73	54%	0.54	43%	0.433	S	S	.	.			trans	-109.6	71.2	-175.9	-69.9	-7.5	0	0	0	112.4	Q181 G739	Q181-N741 PolarHBondContact OE1-OD1 3.47Å; Q181-N741 VanDerWaalsContact OE1-OD1 3.06Å; G739-N741 PolarHBondContact O-N 2.89Å
742	Y	56.1	Low	55.4	Low	92 Å²	92	72.3 Å²	72.3	36%	0.361	43%	0.427	S	S	.	.			trans	-84.8	141.8	169.5	-78.7	-83.3	0	0	0	112	T744	Y742-T744 PolarHBondContact O-N 3.31Å
743	F	55.4	Low	57.4	Low	46 Å²	46	73 Å²	73	20%	0.202	41%	0.413	C	S	.	.			trans	-57.2	136.1	172.8	-163	-106.1	0	0	0	111.6	G745 E819 E820 F856	F743-G745 VanDerWaalsContact C-N 3.32Å; F743-G745 PolarHBondContact O-N 2.98Å; F743-E819 HydrophobicContact CE1-CB 4.37Å; F743-E819 HydrophobicContact CE2-CB 4.18Å; F743-E819 WeakPolarHBondContact CE2-OE2 3.34Å; F743-E819 HydrophobicContact CZ-CB 3.49Å; F743-E819 VanDerWaalsContact CZ-CB 3.49Å; F743-E819 HydrophobicContact CZ-CG 4.41Å; F743-E819 WeakPolarHBondContact CZ-OE2 3.46Å; F743-E820 HydrophobicContact CE1-CG 3.89Å; F743-F856 AromaticContact CD2-CE2 3.91Å; F743-F856 HydrophobicContact CD2-CE2 3.91Å; F743-F856 HydrophobicContact CE1-CZ 4.5Å; F743-F856 HydrophobicContact CE2-CD2 4.34Å; F743-F856 AromaticContact CE2-CE2 3.4Å; F743-F856 HydrophobicContact CE2-CE2 3.4Å; F743-F856 VanDerWaalsContact CE2-CE2 3.4Å; F743-F856 HydrophobicContact CE2-CZ 4.07Å; F743-F856 AromaticContact CZ-CE2 3.81Å; F743-F856 HydrophobicContact CZ-CE2 3.81Å; F743-F856 HydrophobicContact CZ-CZ 4.05Å
744	T	54.7	Low	59.1	Low	7 Å²	7	70.8 Å²	70.8	4%	0.043	40%	0.399	C	S	.	.			trans	-80.8	-10.9	-169.8	41.6	0	0	0	0	113.7	G105 I132 G141 R144 Y742	G105-T744 WeakPolarHBondContact CA-O 3.5Å; I132-T744 HydrophobicContact CG2-CG2 3.89Å; G141-T744 WeakPolarHBondContact CA-OG1 3.45Å; G141-T744 PolarHBondContact O-OG1 3.17Å; R144-T744 HydrophobicContact CB-CG2 3.78Å; Y742-T744 PolarHBondContact O-N 3.31Å
745	G	60	Low	61.6	Low	13 Å²	13	66 Å²	66	13%	0.134	36%	0.36	C	S	.	.			trans	-83.5	151	-170.2	0	0	0	0	0	117.2	F743 E820	F743-G745 VanDerWaalsContact C-N 3.32Å; F743-G745 PolarHBondContact O-N 2.98Å; G745-E820 WeakPolarHBondContact CA-OE1 3.46Å
746	K	66.8	Low	63.6	Low	61 Å²	61	66.6 Å²	66.6	27%	0.265	34%	0.341	S	S	.	.			trans	-112.1	128.9	172.8	-179.1	-177.5	178.1	-175.4	0	109	T748 E820	K746-T748 PolarHBondContact O-N 3.14Å; K746-E820 PolarHBondContact N-OE1 3.49Å
747	K	66	Low	65.6	Low	87 Å²	87	67.2 Å²	67.2	38%	0.378	34%	0.34	S	S	.	.			trans	-57.8	115.4	171.4	-69	-174.9	174.8	-174.6	0	110.1
748	T	69.8	Low	68.2	Low	29 Å²	29	60.8 Å²	60.8	18%	0.178	30%	0.301	C	S	.	.			trans	-112.1	159.3	172.9	62	0	0	0	0	110.2	N104 K746 E750 T751 V752	N104-T748 HydrophobicContact CB-CG2 4.25Å; K746-T748 PolarHBondContact O-N 3.14Å; T748-E750 PolarHBondContact O-N 3.35Å; T748-T751 PolarHBondContact N-OG1 2.86Å; T748-T751 PolarHBondContact O-N 2.81Å; T748-T751 PolarHBondContact O-OG1 3.25Å; T748-T751 WeakPolarHBondContact OG1-CG2 3.36Å; T748-T751 PolarHBondContact OG1-N 3.4Å; T748-V752 PolarHBondContact O-N 3.37Å; T748-V752 VanDerWaalsContact O-N 3.11Å
749	I	72.2	Confident	70.6	Confident	49 Å²	49	54 Å²	54	25%	0.251	27%	0.269	S	S	.	.	H	α-helix	trans	-59.8	-37	175.9	-68.3	178.1	0	0	0	111.1	E722 T751 V752 K753	E722-I749 HydrophobicContact CB-CD1 3.46Å; E722-I749 VanDerWaalsContact CB-CD1 3.46Å; E722-I749 HydrophobicContact CG-CD1 3.46Å; E722-I749 VanDerWaalsContact CG-CD1 3.46Å; E722-I749 HydrophobicContact CG-CG1 4.14Å; I749-T751 PolarHBondContact O-N 2.63Å; I749-V752 PolarHBondContact O-N 3.01Å; I749-V752 VanDerWaalsContact O-N 3.16Å; I749-K753 HydrophobicContact CG2-CD 3.9Å; I749-K753 HydrophobicContact CG2-CG 4.14Å; I749-K753 WeakPolarHBondContact O-CB 3.45Å; I749-K753 WeakPolarHBondContact O-CG 3.44Å; I749-K753 PolarHBondContact O-N 2.83Å
750	E	76.2	Confident	73.1	Confident	92 Å²	92	58.1 Å²	58.1	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-59	-38.3	175.9	-64.4	-173.1	-163.1	0	0	111.1	T748 K753 A754 K814	T748-E750 PolarHBondContact O-N 3.35Å; E750-K753 PolarHBondContact O-N 2.75Å; E750-A754 VanDerWaalsContact O-CB 3.26Å; E750-A754 WeakPolarHBondContact O-CB 3.44Å; E750-A754 PolarHBondContact O-N 2.9Å; E750-K814 IonicContact OE2-NZ 3.78Å; E750-K814 PolarHBondContact OE2-NZ 2.68Å
751	T	80.3	Confident	75.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-70.1	-36.6	176.4	67.5	0	0	0	0	113	T748 I749 A754 A755 E817 E820	T748-T751 PolarHBondContact N-OG1 2.86Å; T748-T751 PolarHBondContact O-N 2.81Å; T748-T751 PolarHBondContact O-OG1 3.25Å; T748-T751 WeakPolarHBondContact OG1-CG2 3.36Å; T748-T751 PolarHBondContact OG1-N 3.4Å; I749-T751 PolarHBondContact O-N 2.63Å; T751-A754 PolarHBondContact O-N 3.5Å; T751-A755 WeakPolarHBondContact O-CB 3.27Å; T751-A755 PolarHBondContact O-N 3.44Å; T751-E817 HydrophobicContact CG2-CB 3.9Å; T751-E817 HydrophobicContact CG2-CG 3.99Å; T751-E820 HydrophobicContact CG2-CB 3.75Å; T751-E820 WeakPolarHBondContact CG2-OE2 3.39Å
752	V	83	Confident	77.4	Confident	50 Å²	50	47.4 Å²	47.4	30%	0.303	22%	0.22	S	C	.	.	H	α-helix	trans	-67.7	-46.6	175.1	178.7	0	0	0	0	109.9	T748 I749 A754 A755 E756	T748-V752 PolarHBondContact O-N 3.37Å; T748-V752 VanDerWaalsContact O-N 3.11Å; I749-V752 PolarHBondContact O-N 3.01Å; I749-V752 VanDerWaalsContact O-N 3.16Å; V752-A754 VanDerWaalsContact C-N 3.28Å; V752-A754 PolarHBondContact O-N 2.64Å; V752-A755 WeakPolarHBondContact O-CB 3.49Å; V752-A755 PolarHBondContact O-N 3.22Å; V752-A755 VanDerWaalsContact O-N 3.11Å; V752-E756 HydrophobicContact CG1-CG 4.47Å; V752-E756 WeakPolarHBondContact O-CG 3.35Å; V752-E756 PolarHBondContact O-N 3.45Å
753	K	84.9	Confident	79	Confident	106 Å²	106	47 Å²	47	46%	0.461	22%	0.222	S	C	.	.	H	α-helix	trans	-61.2	-36.2	174.4	-71.6	-179.4	178	179.4	0	112.1	I749 E750 R757	I749-K753 HydrophobicContact CG2-CD 3.9Å; I749-K753 HydrophobicContact CG2-CG 4.14Å; I749-K753 WeakPolarHBondContact O-CB 3.45Å; I749-K753 WeakPolarHBondContact O-CG 3.44Å; I749-K753 PolarHBondContact O-N 2.83Å; E750-K753 PolarHBondContact O-N 2.75Å; K753-R757 WeakPolarHBondContact O-CB 3.17Å; K753-R757 VanDerWaalsContact O-CG 3.29Å; K753-R757 WeakPolarHBondContact O-CG 3.35Å; K753-R757 PolarHBondContact O-N 3.41Å; K753-R757 PolarHBondContact O-NE 3.31Å
754	A	85.8	Confident	80.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.2	-43.8	173.2	0	0	0	0	0	111.6	E750 T751 V752 R757 I758 V813 A821	E750-A754 VanDerWaalsContact O-CB 3.26Å; E750-A754 WeakPolarHBondContact O-CB 3.44Å; E750-A754 PolarHBondContact O-N 2.9Å; T751-A754 PolarHBondContact O-N 3.5Å; V752-A754 VanDerWaalsContact C-N 3.28Å; V752-A754 PolarHBondContact O-N 2.64Å; A754-R757 PolarHBondContact O-N 3.01Å; A754-I758 WeakPolarHBondContact O-CG1 3.27Å; A754-I758 PolarHBondContact O-N 2.96Å; A754-V813 HydrophobicContact CB-CG1 3.96Å; A754-V813 HydrophobicContact CB-CG2 3.94Å; A754-A821 HydrophobicContact CB-CB 3.95Å
755	A	87.8	Confident	82.1	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.1	-42.9	175.6	0	0	0	0	0	111.8	T751 V752 I758 M759 A821 V824 L825	T751-A755 WeakPolarHBondContact O-CB 3.27Å; T751-A755 PolarHBondContact O-N 3.44Å; V752-A755 WeakPolarHBondContact O-CB 3.49Å; V752-A755 PolarHBondContact O-N 3.22Å; V752-A755 VanDerWaalsContact O-N 3.11Å; A755-I758 PolarHBondContact O-N 2.96Å; A755-M759 WeakPolarHBondContact O-CG 3.34Å; A755-M759 PolarHBondContact O-N 3.13Å; A755-A821 HydrophobicContact CB-CB 4.35Å; A755-A821 WeakPolarHBondContact CB-O 3.43Å; A755-V824 HydrophobicContact CB-CB 3.99Å; A755-V824 HydrophobicContact CB-CG1 4.05Å; A755-L825 HydrophobicContact CB-CD2 4.27Å
756	E	89.3	Confident	83.5	Confident	91 Å²	91	50.1 Å²	50.1	43%	0.425	23%	0.229	S	C	.	.	H	α-helix	trans	-59.2	-47.6	174.7	-73.7	171.1	172.7	0	0	111.6	V752 I758 M759 E760	V752-E756 HydrophobicContact CG1-CG 4.47Å; V752-E756 WeakPolarHBondContact O-CG 3.35Å; V752-E756 PolarHBondContact O-N 3.45Å; E756-I758 VanDerWaalsContact C-N 3.28Å; E756-I758 PolarHBondContact O-N 3.29Å; E756-M759 HydrophobicContact CB-CE 4.33Å; E756-M759 HydrophobicContact CG-CE 3.86Å; E756-M759 PolarHBondContact O-N 2.88Å; E756-M759 VanDerWaalsContact O-N 3.08Å; E756-E760 WeakPolarHBondContact O-CG 3.15Å; E756-E760 PolarHBondContact O-N 3.29Å
757	R	88.9	Confident	84.4	Confident	105 Å²	105	52.2 Å²	52.2	40%	0.396	24%	0.24	S	C	.	.	H	α-helix	trans	-56.9	-40.4	173.6	-76	-176	-67.2	143.3	-5.8	112.7	K753 A754 A761 G812	K753-R757 WeakPolarHBondContact O-CB 3.17Å; K753-R757 VanDerWaalsContact O-CG 3.29Å; K753-R757 WeakPolarHBondContact O-CG 3.35Å; K753-R757 PolarHBondContact O-N 3.41Å; K753-R757 PolarHBondContact O-NE 3.31Å; A754-R757 PolarHBondContact O-N 3.01Å; R757-A761 WeakPolarHBondContact O-CB 3.42Å; R757-A761 PolarHBondContact O-N 3.36Å; R757-A761 VanDerWaalsContact O-N 3.08Å; R757-G812 PolarHBondContact NH1-O 3.19Å
758	I	89.8	Confident	85.2	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.1	-42.3	176.2	-67.8	166	0	0	0	110.5	A754 A755 E756 A761 I762 F810 V813 L825	A754-I758 WeakPolarHBondContact O-CG1 3.27Å; A754-I758 PolarHBondContact O-N 2.96Å; A755-I758 PolarHBondContact O-N 2.96Å; E756-I758 VanDerWaalsContact C-N 3.28Å; E756-I758 PolarHBondContact O-N 3.29Å; I758-A761 PolarHBondContact O-N 2.8Å; I758-I762 HydrophobicContact CG2-CD1 3.71Å; I758-I762 HydrophobicContact CG2-CG1 4.47Å; I758-I762 WeakPolarHBondContact O-CD1 3.47Å; I758-I762 VanDerWaalsContact O-CG1 3.26Å; I758-I762 WeakPolarHBondContact O-CG1 3.43Å; I758-I762 PolarHBondContact O-N 3.02Å; I758-F810 HydrophobicContact CD1-CD1 4.43Å; I758-F810 HydrophobicContact CD1-CE1 4.07Å; I758-F810 HydrophobicContact CD1-CZ 4.44Å; I758-F810 HydrophobicContact CG2-CE2 4.13Å; I758-F810 HydrophobicContact CG2-CZ 3.83Å; I758-V813 HydrophobicContact CD1-CG2 4.2Å; I758-V813 HydrophobicContact CG1-CG2 4.44Å; I758-L825 HydrophobicContact CG2-CD1 4.22Å; I758-L825 HydrophobicContact CG2-CD2 4.37Å
759	M	89.3	Confident	85.8	Confident	37 Å²	37	49.1 Å²	49.1	18%	0.182	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-48.3	177.5	-71.3	-175.2	-66.8	0	0	111.4	A755 E756 A761 I762 E763 L825 P826 Y829	A755-M759 WeakPolarHBondContact O-CG 3.34Å; A755-M759 PolarHBondContact O-N 3.13Å; E756-M759 HydrophobicContact CB-CE 4.33Å; E756-M759 HydrophobicContact CG-CE 3.86Å; E756-M759 PolarHBondContact O-N 2.88Å; E756-M759 VanDerWaalsContact O-N 3.08Å; M759-A761 VanDerWaalsContact C-N 3.3Å; M759-A761 PolarHBondContact O-N 3.34Å; M759-I762 PolarHBondContact O-N 3.11Å; M759-I762 VanDerWaalsContact O-N 3.12Å; M759-E763 WeakPolarHBondContact O-CG 3.23Å; M759-E763 PolarHBondContact O-N 3.46Å; M759-L825 HydrophobicContact CG-CD2 3.49Å; M759-L825 VanDerWaalsContact CG-CD2 3.49Å; M759-L825 HydrophobicContact SD-CD2 4.15Å; M759-P826 HydrophobicContact SD-CG 4.42Å; M759-Y829 HydrophobicContact CB-CE1 4.46Å; M759-Y829 HydrophobicContact CG-CD2 4.43Å; M759-Y829 HydrophobicContact CG-CE2 4.25Å; M759-Y829 HydrophobicContact SD-CE2 4.04Å
760	E	90.3	Very high	86.4	Confident	129 Å²	129	48.8 Å²	48.8	60%	0.603	23%	0.232	S	C	*	.	H	α-helix	trans	-57.1	-43.2	176.1	-72.1	176.9	179.2	0	0	111.6	E756 I762 E763 L764	E756-E760 WeakPolarHBondContact O-CG 3.15Å; E756-E760 PolarHBondContact O-N 3.29Å; E760-I762 VanDerWaalsContact C-N 3.34Å; E760-I762 PolarHBondContact O-N 2.88Å; E760-E763 PolarHBondContact O-N 3.14Å; E760-L764 WeakPolarHBondContact O-CB 3.14Å; E760-L764 PolarHBondContact O-N 2.87Å
761	A	89.9	Confident	86.8	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-38	177.3	0	0	0	0	0	112.7	R757 I758 M759 Y765 Y805 V806 T809	R757-A761 WeakPolarHBondContact O-CB 3.42Å; R757-A761 PolarHBondContact O-N 3.36Å; R757-A761 VanDerWaalsContact O-N 3.08Å; I758-A761 PolarHBondContact O-N 2.8Å; M759-A761 VanDerWaalsContact C-N 3.3Å; M759-A761 PolarHBondContact O-N 3.34Å; A761-Y765 WeakPolarHBondContact O-CB 3.42Å; A761-Y765 PolarHBondContact O-N 3.36Å; A761-Y805 HydrophobicContact CB-CD1 4.17Å; A761-Y805 HydrophobicContact CB-CE1 3.92Å; A761-V806 HydrophobicContact CB-CG2 4.19Å; A761-V806 WeakPolarHBondContact O-CG2 3.17Å; A761-T809 HydrophobicContact CB-CG2 3.75Å
762	I	89.6	Confident	86.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-72.5	-37	177.7	-65.6	162.8	0	0	0	111.2	I758 M759 E760 Y765 R766 Y829 D832 I833	I758-I762 HydrophobicContact CG2-CD1 3.71Å; I758-I762 HydrophobicContact CG2-CG1 4.47Å; I758-I762 WeakPolarHBondContact O-CD1 3.47Å; I758-I762 VanDerWaalsContact O-CG1 3.26Å; I758-I762 WeakPolarHBondContact O-CG1 3.43Å; I758-I762 PolarHBondContact O-N 3.02Å; M759-I762 PolarHBondContact O-N 3.11Å; M759-I762 VanDerWaalsContact O-N 3.12Å; E760-I762 VanDerWaalsContact C-N 3.34Å; E760-I762 PolarHBondContact O-N 2.88Å; I762-Y765 WeakPolarHBondContact O-CB 3.23Å; I762-Y765 PolarHBondContact O-N 2.88Å; I762-R766 WeakPolarHBondContact O-CG 3.25Å; I762-R766 PolarHBondContact O-N 3.11Å; I762-Y829 HydrophobicContact CB-CD1 4.24Å; I762-Y829 HydrophobicContact CD1-CD1 4.49Å; I762-Y829 HydrophobicContact CG2-CD1 3.85Å; I762-D832 HydrophobicContact CG2-CB 4.45Å; I762-I833 HydrophobicContact CD1-CD1 3.69Å; I762-I833 HydrophobicContact CD1-CG1 3.52Å; I762-I833 HydrophobicContact CG1-CG1 4.49Å
763	E	89.8	Confident	86.6	Confident	83 Å²	83	55.1 Å²	55.1	39%	0.388	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-44.8	174.6	-72.2	-179.6	179.4	0	0	111.1	M759 E760 Y765 R766 E767 Y829	M759-E763 WeakPolarHBondContact O-CG 3.23Å; M759-E763 PolarHBondContact O-N 3.46Å; E760-E763 PolarHBondContact O-N 3.14Å; E763-Y765 PolarHBondContact O-N 3.15Å; E763-R766 WeakPolarHBondContact O-CB 3.42Å; E763-R766 PolarHBondContact O-N 3.1Å; E763-E767 WeakPolarHBondContact O-CG 3.16Å; E763-E767 PolarHBondContact O-N 3.48Å; E763-Y829 HydrophobicContact CG-CE1 3.94Å; E763-Y829 PolarHBondContact OE1-OH 3.48Å
764	L	87.4	Confident	86.6	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.099	26%	0.262	C	S	.	.	H	α-helix	trans	-55.8	-42.7	171.5	-168.7	76.5	0	0	0	111.3	E760 E767 E768 N791 I793 L794 Y805	E760-L764 WeakPolarHBondContact O-CB 3.14Å; E760-L764 PolarHBondContact O-N 2.87Å; L764-E767 PolarHBondContact O-N 2.95Å; L764-E768 WeakPolarHBondContact O-CB 3.38Å; L764-E768 WeakPolarHBondContact O-CG 3.37Å; L764-E768 PolarHBondContact O-N 2.94Å; L764-N791 HydrophobicContact CD1-CB 4.35Å; L764-N791 WeakPolarHBondContact CD1-ND2 3.47Å; L764-I793 HydrophobicContact CD1-CD1 4.36Å; L764-I793 HydrophobicContact CD2-CG2 4.28Å; L764-L794 HydrophobicContact CD2-CD2 3.97Å; L764-L794 HydrophobicContact CD2-CG 4.14Å; L764-Y805 HydrophobicContact CD2-CD1 3.76Å; L764-Y805 HydrophobicContact CD2-CE1 3.68Å
765	Y	87.8	Confident	86.1	Confident	34 Å²	34	57.8 Å²	57.8	13%	0.133	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-42.1	175.4	171.9	-100.7	0	0	0	112.6	A761 I762 E763 T769 P802 L836	A761-Y765 WeakPolarHBondContact O-CB 3.42Å; A761-Y765 PolarHBondContact O-N 3.36Å; I762-Y765 WeakPolarHBondContact O-CB 3.23Å; I762-Y765 PolarHBondContact O-N 2.88Å; E763-Y765 PolarHBondContact O-N 3.15Å; Y765-T769 HydrophobicContact CD1-CG2 4.43Å; Y765-T769 HydrophobicContact CD2-CG2 3.86Å; Y765-T769 HydrophobicContact CE1-CG2 4.03Å; Y765-T769 HydrophobicContact CE2-CG2 3.35Å; Y765-T769 HydrophobicContact CG-CG2 4.35Å; Y765-T769 VanDerWaalsContact CZ-CG2 3.46Å; Y765-T769 WeakPolarHBondContact O-CB 3.23Å; Y765-T769 VanDerWaalsContact O-CG2 3.27Å; Y765-T769 WeakPolarHBondContact O-CG2 3.3Å; Y765-T769 PolarHBondContact O-N 2.87Å; Y765-T769 PolarHBondContact O-OG1 2.98Å; Y765-P802 HydrophobicContact CD2-CB 3.95Å; Y765-L836 HydrophobicContact CD1-CD1 3.96Å; Y765-L836 HydrophobicContact CD1-CD2 4.3Å; Y765-L836 HydrophobicContact CD1-CG 4.39Å; Y765-L836 HydrophobicContact CD2-CD2 4.06Å; Y765-L836 HydrophobicContact CE1-CD1 4.03Å; Y765-L836 HydrophobicContact CE1-CD2 3.8Å; Y765-L836 HydrophobicContact CE1-CG 3.96Å; Y765-L836 HydrophobicContact CE2-CD2 3.56Å; Y765-L836 HydrophobicContact CG-CD1 4.3Å; Y765-L836 HydrophobicContact CG-CD2 4.42Å
766	R	88.1	Confident	85.7	Confident	78 Å²	78	65 Å²	65	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-61.4	-46.9	176.3	-76.4	176.3	174.5	166.1	1.5	111.5	I762 E763 T769 A770 S828 D832	I762-R766 WeakPolarHBondContact O-CG 3.25Å; I762-R766 PolarHBondContact O-N 3.11Å; E763-R766 WeakPolarHBondContact O-CB 3.42Å; E763-R766 PolarHBondContact O-N 3.1Å; R766-T769 PolarHBondContact O-OG1 2.87Å; R766-A770 WeakPolarHBondContact O-CB 3.4Å; R766-A770 PolarHBondContact O-N 3.04Å; R766-S828 PolarHBondContact NH2-O 2.82Å; R766-D832 IonicContact CZ-OD2 2.87Å; R766-D832 IonicContact NE-OD2 3.2Å; R766-D832 PolarHBondContact NE-OD2 2.81Å; R766-D832 IonicContact NH2-OD2 3.13Å; R766-D832 PolarHBondContact NH2-OD2 3.25Å
767	E	86.4	Confident	85.3	Confident	106 Å²	106	63.5 Å²	63.5	50%	0.495	30%	0.3	S	S	.	.	H	α-helix	trans	-62.2	-48.8	179.4	-70.8	-175.2	176.5	0	0	111.6	E763 L764 T769 A770 K771	E763-E767 WeakPolarHBondContact O-CG 3.16Å; E763-E767 PolarHBondContact O-N 3.48Å; L764-E767 PolarHBondContact O-N 2.95Å; E767-T769 PolarHBondContact O-N 2.65Å; E767-A770 PolarHBondContact O-N 3.05Å; E767-K771 WeakPolarHBondContact O-CG 3.22Å; E767-K771 PolarHBondContact O-N 3.49Å
768	E	82.6	Confident	84.8	Confident	15 Å²	15	63.1 Å²	63.1	7%	0.07	31%	0.305	C	S	.	.	H	α-helix	trans	-69.7	-35.1	-177.9	-71.6	-64.4	114.7	0	0	112.3	L764 K771 M772 N791 L794 P802	L764-E768 WeakPolarHBondContact O-CB 3.38Å; L764-E768 WeakPolarHBondContact O-CG 3.37Å; L764-E768 PolarHBondContact O-N 2.94Å; E768-K771 WeakPolarHBondContact OE1-CD 3.34Å; E768-K771 IonicContact OE1-NZ 3.71Å; E768-K771 PolarHBondContact OE1-NZ 3.23Å; E768-M772 WeakPolarHBondContact O-CB 3.41Å; E768-M772 VanDerWaalsContact O-CG 3.29Å; E768-M772 WeakPolarHBondContact O-CG 3.3Å; E768-M772 PolarHBondContact O-N 3.1Å; E768-N791 WeakPolarHBondContact CG-ND2 3.49Å; E768-N791 PolarHBondContact OE1-ND2 2.57Å; E768-N791 PolarHBondContact OE1-OD1 2.97Å; E768-L794 HydrophobicContact CG-CD1 3.88Å; E768-P802 HydrophobicContact CB-CB 4.2Å; E768-P802 HydrophobicContact CB-CG 3.79Å; E768-P802 HydrophobicContact CG-CG 4.36Å
769	T	82.9	Confident	84	Confident	36 Å²	36	64.2 Å²	64.2	22%	0.221	31%	0.312	C	S	.	.	H	α-helix	trans	-68.9	-33.6	173.5	53.6	0	0	0	0	112.8	Y765 R766 E767 K773	Y765-T769 HydrophobicContact CD1-CG2 4.43Å; Y765-T769 HydrophobicContact CD2-CG2 3.86Å; Y765-T769 HydrophobicContact CE1-CG2 4.03Å; Y765-T769 HydrophobicContact CE2-CG2 3.35Å; Y765-T769 HydrophobicContact CG-CG2 4.35Å; Y765-T769 VanDerWaalsContact CZ-CG2 3.46Å; Y765-T769 WeakPolarHBondContact O-CB 3.23Å; Y765-T769 VanDerWaalsContact O-CG2 3.27Å; Y765-T769 WeakPolarHBondContact O-CG2 3.3Å; Y765-T769 PolarHBondContact O-N 2.87Å; Y765-T769 PolarHBondContact O-OG1 2.98Å; R766-T769 PolarHBondContact O-OG1 2.87Å; E767-T769 PolarHBondContact O-N 2.65Å; T769-K773 VanDerWaalsContact O-CG 3.27Å; T769-K773 WeakPolarHBondContact O-CG 3.37Å; T769-K773 PolarHBondContact O-N 3.49Å
770	A	85.3	Confident	83.5	Confident	42 Å²	42	72.7 Å²	72.7	35%	0.347	34%	0.342	S	S	.	.	H	α-helix	trans	-65.7	-51.3	172.5	0	0	0	0	0	110.8	R766 E767 M772 K773 E774	R766-A770 WeakPolarHBondContact O-CB 3.4Å; R766-A770 PolarHBondContact O-N 3.04Å; E767-A770 PolarHBondContact O-N 3.05Å; A770-M772 VanDerWaalsContact C-N 3.32Å; A770-M772 PolarHBondContact O-N 2.76Å; A770-K773 WeakPolarHBondContact O-CB 2.85Å; A770-K773 PolarHBondContact O-N 2.91Å; A770-E774 WeakPolarHBondContact O-CG 3.38Å; A770-E774 PolarHBondContact O-N 2.81Å
771	K	83.1	Confident	82.9	Confident	69 Å²	69	71 Å²	71	30%	0.3	35%	0.35	S	S	.	.	H	α-helix	trans	-58.2	-42.4	175.8	-69.5	176.2	-164.5	162.8	0	112.1	E767 E768 K773 E774 H775 N791	E767-K771 WeakPolarHBondContact O-CG 3.22Å; E767-K771 PolarHBondContact O-N 3.49Å; E768-K771 WeakPolarHBondContact OE1-CD 3.34Å; E768-K771 IonicContact OE1-NZ 3.71Å; E768-K771 PolarHBondContact OE1-NZ 3.23Å; K771-K773 VanDerWaalsContact C-N 3.33Å; K771-K773 PolarHBondContact O-N 3.43Å; K771-E774 PolarHBondContact O-N 3.39Å; K771-H775 WeakPolarHBondContact O-CB 3.46Å; K771-H775 PolarHBondContact O-N 3.12Å; K771-N791 PolarHBondContact NZ-OD1 3.05Å
772	M	78.9	Confident	82.1	Confident	62 Å²	62	73.9 Å²	73.9	31%	0.305	37%	0.374	S	S	.	.	H	α-helix	trans	-60.1	-39.5	174.4	-87.3	-96.3	-143.3	0	0	112.5	E768 A770 R776 L788	E768-M772 WeakPolarHBondContact O-CB 3.41Å; E768-M772 VanDerWaalsContact O-CG 3.29Å; E768-M772 WeakPolarHBondContact O-CG 3.3Å; E768-M772 PolarHBondContact O-N 3.1Å; A770-M772 VanDerWaalsContact C-N 3.32Å; A770-M772 PolarHBondContact O-N 2.76Å; M772-R776 WeakPolarHBondContact O-CB 3.4Å; M772-R776 WeakPolarHBondContact O-CG 3.4Å; M772-R776 PolarHBondContact O-N 3.08Å; M772-L788 HydrophobicContact SD-CD1 4.28Å
773	K	81.9	Confident	81.2	Confident	144 Å²	144	77.1 Å²	77.1	63%	0.626	41%	0.408	S	S	*	.	H	α-helix	trans	-70	-45.6	177.9	-76.7	169.8	-176.2	170.8	0	111.8	T769 A770 K771 H775 R776 A777	T769-K773 VanDerWaalsContact O-CG 3.27Å; T769-K773 WeakPolarHBondContact O-CG 3.37Å; T769-K773 PolarHBondContact O-N 3.49Å; A770-K773 WeakPolarHBondContact O-CB 2.85Å; A770-K773 PolarHBondContact O-N 2.91Å; K771-K773 VanDerWaalsContact C-N 3.33Å; K771-K773 PolarHBondContact O-N 3.43Å; K773-H775 VanDerWaalsContact C-N 3.31Å; K773-H775 PolarHBondContact O-N 3.21Å; K773-R776 PolarHBondContact O-N 2.85Å; K773-A777 WeakPolarHBondContact O-CB 3.19Å; K773-A777 PolarHBondContact O-N 3.49Å
774	E	83.1	Confident	80.4	Confident	127 Å²	127	81.2 Å²	81.2	59%	0.593	42%	0.424	S	S	*	.	H	α-helix	trans	-59.7	-46.2	175.3	-70.9	177.4	179.7	0	0	110.6	A770 K771 R776 A777 I778	A770-E774 WeakPolarHBondContact O-CG 3.38Å; A770-E774 PolarHBondContact O-N 2.81Å; K771-E774 PolarHBondContact O-N 3.39Å; E774-R776 PolarHBondContact O-N 2.86Å; E774-A777 WeakPolarHBondContact O-CB 3.3Å; E774-A777 PolarHBondContact O-N 2.88Å; E774-A777 VanDerWaalsContact O-N 3.13Å; E774-I778 VanDerWaalsContact O-CG1 3.27Å; E774-I778 WeakPolarHBondContact O-CG1 3.39Å; E774-I778 PolarHBondContact O-N 2.88Å
775	H	77	Confident	79.2	Confident	34 Å²	34	89.3 Å²	89.3	16%	0.157	46%	0.461	C	S	.	.	H	α-helix	trans	-61.5	-43.8	176.4	-179.2	68.1	0	0	0	112.9	K771 K773 A777 I778 C779 V786 L788	K771-H775 WeakPolarHBondContact O-CB 3.46Å; K771-H775 PolarHBondContact O-N 3.12Å; K773-H775 VanDerWaalsContact C-N 3.31Å; K773-H775 PolarHBondContact O-N 3.21Å; H775-A777 VanDerWaalsContact C-N 3.3Å; H775-A777 PolarHBondContact O-N 3.01Å; H775-I778 PolarHBondContact O-N 2.81Å; H775-C779 PolarHBondContact CE1-SG 2.67Å; H775-C779 PolarHBondContact NE2-SG 2.72Å; H775-C779 WeakPolarHBondContact O-CB 3.37Å; H775-C779 PolarHBondContact O-N 3.4Å; H775-C779 PolarHBondContact O-SG 2.84Å; H775-V786 PolarHBondContact CE1-O 2.85Å; H775-V786 PolarHBondContact NE2-O 3.02Å; H775-L788 HydrophobicContact CB-CD1 4.49Å; H775-L788 HydrophobicContact CB-CD2 3.43Å; H775-L788 VanDerWaalsContact CB-CD2 3.43Å; H775-L788 HydrophobicContact CB-CG 4.15Å; H775-L788 VanDerWaalsContact CD2-CD1 3.45Å; H775-L788 WeakPolarHBondContact CD2-CD1 3.43Å; H775-L788 VanDerWaalsContact CD2-CG 3.46Å; H775-L788 WeakPolarHBondContact CD2-CG 3.32Å; H775-L788 VanDerWaalsContact CG-CG 3.48Å
776	R	78	Confident	78	Confident	151 Å²	151	91.1 Å²	91.1	57%	0.57	48%	0.476	S	S	*	.	H	α-helix	trans	-61.9	-37.8	173.7	-78.7	175	-176.2	-177.7	3.2	111.8	M772 K773 E774 R780	M772-R776 WeakPolarHBondContact O-CB 3.4Å; M772-R776 WeakPolarHBondContact O-CG 3.4Å; M772-R776 PolarHBondContact O-N 3.08Å; K773-R776 PolarHBondContact O-N 2.85Å; E774-R776 PolarHBondContact O-N 2.86Å; R776-R780 WeakPolarHBondContact O-CB 3.2Å; R776-R780 VanDerWaalsContact O-CG 3.25Å; R776-R780 WeakPolarHBondContact O-CG 3.31Å; R776-R780 PolarHBondContact O-N 2.69Å
777	A	81.2	Confident	76.8	Confident	61 Å²	61	93 Å²	93	50%	0.504	50%	0.498	S	S	.	.	H	α-helix	trans	-66.6	-42.8	176	0	0	0	0	0	111.4	K773 E774 H775 R780 A781	K773-A777 WeakPolarHBondContact O-CB 3.19Å; K773-A777 PolarHBondContact O-N 3.49Å; E774-A777 WeakPolarHBondContact O-CB 3.3Å; E774-A777 PolarHBondContact O-N 2.88Å; E774-A777 VanDerWaalsContact O-N 3.13Å; H775-A777 VanDerWaalsContact C-N 3.3Å; H775-A777 PolarHBondContact O-N 3.01Å; A777-R780 PolarHBondContact O-N 3.42Å; A777-A781 WeakPolarHBondContact O-CB 3.27Å; A777-A781 PolarHBondContact O-N 2.92Å
778	I	79.6	Confident	75.7	Confident	97 Å²	97	91.2 Å²	91.2	50%	0.497	49%	0.492	S	S	.	.	H	α-helix	trans	-65.1	-44.4	176.6	-67	163.2	0	0	0	110.9	E774 H775 R780 A781 A782	E774-I778 VanDerWaalsContact O-CG1 3.27Å; E774-I778 WeakPolarHBondContact O-CG1 3.39Å; E774-I778 PolarHBondContact O-N 2.88Å; H775-I778 PolarHBondContact O-N 2.81Å; I778-R780 VanDerWaalsContact C-N 3.34Å; I778-R780 PolarHBondContact O-N 2.88Å; I778-A781 PolarHBondContact O-N 3.09Å; I778-A782 VanDerWaalsContact O-CB 3.23Å; I778-A782 WeakPolarHBondContact O-CB 3.2Å; I778-A782 PolarHBondContact O-N 3.08Å
779	C	72.4	Confident	74.9	Confident	24 Å²	24	95.5 Å²	95.5	16%	0.162	52%	0.521	C	S	.	.	H	α-helix	trans	-64.9	-38	176.9	-70.2	0	0	0	0	112.2	H775 A781 A782 G783	H775-C779 PolarHBondContact CE1-SG 2.67Å; H775-C779 PolarHBondContact NE2-SG 2.72Å; H775-C779 WeakPolarHBondContact O-CB 3.37Å; H775-C779 PolarHBondContact O-N 3.4Å; H775-C779 PolarHBondContact O-SG 2.84Å; C779-A781 VanDerWaalsContact C-N 3.34Å; C779-A782 PolarHBondContact O-N 3.31Å; C779-G783 WeakPolarHBondContact O-CA 3.43Å; C779-G783 PolarHBondContact O-N 3.41Å
780	R	77.5	Confident	74.1	Confident	215 Å²	215	96.7 Å²	96.7	81%	0.811	53%	0.528	S	S	*	.	H	α-helix	trans	-65.4	-37.4	173	-77.6	177.5	-175.4	176.9	1.2	112.2	R776 A777 I778	R776-R780 WeakPolarHBondContact O-CB 3.2Å; R776-R780 VanDerWaalsContact O-CG 3.25Å; R776-R780 WeakPolarHBondContact O-CG 3.31Å; R776-R780 PolarHBondContact O-N 2.69Å; A777-R780 PolarHBondContact O-N 3.42Å; I778-R780 VanDerWaalsContact C-N 3.34Å; I778-R780 PolarHBondContact O-N 2.88Å
781	A	78.8	Confident	73.7	Confident	92 Å²	92	95.9 Å²	95.9	76%	0.76	52%	0.518	S	S	*	.	H	α-helix	trans	-73.5	-33.8	177.2	0	0	0	0	0	112.8	A777 I778 C779	A777-A781 WeakPolarHBondContact O-CB 3.27Å; A777-A781 PolarHBondContact O-N 2.92Å; I778-A781 PolarHBondContact O-N 3.09Å; C779-A781 VanDerWaalsContact C-N 3.34Å
782	A	72.2	Confident	73.4	Confident	62 Å²	62	97.5 Å²	97.5	51%	0.512	54%	0.535	S	S	.	.	H	α-helix	trans	-95.8	-14.3	-174.6	0	0	0	0	0	114.5	I778 C779 K784	I778-A782 VanDerWaalsContact O-CB 3.23Å; I778-A782 WeakPolarHBondContact O-CB 3.2Å; I778-A782 PolarHBondContact O-N 3.08Å; C779-A782 PolarHBondContact O-N 3.31Å; A782-K784 PolarHBondContact O-N 3.43Å; A782-K784 VanDerWaalsContact O-N 3.13Å
783	G	71.7	Confident	73.3	Confident	69 Å²	69	98.6 Å²	98.6	71%	0.711	54%	0.541	S	S	*	.	S	Bend	trans	63.1	14.1	-178.6	0	0	0	0	0	115	C779	C779-G783 WeakPolarHBondContact O-CA 3.43Å; C779-G783 PolarHBondContact O-N 3.41Å
784	K	72.5	Confident	73.2	Confident	168 Å²	168	91.8 Å²	91.8	73%	0.73	51%	0.512	S	S	*	.	S	Bend	trans	-137.9	143.8	178.7	-71.8	-177.5	179.3	178.5	0	109.9	A782	A782-K784 PolarHBondContact O-N 3.43Å; A782-K784 VanDerWaalsContact O-N 3.13Å
785	E	61.3	Low	72.8	Confident	189 Å²	189	91.2 Å²	91.2	88%	0.883	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-75.3	124.2	173.4	-67.2	-174.8	166.9	0	0	110.1
786	V	64.4	Low	72.8	Confident	73 Å²	73	93.7 Å²	93.7	44%	0.442	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-99.5	143.9	173.2	-176.9	0	0	0	0	107.6	H775 L788	H775-V786 PolarHBondContact CE1-O 2.85Å; H775-V786 PolarHBondContact NE2-O 3.02Å; V786-L788 PolarHBondContact O-N 3.14Å
787	P	61.7	Low	72.6	Confident	118 Å²	118	90.7 Å²	90.7	77%	0.766	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-68.8	130.7	175.7	23.5	-31	0	0	0	111.6
788	L	64.7	Low	72.2	Confident	68 Å²	68	90.7 Å²	90.7	36%	0.356	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-79.2	130.1	175	-87.2	161.3	0	0	0	110.9	M772 H775 V786 V790	M772-L788 HydrophobicContact SD-CD1 4.28Å; H775-L788 HydrophobicContact CB-CD1 4.49Å; H775-L788 HydrophobicContact CB-CD2 3.43Å; H775-L788 VanDerWaalsContact CB-CD2 3.43Å; H775-L788 HydrophobicContact CB-CG 4.15Å; H775-L788 VanDerWaalsContact CD2-CD1 3.45Å; H775-L788 WeakPolarHBondContact CD2-CD1 3.43Å; H775-L788 VanDerWaalsContact CD2-CG 3.46Å; H775-L788 WeakPolarHBondContact CD2-CG 3.32Å; H775-L788 VanDerWaalsContact CG-CG 3.48Å; V786-L788 PolarHBondContact O-N 3.14Å; L788-V790 PolarHBondContact O-N 3.23Å
789	P	64.1	Low	71.6	Confident	105 Å²	105	91.1 Å²	91.1	68%	0.682	54%	0.539	S	S	*	.			trans	-71.3	110.4	164.5	27.7	-28.9	0	0	0	108.9
790	V	67.1	Low	71.8	Confident	60 Å²	60	92.3 Å²	92.3	36%	0.364	54%	0.543	S	S	.	.			trans	-80.6	138.7	177.5	-173.6	0	0	0	0	109.1	L788 L794 M795	L788-V790 PolarHBondContact O-N 3.23Å; V790-L794 HydrophobicContact CG1-CB 4.1Å; V790-M795 HydrophobicContact CB-CE 4.46Å
791	N	75.9	Confident	71.8	Confident	25 Å²	25	87.6 Å²	87.6	13%	0.134	53%	0.533	C	S	.	.			trans	-56.9	136.5	175.3	-89	-11.7	0	0	0	111.6	L764 E768 K771 I793 L794 M795	L764-N791 HydrophobicContact CD1-CB 4.35Å; L764-N791 WeakPolarHBondContact CD1-ND2 3.47Å; E768-N791 WeakPolarHBondContact CG-ND2 3.49Å; E768-N791 PolarHBondContact OE1-ND2 2.57Å; E768-N791 PolarHBondContact OE1-OD1 2.97Å; K771-N791 PolarHBondContact NZ-OD1 3.05Å; N791-I793 PolarHBondContact O-N 3.37Å; N791-I793 VanDerWaalsContact O-N 3.16Å; N791-L794 HydrophobicContact CB-CD1 4.41Å; N791-L794 HydrophobicContact CB-CG 4.47Å; N791-L794 PolarHBondContact O-N 2.7Å; N791-L794 VanDerWaalsContact O-N 3.12Å; N791-M795 PolarHBondContact O-N 2.72Å; N791-M795 VanDerWaalsContact O-N 3.13Å
792	P	77.9	Confident	72	Confident	104 Å²	104	84 Å²	84	68%	0.675	50%	0.502	S	S	*	.	H	α-helix	trans	-56.8	-32.7	-178.6	-27.5	34.8	0	0	0	114.4	M795 A796	P792-M795 PolarHBondContact O-N 2.86Å; P792-A796 WeakPolarHBondContact O-CB 3.27Å; P792-A796 PolarHBondContact O-N 3.19Å
793	I	77.1	Confident	72.4	Confident	84 Å²	84	82.3 Å²	82.3	43%	0.431	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-47.3	178	-61.9	171	0	0	0	110.4	L764 N791 M795 A796 H797 Y805	L764-I793 HydrophobicContact CD1-CD1 4.36Å; L764-I793 HydrophobicContact CD2-CG2 4.28Å; N791-I793 PolarHBondContact O-N 3.37Å; N791-I793 VanDerWaalsContact O-N 3.16Å; I793-M795 VanDerWaalsContact C-N 3.28Å; I793-M795 PolarHBondContact O-N 2.88Å; I793-A796 PolarHBondContact O-N 3.19Å; I793-H797 PolarHBondContact O-CD2 2.84Å; I793-H797 PolarHBondContact O-N 3.16Å; I793-Y805 HydrophobicContact CG2-CE2 4.38Å
794	L	78.4	Confident	73	Confident	2 Å²	2	80.8 Å²	80.8	1%	0.01	47%	0.467	C	S	.	.	H	α-helix	trans	-66.9	-33.1	178.2	-64.6	176.8	0	0	0	111.9	L764 E768 V790 N791 H797 G798 N799 P802 Y805	L764-L794 HydrophobicContact CD2-CD2 3.97Å; L764-L794 HydrophobicContact CD2-CG 4.14Å; E768-L794 HydrophobicContact CG-CD1 3.88Å; V790-L794 HydrophobicContact CG1-CB 4.1Å; N791-L794 HydrophobicContact CB-CD1 4.41Å; N791-L794 HydrophobicContact CB-CG 4.47Å; N791-L794 PolarHBondContact O-N 2.7Å; N791-L794 VanDerWaalsContact O-N 3.12Å; L794-H797 PolarHBondContact O-N 3.44Å; L794-G798 PolarHBondContact O-N 3.09Å; L794-N799 WeakPolarHBondContact O-CA 3.43Å; L794-N799 PolarHBondContact O-N 3.34Å; L794-P802 HydrophobicContact CD1-CB 4.45Å; L794-P802 HydrophobicContact CD1-CG 3.88Å; L794-Y805 HydrophobicContact CD2-CD1 4.47Å; L794-Y805 HydrophobicContact CD2-CD2 4.46Å; L794-Y805 HydrophobicContact CD2-CG 4.04Å
795	M	76.5	Confident	73.6	Confident	114 Å²	114	74.8 Å²	74.8	56%	0.562	44%	0.44	S	S	*	.	H	α-helix	trans	-66.9	-41.4	174.6	-170.6	177	-71.8	0	0	111.8	V790 N791 P792 I793 H797 G798	V790-M795 HydrophobicContact CB-CE 4.46Å; N791-M795 PolarHBondContact O-N 2.72Å; N791-M795 VanDerWaalsContact O-N 3.13Å; P792-M795 PolarHBondContact O-N 2.86Å; I793-M795 VanDerWaalsContact C-N 3.28Å; I793-M795 PolarHBondContact O-N 2.88Å; M795-H797 VanDerWaalsContact C-N 3.29Å; M795-H797 PolarHBondContact O-N 3.36Å; M795-G798 PolarHBondContact O-N 3.5Å
796	A	76.4	Confident	74.8	Confident	87 Å²	87	65.8 Å²	65.8	72%	0.719	40%	0.398	S	S	*	.	H	α-helix	trans	-62.7	-34.7	177.1	0	0	0	0	0	112.7	P792 I793 G798	P792-A796 WeakPolarHBondContact O-CB 3.27Å; P792-A796 PolarHBondContact O-N 3.19Å; I793-A796 PolarHBondContact O-N 3.19Å; A796-G798 PolarHBondContact O-N 3.12Å
797	H	73.1	Confident	75.9	Confident	88 Å²	88	63.1 Å²	63.1	41%	0.407	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	2.4	174.6	-79.2	-89.1	0	0	0	114.1	I793 L794 M795 I800 Y805	I793-H797 PolarHBondContact O-CD2 2.84Å; I793-H797 PolarHBondContact O-N 3.16Å; L794-H797 PolarHBondContact O-N 3.44Å; M795-H797 VanDerWaalsContact C-N 3.29Å; M795-H797 PolarHBondContact O-N 3.36Å; H797-I800 HydrophobicContact CB-CD1 3.9Å; H797-I800 HydrophobicContact CB-CG1 4.32Å; H797-I800 VanDerWaalsContact O-CD1 3.3Å; H797-I800 WeakPolarHBondContact O-CD1 3.18Å; H797-I800 WeakPolarHBondContact O-CG1 3.44Å; H797-Y805 AromaticContact CD2-CE2 3.81Å; H797-Y805 AromaticContact NE2-CE2 3.78Å
798	G	74.1	Confident	77.1	Confident	60 Å²	60	61.8 Å²	61.8	62%	0.619	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	33.5	176.3	0	0	0	0	0	115.1	L794 M795 A796	L794-G798 PolarHBondContact O-N 3.09Å; M795-G798 PolarHBondContact O-N 3.5Å; A796-G798 PolarHBondContact O-N 3.12Å
799	N	66.3	Low	78.1	Confident	107 Å²	107	59.4 Å²	59.4	57%	0.572	35%	0.353	S	S	*	.	S	Bend	trans	59.8	43.5	-179.1	-69.5	-20.7	0	0	0	113.5	L794	L794-N799 WeakPolarHBondContact O-CA 3.43Å; L794-N799 PolarHBondContact O-N 3.34Å
800	I	76.3	Confident	79.2	Confident	49 Å²	49	54.5 Å²	54.5	25%	0.251	32%	0.321	S	S	.	.			trans	-68.5	144.8	174.2	-56.8	-179.9	0	0	0	109.6	H797 A804 E808	H797-I800 HydrophobicContact CB-CD1 3.9Å; H797-I800 HydrophobicContact CB-CG1 4.32Å; H797-I800 VanDerWaalsContact O-CD1 3.3Å; H797-I800 WeakPolarHBondContact O-CD1 3.18Å; H797-I800 WeakPolarHBondContact O-CG1 3.44Å; I800-A804 HydrophobicContact CG2-CB 3.47Å; I800-A804 VanDerWaalsContact CG2-CB 3.47Å; I800-E808 WeakPolarHBondContact CD1-OE2 3.34Å
801	L	77.5	Confident	80.2	Confident	115 Å²	115	56.9 Å²	56.9	60%	0.602	33%	0.327	S	S	*	.			trans	-58.1	138.6	171.7	-80.3	146	0	0	0	110.2	S803 A804 Y805	L801-S803 PolarHBondContact O-N 3.02Å; L801-S803 VanDerWaalsContact O-N 3.09Å; L801-A804 HydrophobicContact CB-CB 4.17Å; L801-A804 WeakPolarHBondContact O-CA 3.21Å; L801-A804 PolarHBondContact O-N 3.48Å; L801-Y805 PolarHBondContact O-N 3.49Å
802	P	82.3	Confident	80.6	Confident	18 Å²	18	58 Å²	58	12%	0.117	34%	0.344	C	S	.	.	H	α-helix	trans	-53.3	-35.7	-180	-27.6	33.2	0	0	0	114	Y765 E768 L794 V806	Y765-P802 HydrophobicContact CD2-CB 3.95Å; E768-P802 HydrophobicContact CB-CB 4.2Å; E768-P802 HydrophobicContact CB-CG 3.79Å; E768-P802 HydrophobicContact CG-CG 4.36Å; L794-P802 HydrophobicContact CD1-CB 4.45Å; L794-P802 HydrophobicContact CD1-CG 3.88Å; P802-V806 PolarHBondContact O-N 2.89Å
803	S	82.2	Confident	81	Confident	26 Å²	26	53.6 Å²	53.6	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-69	-40.6	175.5	57.1	0	0	0	0	112.1	L801 Y805 V806 L807 F840	L801-S803 PolarHBondContact O-N 3.02Å; L801-S803 VanDerWaalsContact O-N 3.09Å; S803-Y805 VanDerWaalsContact C-N 3.31Å; S803-Y805 PolarHBondContact O-N 3.47Å; S803-V806 PolarHBondContact O-N 2.77Å; S803-L807 PolarHBondContact O-N 2.93Å; S803-L807 VanDerWaalsContact O-N 3.12Å; S803-F840 WeakPolarHBondContact O-CE1 3.46Å; S803-F840 WeakPolarHBondContact O-CZ 3.38Å
804	A	83.3	Confident	81.2	Confident	37 Å²	37	53.8 Å²	53.8	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-66.9	-32	176.5	0	0	0	0	0	112.6	I800 L801 L807 E808	I800-A804 HydrophobicContact CG2-CB 3.47Å; I800-A804 VanDerWaalsContact CG2-CB 3.47Å; L801-A804 HydrophobicContact CB-CB 4.17Å; L801-A804 WeakPolarHBondContact O-CA 3.21Å; L801-A804 PolarHBondContact O-N 3.48Å; A804-L807 PolarHBondContact O-N 3.35Å; A804-E808 PolarHBondContact O-N 2.81Å
805	Y	85.7	Confident	81.3	Confident	42 Å²	42	55.6 Å²	55.6	17%	0.165	33%	0.326	C	S	.	.	H	α-helix	trans	-61.7	-44.3	171.7	-179.4	-106.2	0	0	0	111.7	A761 L764 I793 L794 H797 L801 S803 L807 E808 T809	A761-Y805 HydrophobicContact CB-CD1 4.17Å; A761-Y805 HydrophobicContact CB-CE1 3.92Å; L764-Y805 HydrophobicContact CD2-CD1 3.76Å; L764-Y805 HydrophobicContact CD2-CE1 3.68Å; I793-Y805 HydrophobicContact CG2-CE2 4.38Å; L794-Y805 HydrophobicContact CD2-CD1 4.47Å; L794-Y805 HydrophobicContact CD2-CD2 4.46Å; L794-Y805 HydrophobicContact CD2-CG 4.04Å; H797-Y805 AromaticContact CD2-CE2 3.81Å; H797-Y805 AromaticContact NE2-CE2 3.78Å; L801-Y805 PolarHBondContact O-N 3.49Å; S803-Y805 VanDerWaalsContact C-N 3.31Å; S803-Y805 PolarHBondContact O-N 3.47Å; Y805-L807 VanDerWaalsContact C-N 3.31Å; Y805-L807 PolarHBondContact O-N 3.1Å; Y805-E808 WeakPolarHBondContact O-CB 3.28Å; Y805-E808 PolarHBondContact O-N 2.68Å; Y805-E808 VanDerWaalsContact O-N 3.16Å; Y805-T809 HydrophobicContact CD1-CG2 4.4Å; Y805-T809 HydrophobicContact CE1-CG2 4.04Å; Y805-T809 WeakPolarHBondContact O-CG2 3.15Å; Y805-T809 PolarHBondContact O-N 3.42Å
806	V	86.7	Confident	81.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.1	-44.5	174.2	177.1	0	0	0	0	110.6	A761 P802 S803 E808 T809 F810 L836 F840	A761-V806 HydrophobicContact CB-CG2 4.19Å; A761-V806 WeakPolarHBondContact O-CG2 3.17Å; P802-V806 PolarHBondContact O-N 2.89Å; S803-V806 PolarHBondContact O-N 2.77Å; V806-E808 VanDerWaalsContact C-N 3.32Å; V806-E808 PolarHBondContact O-N 3.1Å; V806-T809 PolarHBondContact O-N 2.9Å; V806-T809 VanDerWaalsContact O-N 3.16Å; V806-T809 PolarHBondContact O-OG1 2.85Å; V806-F810 HydrophobicContact CG1-CD2 3.78Å; V806-F810 HydrophobicContact CG1-CE2 3.68Å; V806-F810 VanDerWaalsContact O-CD2 3.32Å; V806-F810 WeakPolarHBondContact O-CD2 3.24Å; V806-F810 PolarHBondContact O-N 2.9Å; V806-L836 HydrophobicContact CB-CD1 4.44Å; V806-L836 HydrophobicContact CG1-CD1 4.06Å; V806-L836 HydrophobicContact CG2-CD1 4.33Å; V806-F840 HydrophobicContact CB-CZ 4.4Å
807	L	86.5	Confident	81.5	Confident	16 Å²	16	47.3 Å²	47.3	8%	0.084	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-40.4	176.5	-177.1	65.8	0	0	0	112.4	S803 A804 Y805 T809 F810 K811 F840 L850	S803-L807 PolarHBondContact O-N 2.93Å; S803-L807 VanDerWaalsContact O-N 3.12Å; A804-L807 PolarHBondContact O-N 3.35Å; Y805-L807 VanDerWaalsContact C-N 3.31Å; Y805-L807 PolarHBondContact O-N 3.1Å; L807-T809 VanDerWaalsContact C-N 3.34Å; L807-F810 PolarHBondContact O-N 2.92Å; L807-K811 WeakPolarHBondContact O-CG 3.47Å; L807-K811 PolarHBondContact O-N 3.35Å; L807-F840 HydrophobicContact CB-CD1 4.46Å; L807-F840 HydrophobicContact CB-CE1 4.08Å; L807-F840 HydrophobicContact CB-CE2 4.22Å; L807-F840 HydrophobicContact CB-CZ 3.98Å; L807-F840 HydrophobicContact CD1-CD2 4.17Å; L807-F840 HydrophobicContact CD1-CE2 4.48Å; L807-F840 HydrophobicContact CD1-CG 4.38Å; L807-L850 HydrophobicContact CD1-CD2 4.13Å
808	E	86.4	Confident	82	Confident	90 Å²	90	43.2 Å²	43.2	42%	0.421	25%	0.254	S	S	.	.	H	α-helix	trans	-63.9	-39	175.7	-167.8	174.2	-172.9	0	0	111.8	I800 A804 Y805 V806 F810 K811 G812	I800-E808 WeakPolarHBondContact CD1-OE2 3.34Å; A804-E808 PolarHBondContact O-N 2.81Å; Y805-E808 WeakPolarHBondContact O-CB 3.28Å; Y805-E808 PolarHBondContact O-N 2.68Å; Y805-E808 VanDerWaalsContact O-N 3.16Å; V806-E808 VanDerWaalsContact C-N 3.32Å; V806-E808 PolarHBondContact O-N 3.1Å; E808-F810 PolarHBondContact O-N 2.98Å; E808-K811 PolarHBondContact O-N 3.42Å; E808-G812 PolarHBondContact O-N 3.43Å
809	T	86.8	Confident	82.4	Confident	19 Å²	19	41.7 Å²	41.7	12%	0.117	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-39.3	173.3	65	0	0	0	0	112.5	A761 Y805 V806 L807 K811 G812 V813	A761-T809 HydrophobicContact CB-CG2 3.75Å; Y805-T809 HydrophobicContact CD1-CG2 4.4Å; Y805-T809 HydrophobicContact CE1-CG2 4.04Å; Y805-T809 WeakPolarHBondContact O-CG2 3.15Å; Y805-T809 PolarHBondContact O-N 3.42Å; V806-T809 PolarHBondContact O-N 2.9Å; V806-T809 VanDerWaalsContact O-N 3.16Å; V806-T809 PolarHBondContact O-OG1 2.85Å; L807-T809 VanDerWaalsContact C-N 3.34Å; T809-K811 VanDerWaalsContact C-N 3.34Å; T809-K811 PolarHBondContact O-N 2.71Å; T809-G812 PolarHBondContact O-N 3.4Å; T809-V813 WeakPolarHBondContact O-CG2 3.48Å; T809-V813 PolarHBondContact O-N 2.88Å
810	F	87.8	Confident	83	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-63.7	-37.1	173.7	-87.6	-79.1	0	0	0	112.6	I758 V806 L807 E808 G812 V813 L818 L822 I833 F837	I758-F810 HydrophobicContact CD1-CD1 4.43Å; I758-F810 HydrophobicContact CD1-CE1 4.07Å; I758-F810 HydrophobicContact CD1-CZ 4.44Å; I758-F810 HydrophobicContact CG2-CE2 4.13Å; I758-F810 HydrophobicContact CG2-CZ 3.83Å; V806-F810 HydrophobicContact CG1-CD2 3.78Å; V806-F810 HydrophobicContact CG1-CE2 3.68Å; V806-F810 VanDerWaalsContact O-CD2 3.32Å; V806-F810 WeakPolarHBondContact O-CD2 3.24Å; V806-F810 PolarHBondContact O-N 2.9Å; L807-F810 PolarHBondContact O-N 2.92Å; E808-F810 PolarHBondContact O-N 2.98Å; F810-G812 VanDerWaalsContact C-N 3.35Å; F810-V813 PolarHBondContact O-N 2.72Å; F810-L818 HydrophobicContact CD1-CD1 4.04Å; F810-L818 HydrophobicContact CE1-CD1 4.5Å; F810-L822 HydrophobicContact CE1-CD2 3.93Å; F810-L822 HydrophobicContact CZ-CD2 4.4Å; F810-I833 HydrophobicContact CZ-CG2 4.42Å; F810-F837 HydrophobicContact CE1-CE1 4.49Å; F810-F837 HydrophobicContact CE1-CZ 4.21Å; F810-F837 HydrophobicContact CE2-CE1 4.21Å; F810-F837 HydrophobicContact CZ-CE1 4.17Å; F810-F837 HydrophobicContact CZ-CZ 4.15Å
811	K	86.8	Confident	83.4	Confident	111 Å²	111	34.9 Å²	34.9	48%	0.483	20%	0.195	S	C	.	.	H	α-helix	trans	-69.6	-32.1	173.8	-70.4	179.6	-178.2	-162.3	0	113.2	L807 E808 T809 V813 D846 L849	L807-K811 WeakPolarHBondContact O-CG 3.47Å; L807-K811 PolarHBondContact O-N 3.35Å; E808-K811 PolarHBondContact O-N 3.42Å; T809-K811 VanDerWaalsContact C-N 3.34Å; T809-K811 PolarHBondContact O-N 2.71Å; K811-V813 PolarHBondContact O-N 2.92Å; K811-D846 WeakPolarHBondContact CE-OD2 3.42Å; K811-D846 IonicContact NZ-OD1 2.62Å; K811-D846 IonicContact NZ-OD2 2.96Å; K811-D846 PolarHBondContact NZ-OD2 3.16Å; K811-L849 HydrophobicContact CG-CD2 4.43Å
812	G	84.7	Confident	83.8	Confident	49 Å²	49	29.4 Å²	29.4	51%	0.505	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-4.2	179.3	0	0	0	0	0	114.1	R757 E808 T809 F810	R757-G812 PolarHBondContact NH1-O 3.19Å; E808-G812 PolarHBondContact O-N 3.43Å; T809-G812 PolarHBondContact O-N 3.4Å; F810-G812 VanDerWaalsContact C-N 3.35Å
813	V	85.9	Confident	83.9	Confident	10 Å²	10	30.8 Å²	30.8	6%	0.061	17%	0.172	C	C	.	.	S	Bend	trans	-91.8	134.8	171.5	177.3	0	0	0	0	108.9	A754 I758 T809 F810 K811 E817 L818	A754-V813 HydrophobicContact CB-CG1 3.96Å; A754-V813 HydrophobicContact CB-CG2 3.94Å; I758-V813 HydrophobicContact CD1-CG2 4.2Å; I758-V813 HydrophobicContact CG1-CG2 4.44Å; T809-V813 WeakPolarHBondContact O-CG2 3.48Å; T809-V813 PolarHBondContact O-N 2.88Å; F810-V813 PolarHBondContact O-N 2.72Å; K811-V813 PolarHBondContact O-N 2.92Å; V813-E817 HydrophobicContact CG1-CB 4.49Å; V813-L818 HydrophobicContact CB-CD1 4.18Å; V813-L818 HydrophobicContact CG1-CB 4.22Å; V813-L818 HydrophobicContact CG1-CD1 3.99Å
814	K	81.4	Confident	84	Confident	88 Å²	88	31.5 Å²	31.5	38%	0.383	18%	0.175	S	C	.	.			trans	-64.6	139.6	178.3	-55.4	-170.2	-148.8	132.4	0	110	E750 S816 E817 L818	E750-K814 IonicContact OE2-NZ 3.78Å; E750-K814 PolarHBondContact OE2-NZ 2.68Å; K814-S816 PolarHBondContact O-N 3.15Å; K814-E817 HydrophobicContact CB-CB 4.49Å; K814-E817 HydrophobicContact CB-CG 4.44Å; K814-E817 WeakPolarHBondContact CD-OE1 3.48Å; K814-E817 IonicContact NZ-OE1 2.69Å; K814-E817 PolarHBondContact NZ-OE1 2.99Å; K814-E817 IonicContact NZ-OE2 3Å; K814-E817 PolarHBondContact O-N 3.3Å; K814-L818 PolarHBondContact O-N 3.33Å
815	S	80.1	Confident	84	Confident	40 Å²	40	30 Å²	30	28%	0.28	16%	0.162	S	C	.	.	H	α-helix	trans	-57.4	-34.5	-178.3	4.6	0	0	0	0	113.5	E139 E817 R852	E139-S815 WeakPolarHBondContact OE2-CB 3.24Å; E139-S815 PolarHBondContact OE2-OG 2.96Å; S815-E817 VanDerWaalsContact C-N 3.31Å; S815-E817 PolarHBondContact O-N 2.73Å; S815-R852 PolarHBondContact O-NH2 2.85Å
816	S	77.3	Confident	84.1	Confident	23 Å²	23	30.8 Å²	30.8	16%	0.161	17%	0.172	C	C	.	.	H	α-helix	trans	-66.2	-30.4	176.3	55.2	0	0	0	0	113.7	T102 E139 K814	T102-S816 WeakPolarHBondContact O-CB 3.32Å; T102-S816 PolarHBondContact O-OG 3.39Å; T102-S816 VanDerWaalsContact O-OG 3.14Å; E139-S816 WeakPolarHBondContact O-CA 3.34Å; K814-S816 PolarHBondContact O-N 3.15Å
817	E	80.1	Confident	84.1	Confident	5 Å²	5	33.3 Å²	33.3	2%	0.023	18%	0.184	C	C	.	.	H	α-helix	trans	-98.2	-14.5	-175.3	-67.9	162	-157.5	0	0	112.2	T751 V813 K814 S815 E819 E820 A821	T751-E817 HydrophobicContact CG2-CB 3.9Å; T751-E817 HydrophobicContact CG2-CG 3.99Å; V813-E817 HydrophobicContact CG1-CB 4.49Å; K814-E817 HydrophobicContact CB-CB 4.49Å; K814-E817 HydrophobicContact CB-CG 4.44Å; K814-E817 WeakPolarHBondContact CD-OE1 3.48Å; K814-E817 IonicContact NZ-OE1 2.69Å; K814-E817 PolarHBondContact NZ-OE1 2.99Å; K814-E817 IonicContact NZ-OE2 3Å; K814-E817 PolarHBondContact O-N 3.3Å; S815-E817 VanDerWaalsContact C-N 3.31Å; S815-E817 PolarHBondContact O-N 2.73Å; E817-E819 PolarHBondContact O-N 2.67Å; E817-E820 PolarHBondContact O-N 3.11Å; E817-A821 WeakPolarHBondContact O-CB 3.4Å; E817-A821 PolarHBondContact O-N 3.36Å
818	L	84.6	Confident	84.2	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-46.2	-169.9	-178.2	63.8	0	0	0	113.2	F810 V813 K814 A821 L822 L849 C853	F810-L818 HydrophobicContact CD1-CD1 4.04Å; F810-L818 HydrophobicContact CE1-CD1 4.5Å; V813-L818 HydrophobicContact CB-CD1 4.18Å; V813-L818 HydrophobicContact CG1-CB 4.22Å; V813-L818 HydrophobicContact CG1-CD1 3.99Å; K814-L818 PolarHBondContact O-N 3.33Å; L818-A821 PolarHBondContact O-N 2.95Å; L818-L822 WeakPolarHBondContact O-CB 3.21Å; L818-L822 VanDerWaalsContact O-CG 3.27Å; L818-L822 WeakPolarHBondContact O-CG 3.48Å; L818-L822 PolarHBondContact O-N 3.41Å; L818-L849 HydrophobicContact CD2-CD1 3.34Å; L818-L849 HydrophobicContact CD2-CG 4.37Å; L818-C853 WeakPolarHBondContact CD2-SG 3.45Å
819	E	81.6	Confident	84.3	Confident	28 Å²	28	33 Å²	33	13%	0.131	19%	0.188	C	C	.	.	H	α-helix	trans	-66.4	-39.6	178.5	-70.8	175.2	-165.8	0	0	111.2	F743 E817 L822 L823 R852 F856	F743-E819 HydrophobicContact CE1-CB 4.37Å; F743-E819 HydrophobicContact CE2-CB 4.18Å; F743-E819 WeakPolarHBondContact CE2-OE2 3.34Å; F743-E819 HydrophobicContact CZ-CB 3.49Å; F743-E819 VanDerWaalsContact CZ-CB 3.49Å; F743-E819 HydrophobicContact CZ-CG 4.41Å; F743-E819 WeakPolarHBondContact CZ-OE2 3.46Å; E817-E819 PolarHBondContact O-N 2.67Å; E819-L822 PolarHBondContact O-N 2.85Å; E819-L823 PolarHBondContact O-N 2.85Å; E819-L823 VanDerWaalsContact O-N 3.09Å; E819-R852 IonicContact OE1-CZ 2.72Å; E819-R852 IonicContact OE1-NE 3.78Å; E819-R852 PolarHBondContact OE1-NE 2.79Å; E819-R852 IonicContact OE1-NH2 2.8Å; E819-R852 PolarHBondContact OE1-NH2 2.92Å; E819-F856 HydrophobicContact CB-CD1 4.38Å; E819-F856 HydrophobicContact CB-CD2 4.12Å; E819-F856 HydrophobicContact CB-CE1 4.03Å; E819-F856 HydrophobicContact CB-CE2 3.77Å; E819-F856 HydrophobicContact CB-CG 4.39Å; E819-F856 HydrophobicContact CB-CZ 3.68Å; E819-F856 HydrophobicContact CG-CD1 4.47Å; E819-F856 HydrophobicContact CG-CD2 3.92Å; E819-F856 HydrophobicContact CG-CE2 4.09Å; E819-F856 HydrophobicContact CG-CG 4.11Å; E819-F856 HydrophobicContact CG-CZ 4.38Å; E819-F856 WeakPolarHBondContact O-CE1 3.34Å; E819-F856 WeakPolarHBondContact O-CZ 3.12Å
820	E	78.2	Confident	84.4	Confident	13 Å²	13	32 Å²	32	6%	0.061	18%	0.183	C	C	.	.	H	α-helix	trans	-66.6	-41.8	176.2	-67.3	177.3	172.7	0	0	112.1	F743 G745 K746 T751 E817 L822 L823 V824	F743-E820 HydrophobicContact CE1-CG 3.89Å; G745-E820 WeakPolarHBondContact CA-OE1 3.46Å; K746-E820 PolarHBondContact N-OE1 3.49Å; T751-E820 HydrophobicContact CG2-CB 3.75Å; T751-E820 WeakPolarHBondContact CG2-OE2 3.39Å; E817-E820 PolarHBondContact O-N 3.11Å; E820-L822 VanDerWaalsContact C-N 3.3Å; E820-L822 PolarHBondContact O-N 2.77Å; E820-L823 WeakPolarHBondContact O-CB 3.35Å; E820-L823 PolarHBondContact O-N 3.28Å; E820-L823 VanDerWaalsContact O-N 3.16Å; E820-V824 PolarHBondContact O-N 3.42Å
821	A	85.8	Confident	84.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-41.5	175.7	0	0	0	0	0	111.1	A754 A755 E817 L818 L823 V824	A754-A821 HydrophobicContact CB-CB 3.95Å; A755-A821 HydrophobicContact CB-CB 4.35Å; A755-A821 WeakPolarHBondContact CB-O 3.43Å; E817-A821 WeakPolarHBondContact O-CB 3.4Å; E817-A821 PolarHBondContact O-N 3.36Å; L818-A821 PolarHBondContact O-N 2.95Å; A821-L823 VanDerWaalsContact C-N 3.3Å; A821-L823 PolarHBondContact O-N 2.91Å; A821-V824 PolarHBondContact O-N 2.84Å
822	L	85.6	Confident	84.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-31.7	175.7	-73.9	175.7	0	0	0	113	F810 L818 E819 E820 V824 L825 C853 F856 L857	F810-L822 HydrophobicContact CE1-CD2 3.93Å; F810-L822 HydrophobicContact CZ-CD2 4.4Å; L818-L822 WeakPolarHBondContact O-CB 3.21Å; L818-L822 VanDerWaalsContact O-CG 3.27Å; L818-L822 WeakPolarHBondContact O-CG 3.48Å; L818-L822 PolarHBondContact O-N 3.41Å; E819-L822 PolarHBondContact O-N 2.85Å; E820-L822 VanDerWaalsContact C-N 3.3Å; E820-L822 PolarHBondContact O-N 2.77Å; L822-V824 VanDerWaalsContact C-N 3.3Å; L822-V824 PolarHBondContact O-N 2.82Å; L822-L825 HydrophobicContact CD2-CD1 3.59Å; L822-L825 WeakPolarHBondContact O-CB 3.31Å; L822-L825 PolarHBondContact O-N 3.36Å; L822-C853 HydrophobicContact CD1-CB 3.84Å; L822-F856 HydrophobicContact CB-CD1 3.78Å; L822-F856 HydrophobicContact CB-CE1 3.69Å; L822-F856 HydrophobicContact CD1-CD1 3.88Å; L822-L857 HydrophobicContact CB-CD2 4.39Å; L822-L857 HydrophobicContact CD1-CG 4.41Å; L822-L857 HydrophobicContact CD2-CD1 4.3Å; L822-L857 HydrophobicContact CD2-CD2 4.21Å; L822-L857 HydrophobicContact CD2-CG 4.36Å
823	L	84.3	Confident	84.6	Confident	47 Å²	47	27 Å²	27	25%	0.246	15%	0.151	C	C	.	.	H	α-helix	trans	-69	-28.1	176.4	179.7	65.7	0	0	0	112.7	V733 E819 E820 A821 L825 F856 I860	V733-L823 HydrophobicContact CG2-CD1 4.12Å; E819-L823 PolarHBondContact O-N 2.85Å; E819-L823 VanDerWaalsContact O-N 3.09Å; E820-L823 WeakPolarHBondContact O-CB 3.35Å; E820-L823 PolarHBondContact O-N 3.28Å; E820-L823 VanDerWaalsContact O-N 3.16Å; A821-L823 VanDerWaalsContact C-N 3.3Å; A821-L823 PolarHBondContact O-N 2.91Å; L823-L825 VanDerWaalsContact C-N 3.28Å; L823-F856 HydrophobicContact CB-CZ 4.48Å; L823-I860 HydrophobicContact CB-CD1 4.28Å; L823-I860 HydrophobicContact CD1-CD1 3.72Å; L823-I860 HydrophobicContact CD1-CG1 4.42Å; L823-I860 HydrophobicContact CD1-CG2 4.3Å
824	V	83.7	Confident	84.7	Confident	41 Å²	41	26.6 Å²	26.6	25%	0.248	15%	0.148	C	C	.	.	H	α-helix	trans	-76.1	-18.9	178.6	177.6	0	0	0	0	111.7	A755 E820 A821 L822	A755-V824 HydrophobicContact CB-CB 3.99Å; A755-V824 HydrophobicContact CB-CG1 4.05Å; E820-V824 PolarHBondContact O-N 3.42Å; A821-V824 PolarHBondContact O-N 2.84Å; L822-V824 VanDerWaalsContact C-N 3.3Å; L822-V824 PolarHBondContact O-N 2.82Å
825	L	84.8	Confident	85	Confident	5 Å²	5	26.9 Å²	26.9	3%	0.026	15%	0.149	C	C	.	.	S	Bend	trans	-67.4	132.3	-175.8	-66.9	175.4	0	0	0	112.8	A755 I758 M759 L822 L823 I833	A755-L825 HydrophobicContact CB-CD2 4.27Å; I758-L825 HydrophobicContact CG2-CD1 4.22Å; I758-L825 HydrophobicContact CG2-CD2 4.37Å; M759-L825 HydrophobicContact CG-CD2 3.49Å; M759-L825 VanDerWaalsContact CG-CD2 3.49Å; M759-L825 HydrophobicContact SD-CD2 4.15Å; L822-L825 HydrophobicContact CD2-CD1 3.59Å; L822-L825 WeakPolarHBondContact O-CB 3.31Å; L822-L825 PolarHBondContact O-N 3.36Å; L823-L825 VanDerWaalsContact C-N 3.28Å; L825-I833 HydrophobicContact CD1-CD1 3.84Å
826	P	87.1	Confident	85.3	Confident	59 Å²	59	25 Å²	25	38%	0.383	14%	0.136	S	C	.	.			trans	-64.8	146.5	169.4	-21.6	33	0	0	0	112.4	M759 S828 Y829	M759-P826 HydrophobicContact SD-CG 4.42Å; P826-S828 PolarHBondContact O-N 2.92Å; P826-Y829 HydrophobicContact CB-CD2 4.07Å; P826-Y829 HydrophobicContact CB-CE2 4.24Å; P826-Y829 HydrophobicContact CG-CD2 4.18Å; P826-Y829 HydrophobicContact CG-CE2 4.05Å; P826-Y829 PolarHBondContact O-N 3.27Å; P826-Y829 VanDerWaalsContact O-N 3.12Å
827	F	86.4	Confident	85.8	Confident	54 Å²	54	24 Å²	24	24%	0.237	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.9	179.6	-178.5	-106.7	0	0	0	113.9	Y829 V830 P831 H861 Q864 I865 L871	F827-Y829 PolarHBondContact O-N 2.73Å; F827-V830 HydrophobicContact CD2-CB 4.17Å; F827-V830 HydrophobicContact CD2-CG2 4.26Å; F827-V830 HydrophobicContact CE2-CB 4.46Å; F827-V830 PolarHBondContact O-N 3.32Å; F827-P831 WeakPolarHBondContact O-CD 3.47Å; F827-H861 HydrophobicContact CD2-CB 4.12Å; F827-H861 AromaticContact CD2-CG 3.9Å; F827-H861 AromaticContact CD2-ND1 3.61Å; F827-H861 HydrophobicContact CE2-CB 4.13Å; F827-Q864 HydrophobicContact CD2-CB 3.95Å; F827-Q864 HydrophobicContact CE1-CB 4.32Å; F827-Q864 HydrophobicContact CE2-CB 3.6Å; F827-Q864 HydrophobicContact CG-CB 4.44Å; F827-Q864 VanDerWaalsContact CG-OE1 3.23Å; F827-Q864 HydrophobicContact CZ-CB 3.8Å; F827-I865 HydrophobicContact CE2-CG1 4.1Å; F827-L871 HydrophobicContact CZ-CD1 4.24Å
828	S	88.8	Confident	86.1	Confident	69 Å²	69	24.7 Å²	24.7	48%	0.483	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.8	177.6	54.9	0	0	0	0	113.6	R766 P826	R766-S828 PolarHBondContact NH2-O 2.82Å; P826-S828 PolarHBondContact O-N 2.92Å
829	Y	89.3	Confident	86.2	Confident	29 Å²	29	28.6 Å²	28.6	11%	0.114	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-24.3	179.9	-61.6	-87.5	0	0	0	112.9	M759 I762 E763 P826 F827 D832 I833	M759-Y829 HydrophobicContact CB-CE1 4.46Å; M759-Y829 HydrophobicContact CG-CD2 4.43Å; M759-Y829 HydrophobicContact CG-CE2 4.25Å; M759-Y829 HydrophobicContact SD-CE2 4.04Å; I762-Y829 HydrophobicContact CB-CD1 4.24Å; I762-Y829 HydrophobicContact CD1-CD1 4.49Å; I762-Y829 HydrophobicContact CG2-CD1 3.85Å; E763-Y829 HydrophobicContact CG-CE1 3.94Å; E763-Y829 PolarHBondContact OE1-OH 3.48Å; P826-Y829 HydrophobicContact CB-CD2 4.07Å; P826-Y829 HydrophobicContact CB-CE2 4.24Å; P826-Y829 HydrophobicContact CG-CD2 4.18Å; P826-Y829 HydrophobicContact CG-CE2 4.05Å; P826-Y829 PolarHBondContact O-N 3.27Å; P826-Y829 VanDerWaalsContact O-N 3.12Å; F827-Y829 PolarHBondContact O-N 2.73Å; Y829-D832 PolarHBondContact O-N 2.97Å; Y829-D832 VanDerWaalsContact O-N 3.12Å; Y829-I833 WeakPolarHBondContact O-CG1 3.34Å; Y829-I833 PolarHBondContact O-N 2.99Å; Y829-I833 VanDerWaalsContact O-N 3.12Å
830	V	87.4	Confident	86.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.1	-44.1	-174.7	179.8	0	0	0	0	113.5	F827 D832 I833 L834 L857	F827-V830 HydrophobicContact CD2-CB 4.17Å; F827-V830 HydrophobicContact CD2-CG2 4.26Å; F827-V830 HydrophobicContact CE2-CB 4.46Å; F827-V830 PolarHBondContact O-N 3.32Å; V830-D832 PolarHBondContact O-N 3.34Å; V830-I833 PolarHBondContact O-N 2.94Å; V830-L834 HydrophobicContact CG1-CD1 4.19Å; V830-L834 HydrophobicContact CG1-CG 4.31Å; V830-L834 WeakPolarHBondContact O-CG 3.44Å; V830-L834 PolarHBondContact O-N 3.3Å; V830-L857 HydrophobicContact CG2-CD2 4.32Å
831	P	87.8	Confident	86.6	Confident	24 Å²	24	27 Å²	27	16%	0.156	14%	0.144	C	C	.	.	H	α-helix	trans	-57.4	-33.9	176.5	-29.5	37.3	0	0	0	114.5	F827 K835 L871	F827-P831 WeakPolarHBondContact O-CD 3.47Å; P831-K835 WeakPolarHBondContact O-CG 3.3Å; P831-K835 PolarHBondContact O-N 2.69Å; P831-L871 HydrophobicContact CB-CD2 3.92Å; P831-L871 HydrophobicContact CG-CD2 4.27Å
832	D	87.1	Confident	86.6	Confident	30 Å²	30	32.4 Å²	32.4	16%	0.16	17%	0.169	C	C	.	.	H	α-helix	trans	-80.8	-36.8	-179.1	-65.1	-30.9	0	0	0	110.9	I762 R766 Y829 V830 L834 K835 L836	I762-D832 HydrophobicContact CG2-CB 4.45Å; R766-D832 IonicContact CZ-OD2 2.87Å; R766-D832 IonicContact NE-OD2 3.2Å; R766-D832 PolarHBondContact NE-OD2 2.81Å; R766-D832 IonicContact NH2-OD2 3.13Å; R766-D832 PolarHBondContact NH2-OD2 3.25Å; Y829-D832 PolarHBondContact O-N 2.97Å; Y829-D832 VanDerWaalsContact O-N 3.12Å; V830-D832 PolarHBondContact O-N 3.34Å; D832-L834 VanDerWaalsContact C-N 3.34Å; D832-L834 PolarHBondContact O-N 2.84Å; D832-K835 PolarHBondContact O-N 3.08Å; D832-K835 IonicContact OD1-NZ 2.91Å; D832-K835 PolarHBondContact OD1-NZ 3.32Å; D832-K835 VanDerWaalsContact OD1-NZ 3.13Å; D832-L836 WeakPolarHBondContact O-CB 3.41Å; D832-L836 WeakPolarHBondContact O-CG 3.19Å; D832-L836 PolarHBondContact O-N 2.82Å
833	I	89.1	Confident	86.4	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-59.2	-45.4	171.3	-63.2	169.2	0	0	0	110.6	I762 F810 L825 Y829 V830 K835 L836 F837 L857	I762-I833 HydrophobicContact CD1-CD1 3.69Å; I762-I833 HydrophobicContact CD1-CG1 3.52Å; I762-I833 HydrophobicContact CG1-CG1 4.49Å; F810-I833 HydrophobicContact CZ-CG2 4.42Å; L825-I833 HydrophobicContact CD1-CD1 3.84Å; Y829-I833 WeakPolarHBondContact O-CG1 3.34Å; Y829-I833 PolarHBondContact O-N 2.99Å; Y829-I833 VanDerWaalsContact O-N 3.12Å; V830-I833 PolarHBondContact O-N 2.94Å; I833-K835 VanDerWaalsContact C-N 3.31Å; I833-K835 PolarHBondContact O-N 2.81Å; I833-L836 PolarHBondContact O-N 2.9Å; I833-F837 HydrophobicContact CG2-CD1 4.01Å; I833-F837 HydrophobicContact CG2-CD2 4Å; I833-F837 HydrophobicContact CG2-CE1 3.63Å; I833-F837 HydrophobicContact CG2-CE2 3.61Å; I833-F837 HydrophobicContact CG2-CG 4.21Å; I833-F837 HydrophobicContact CG2-CZ 3.41Å; I833-F837 VanDerWaalsContact CG2-CZ 3.41Å; I833-F837 WeakPolarHBondContact O-CB 3.22Å; I833-F837 WeakPolarHBondContact O-CG 3.48Å; I833-F837 PolarHBondContact O-N 3.49Å; I833-L857 HydrophobicContact CB-CD1 4.47Å; I833-L857 HydrophobicContact CG2-CD1 3.65Å
834	L	88.4	Confident	86	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-37.7	178.4	-69.9	175.3	0	0	0	112.5	V830 D832 N838 L854 I865 V874 L878	V830-L834 HydrophobicContact CG1-CD1 4.19Å; V830-L834 HydrophobicContact CG1-CG 4.31Å; V830-L834 WeakPolarHBondContact O-CG 3.44Å; V830-L834 PolarHBondContact O-N 3.3Å; D832-L834 VanDerWaalsContact C-N 3.34Å; D832-L834 PolarHBondContact O-N 2.84Å; L834-N838 PolarHBondContact O-N 3.12Å; L834-L854 HydrophobicContact CD2-CD1 3.58Å; L834-I865 HydrophobicContact CD1-CD1 4.42Å; L834-V874 HydrophobicContact CB-CG1 4.34Å; L834-L878 HydrophobicContact CB-CD1 4.46Å; L834-L878 HydrophobicContact CD2-CD1 4.32Å; L834-L878 VanDerWaalsContact O-CD1 3.25Å; L834-L878 WeakPolarHBondContact O-CD1 3.42Å
835	K	86.9	Confident	85.4	Confident	95 Å²	95	39 Å²	39	41%	0.413	21%	0.211	S	C	.	.	H	α-helix	trans	-66.9	-45.8	174.8	-68.2	168.2	-162.2	154.7	0	111.3	P831 D832 I833 F837 N838 E839 V874	P831-K835 WeakPolarHBondContact O-CG 3.3Å; P831-K835 PolarHBondContact O-N 2.69Å; D832-K835 PolarHBondContact O-N 3.08Å; D832-K835 IonicContact OD1-NZ 2.91Å; D832-K835 PolarHBondContact OD1-NZ 3.32Å; D832-K835 VanDerWaalsContact OD1-NZ 3.13Å; I833-K835 VanDerWaalsContact C-N 3.31Å; I833-K835 PolarHBondContact O-N 2.81Å; K835-F837 VanDerWaalsContact C-N 3.34Å; K835-F837 PolarHBondContact O-N 3.3Å; K835-N838 WeakPolarHBondContact O-CB 3.23Å; K835-N838 PolarHBondContact O-N 3.32Å; K835-E839 PolarHBondContact O-N 2.76Å; K835-V874 HydrophobicContact CG-CG1 4.24Å
836	L	87.6	Confident	84.9	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-41.8	177.8	-77.2	172.8	0	0	0	111.8	Y765 V806 D832 I833 N838 E839 F840	Y765-L836 HydrophobicContact CD1-CD1 3.96Å; Y765-L836 HydrophobicContact CD1-CD2 4.3Å; Y765-L836 HydrophobicContact CD1-CG 4.39Å; Y765-L836 HydrophobicContact CD2-CD2 4.06Å; Y765-L836 HydrophobicContact CE1-CD1 4.03Å; Y765-L836 HydrophobicContact CE1-CD2 3.8Å; Y765-L836 HydrophobicContact CE1-CG 3.96Å; Y765-L836 HydrophobicContact CE2-CD2 3.56Å; Y765-L836 HydrophobicContact CG-CD1 4.3Å; Y765-L836 HydrophobicContact CG-CD2 4.42Å; V806-L836 HydrophobicContact CB-CD1 4.44Å; V806-L836 HydrophobicContact CG1-CD1 4.06Å; V806-L836 HydrophobicContact CG2-CD1 4.33Å; D832-L836 WeakPolarHBondContact O-CB 3.41Å; D832-L836 WeakPolarHBondContact O-CG 3.19Å; D832-L836 PolarHBondContact O-N 2.82Å; I833-L836 PolarHBondContact O-N 2.9Å; L836-N838 VanDerWaalsContact C-N 3.3Å; L836-N838 PolarHBondContact O-N 3.11Å; L836-E839 WeakPolarHBondContact O-CB 3.46Å; L836-E839 PolarHBondContact O-N 3.48Å; L836-E839 VanDerWaalsContact O-N 3.1Å; L836-F840 HydrophobicContact CB-CE2 3.86Å; L836-F840 HydrophobicContact CB-CZ 4.12Å; L836-F840 HydrophobicContact CD2-CZ 4.11Å; L836-F840 VanDerWaalsContact O-CD2 3.24Å; L836-F840 WeakPolarHBondContact O-CD2 3.33Å; L836-F840 VanDerWaalsContact O-CG 3.24Å; L836-F840 WeakPolarHBondContact O-CG 3.32Å; L836-F840 PolarHBondContact O-N 2.9Å
837	F	87.9	Confident	84.7	Confident	1 Å²	1	40.6 Å²	40.6	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-61.8	-38.6	176.1	-74.8	0.8	0	0	0	112.1	F810 I833 K835 E839 F840 I841 L850 C853 L854 L857 L878	F810-F837 HydrophobicContact CE1-CE1 4.49Å; F810-F837 HydrophobicContact CE1-CZ 4.21Å; F810-F837 HydrophobicContact CE2-CE1 4.21Å; F810-F837 HydrophobicContact CZ-CE1 4.17Å; F810-F837 HydrophobicContact CZ-CZ 4.15Å; I833-F837 HydrophobicContact CG2-CD1 4.01Å; I833-F837 HydrophobicContact CG2-CD2 4Å; I833-F837 HydrophobicContact CG2-CE1 3.63Å; I833-F837 HydrophobicContact CG2-CE2 3.61Å; I833-F837 HydrophobicContact CG2-CG 4.21Å; I833-F837 HydrophobicContact CG2-CZ 3.41Å; I833-F837 VanDerWaalsContact CG2-CZ 3.41Å; I833-F837 WeakPolarHBondContact O-CB 3.22Å; I833-F837 WeakPolarHBondContact O-CG 3.48Å; I833-F837 PolarHBondContact O-N 3.49Å; K835-F837 VanDerWaalsContact C-N 3.34Å; K835-F837 PolarHBondContact O-N 3.3Å; F837-E839 VanDerWaalsContact C-N 3.33Å; F837-E839 PolarHBondContact O-N 3.03Å; F837-F840 HydrophobicContact CD1-CD2 4.05Å; F837-F840 HydrophobicContact CD1-CE2 4.39Å; F837-F840 PolarHBondContact O-N 3.04Å; F837-I841 WeakPolarHBondContact O-CB 3.43Å; F837-I841 WeakPolarHBondContact O-CD1 2.99Å; F837-I841 WeakPolarHBondContact O-CG1 3.49Å; F837-I841 PolarHBondContact O-N 2.81Å; F837-L850 HydrophobicContact CD1-CD2 3.66Å; F837-L850 HydrophobicContact CE1-CD2 3.67Å; F837-L850 HydrophobicContact CG-CD2 4.33Å; F837-L850 HydrophobicContact CZ-CD2 4.35Å; F837-C853 HydrophobicContact CE2-CB 3.57Å; F837-C853 HydrophobicContact CZ-CB 3.55Å; F837-L854 HydrophobicContact CD2-CB 4.08Å; F837-L854 HydrophobicContact CD2-CD1 4.27Å; F837-L854 HydrophobicContact CE2-CB 4.41Å; F837-L857 HydrophobicContact CE2-CD1 3.91Å; F837-L857 HydrophobicContact CZ-CD1 4.45Å; F837-L878 HydrophobicContact CB-CD1 4.49Å
838	N	86.7	Confident	84.5	Confident	19 Å²	19	45.1 Å²	45.1	10%	0.102	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-41	174	-169.8	37.9	0	0	0	111.7	L834 K835 L836 Q842 L878 T881	L834-N838 PolarHBondContact O-N 3.12Å; K835-N838 WeakPolarHBondContact O-CB 3.23Å; K835-N838 PolarHBondContact O-N 3.32Å; L836-N838 VanDerWaalsContact C-N 3.3Å; L836-N838 PolarHBondContact O-N 3.11Å; N838-Q842 VanDerWaalsContact O-CG 3.28Å; N838-Q842 WeakPolarHBondContact O-CG 3.39Å; N838-Q842 PolarHBondContact O-N 3.12Å; N838-Q842 VanDerWaalsContact O-N 3.14Å; N838-L878 HydrophobicContact CB-CD1 4.27Å; N838-L878 HydrophobicContact CB-CG 4.3Å; N838-T881 PolarHBondContact OD1-OG1 2.78Å
839	E	85.2	Confident	84.3	Confident	84 Å²	84	43.8 Å²	43.8	39%	0.393	23%	0.225	S	C	.	.	H	α-helix	trans	-63.3	-44.8	174.6	-67	-178.8	-176.7	0	0	111.8	K835 L836 F837 Q842 M843	K835-E839 PolarHBondContact O-N 2.76Å; L836-E839 WeakPolarHBondContact O-CB 3.46Å; L836-E839 PolarHBondContact O-N 3.48Å; L836-E839 VanDerWaalsContact O-N 3.1Å; F837-E839 VanDerWaalsContact C-N 3.33Å; F837-E839 PolarHBondContact O-N 3.03Å; E839-Q842 PolarHBondContact O-N 3.48Å; E839-M843 WeakPolarHBondContact O-CG 3.17Å; E839-M843 PolarHBondContact O-N 3.23Å; E839-M843 VanDerWaalsContact O-N 3.13Å
840	F	85.2	Confident	84.2	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.035	22%	0.22	C	C	.	.	H	α-helix	trans	-67.6	-40.1	-179.5	-58.7	-35	0	0	0	113.3	S803 V806 L807 L836 F837 Q842 M843 G844 S845 L850	S803-F840 WeakPolarHBondContact O-CE1 3.46Å; S803-F840 WeakPolarHBondContact O-CZ 3.38Å; V806-F840 HydrophobicContact CB-CZ 4.4Å; L807-F840 HydrophobicContact CB-CD1 4.46Å; L807-F840 HydrophobicContact CB-CE1 4.08Å; L807-F840 HydrophobicContact CB-CE2 4.22Å; L807-F840 HydrophobicContact CB-CZ 3.98Å; L807-F840 HydrophobicContact CD1-CD2 4.17Å; L807-F840 HydrophobicContact CD1-CE2 4.48Å; L807-F840 HydrophobicContact CD1-CG 4.38Å; L836-F840 HydrophobicContact CB-CE2 3.86Å; L836-F840 HydrophobicContact CB-CZ 4.12Å; L836-F840 HydrophobicContact CD2-CZ 4.11Å; L836-F840 VanDerWaalsContact O-CD2 3.24Å; L836-F840 WeakPolarHBondContact O-CD2 3.33Å; L836-F840 VanDerWaalsContact O-CG 3.24Å; L836-F840 WeakPolarHBondContact O-CG 3.32Å; L836-F840 PolarHBondContact O-N 2.9Å; F837-F840 HydrophobicContact CD1-CD2 4.05Å; F837-F840 HydrophobicContact CD1-CE2 4.39Å; F837-F840 PolarHBondContact O-N 3.04Å; F840-Q842 VanDerWaalsContact C-N 3.31Å; F840-Q842 PolarHBondContact O-N 2.96Å; F840-M843 CarbonylContact O-C 3.59Å; F840-M843 PolarHBondContact O-N 2.86Å; F840-M843 VanDerWaalsContact O-N 3.17Å; F840-G844 PolarHBondContact O-N 3.08Å; F840-S845 PolarHBondContact O-N 3Å; F840-L850 HydrophobicContact CB-CD1 3.42Å; F840-L850 VanDerWaalsContact CB-CD1 3.42Å; F840-L850 HydrophobicContact CB-CD2 4.42Å; F840-L850 HydrophobicContact CD2-CD1 4.46Å; F840-L850 HydrophobicContact CD2-CD2 3.96Å; F840-L850 HydrophobicContact CG-CD1 4.39Å
841	I	84.3	Confident	84.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-36.3	177.4	-66.2	166.8	0	0	0	110.2	F837 M843 G844 L850 L878 T881 K885	F837-I841 WeakPolarHBondContact O-CB 3.43Å; F837-I841 WeakPolarHBondContact O-CD1 2.99Å; F837-I841 WeakPolarHBondContact O-CG1 3.49Å; F837-I841 PolarHBondContact O-N 2.81Å; I841-M843 VanDerWaalsContact C-N 3.33Å; I841-M843 PolarHBondContact O-N 2.96Å; I841-G844 PolarHBondContact O-N 3.42Å; I841-G844 VanDerWaalsContact O-N 3.12Å; I841-L850 HydrophobicContact CG1-CB 4.29Å; I841-L850 HydrophobicContact CG1-CD1 4.07Å; I841-L878 HydrophobicContact CD1-CD2 4.47Å; I841-T881 HydrophobicContact CB-CG2 4.45Å; I841-T881 HydrophobicContact CG2-CG2 3.83Å; I841-K885 HydrophobicContact CG2-CB 4.14Å; I841-K885 HydrophobicContact CG2-CG 4.01Å
842	Q	84.3	Confident	84	Confident	112 Å²	112	44.4 Å²	44.4	52%	0.523	23%	0.225	S	C	.	.	H	α-helix	trans	-61.3	-42	172.3	-75.2	179.7	2	0	0	112.1	N838 E839 F840 G844 T881	N838-Q842 VanDerWaalsContact O-CG 3.28Å; N838-Q842 WeakPolarHBondContact O-CG 3.39Å; N838-Q842 PolarHBondContact O-N 3.12Å; N838-Q842 VanDerWaalsContact O-N 3.14Å; E839-Q842 PolarHBondContact O-N 3.48Å; F840-Q842 VanDerWaalsContact C-N 3.31Å; F840-Q842 PolarHBondContact O-N 2.96Å; Q842-G844 PolarHBondContact O-N 2.72Å; Q842-T881 HydrophobicContact CB-CG2 4.42Å; Q842-T881 HydrophobicContact CG-CG2 3.47Å; Q842-T881 VanDerWaalsContact CG-CG2 3.47Å
843	M	82.3	Confident	84	Confident	152 Å²	152	43 Å²	43	75%	0.749	22%	0.218	S	C	*	.	H	α-helix	trans	-70.3	-13.6	176.1	-64.6	-61.9	-67.9	0	0	113.3	E839 F840 I841 S845	E839-M843 WeakPolarHBondContact O-CG 3.17Å; E839-M843 PolarHBondContact O-N 3.23Å; E839-M843 VanDerWaalsContact O-N 3.13Å; F840-M843 CarbonylContact O-C 3.59Å; F840-M843 PolarHBondContact O-N 2.86Å; F840-M843 VanDerWaalsContact O-N 3.17Å; I841-M843 VanDerWaalsContact C-N 3.33Å; I841-M843 PolarHBondContact O-N 2.96Å; M843-S845 VanDerWaalsContact C-N 3.31Å; M843-S845 PolarHBondContact O-N 3.42Å
844	G	75.1	Confident	83.9	Confident	32 Å²	32	43.1 Å²	43.1	33%	0.33	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	20	177.4	0	0	0	0	0	114.5	F840 I841 Q842	F840-G844 PolarHBondContact O-N 3.08Å; I841-G844 PolarHBondContact O-N 3.42Å; I841-G844 VanDerWaalsContact O-N 3.12Å; Q842-G844 PolarHBondContact O-N 2.72Å
845	S	72.6	Confident	83.9	Confident	44 Å²	44	49 Å²	49	31%	0.308	24%	0.244	S	C	.	.	S	Bend	trans	-85.8	127.6	177.1	-57.7	0	0	0	0	110.2	F840 M843 I847 L850	F840-S845 PolarHBondContact O-N 3Å; M843-S845 VanDerWaalsContact C-N 3.31Å; M843-S845 PolarHBondContact O-N 3.42Å; S845-I847 PolarHBondContact O-N 2.71Å; S845-L850 WeakPolarHBondContact O-CD1 2.8Å
846	D	73.9	Confident	83.8	Confident	71 Å²	71	44.9 Å²	44.9	38%	0.38	23%	0.226	S	C	.	.			trans	44	56.9	170.4	-51.2	-71.8	0	0	0	115.4	K811 E848 L849 L850	K811-D846 WeakPolarHBondContact CE-OD2 3.42Å; K811-D846 IonicContact NZ-OD1 2.62Å; K811-D846 IonicContact NZ-OD2 2.96Å; K811-D846 PolarHBondContact NZ-OD2 3.16Å; D846-E848 VanDerWaalsContact C-N 3.28Å; D846-E848 PolarHBondContact O-N 3.27Å; D846-L849 HydrophobicContact CB-CB 4.31Å; D846-L849 PolarHBondContact O-N 2.79Å; D846-L850 WeakPolarHBondContact O-CG 3.26Å; D846-L850 PolarHBondContact O-N 2.92Å; D846-L850 VanDerWaalsContact O-N 3.12Å
847	I	83.1	Confident	83.7	Confident	25 Å²	25	44.8 Å²	44.8	13%	0.128	23%	0.226	C	C	.	.	H	α-helix	trans	-58.5	-39.6	-174.6	-62.8	162.6	0	0	0	111.6	S845 L850 C851 K885 V886 V889	S845-I847 PolarHBondContact O-N 2.71Å; I847-L850 PolarHBondContact O-N 3.19Å; I847-C851 VanDerWaalsContact O-CB 3.24Å; I847-C851 WeakPolarHBondContact O-CB 3.37Å; I847-C851 PolarHBondContact O-N 3.21Å; I847-C851 PolarHBondContact O-SG 3.37Å; I847-K885 HydrophobicContact CD1-CB 4.17Å; I847-V886 HydrophobicContact CG2-CG2 4.29Å; I847-V889 HydrophobicContact CD1-CG2 3.62Å
848	E	81.9	Confident	83.6	Confident	149 Å²	149	47 Å²	47	70%	0.696	24%	0.238	S	C	*	.	H	α-helix	trans	-63.4	-49.1	-178.2	-66.1	177.1	178.3	0	0	112	D846 C851 R852	D846-E848 VanDerWaalsContact C-N 3.28Å; D846-E848 PolarHBondContact O-N 3.27Å; E848-C851 PolarHBondContact O-N 3.06Å; E848-R852 WeakPolarHBondContact O-CB 3.39Å; E848-R852 PolarHBondContact O-N 3.45Å
849	L	84.5	Confident	83.5	Confident	41 Å²	41	52.7 Å²	52.7	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-49.2	177.6	-177	68.3	0	0	0	110.9	K811 L818 D846 C851 R852 C853	K811-L849 HydrophobicContact CG-CD2 4.43Å; L818-L849 HydrophobicContact CD2-CD1 3.34Å; L818-L849 HydrophobicContact CD2-CG 4.37Å; D846-L849 HydrophobicContact CB-CB 4.31Å; D846-L849 PolarHBondContact O-N 2.79Å; L849-C851 PolarHBondContact O-N 3.08Å; L849-R852 WeakPolarHBondContact O-CB 3.28Å; L849-R852 PolarHBondContact O-N 2.74Å; L849-C853 PolarHBondContact O-N 2.75Å; L849-C853 PolarHBondContact O-SG 3.19Å
850	L	86.1	Confident	83.4	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-40.3	-179.1	-66.6	172.9	0	0	0	112.1	L807 F837 F840 I841 S845 D846 I847 R852 C853 L854	L807-L850 HydrophobicContact CD1-CD2 4.13Å; F837-L850 HydrophobicContact CD1-CD2 3.66Å; F837-L850 HydrophobicContact CE1-CD2 3.67Å; F837-L850 HydrophobicContact CG-CD2 4.33Å; F837-L850 HydrophobicContact CZ-CD2 4.35Å; F840-L850 HydrophobicContact CB-CD1 3.42Å; F840-L850 VanDerWaalsContact CB-CD1 3.42Å; F840-L850 HydrophobicContact CB-CD2 4.42Å; F840-L850 HydrophobicContact CD2-CD1 4.46Å; F840-L850 HydrophobicContact CD2-CD2 3.96Å; F840-L850 HydrophobicContact CG-CD1 4.39Å; I841-L850 HydrophobicContact CG1-CB 4.29Å; I841-L850 HydrophobicContact CG1-CD1 4.07Å; S845-L850 WeakPolarHBondContact O-CD1 2.8Å; D846-L850 WeakPolarHBondContact O-CG 3.26Å; D846-L850 PolarHBondContact O-N 2.92Å; D846-L850 VanDerWaalsContact O-N 3.12Å; I847-L850 PolarHBondContact O-N 3.19Å; L850-R852 VanDerWaalsContact C-N 3.34Å; L850-C853 PolarHBondContact O-N 3.24Å; L850-L854 WeakPolarHBondContact O-CB 3.46Å; L850-L854 PolarHBondContact O-N 3.03Å
851	C	86.1	Confident	83.4	Confident	10 Å²	10	50.6 Å²	50.6	7%	0.068	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-41.4	175.6	-71.4	0	0	0	0	111.1	I847 E848 L849 L854 F855	I847-C851 VanDerWaalsContact O-CB 3.24Å; I847-C851 WeakPolarHBondContact O-CB 3.37Å; I847-C851 PolarHBondContact O-N 3.21Å; I847-C851 PolarHBondContact O-SG 3.37Å; E848-C851 PolarHBondContact O-N 3.06Å; L849-C851 PolarHBondContact O-N 3.08Å; C851-L854 PolarHBondContact O-N 3.04Å; C851-F855 HydrophobicContact CB-CD2 4.41Å; C851-F855 HydrophobicContact CB-CE2 3.95Å; C851-F855 HydrophobicContact CB-CZ 4.42Å; C851-F855 WeakPolarHBondContact O-CB 3.33Å; C851-F855 WeakPolarHBondContact O-CD2 3.45Å; C851-F855 WeakPolarHBondContact O-CG 3.47Å; C851-F855 PolarHBondContact O-N 2.84Å
852	R	85.1	Confident	83.4	Confident	55 Å²	55	57.3 Å²	57.3	21%	0.208	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-51.5	175.1	-177.2	177	174.8	-172.6	-7.5	111.5	N138 S140 S815 E819 E848 L849 L850 L854 F855 F856	N138-R852 PolarHBondContact O-NH1 3.37Å; S140-R852 VanDerWaalsContact CB-NH2 3.27Å; S815-R852 PolarHBondContact O-NH2 2.85Å; E819-R852 IonicContact OE1-CZ 2.72Å; E819-R852 IonicContact OE1-NE 3.78Å; E819-R852 PolarHBondContact OE1-NE 2.79Å; E819-R852 IonicContact OE1-NH2 2.8Å; E819-R852 PolarHBondContact OE1-NH2 2.92Å; E848-R852 WeakPolarHBondContact O-CB 3.39Å; E848-R852 PolarHBondContact O-N 3.45Å; L849-R852 WeakPolarHBondContact O-CB 3.28Å; L849-R852 PolarHBondContact O-N 2.74Å; L850-R852 VanDerWaalsContact C-N 3.34Å; R852-L854 VanDerWaalsContact C-N 3.31Å; R852-L854 PolarHBondContact O-N 2.9Å; R852-F855 PolarHBondContact O-N 2.98Å; R852-F856 VanDerWaalsContact O-CB 3.23Å; R852-F856 WeakPolarHBondContact O-CB 3.24Å; R852-F856 PolarHBondContact O-N 2.79Å
853	C	86.9	Confident	83.3	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.007	28%	0.279	C	S	.	.	H	α-helix	trans	-59.8	-42.1	176.1	-64.5	0	0	0	0	112.2	L818 L822 F837 L849 L850 F856 L857	L818-C853 WeakPolarHBondContact CD2-SG 3.45Å; L822-C853 HydrophobicContact CD1-CB 3.84Å; F837-C853 HydrophobicContact CE2-CB 3.57Å; F837-C853 HydrophobicContact CZ-CB 3.55Å; L849-C853 PolarHBondContact O-N 2.75Å; L849-C853 PolarHBondContact O-SG 3.19Å; L850-C853 PolarHBondContact O-N 3.24Å; C853-F856 PolarHBondContact O-N 3.08Å; C853-L857 WeakPolarHBondContact O-CB 3.43Å; C853-L857 WeakPolarHBondContact O-CG 3.39Å; C853-L857 PolarHBondContact O-N 2.87Å
854	L	88	Confident	83.4	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-53.8	179.7	173.7	74.6	0	0	0	111.5	L834 F837 L850 C851 R852 F856 L857 L858 L878 T882	L834-L854 HydrophobicContact CD2-CD1 3.58Å; F837-L854 HydrophobicContact CD2-CB 4.08Å; F837-L854 HydrophobicContact CD2-CD1 4.27Å; F837-L854 HydrophobicContact CE2-CB 4.41Å; L850-L854 WeakPolarHBondContact O-CB 3.46Å; L850-L854 PolarHBondContact O-N 3.03Å; C851-L854 PolarHBondContact O-N 3.04Å; R852-L854 VanDerWaalsContact C-N 3.31Å; R852-L854 PolarHBondContact O-N 2.9Å; L854-F856 PolarHBondContact O-N 3.35Å; L854-L857 PolarHBondContact O-N 3.13Å; L854-L858 HydrophobicContact CD1-CD1 4.01Å; L854-L858 HydrophobicContact CD1-CG 4.22Å; L854-L858 HydrophobicContact CD2-CD1 4.49Å; L854-L858 HydrophobicContact CG-CD1 3.88Å; L854-L858 HydrophobicContact CG-CG 4.4Å; L854-L858 WeakPolarHBondContact O-CB 3.45Å; L854-L858 VanDerWaalsContact O-CG 3.26Å; L854-L858 WeakPolarHBondContact O-CG 3.27Å; L854-L858 PolarHBondContact O-N 2.8Å; L854-L878 HydrophobicContact CD1-CD1 3.78Å; L854-L878 HydrophobicContact CD1-CD2 3.46Å; L854-L878 VanDerWaalsContact CD1-CD2 3.46Å; L854-L878 HydrophobicContact CD1-CG 4.3Å; L854-L878 HydrophobicContact CD2-CD2 3.22Å; L854-L878 HydrophobicContact CG-CD2 3.91Å; L854-T882 HydrophobicContact CD2-CG2 4.47Å
855	F	87.3	Confident	83.9	Confident	125 Å²	125	50.5 Å²	50.5	55%	0.548	25%	0.25	S	S	.	.	H	α-helix	trans	-61.6	-36.9	-179.7	-64.1	-35.4	0	0	0	111.1	C851 R852 R859	C851-F855 HydrophobicContact CB-CD2 4.41Å; C851-F855 HydrophobicContact CB-CE2 3.95Å; C851-F855 HydrophobicContact CB-CZ 4.42Å; C851-F855 WeakPolarHBondContact O-CB 3.33Å; C851-F855 WeakPolarHBondContact O-CD2 3.45Å; C851-F855 WeakPolarHBondContact O-CG 3.47Å; C851-F855 PolarHBondContact O-N 2.84Å; R852-F855 PolarHBondContact O-N 2.98Å; F855-R859 VanDerWaalsContact O-CB 3.3Å; F855-R859 WeakPolarHBondContact O-CB 3.22Å; F855-R859 PolarHBondContact O-N 2.99Å
856	F	85.3	Confident	84.4	Confident	8 Å²	8	53 Å²	53	4%	0.035	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-50	175.2	-173.5	-102	0	0	0	112.6	F743 E819 L822 L823 R852 C853 L854 L858 R859 I860	F743-F856 AromaticContact CD2-CE2 3.91Å; F743-F856 HydrophobicContact CD2-CE2 3.91Å; F743-F856 HydrophobicContact CE1-CZ 4.5Å; F743-F856 HydrophobicContact CE2-CD2 4.34Å; F743-F856 AromaticContact CE2-CE2 3.4Å; F743-F856 HydrophobicContact CE2-CE2 3.4Å; F743-F856 VanDerWaalsContact CE2-CE2 3.4Å; F743-F856 HydrophobicContact CE2-CZ 4.07Å; F743-F856 AromaticContact CZ-CE2 3.81Å; F743-F856 HydrophobicContact CZ-CE2 3.81Å; F743-F856 HydrophobicContact CZ-CZ 4.05Å; E819-F856 HydrophobicContact CB-CD1 4.38Å; E819-F856 HydrophobicContact CB-CD2 4.12Å; E819-F856 HydrophobicContact CB-CE1 4.03Å; E819-F856 HydrophobicContact CB-CE2 3.77Å; E819-F856 HydrophobicContact CB-CG 4.39Å; E819-F856 HydrophobicContact CB-CZ 3.68Å; E819-F856 HydrophobicContact CG-CD1 4.47Å; E819-F856 HydrophobicContact CG-CD2 3.92Å; E819-F856 HydrophobicContact CG-CE2 4.09Å; E819-F856 HydrophobicContact CG-CG 4.11Å; E819-F856 HydrophobicContact CG-CZ 4.38Å; E819-F856 WeakPolarHBondContact O-CE1 3.34Å; E819-F856 WeakPolarHBondContact O-CZ 3.12Å; L822-F856 HydrophobicContact CB-CD1 3.78Å; L822-F856 HydrophobicContact CB-CE1 3.69Å; L822-F856 HydrophobicContact CD1-CD1 3.88Å; L823-F856 HydrophobicContact CB-CZ 4.48Å; R852-F856 VanDerWaalsContact O-CB 3.23Å; R852-F856 WeakPolarHBondContact O-CB 3.24Å; R852-F856 PolarHBondContact O-N 2.79Å; C853-F856 PolarHBondContact O-N 3.08Å; L854-F856 PolarHBondContact O-N 3.35Å; F856-L858 PolarHBondContact O-N 2.95Å; F856-R859 PolarHBondContact O-N 2.92Å; F856-I860 HydrophobicContact CD1-CD1 3.71Å; F856-I860 HydrophobicContact CD2-CD1 4.48Å; F856-I860 HydrophobicContact CE1-CD1 3.09Å; F856-I860 HydrophobicContact CE1-CG1 4.3Å; F856-I860 HydrophobicContact CE2-CD1 3.96Å; F856-I860 HydrophobicContact CG-CD1 4.37Å; F856-I860 HydrophobicContact CZ-CD1 3.27Å; F856-I860 HydrophobicContact CZ-CG1 4.28Å; F856-I860 PolarHBondContact O-N 3.15Å
857	L	86.1	Confident	85	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-41.1	177.3	-77	172.1	0	0	0	112.5	L822 V830 I833 F837 C853 L854 R859 H861	L822-L857 HydrophobicContact CB-CD2 4.39Å; L822-L857 HydrophobicContact CD1-CG 4.41Å; L822-L857 HydrophobicContact CD2-CD1 4.3Å; L822-L857 HydrophobicContact CD2-CD2 4.21Å; L822-L857 HydrophobicContact CD2-CG 4.36Å; V830-L857 HydrophobicContact CG2-CD2 4.32Å; I833-L857 HydrophobicContact CB-CD1 4.47Å; I833-L857 HydrophobicContact CG2-CD1 3.65Å; F837-L857 HydrophobicContact CE2-CD1 3.91Å; F837-L857 HydrophobicContact CZ-CD1 4.45Å; C853-L857 WeakPolarHBondContact O-CB 3.43Å; C853-L857 WeakPolarHBondContact O-CG 3.39Å; C853-L857 PolarHBondContact O-N 2.87Å; L854-L857 PolarHBondContact O-N 3.13Å; L857-R859 VanDerWaalsContact C-N 3.33Å; L857-H861 PolarHBondContact O-N 3.1Å
858	L	86.7	Confident	85.2	Confident	48 Å²	48	55.4 Å²	55.4	25%	0.251	28%	0.284	S	S	.	.	H	α-helix	trans	-63.9	-39.1	176.4	-73	175.2	0	0	0	111.6	L854 F856 F862 I865	L854-L858 HydrophobicContact CD1-CD1 4.01Å; L854-L858 HydrophobicContact CD1-CG 4.22Å; L854-L858 HydrophobicContact CD2-CD1 4.49Å; L854-L858 HydrophobicContact CG-CD1 3.88Å; L854-L858 HydrophobicContact CG-CG 4.4Å; L854-L858 WeakPolarHBondContact O-CB 3.45Å; L854-L858 VanDerWaalsContact O-CG 3.26Å; L854-L858 WeakPolarHBondContact O-CG 3.27Å; L854-L858 PolarHBondContact O-N 2.8Å; F856-L858 PolarHBondContact O-N 2.95Å; L858-F862 WeakPolarHBondContact O-CA 3.49Å; L858-F862 WeakPolarHBondContact O-CB 3.35Å; L858-F862 PolarHBondContact O-N 3.47Å; L858-I865 HydrophobicContact CD2-CD1 3.92Å
859	R	84.5	Confident	85.3	Confident	137 Å²	137	56 Å²	56	52%	0.517	29%	0.287	S	S	.	.	H	α-helix	trans	-65.6	-48.2	177.2	-175.3	175.3	66.1	172.8	-0.4	111.6	F855 F856 L857	F855-R859 VanDerWaalsContact O-CB 3.3Å; F855-R859 WeakPolarHBondContact O-CB 3.22Å; F855-R859 PolarHBondContact O-N 2.99Å; F856-R859 PolarHBondContact O-N 2.92Å; L857-R859 VanDerWaalsContact C-N 3.33Å
860	I	82.8	Confident	85.2	Confident	30 Å²	30	61.4 Å²	61.4	15%	0.154	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-51.7	-177.7	-70	172.8	0	0	0	111.5	V733 L823 F856 F862	V733-I860 HydrophobicContact CG1-CG2 4.47Å; L823-I860 HydrophobicContact CB-CD1 4.28Å; L823-I860 HydrophobicContact CD1-CD1 3.72Å; L823-I860 HydrophobicContact CD1-CG1 4.42Å; L823-I860 HydrophobicContact CD1-CG2 4.3Å; F856-I860 HydrophobicContact CD1-CD1 3.71Å; F856-I860 HydrophobicContact CD2-CD1 4.48Å; F856-I860 HydrophobicContact CE1-CD1 3.09Å; F856-I860 HydrophobicContact CE1-CG1 4.3Å; F856-I860 HydrophobicContact CE2-CD1 3.96Å; F856-I860 HydrophobicContact CG-CD1 4.37Å; F856-I860 HydrophobicContact CZ-CD1 3.27Å; F856-I860 HydrophobicContact CZ-CG1 4.28Å; F856-I860 PolarHBondContact O-N 3.15Å; I860-F862 VanDerWaalsContact C-N 3.25Å; I860-F862 PolarHBondContact O-N 2.96Å
861	H	84.3	Confident	85	Confident	18 Å²	18	61.7 Å²	61.7	8%	0.083	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	19	-172.6	-63.7	-75.6	0	0	0	112.5	F827 L857 G863 Q864 I865	F827-H861 HydrophobicContact CD2-CB 4.12Å; F827-H861 AromaticContact CD2-CG 3.9Å; F827-H861 AromaticContact CD2-ND1 3.61Å; F827-H861 HydrophobicContact CE2-CB 4.13Å; L857-H861 PolarHBondContact O-N 3.1Å; H861-G863 VanDerWaalsContact C-N 3.28Å; H861-G863 PolarHBondContact O-N 2.88Å; H861-G863 VanDerWaalsContact O-N 3.17Å; H861-Q864 PolarHBondContact ND1-OE1 2.89Å; H861-Q864 PolarHBondContact O-N 3.39Å; H861-I865 HydrophobicContact CB-CD1 3.82Å; H861-I865 HydrophobicContact CB-CG1 3.96Å; H861-I865 WeakPolarHBondContact O-CB 3.11Å; H861-I865 VanDerWaalsContact O-CG1 3.26Å; H861-I865 WeakPolarHBondContact O-CG1 3.2Å; H861-I865 PolarHBondContact O-N 3.09Å
862	F	83.9	Confident	84.9	Confident	142 Å²	142	65.3 Å²	65.3	62%	0.623	34%	0.336	S	S	*	.	H	α-helix	trans	-50.5	-46.3	-175	-178.8	-104.9	0	0	0	112.8	L858 I860 T866	L858-F862 WeakPolarHBondContact O-CA 3.49Å; L858-F862 WeakPolarHBondContact O-CB 3.35Å; L858-F862 PolarHBondContact O-N 3.47Å; I860-F862 VanDerWaalsContact C-N 3.25Å; I860-F862 PolarHBondContact O-N 2.96Å; F862-T866 WeakPolarHBondContact O-CB 3.41Å; F862-T866 PolarHBondContact O-N 3Å; F862-T866 PolarHBondContact O-OG1 3.06Å
863	G	83.6	Confident	85	Confident	53 Å²	53	66.1 Å²	66.1	55%	0.546	35%	0.348	S	S	.	.	H	α-helix	trans	-66.2	-40.4	178.4	0	0	0	0	0	114	H861 S867	H861-G863 VanDerWaalsContact C-N 3.28Å; H861-G863 PolarHBondContact O-N 2.88Å; H861-G863 VanDerWaalsContact O-N 3.17Å; G863-S867 PolarHBondContact O-N 2.64Å; G863-S867 PolarHBondContact O-OG 3.14Å
864	Q	84.1	Confident	84.9	Confident	90 Å²	90	67.3 Å²	67.3	42%	0.421	36%	0.356	S	S	.	.	H	α-helix	trans	-74.5	-33.8	179.7	-68.5	177.1	-23.4	0	0	112.1	F827 H861 S867 N868	F827-Q864 HydrophobicContact CD2-CB 3.95Å; F827-Q864 HydrophobicContact CE1-CB 4.32Å; F827-Q864 HydrophobicContact CE2-CB 3.6Å; F827-Q864 HydrophobicContact CG-CB 4.44Å; F827-Q864 VanDerWaalsContact CG-OE1 3.23Å; F827-Q864 HydrophobicContact CZ-CB 3.8Å; H861-Q864 PolarHBondContact ND1-OE1 2.89Å; H861-Q864 PolarHBondContact O-N 3.39Å; Q864-S867 PolarHBondContact O-OG 3.44Å; Q864-N868 PolarHBondContact O-N 2.86Å
865	I	85.1	Confident	84.8	Confident	10 Å²	10	69.8 Å²	69.8	5%	0.051	37%	0.369	C	S	.	.	H	α-helix	trans	-70.9	-43.6	176.8	-68.5	173.7	0	0	0	110.3	F827 L834 L858 H861 S867 N868 L871 I875	F827-I865 HydrophobicContact CE2-CG1 4.1Å; L834-I865 HydrophobicContact CD1-CD1 4.42Å; L858-I865 HydrophobicContact CD2-CD1 3.92Å; H861-I865 HydrophobicContact CB-CD1 3.82Å; H861-I865 HydrophobicContact CB-CG1 3.96Å; H861-I865 WeakPolarHBondContact O-CB 3.11Å; H861-I865 VanDerWaalsContact O-CG1 3.26Å; H861-I865 WeakPolarHBondContact O-CG1 3.2Å; H861-I865 PolarHBondContact O-N 3.09Å; I865-S867 VanDerWaalsContact C-N 3.28Å; I865-S867 PolarHBondContact O-N 3.04Å; I865-N868 PolarHBondContact O-N 2.83Å; I865-L871 HydrophobicContact CB-CD1 4.49Å; I865-L871 HydrophobicContact CG1-CD1 4.18Å; I865-L871 HydrophobicContact CG2-CD1 4.33Å; I865-I875 HydrophobicContact CG2-CD1 3.27Å
866	T	83.8	Confident	84.9	Confident	95 Å²	95	69.6 Å²	69.6	58%	0.583	37%	0.369	S	S	*	.	H	α-helix	trans	-65.4	-32.1	179.7	-55.4	0	0	0	0	112.3	F862	F862-T866 WeakPolarHBondContact O-CB 3.41Å; F862-T866 PolarHBondContact O-N 3Å; F862-T866 PolarHBondContact O-OG1 3.06Å
867	S	86.9	Confident	85	Confident	94 Å²	94	75.4 Å²	75.4	66%	0.657	40%	0.395	S	S	*	.	H	α-helix	trans	-75.3	-21.9	176.6	56.7	0	0	0	0	113.6	G863 Q864 I865	G863-S867 PolarHBondContact O-N 2.64Å; G863-S867 PolarHBondContact O-OG 3.14Å; Q864-S867 PolarHBondContact O-OG 3.44Å; I865-S867 VanDerWaalsContact C-N 3.28Å; I865-S867 PolarHBondContact O-N 3.04Å
868	N	86.3	Confident	85.1	Confident	53 Å²	53	75.8 Å²	75.8	28%	0.283	40%	0.397	S	S	.	.			trans	-95.9	102.5	-177.3	-170.1	-9.1	0	0	0	112.7	Q864 I865 M870 L871	Q864-N868 PolarHBondContact O-N 2.86Å; I865-N868 PolarHBondContact O-N 2.83Å; N868-M870 PolarHBondContact O-N 2.91Å; N868-M870 VanDerWaalsContact O-N 3.16Å; N868-M870 WeakPolarHBondContact OD1-CB 2.96Å; N868-M870 PolarHBondContact OD1-N 2.94Å; N868-M870 VanDerWaalsContact OD1-N 3.1Å; N868-L871 HydrophobicContact CB-CD1 4.14Å; N868-L871 HydrophobicContact CB-CG 4.39Å; N868-L871 PolarHBondContact O-N 3.04Å
869	Q	83.3	Confident	85.2	Confident	163 Å²	163	80.2 Å²	80.2	76%	0.762	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-61.4	-24.7	179.8	-65.5	-177.1	-4.3	0	0	114	L871 V872	Q869-L871 PolarHBondContact O-N 2.9Å; Q869-V872 PolarHBondContact O-N 3.36Å
870	M	82.4	Confident	85.5	Confident	154 Å²	154	79.9 Å²	79.9	76%	0.759	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-70.6	-19.2	-178.8	-61.8	-58.6	-65.4	0	0	113.4	N868	N868-M870 PolarHBondContact O-N 2.91Å; N868-M870 VanDerWaalsContact O-N 3.16Å; N868-M870 WeakPolarHBondContact OD1-CB 2.96Å; N868-M870 PolarHBondContact OD1-N 2.94Å; N868-M870 VanDerWaalsContact OD1-N 3.1Å
871	L	82.1	Confident	85.7	Confident	7 Å²	7	79.6 Å²	79.6	4%	0.037	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-86.6	-16.2	-179.9	-68.8	176.2	0	0	0	113.1	F827 P831 I865 N868 Q869 V874 I875	F827-L871 HydrophobicContact CZ-CD1 4.24Å; P831-L871 HydrophobicContact CB-CD2 3.92Å; P831-L871 HydrophobicContact CG-CD2 4.27Å; I865-L871 HydrophobicContact CB-CD1 4.49Å; I865-L871 HydrophobicContact CG1-CD1 4.18Å; I865-L871 HydrophobicContact CG2-CD1 4.33Å; N868-L871 HydrophobicContact CB-CD1 4.14Å; N868-L871 HydrophobicContact CB-CG 4.39Å; N868-L871 PolarHBondContact O-N 3.04Å; Q869-L871 PolarHBondContact O-N 2.9Å; L871-V874 WeakPolarHBondContact O-CB 3.34Å; L871-V874 PolarHBondContact O-N 2.86Å; L871-V874 VanDerWaalsContact O-N 3.11Å; L871-I875 HydrophobicContact CB-CD1 4.23Å; L871-I875 WeakPolarHBondContact O-CG1 3.48Å; L871-I875 PolarHBondContact O-N 3.44Å
872	V	84.8	Confident	85.8	Confident	85 Å²	85	79.2 Å²	79.2	52%	0.515	42%	0.416	S	S	.	.	H	α-helix	trans	-56.9	-48.7	-176.7	179.4	0	0	0	0	112.3	Q869 V874 I875 E876	Q869-V872 PolarHBondContact O-N 3.36Å; V872-V874 VanDerWaalsContact C-N 3.27Å; V872-V874 PolarHBondContact O-N 3.48Å; V872-I875 PolarHBondContact O-N 2.83Å; V872-E876 PolarHBondContact O-N 3.08Å
873	P	87.6	Confident	86	Confident	72 Å²	72	75.8 Å²	75.8	47%	0.468	40%	0.404	S	S	.	.	H	α-helix	trans	-67.3	-27.2	179.3	-19.7	33.5	0	0	0	113.6	K877	P873-K877 WeakPolarHBondContact O-CG 3.5Å; P873-K877 PolarHBondContact O-N 3.28Å
874	V	84.3	Confident	86.3	Confident	27 Å²	27	76.2 Å²	76.2	16%	0.164	40%	0.399	C	S	.	.	H	α-helix	trans	-71.7	-44.4	177	179.9	0	0	0	0	109.4	L834 K835 L871 V872 K877 L878	L834-V874 HydrophobicContact CB-CG1 4.34Å; K835-V874 HydrophobicContact CG-CG1 4.24Å; L871-V874 WeakPolarHBondContact O-CB 3.34Å; L871-V874 PolarHBondContact O-N 2.86Å; L871-V874 VanDerWaalsContact O-N 3.11Å; V872-V874 VanDerWaalsContact C-N 3.27Å; V872-V874 PolarHBondContact O-N 3.48Å; V874-K877 PolarHBondContact O-N 2.86Å; V874-L878 VanDerWaalsContact O-CB 3.23Å; V874-L878 WeakPolarHBondContact O-CB 3.39Å; V874-L878 PolarHBondContact O-N 3.35Å
875	I	86.6	Confident	86.4	Confident	55 Å²	55	74.3 Å²	74.3	28%	0.282	39%	0.389	S	S	.	.	H	α-helix	trans	-66.8	-39.1	179.2	-67.3	166	0	0	0	111.5	I865 L871 V872 L878 K879	I865-I875 HydrophobicContact CG2-CD1 3.27Å; L871-I875 HydrophobicContact CB-CD1 4.23Å; L871-I875 WeakPolarHBondContact O-CG1 3.48Å; L871-I875 PolarHBondContact O-N 3.44Å; V872-I875 PolarHBondContact O-N 2.83Å; I875-L878 PolarHBondContact O-N 2.92Å; I875-K879 WeakPolarHBondContact O-CB 3.4Å; I875-K879 PolarHBondContact O-N 3.27Å
876	E	88.6	Confident	86.6	Confident	121 Å²	121	76.7 Å²	76.7	57%	0.565	40%	0.404	S	S	*	.	H	α-helix	trans	-61.8	-47.8	177.1	-173.1	168	-151.5	0	0	111.5	V872 L878 K879 E880	V872-E876 PolarHBondContact O-N 3.08Å; E876-L878 VanDerWaalsContact C-N 3.33Å; E876-L878 PolarHBondContact O-N 2.87Å; E876-K879 WeakPolarHBondContact O-CB 3.33Å; E876-K879 PolarHBondContact O-N 2.8Å; E876-E880 PolarHBondContact O-N 3.34Å; E876-E880 VanDerWaalsContact O-N 3.16Å
877	K	87.1	Confident	86.9	Confident	130 Å²	130	79.6 Å²	79.6	57%	0.565	40%	0.404	S	S	*	.	H	α-helix	trans	-58.2	-47.1	172.4	-73.2	177.3	-179	-178.4	0	111.4	P873 V874 K879 E880 T881	P873-K877 WeakPolarHBondContact O-CG 3.5Å; P873-K877 PolarHBondContact O-N 3.28Å; V874-K877 PolarHBondContact O-N 2.86Å; K877-K879 VanDerWaalsContact C-N 3.31Å; K877-K879 PolarHBondContact O-N 2.69Å; K877-E880 PolarHBondContact O-N 3.34Å; K877-T881 PolarHBondContact O-N 3.23Å; K877-T881 PolarHBondContact O-OG1 3.11Å
878	L	87.9	Confident	87	Confident	8 Å²	8	79.8 Å²	79.8	4%	0.042	40%	0.395	C	S	.	.	H	α-helix	trans	-63.3	-39.2	-176.8	-156.2	155.9	0	0	0	111.3	L834 F837 N838 I841 L854 V874 I875 E876 T881 T882	L834-L878 HydrophobicContact CB-CD1 4.46Å; L834-L878 HydrophobicContact CD2-CD1 4.32Å; L834-L878 VanDerWaalsContact O-CD1 3.25Å; L834-L878 WeakPolarHBondContact O-CD1 3.42Å; F837-L878 HydrophobicContact CB-CD1 4.49Å; N838-L878 HydrophobicContact CB-CD1 4.27Å; N838-L878 HydrophobicContact CB-CG 4.3Å; I841-L878 HydrophobicContact CD1-CD2 4.47Å; L854-L878 HydrophobicContact CD1-CD1 3.78Å; L854-L878 HydrophobicContact CD1-CD2 3.46Å; L854-L878 VanDerWaalsContact CD1-CD2 3.46Å; L854-L878 HydrophobicContact CD1-CG 4.3Å; L854-L878 HydrophobicContact CD2-CD2 3.22Å; L854-L878 HydrophobicContact CG-CD2 3.91Å; V874-L878 VanDerWaalsContact O-CB 3.23Å; V874-L878 WeakPolarHBondContact O-CB 3.39Å; V874-L878 PolarHBondContact O-N 3.35Å; I875-L878 PolarHBondContact O-N 2.92Å; E876-L878 VanDerWaalsContact C-N 3.33Å; E876-L878 PolarHBondContact O-N 2.87Å; L878-T881 PolarHBondContact O-N 3.46Å; L878-T882 WeakPolarHBondContact CD2-OG1 3.19Å; L878-T882 VanDerWaalsContact O-CB 3.22Å; L878-T882 WeakPolarHBondContact O-CB 3.28Å; L878-T882 PolarHBondContact O-N 3.29Å; L878-T882 PolarHBondContact O-OG1 2.87Å
879	K	89.1	Confident	87	Confident	140 Å²	140	79.4 Å²	79.4	61%	0.609	39%	0.394	S	S	*	.	H	α-helix	trans	-58.6	-50.6	173.6	177.2	-172.4	173.6	-172.2	0	111.6	I875 E876 K877 T882 I883	I875-K879 WeakPolarHBondContact O-CB 3.4Å; I875-K879 PolarHBondContact O-N 3.27Å; E876-K879 WeakPolarHBondContact O-CB 3.33Å; E876-K879 PolarHBondContact O-N 2.8Å; K877-K879 VanDerWaalsContact C-N 3.31Å; K877-K879 PolarHBondContact O-N 2.69Å; K879-T882 PolarHBondContact O-N 2.78Å; K879-I883 HydrophobicContact CG-CD1 3.71Å; K879-I883 WeakPolarHBondContact O-CB 3.38Å; K879-I883 VanDerWaalsContact O-CG1 3.25Å; K879-I883 WeakPolarHBondContact O-CG1 3.2Å; K879-I883 PolarHBondContact O-N 2.83Å
880	E	90.1	Very high	87.3	Confident	131 Å²	131	77.6 Å²	77.6	61%	0.612	39%	0.386	S	S	*	.	H	α-helix	trans	-61	-47.7	179.4	-69.8	-177.3	167.4	0	0	111.7	E876 K877 S884	E876-E880 PolarHBondContact O-N 3.34Å; E876-E880 VanDerWaalsContact O-N 3.16Å; K877-E880 PolarHBondContact O-N 3.34Å; E880-S884 WeakPolarHBondContact O-CB 3.32Å; E880-S884 PolarHBondContact O-N 2.9Å; E880-S884 VanDerWaalsContact O-N 3.13Å
881	T	87.3	Confident	87.8	Confident	23 Å²	23	75.8 Å²	75.8	14%	0.141	38%	0.379	C	S	.	.	H	α-helix	trans	-62.7	-46.1	179.9	-37.3	0	0	0	0	111.5	N838 I841 Q842 K877 L878 S884 K885	N838-T881 PolarHBondContact OD1-OG1 2.78Å; I841-T881 HydrophobicContact CB-CG2 4.45Å; I841-T881 HydrophobicContact CG2-CG2 3.83Å; Q842-T881 HydrophobicContact CB-CG2 4.42Å; Q842-T881 HydrophobicContact CG-CG2 3.47Å; Q842-T881 VanDerWaalsContact CG-CG2 3.47Å; K877-T881 PolarHBondContact O-N 3.23Å; K877-T881 PolarHBondContact O-OG1 3.11Å; L878-T881 PolarHBondContact O-N 3.46Å; T881-S884 PolarHBondContact O-N 2.86Å; T881-K885 WeakPolarHBondContact O-CB 3.18Å; T881-K885 WeakPolarHBondContact O-CG 3Å; T881-K885 PolarHBondContact O-N 2.86Å
882	T	86.9	Confident	88.2	Confident	10 Å²	10	79.6 Å²	79.6	6%	0.061	40%	0.402	C	S	.	.	H	α-helix	trans	-66.5	-46	-176	-52.9	0	0	0	0	111.1	L854 L878 K879 S884 K885 V886	L854-T882 HydrophobicContact CD2-CG2 4.47Å; L878-T882 WeakPolarHBondContact CD2-OG1 3.19Å; L878-T882 VanDerWaalsContact O-CB 3.22Å; L878-T882 WeakPolarHBondContact O-CB 3.28Å; L878-T882 PolarHBondContact O-N 3.29Å; L878-T882 PolarHBondContact O-OG1 2.87Å; K879-T882 PolarHBondContact O-N 2.78Å; T882-S884 VanDerWaalsContact C-N 3.34Å; T882-S884 PolarHBondContact O-N 2.8Å; T882-K885 PolarHBondContact O-N 3.12Å; T882-V886 HydrophobicContact CG2-CG2 4.05Å; T882-V886 WeakPolarHBondContact O-CB 3.32Å; T882-V886 VanDerWaalsContact O-CG2 3.24Å; T882-V886 WeakPolarHBondContact O-CG2 3.38Å; T882-V886 PolarHBondContact O-N 2.76Å
883	I	89.1	Confident	88.4	Confident	71 Å²	71	79.3 Å²	79.3	36%	0.364	40%	0.397	S	S	.	.	H	α-helix	trans	-62.2	-43.5	178.5	-68.2	169.4	0	0	0	111	K879 K885 R887	K879-I883 HydrophobicContact CG-CD1 3.71Å; K879-I883 WeakPolarHBondContact O-CB 3.38Å; K879-I883 VanDerWaalsContact O-CG1 3.25Å; K879-I883 WeakPolarHBondContact O-CG1 3.2Å; K879-I883 PolarHBondContact O-N 2.83Å; I883-K885 PolarHBondContact O-N 2.9Å; I883-R887 WeakPolarHBondContact O-CB 3.45Å; I883-R887 VanDerWaalsContact O-CG 3.29Å; I883-R887 WeakPolarHBondContact O-CG 3.21Å; I883-R887 PolarHBondContact O-N 2.91Å
884	S	89.2	Confident	88.7	Confident	62 Å²	62	77.6 Å²	77.6	43%	0.434	39%	0.393	S	S	.	.	H	α-helix	trans	-60.3	-46.3	178.3	-176.5	0	0	0	0	111.5	E880 T881 T882 Q888	E880-S884 WeakPolarHBondContact O-CB 3.32Å; E880-S884 PolarHBondContact O-N 2.9Å; E880-S884 VanDerWaalsContact O-N 3.13Å; T881-S884 PolarHBondContact O-N 2.86Å; T882-S884 VanDerWaalsContact C-N 3.34Å; T882-S884 PolarHBondContact O-N 2.8Å; S884-Q888 WeakPolarHBondContact O-CG 3.43Å; S884-Q888 PolarHBondContact O-N 2.75Å; S884-Q888 VanDerWaalsContact O-N 3.13Å
885	K	86.9	Confident	89.2	Confident	49 Å²	49	84.1 Å²	84.1	21%	0.213	42%	0.419	C	S	.	.	H	α-helix	trans	-73.3	-39.7	-178.6	-72.3	-68.7	179.1	-174	0	113.7	I841 I847 T881 T882 I883 R887 Q888 V889	I841-K885 HydrophobicContact CG2-CB 4.14Å; I841-K885 HydrophobicContact CG2-CG 4.01Å; I847-K885 HydrophobicContact CD1-CB 4.17Å; T881-K885 WeakPolarHBondContact O-CB 3.18Å; T881-K885 WeakPolarHBondContact O-CG 3Å; T881-K885 PolarHBondContact O-N 2.86Å; T882-K885 PolarHBondContact O-N 3.12Å; I883-K885 PolarHBondContact O-N 2.9Å; K885-R887 VanDerWaalsContact C-N 3.31Å; K885-R887 PolarHBondContact O-N 2.98Å; K885-Q888 WeakPolarHBondContact O-CB 3.49Å; K885-Q888 PolarHBondContact O-N 2.69Å; K885-V889 WeakPolarHBondContact O-CG2 3.4Å; K885-V889 PolarHBondContact O-N 3.45Å
886	V	88.1	Confident	89.6	Confident	61 Å²	61	85.7 Å²	85.7	37%	0.37	43%	0.428	S	S	.	.	H	α-helix	trans	-63	-39.8	174.6	171.2	0	0	0	0	110.6	I847 T882 Q888 V889 Q890	I847-V886 HydrophobicContact CG2-CG2 4.29Å; T882-V886 HydrophobicContact CG2-CG2 4.05Å; T882-V886 WeakPolarHBondContact O-CB 3.32Å; T882-V886 VanDerWaalsContact O-CG2 3.24Å; T882-V886 WeakPolarHBondContact O-CG2 3.38Å; T882-V886 PolarHBondContact O-N 2.76Å; V886-Q888 PolarHBondContact O-N 3.26Å; V886-V889 PolarHBondContact O-N 2.95Å; V886-Q890 VanDerWaalsContact O-CB 3.29Å; V886-Q890 WeakPolarHBondContact O-CB 3.46Å; V886-Q890 PolarHBondContact O-N 2.86Å
887	R	89.9	Confident	89.7	Confident	156 Å²	156	84.8 Å²	84.8	59%	0.589	43%	0.425	S	S	*	.	H	α-helix	trans	-60.4	-43.8	172.5	-76.8	177	-178.3	172.5	1.2	112.2	I883 K885 V889 Q890 D891	I883-R887 WeakPolarHBondContact O-CB 3.45Å; I883-R887 VanDerWaalsContact O-CG 3.29Å; I883-R887 WeakPolarHBondContact O-CG 3.21Å; I883-R887 PolarHBondContact O-N 2.91Å; K885-R887 VanDerWaalsContact C-N 3.31Å; K885-R887 PolarHBondContact O-N 2.98Å; R887-V889 VanDerWaalsContact C-N 3.33Å; R887-V889 PolarHBondContact O-N 2.85Å; R887-Q890 PolarHBondContact O-N 2.98Å; R887-D891 WeakPolarHBondContact O-CB 3.28Å; R887-D891 PolarHBondContact O-N 2.86Å
888	Q	89.1	Confident	89.9	Confident	98 Å²	98	81.6 Å²	81.6	46%	0.458	42%	0.423	S	S	.	.	H	α-helix	trans	-58.2	-44.6	175.4	-72.3	176.3	2.8	0	0	112	S884 K885 V886 V892	S884-Q888 WeakPolarHBondContact O-CG 3.43Å; S884-Q888 PolarHBondContact O-N 2.75Å; S884-Q888 VanDerWaalsContact O-N 3.13Å; K885-Q888 WeakPolarHBondContact O-CB 3.49Å; K885-Q888 PolarHBondContact O-N 2.69Å; V886-Q888 PolarHBondContact O-N 3.26Å; Q888-V892 VanDerWaalsContact O-CG2 3.32Å; Q888-V892 WeakPolarHBondContact O-CG2 3.44Å; Q888-V892 PolarHBondContact O-N 3.33Å
889	V	86.4	Confident	90.2	Very high	44 Å²	44	82.8 Å²	82.8	27%	0.267	44%	0.437	S	S	.	.	H	α-helix	trans	-66.6	-43.1	177.2	175.2	0	0	0	0	111	I847 K885 V886 R887 D891 V892 I893	I847-V889 HydrophobicContact CD1-CG2 3.62Å; K885-V889 WeakPolarHBondContact O-CG2 3.4Å; K885-V889 PolarHBondContact O-N 3.45Å; V886-V889 PolarHBondContact O-N 2.95Å; R887-V889 VanDerWaalsContact C-N 3.33Å; R887-V889 PolarHBondContact O-N 2.85Å; V889-D891 VanDerWaalsContact C-N 3.34Å; V889-D891 PolarHBondContact O-N 2.82Å; V889-V892 PolarHBondContact O-N 3.14Å; V889-I893 HydrophobicContact CG1-CD1 3.72Å; V889-I893 HydrophobicContact CG1-CG1 4.33Å; V889-I893 WeakPolarHBondContact O-CG1 3.21Å; V889-I893 PolarHBondContact O-N 3Å
890	Q	89.9	Confident	90.2	Very high	126 Å²	126	81.6 Å²	81.6	59%	0.589	44%	0.436	S	S	*	.	H	α-helix	trans	-59.7	-43.3	177.1	-175.8	-179.9	19	0	0	111.8	V886 R887 V892 I893 G894	V886-Q890 VanDerWaalsContact O-CB 3.29Å; V886-Q890 WeakPolarHBondContact O-CB 3.46Å; V886-Q890 PolarHBondContact O-N 2.86Å; R887-Q890 PolarHBondContact O-N 2.98Å; Q890-V892 VanDerWaalsContact C-N 3.35Å; Q890-I893 PolarHBondContact O-N 2.91Å; Q890-G894 PolarHBondContact O-N 3.44Å
891	D	92.8	Very high	90.3	Very high	115 Å²	115	78.9 Å²	78.9	62%	0.615	43%	0.426	S	S	*	.	H	α-helix	trans	-64.5	-40.4	178.3	-69.6	-22	0	0	0	111.2	R887 V889 G894 F895	R887-D891 WeakPolarHBondContact O-CB 3.28Å; R887-D891 PolarHBondContact O-N 2.86Å; V889-D891 VanDerWaalsContact C-N 3.34Å; V889-D891 PolarHBondContact O-N 2.82Å; D891-G894 PolarHBondContact O-N 2.85Å; D891-F895 WeakPolarHBondContact O-CB 3.32Å; D891-F895 PolarHBondContact O-N 3.26Å
892	V	90.2	Very high	90.5	Very high	87 Å²	87	85.2 Å²	85.2	53%	0.527	45%	0.449	S	S	.	.	H	α-helix	trans	-64.6	-45.5	175.2	172.3	0	0	0	0	111.2	Q888 V889 Q890 F895 N896	Q888-V892 VanDerWaalsContact O-CG2 3.32Å; Q888-V892 WeakPolarHBondContact O-CG2 3.44Å; Q888-V892 PolarHBondContact O-N 3.33Å; V889-V892 PolarHBondContact O-N 3.14Å; Q890-V892 VanDerWaalsContact C-N 3.35Å; V892-F895 PolarHBondContact O-N 3.29Å; V892-N896 WeakPolarHBondContact O-CB 3.42Å; V892-N896 PolarHBondContact O-N 3.48Å; V892-N896 PolarHBondContact O-ND2 2.85Å
893	I	89.1	Confident	90.6	Very high	79 Å²	79	89 Å²	89	41%	0.405	47%	0.468	S	S	.	.	H	α-helix	trans	-64.2	-43.6	177	-67.2	170.1	0	0	0	110.4	V889 Q890 F895 N896 M897	V889-I893 HydrophobicContact CG1-CD1 3.72Å; V889-I893 HydrophobicContact CG1-CG1 4.33Å; V889-I893 WeakPolarHBondContact O-CG1 3.21Å; V889-I893 PolarHBondContact O-N 3Å; Q890-I893 PolarHBondContact O-N 2.91Å; I893-F895 VanDerWaalsContact C-N 3.34Å; I893-F895 PolarHBondContact O-N 2.88Å; I893-N896 PolarHBondContact O-N 2.93Å; I893-M897 HydrophobicContact CG2-CE 4.07Å; I893-M897 VanDerWaalsContact O-CB 3.31Å; I893-M897 WeakPolarHBondContact O-CB 3.42Å; I893-M897 PolarHBondContact O-N 3.2Å
894	G	94.1	Very high	90.6	Very high	36 Å²	36	91.5 Å²	91.5	37%	0.371	48%	0.476	S	S	.	.	H	α-helix	trans	-60.5	-42.7	177.6	0	0	0	0	0	112.1	Q890 D891 A898	Q890-G894 PolarHBondContact O-N 3.44Å; D891-G894 PolarHBondContact O-N 2.85Å; G894-A898 WeakPolarHBondContact O-CB 3.34Å; G894-A898 PolarHBondContact O-N 3.3Å
895	F	94.9	Very high	90.5	Very high	164 Å²	164	96.7 Å²	96.7	72%	0.719	49%	0.487	S	S	*	.	H	α-helix	trans	-62.6	-46.1	173.8	-175.5	-95.1	0	0	0	112	D891 V892 I893 A898 G899	D891-F895 WeakPolarHBondContact O-CB 3.32Å; D891-F895 PolarHBondContact O-N 3.26Å; V892-F895 PolarHBondContact O-N 3.29Å; I893-F895 VanDerWaalsContact C-N 3.34Å; I893-F895 PolarHBondContact O-N 2.88Å; F895-A898 PolarHBondContact O-N 3.49Å; F895-G899 PolarHBondContact O-N 3.01Å
896	N	94.1	Very high	90.5	Very high	88 Å²	88	97.8 Å²	97.8	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-64.7	-40.6	178.9	-70.9	-15.7	0	0	0	112.4	V892 I893 G899 L900	V892-N896 WeakPolarHBondContact O-CB 3.42Å; V892-N896 PolarHBondContact O-N 3.48Å; V892-N896 PolarHBondContact O-ND2 2.85Å; I893-N896 PolarHBondContact O-N 2.93Å; N896-G899 CarbonylContact O-C 3.52Å; N896-G899 PolarHBondContact O-N 2.97Å; N896-L900 WeakPolarHBondContact O-CG 3.45Å; N896-L900 PolarHBondContact O-N 2.94Å
897	M	90.9	Very high	90.1	Very high	103 Å²	103	98.6 Å²	98.6	51%	0.507	50%	0.5	S	S	.	.	H	α-helix	trans	-66.3	-44.6	178.3	-166.6	-175.2	-28.8	0	0	111.1	I893 G899 L900 D901	I893-M897 HydrophobicContact CG2-CE 4.07Å; I893-M897 VanDerWaalsContact O-CB 3.31Å; I893-M897 WeakPolarHBondContact O-CB 3.42Å; I893-M897 PolarHBondContact O-N 3.2Å; M897-G899 VanDerWaalsContact C-N 3.26Å; M897-G899 PolarHBondContact O-N 3.05Å; M897-L900 PolarHBondContact O-N 2.88Å; M897-D901 WeakPolarHBondContact O-CB 3.17Å; M897-D901 PolarHBondContact O-N 2.88Å
898	A	91.8	Very high	89.7	Confident	63 Å²	63	95.2 Å²	95.2	52%	0.521	49%	0.491	S	S	.	.	H	α-helix	trans	-60.5	-37.9	172.9	0	0	0	0	0	111.8	G894 F895 Y902	G894-A898 WeakPolarHBondContact O-CB 3.34Å; G894-A898 PolarHBondContact O-N 3.3Å; F895-A898 PolarHBondContact O-N 3.49Å; A898-Y902 WeakPolarHBondContact O-CB 3.5Å; A898-Y902 PolarHBondContact O-N 2.91Å
899	G	93.6	Very high	89.3	Confident	32 Å²	32	93 Å²	93	33%	0.33	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-43.2	172.9	0	0	0	0	0	113.3	F895 N896 M897 Y902 L903	F895-G899 PolarHBondContact O-N 3.01Å; N896-G899 CarbonylContact O-C 3.52Å; N896-G899 PolarHBondContact O-N 2.97Å; M897-G899 VanDerWaalsContact C-N 3.26Å; M897-G899 PolarHBondContact O-N 3.05Å; G899-Y902 WeakPolarHBondContact O-CB 3.03Å; G899-Y902 PolarHBondContact O-N 2.83Å; G899-L903 WeakPolarHBondContact O-CG 3.31Å; G899-L903 PolarHBondContact O-N 2.84Å
900	L	90.8	Very high	88.9	Confident	115 Å²	115	96.6 Å²	96.6	60%	0.602	50%	0.501	S	S	*	.	H	α-helix	trans	-67.6	-40.4	176.3	-76.5	171.1	0	0	0	112.1	N896 M897 Y902 L903 K904	N896-L900 WeakPolarHBondContact O-CG 3.45Å; N896-L900 PolarHBondContact O-N 2.94Å; M897-L900 PolarHBondContact O-N 2.88Å; L900-Y902 VanDerWaalsContact C-N 3.3Å; L900-Y902 PolarHBondContact O-N 3.05Å; L900-L903 CarbonylContact O-C 3.56Å; L900-L903 PolarHBondContact O-N 2.86Å; L900-K904 VanDerWaalsContact O-CB 3.27Å; L900-K904 WeakPolarHBondContact O-CB 3.16Å; L900-K904 PolarHBondContact O-N 3.2Å
901	D	90.6	Very high	87.9	Confident	75 Å²	75	93.3 Å²	93.3	40%	0.401	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-39.4	174.6	-86.4	-12.5	0	0	0	111.4	M897 K904 R905	M897-D901 WeakPolarHBondContact O-CB 3.17Å; M897-D901 PolarHBondContact O-N 2.88Å; D901-K904 PolarHBondContact O-N 3.25Å; D901-R905 WeakPolarHBondContact O-CB 3.29Å; D901-R905 VanDerWaalsContact O-CG 3.31Å; D901-R905 WeakPolarHBondContact O-CG 3.47Å; D901-R905 PolarHBondContact O-N 2.9Å
902	Y	92.3	Very high	86.8	Confident	156 Å²	156	93.4 Å²	93.4	61%	0.612	49%	0.489	S	S	*	.	H	α-helix	trans	-61	-48.2	172.2	179.8	-96.2	0	0	0	111.4	A898 G899 L900 K904 R905 E906	A898-Y902 WeakPolarHBondContact O-CB 3.5Å; A898-Y902 PolarHBondContact O-N 2.91Å; G899-Y902 WeakPolarHBondContact O-CB 3.03Å; G899-Y902 PolarHBondContact O-N 2.83Å; L900-Y902 VanDerWaalsContact C-N 3.3Å; L900-Y902 PolarHBondContact O-N 3.05Å; Y902-K904 VanDerWaalsContact C-N 3.33Å; Y902-K904 PolarHBondContact O-N 3.03Å; Y902-R905 PolarHBondContact O-N 3.47Å; Y902-E906 PolarHBondContact O-N 2.92Å
903	L	89.1	Confident	85.3	Confident	90 Å²	90	94 Å²	94	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-36.7	176.9	-73.6	170.7	0	0	0	112.7	G899 L900 E906 C907	G899-L903 WeakPolarHBondContact O-CG 3.31Å; G899-L903 PolarHBondContact O-N 2.84Å; L900-L903 CarbonylContact O-C 3.56Å; L900-L903 PolarHBondContact O-N 2.86Å; L903-E906 WeakPolarHBondContact O-CB 3.35Å; L903-E906 PolarHBondContact O-N 3.28Å; L903-C907 WeakPolarHBondContact O-CB 3.42Å; L903-C907 PolarHBondContact O-N 3.3Å; L903-C907 PolarHBondContact O-SG 3.07Å
904	K	89.1	Confident	83.9	Confident	122 Å²	122	96.3 Å²	96.3	53%	0.53	50%	0.503	S	S	.	.	H	α-helix	trans	-64.7	-48.3	176.1	180	179.3	171.4	-176	0	110.1	L900 D901 Y902 E906 C907 E908	L900-K904 VanDerWaalsContact O-CB 3.27Å; L900-K904 WeakPolarHBondContact O-CB 3.16Å; L900-K904 PolarHBondContact O-N 3.2Å; D901-K904 PolarHBondContact O-N 3.25Å; Y902-K904 VanDerWaalsContact C-N 3.33Å; Y902-K904 PolarHBondContact O-N 3.03Å; K904-E906 PolarHBondContact O-N 3.39Å; K904-C907 CarbonylContact O-C 3.55Å; K904-C907 WeakPolarHBondContact O-CB 3.47Å; K904-C907 PolarHBondContact O-N 2.91Å; K904-C907 VanDerWaalsContact O-N 3.12Å; K904-E908 WeakPolarHBondContact CE-OE1 3.2Å; K904-E908 HydrophobicContact CG-CG 4.44Å; K904-E908 WeakPolarHBondContact O-CB 3.38Å; K904-E908 WeakPolarHBondContact O-CG 3.38Å; K904-E908 PolarHBondContact O-N 2.99Å
905	R	87.4	Confident	82.1	Confident	172 Å²	172	101.6 Å²	101.6	65%	0.649	52%	0.516	S	S	*	.	H	α-helix	trans	-59.5	-37.4	173.7	-72.8	176.1	-171.4	166.4	6	111.7	D901 Y902 E908 A909	D901-R905 WeakPolarHBondContact O-CB 3.29Å; D901-R905 VanDerWaalsContact O-CG 3.31Å; D901-R905 WeakPolarHBondContact O-CG 3.47Å; D901-R905 PolarHBondContact O-N 2.9Å; Y902-R905 PolarHBondContact O-N 3.47Å; R905-E908 PolarHBondContact O-N 2.9Å; R905-A909 VanDerWaalsContact O-CB 3.27Å; R905-A909 WeakPolarHBondContact O-CB 2.99Å; R905-A909 PolarHBondContact O-N 2.76Å
906	E	86.6	Confident	80.3	Confident	71 Å²	71	100.4 Å²	100.4	33%	0.332	51%	0.511	S	S	.	.	H	α-helix	trans	-67.5	-39.8	175.3	-155.2	-163.6	149	0	0	111.9	Y902 L903 K904 K910	Y902-E906 PolarHBondContact O-N 2.92Å; L903-E906 WeakPolarHBondContact O-CB 3.35Å; L903-E906 PolarHBondContact O-N 3.28Å; K904-E906 PolarHBondContact O-N 3.39Å; E906-K910 WeakPolarHBondContact O-CB 3.41Å; E906-K910 VanDerWaalsContact O-CG 3.28Å; E906-K910 WeakPolarHBondContact O-CG 3.11Å; E906-K910 PolarHBondContact O-N 3.39Å; E906-K910 VanDerWaalsContact OE1-CE 3.24Å; E906-K910 WeakPolarHBondContact OE1-CE 3.2Å; E906-K910 IonicContact OE1-NZ 2.67Å; E906-K910 PolarHBondContact OE1-NZ 2.9Å
907	C	79.6	Confident	78.5	Confident	78 Å²	78	98.7 Å²	98.7	53%	0.527	51%	0.509	S	S	.	.	H	α-helix	trans	-67.2	-40.8	173.7	-68.5	0	0	0	0	112.1	L903 K904 K910 S911	L903-C907 WeakPolarHBondContact O-CB 3.42Å; L903-C907 PolarHBondContact O-N 3.3Å; L903-C907 PolarHBondContact O-SG 3.07Å; K904-C907 CarbonylContact O-C 3.55Å; K904-C907 WeakPolarHBondContact O-CB 3.47Å; K904-C907 PolarHBondContact O-N 2.91Å; K904-C907 VanDerWaalsContact O-N 3.12Å; C907-K910 PolarHBondContact O-N 3.27Å; C907-S911 WeakPolarHBondContact O-CB 3.29Å; C907-S911 PolarHBondContact O-N 2.91Å; C907-S911 PolarHBondContact O-OG 3.06Å; C907-S911 VanDerWaalsContact O-OG 3.12Å
908	E	82.4	Confident	76.8	Confident	86 Å²	86	99.6 Å²	99.6	40%	0.402	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-48.2	174.6	-75.9	172.7	173.8	0	0	109.8	K904 R905 K910 S911 E912	K904-E908 WeakPolarHBondContact CE-OE1 3.2Å; K904-E908 HydrophobicContact CG-CG 4.44Å; K904-E908 WeakPolarHBondContact O-CB 3.38Å; K904-E908 WeakPolarHBondContact O-CG 3.38Å; K904-E908 PolarHBondContact O-N 2.99Å; R905-E908 PolarHBondContact O-N 2.9Å; E908-K910 VanDerWaalsContact C-N 3.33Å; E908-K910 PolarHBondContact O-N 2.88Å; E908-S911 WeakPolarHBondContact CA-OG 3.18Å; E908-S911 CarbonylContact O-C 3.54Å; E908-S911 PolarHBondContact O-N 2.84Å; E908-S911 VanDerWaalsContact O-N 3.09Å; E908-S911 PolarHBondContact O-OG 3.06Å; E908-E912 WeakPolarHBondContact O-CB 3.34Å; E908-E912 WeakPolarHBondContact O-CG 3.46Å; E908-E912 PolarHBondContact O-N 3.5Å
909	A	79.6	Confident	75.1	Confident	50 Å²	50	99.1 Å²	99.1	41%	0.413	51%	0.508	S	S	.	.	H	α-helix	trans	-58.4	-43	174.3	0	0	0	0	0	112.2	R905 V913	R905-A909 VanDerWaalsContact O-CB 3.27Å; R905-A909 WeakPolarHBondContact O-CB 2.99Å; R905-A909 PolarHBondContact O-N 2.76Å; A909-V913 WeakPolarHBondContact O-CB 3.32Å; A909-V913 WeakPolarHBondContact O-CG2 3.25Å; A909-V913 PolarHBondContact O-N 3.35Å
910	K	77.3	Confident	73.3	Confident	120 Å²	120	101.6 Å²	101.6	52%	0.522	52%	0.517	S	S	.	.	H	α-helix	trans	-64.7	-39.9	174.5	-75.3	172.1	-172.9	165.5	0	112.3	E906 C907 E908 V913 M914	E906-K910 WeakPolarHBondContact O-CB 3.41Å; E906-K910 VanDerWaalsContact O-CG 3.28Å; E906-K910 WeakPolarHBondContact O-CG 3.11Å; E906-K910 PolarHBondContact O-N 3.39Å; E906-K910 VanDerWaalsContact OE1-CE 3.24Å; E906-K910 WeakPolarHBondContact OE1-CE 3.2Å; E906-K910 IonicContact OE1-NZ 2.67Å; E906-K910 PolarHBondContact OE1-NZ 2.9Å; C907-K910 PolarHBondContact O-N 3.27Å; E908-K910 VanDerWaalsContact C-N 3.33Å; E908-K910 PolarHBondContact O-N 2.88Å; K910-V913 PolarHBondContact O-N 2.95Å; K910-M914 WeakPolarHBondContact O-CG 3.39Å; K910-M914 PolarHBondContact O-N 3.24Å
911	S	69.6	Low	71.6	Confident	58 Å²	58	98.9 Å²	98.9	41%	0.406	51%	0.508	S	S	.	.	H	α-helix	trans	-75.6	-33.9	-179.4	67.6	0	0	0	0	112.6	C907 E908 M914 F915	C907-S911 WeakPolarHBondContact O-CB 3.29Å; C907-S911 PolarHBondContact O-N 2.91Å; C907-S911 PolarHBondContact O-OG 3.06Å; C907-S911 VanDerWaalsContact O-OG 3.12Å; E908-S911 WeakPolarHBondContact CA-OG 3.18Å; E908-S911 CarbonylContact O-C 3.54Å; E908-S911 PolarHBondContact O-N 2.84Å; E908-S911 VanDerWaalsContact O-N 3.09Å; E908-S911 PolarHBondContact O-OG 3.06Å; S911-M914 CarbonylContact O-C 3.55Å; S911-M914 WeakPolarHBondContact O-CB 3.19Å; S911-M914 PolarHBondContact O-N 3.49Å; S911-F915 WeakPolarHBondContact O-CB 3.43Å; S911-F915 PolarHBondContact O-N 3.43Å
912	E	69.4	Low	70.1	Confident	116 Å²	116	101 Å²	101	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-46.1	167.7	-77.5	-175.6	177.2	0	0	110.5	E908 M914 F915 F916	E908-E912 WeakPolarHBondContact O-CB 3.34Å; E908-E912 WeakPolarHBondContact O-CG 3.46Å; E908-E912 PolarHBondContact O-N 3.5Å; E912-M914 VanDerWaalsContact C-N 3.26Å; E912-M914 PolarHBondContact O-N 3.16Å; E912-F915 CarbonylContact O-C 3.58Å; E912-F915 WeakPolarHBondContact O-CA 3.3Å; E912-F915 WeakPolarHBondContact O-CB 3.37Å; E912-F915 PolarHBondContact O-N 3.47Å; E912-F916 HydrophobicContact CB-CD2 4.35Å; E912-F916 HydrophobicContact CB-CE2 4.32Å; E912-F916 WeakPolarHBondContact O-CD2 3.09Å; E912-F916 PolarHBondContact O-N 3.33Å
913	V	59.8	Low	68.4	Low	99 Å²	99	98.1 Å²	98.1	60%	0.6	51%	0.509	S	S	*	.	H	α-helix	trans	-57.9	-40.2	174.6	169.7	0	0	0	0	111.2	A909 K910 F916 A917	A909-V913 WeakPolarHBondContact O-CB 3.32Å; A909-V913 WeakPolarHBondContact O-CG2 3.25Å; A909-V913 PolarHBondContact O-N 3.35Å; K910-V913 PolarHBondContact O-N 2.95Å; V913-F916 PolarHBondContact O-N 2.92Å; V913-A917 WeakPolarHBondContact O-CB 3.21Å; V913-A917 PolarHBondContact O-N 2.8Å
914	M	59	Low	67.2	Low	128 Å²	128	100.2 Å²	100.2	63%	0.631	52%	0.517	S	S	*	.	H	α-helix	trans	-65.9	-42.1	173	-71.6	-67	-68.6	0	0	112.3	K910 S911 E912 A917 E918	K910-M914 WeakPolarHBondContact O-CG 3.39Å; K910-M914 PolarHBondContact O-N 3.24Å; S911-M914 CarbonylContact O-C 3.55Å; S911-M914 WeakPolarHBondContact O-CB 3.19Å; S911-M914 PolarHBondContact O-N 3.49Å; E912-M914 VanDerWaalsContact C-N 3.26Å; E912-M914 PolarHBondContact O-N 3.16Å; M914-A917 PolarHBondContact O-N 3.43Å; M914-E918 PolarHBondContact O-N 2.91Å
915	F	57.3	Low	66.1	Low	147 Å²	147	98.7 Å²	98.7	65%	0.645	51%	0.512	S	S	*	.	H	α-helix	trans	-64.2	-39	175.7	-108.7	-80.7	0	0	0	112.4	S911 E912 E918 A919	S911-F915 WeakPolarHBondContact O-CB 3.43Å; S911-F915 PolarHBondContact O-N 3.43Å; E912-F915 CarbonylContact O-C 3.58Å; E912-F915 WeakPolarHBondContact O-CA 3.3Å; E912-F915 WeakPolarHBondContact O-CB 3.37Å; E912-F915 PolarHBondContact O-N 3.47Å; F915-E918 PolarHBondContact O-N 3.1Å; F915-A919 WeakPolarHBondContact O-CB 3.47Å; F915-A919 PolarHBondContact O-N 2.8Å
916	F	55.9	Low	65.1	Low	139 Å²	139	97.5 Å²	97.5	61%	0.61	51%	0.511	S	S	*	.	H	α-helix	trans	-67.8	-38.8	174.2	-79.2	-69.1	0	0	0	110.9	E912 V913 T920	E912-F916 HydrophobicContact CB-CD2 4.35Å; E912-F916 HydrophobicContact CB-CE2 4.32Å; E912-F916 WeakPolarHBondContact O-CD2 3.09Å; E912-F916 PolarHBondContact O-N 3.33Å; V913-F916 PolarHBondContact O-N 2.92Å; F916-T920 VanDerWaalsContact O-CB 3.26Å; F916-T920 WeakPolarHBondContact O-CB 3.36Å; F916-T920 WeakPolarHBondContact O-CG2 3.28Å; F916-T920 PolarHBondContact O-N 2.8Å; F916-T920 PolarHBondContact O-OG1 2.92Å
917	A	57.5	Low	64.1	Low	52 Å²	52	102.2 Å²	102.2	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-65.1	-41.3	173.1	0	0	0	0	0	112.5	V913 M914 T920 S921	V913-A917 WeakPolarHBondContact O-CB 3.21Å; V913-A917 PolarHBondContact O-N 2.8Å; M914-A917 PolarHBondContact O-N 3.43Å; A917-T920 WeakPolarHBondContact CA-OG1 3.46Å; A917-T920 PolarHBondContact O-OG1 3.18Å; A917-S921 WeakPolarHBondContact O-CB 3.26Å; A917-S921 PolarHBondContact O-N 3.07Å; A917-S921 PolarHBondContact O-OG 3.43Å
918	E	54.2	Low	63.7	Low	122 Å²	122	107.7 Å²	107.7	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-69.8	-44.8	175.9	-107	-175.9	160.2	0	0	112.1	M914 F915 T920 S921 H922	M914-E918 PolarHBondContact O-N 2.91Å; F915-E918 PolarHBondContact O-N 3.1Å; E918-T920 PolarHBondContact O-N 2.83Å; E918-S921 PolarHBondContact O-N 2.84Å; E918-S921 PolarHBondContact O-OG 3.01Å; E918-H922 WeakPolarHBondContact O-CB 2.97Å; E918-H922 PolarHBondContact O-N 3.17Å
919	A	55.3	Low	63.2	Low	54 Å²	54	109.2 Å²	109.2	45%	0.446	54%	0.541	S	S	.	.	H	α-helix	trans	-64.3	-40.3	178	0	0	0	0	0	111.9	F915 H922 L923	F915-A919 WeakPolarHBondContact O-CB 3.47Å; F915-A919 PolarHBondContact O-N 2.8Å; A919-H922 PolarHBondContact O-N 2.81Å; A919-L923 WeakPolarHBondContact O-CB 3.15Å; A919-L923 PolarHBondContact O-N 3.39Å
920	T	56.8	Low	62.8	Low	83 Å²	83	115.9 Å²	115.9	51%	0.509	56%	0.555	S	S	.	*	H	α-helix	trans	-65.6	-43.1	174.9	49.8	0	0	0	0	111.5	F916 A917 E918 H922 L923 E924	F916-T920 VanDerWaalsContact O-CB 3.26Å; F916-T920 WeakPolarHBondContact O-CB 3.36Å; F916-T920 WeakPolarHBondContact O-CG2 3.28Å; F916-T920 PolarHBondContact O-N 2.8Å; F916-T920 PolarHBondContact O-OG1 2.92Å; A917-T920 WeakPolarHBondContact CA-OG1 3.46Å; A917-T920 PolarHBondContact O-OG1 3.18Å; E918-T920 PolarHBondContact O-N 2.83Å; T920-H922 PolarHBondContact O-N 2.82Å; T920-L923 PolarHBondContact O-N 3.43Å; T920-E924 WeakPolarHBondContact O-CG 3.33Å; T920-E924 PolarHBondContact O-N 3.02Å
921	S	55.1	Low	62.5	Low	59 Å²	59	117.2 Å²	117.2	41%	0.413	56%	0.561	S	S	.	*	H	α-helix	trans	-63.5	-39.2	175.3	71	0	0	0	0	112.8	A917 E918 L923 E924 E925	A917-S921 WeakPolarHBondContact O-CB 3.26Å; A917-S921 PolarHBondContact O-N 3.07Å; A917-S921 PolarHBondContact O-OG 3.43Å; E918-S921 PolarHBondContact O-N 2.84Å; E918-S921 PolarHBondContact O-OG 3.01Å; S921-L923 VanDerWaalsContact C-N 3.32Å; S921-L923 PolarHBondContact O-N 3.09Å; S921-E924 PolarHBondContact O-N 2.71Å; S921-E925 WeakPolarHBondContact O-CB 3.41Å; S921-E925 PolarHBondContact O-N 2.65Å
922	H	58.8	Low	62.6	Low	119 Å²	119	118.4 Å²	118.4	55%	0.551	56%	0.563	S	S	*	*	H	α-helix	trans	-65	-34.5	174	-112.1	-53.6	0	0	0	112.9	E918 A919 T920 K926	E918-H922 WeakPolarHBondContact O-CB 2.97Å; E918-H922 PolarHBondContact O-N 3.17Å; A919-H922 PolarHBondContact O-N 2.81Å; T920-H922 PolarHBondContact O-N 2.82Å; H922-K926 WeakPolarHBondContact O-CB 3.36Å; H922-K926 PolarHBondContact O-N 3.32Å
923	L	56.4	Low	62.5	Low	95 Å²	95	122 Å²	122	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-74.5	-38.3	178.1	-148.8	153.2	0	0	0	110.9	A919 T920 S921 K926 R927	A919-L923 WeakPolarHBondContact O-CB 3.15Å; A919-L923 PolarHBondContact O-N 3.39Å; T920-L923 PolarHBondContact O-N 3.43Å; S921-L923 VanDerWaalsContact C-N 3.32Å; S921-L923 PolarHBondContact O-N 3.09Å; L923-K926 PolarHBondContact O-N 3.04Å; L923-R927 HydrophobicContact CD2-CG 4.32Å; L923-R927 WeakPolarHBondContact O-CB 3.5Å; L923-R927 WeakPolarHBondContact O-CG 3.38Å; L923-R927 PolarHBondContact O-N 2.81Å
924	E	63.1	Low	62.9	Low	135 Å²	135	124.4 Å²	124.4	63%	0.631	57%	0.574	S	S	*	*	H	α-helix	trans	-63.5	-44.8	170.4	-74.7	-165.5	157.4	0	0	111.9	T920 S921 K926 R927 R928	T920-E924 WeakPolarHBondContact O-CG 3.33Å; T920-E924 PolarHBondContact O-N 3.02Å; S921-E924 PolarHBondContact O-N 2.71Å; E924-K926 PolarHBondContact O-N 2.92Å; E924-R927 CarbonylContact O-C 3.56Å; E924-R927 WeakPolarHBondContact O-CB 3.43Å; E924-R927 PolarHBondContact O-N 2.8Å; E924-R928 WeakPolarHBondContact O-CB 3.45Å; E924-R928 PolarHBondContact O-N 3.41Å
925	E	66.1	Low	63.3	Low	90 Å²	90	125.3 Å²	125.3	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-57.2	-46.3	172.4	-108.6	-142.4	132.5	0	0	111.7	S921 R927 R928 K929	S921-E925 WeakPolarHBondContact O-CB 3.41Å; S921-E925 PolarHBondContact O-N 2.65Å; E925-R927 VanDerWaalsContact C-N 3.34Å; E925-R927 PolarHBondContact O-N 3.09Å; E925-R928 PolarHBondContact O-N 2.73Å; E925-K929 WeakPolarHBondContact O-CB 3.1Å; E925-K929 WeakPolarHBondContact O-CG 3.42Å; E925-K929 PolarHBondContact O-N 2.81Å; E925-K929 IonicContact OE1-NZ 3.97Å; E925-K929 PolarHBondContact OE1-NZ 2.63Å; E925-K929 IonicContact OE2-NZ 3.89Å; E925-K929 PolarHBondContact OE2-NZ 3.11Å
926	K	66.8	Low	63.6	Low	147 Å²	147	124.1 Å²	124.1	64%	0.639	57%	0.572	S	S	*	*	H	α-helix	trans	-62.3	-39.8	176.1	-90	-179.8	177.7	170	0	111.7	H922 L923 E924 R930	H922-K926 WeakPolarHBondContact O-CB 3.36Å; H922-K926 PolarHBondContact O-N 3.32Å; L923-K926 PolarHBondContact O-N 3.04Å; E924-K926 PolarHBondContact O-N 2.92Å; K926-R930 WeakPolarHBondContact O-CB 3.41Å; K926-R930 WeakPolarHBondContact O-CG 3.46Å; K926-R930 PolarHBondContact O-N 3.34Å
927	R	66.3	Low	63.9	Low	170 Å²	170	123 Å²	123	64%	0.642	57%	0.571	S	S	*	*	H	α-helix	trans	-65.7	-39.5	174.4	-78.9	178.4	174	-175.1	-0.3	111.5	L923 E924 E925 R930 K931	L923-R927 HydrophobicContact CD2-CG 4.32Å; L923-R927 WeakPolarHBondContact O-CB 3.5Å; L923-R927 WeakPolarHBondContact O-CG 3.38Å; L923-R927 PolarHBondContact O-N 2.81Å; E924-R927 CarbonylContact O-C 3.56Å; E924-R927 WeakPolarHBondContact O-CB 3.43Å; E924-R927 PolarHBondContact O-N 2.8Å; E925-R927 VanDerWaalsContact C-N 3.34Å; E925-R927 PolarHBondContact O-N 3.09Å; R927-R930 PolarHBondContact O-N 2.89Å; R927-K931 WeakPolarHBondContact O-CB 3.36Å; R927-K931 PolarHBondContact O-N 3.26Å
928	R	71.3	Confident	63.9	Low	192 Å²	192	126.8 Å²	126.8	73%	0.725	58%	0.584	S	S	*	*	H	α-helix	trans	-66.2	-44.8	176.4	-145.9	173.2	-178.5	-176.5	0.3	111	E924 E925 R930 K931 N932	E924-R928 WeakPolarHBondContact O-CB 3.45Å; E924-R928 PolarHBondContact O-N 3.41Å; E925-R928 PolarHBondContact O-N 2.73Å; R928-R930 PolarHBondContact O-N 3.33Å; R928-K931 PolarHBondContact O-N 3.27Å; R928-N932 WeakPolarHBondContact O-CB 3.07Å; R928-N932 VanDerWaalsContact O-CG 3.29Å; R928-N932 PolarHBondContact O-N 2.81Å; R928-N932 PolarHBondContact O-OD1 2.97Å
929	K	72.5	Confident	63.9	Low	118 Å²	118	126.4 Å²	126.4	51%	0.513	59%	0.59	S	S	.	*	H	α-helix	trans	-61.4	-40.8	172.7	-74.2	168	-178.4	158.4	0	111.9	E925 N932 R933	E925-K929 WeakPolarHBondContact O-CB 3.1Å; E925-K929 WeakPolarHBondContact O-CG 3.42Å; E925-K929 PolarHBondContact O-N 2.81Å; E925-K929 IonicContact OE1-NZ 3.97Å; E925-K929 PolarHBondContact OE1-NZ 2.63Å; E925-K929 IonicContact OE2-NZ 3.89Å; E925-K929 PolarHBondContact OE2-NZ 3.11Å; K929-N932 PolarHBondContact O-N 3.47Å; K929-R933 PolarHBondContact O-N 3.48Å
930	R	69.5	Low	63.6	Low	190 Å²	190	131 Å²	131	72%	0.717	61%	0.606	S	S	*	*	H	α-helix	trans	-65.6	-42.6	172.8	-82.8	-178.1	173.8	180	-1.1	112.7	K926 R927 R928 R933 K934	K926-R930 WeakPolarHBondContact O-CB 3.41Å; K926-R930 WeakPolarHBondContact O-CG 3.46Å; K926-R930 PolarHBondContact O-N 3.34Å; R927-R930 PolarHBondContact O-N 2.89Å; R928-R930 PolarHBondContact O-N 3.33Å; R930-R933 PolarHBondContact O-N 2.96Å; R930-K934 WeakPolarHBondContact O-CB 3.29Å; R930-K934 WeakPolarHBondContact O-CG 3.47Å; R930-K934 PolarHBondContact O-N 2.83Å
931	K	71.9	Confident	62.9	Low	148 Å²	148	135 Å²	135	64%	0.643	63%	0.631	S	S	*	*	H	α-helix	trans	-62.8	-41.8	174.6	-85.2	-175.2	175.3	-179.6	0	111.3	R927 R928 K934 K935	R927-K931 WeakPolarHBondContact O-CB 3.36Å; R927-K931 PolarHBondContact O-N 3.26Å; R928-K931 PolarHBondContact O-N 3.27Å; K931-K934 PolarHBondContact O-N 3.45Å; K931-K935 WeakPolarHBondContact O-CB 3.03Å; K931-K935 WeakPolarHBondContact O-CG 3.41Å; K931-K935 PolarHBondContact O-N 3.41Å
932	N	70.8	Confident	63.3	Low	83 Å²	83	138.8 Å²	138.8	44%	0.444	64%	0.641	S	S	.	*	H	α-helix	trans	-66.5	-40.8	176.9	-71.5	-2.3	0	0	0	111.9	R928 K929 K935 M936	R928-N932 WeakPolarHBondContact O-CB 3.07Å; R928-N932 VanDerWaalsContact O-CG 3.29Å; R928-N932 PolarHBondContact O-N 2.81Å; R928-N932 PolarHBondContact O-OD1 2.97Å; K929-N932 PolarHBondContact O-N 3.47Å; N932-K935 PolarHBondContact O-N 2.85Å; N932-M936 WeakPolarHBondContact O-CG 3.42Å; N932-M936 PolarHBondContact O-N 3.41Å
933	R	68.8	Low	63.6	Low	191 Å²	191	139.8 Å²	139.8	72%	0.721	65%	0.646	S	S	*	*	H	α-helix	trans	-61.3	-44.6	171.4	-100.8	-176.8	168	-178.9	-3	112.6	K929 R930 K935 M936 I937	K929-R933 PolarHBondContact O-N 3.48Å; R930-R933 PolarHBondContact O-N 2.96Å; R933-K935 VanDerWaalsContact C-N 3.34Å; R933-K935 PolarHBondContact O-N 3.02Å; R933-M936 PolarHBondContact O-N 3.02Å; R933-I937 WeakPolarHBondContact O-CD1 3.45Å; R933-I937 VanDerWaalsContact O-CG1 3.26Å; R933-I937 WeakPolarHBondContact O-CG1 3.49Å; R933-I937 PolarHBondContact O-N 2.83Å
934	K	68.1	Low	64	Low	150 Å²	150	142.3 Å²	142.3	65%	0.652	65%	0.654	S	S	*	*	H	α-helix	trans	-63.4	-39.7	176.4	-76.3	-173.9	175.9	-168.7	0	112	R930 K931 I937 L938	R930-K934 WeakPolarHBondContact O-CB 3.29Å; R930-K934 WeakPolarHBondContact O-CG 3.47Å; R930-K934 PolarHBondContact O-N 2.83Å; K931-K934 PolarHBondContact O-N 3.45Å; K934-I937 PolarHBondContact O-N 3.2Å; K934-L938 PolarHBondContact O-N 3.26Å
935	K	67.6	Low	64	Low	148 Å²	148	142.8 Å²	142.8	64%	0.643	66%	0.656	S	S	*	*	H	α-helix	trans	-63.9	-43.1	174.2	-79.2	-174	174.2	-170.6	0	112.2	K931 N932 R933 I937 L938 T939	K931-K935 WeakPolarHBondContact O-CB 3.03Å; K931-K935 WeakPolarHBondContact O-CG 3.41Å; K931-K935 PolarHBondContact O-N 3.41Å; N932-K935 PolarHBondContact O-N 2.85Å; R933-K935 VanDerWaalsContact C-N 3.34Å; R933-K935 PolarHBondContact O-N 3.02Å; K935-I937 VanDerWaalsContact C-N 3.31Å; K935-I937 PolarHBondContact O-N 2.95Å; K935-L938 PolarHBondContact O-N 2.62Å; K935-T939 PolarHBondContact O-N 3.07Å; K935-T939 VanDerWaalsContact O-N 3.13Å; K935-T939 PolarHBondContact O-OG1 3.34Å; K935-T939 VanDerWaalsContact O-OG1 3.11Å
936	M	62.3	Low	63.9	Low	122 Å²	122	146.1 Å²	146.1	60%	0.601	67%	0.671	S	S	*	*	H	α-helix	trans	-62.5	-37.5	175.4	-74.3	-175	-153.8	0	0	112.8	N932 R933 T939 L940	N932-M936 WeakPolarHBondContact O-CG 3.42Å; N932-M936 PolarHBondContact O-N 3.41Å; R933-M936 PolarHBondContact O-N 3.02Å; M936-T939 VanDerWaalsContact CA-OG1 3.32Å; M936-T939 WeakPolarHBondContact CA-OG1 3.44Å; M936-T939 PolarHBondContact O-N 2.84Å; M936-T939 PolarHBondContact O-OG1 3.24Å; M936-L940 PolarHBondContact O-N 2.92Å
937	I	63.3	Low	63.7	Low	115 Å²	115	146 Å²	146	59%	0.59	67%	0.673	S	S	*	*	H	α-helix	trans	-68.2	-37.8	176.9	-67.8	162.8	0	0	0	110.9	R933 K934 K935 T939 L940	R933-I937 WeakPolarHBondContact O-CD1 3.45Å; R933-I937 VanDerWaalsContact O-CG1 3.26Å; R933-I937 WeakPolarHBondContact O-CG1 3.49Å; R933-I937 PolarHBondContact O-N 2.83Å; K934-I937 PolarHBondContact O-N 3.2Å; K935-I937 VanDerWaalsContact C-N 3.31Å; K935-I937 PolarHBondContact O-N 2.95Å; I937-T939 VanDerWaalsContact C-N 3.28Å; I937-T939 PolarHBondContact O-N 2.79Å; I937-L940 PolarHBondContact O-N 3.22Å
938	L	57.8	Low	63.5	Low	132 Å²	132	144.3 Å²	144.3	69%	0.691	68%	0.675	S	S	*	*	H	α-helix	trans	-72.5	-17.8	177.2	-120.7	116.2	0	0	0	114.1	K934 K935 T941	K934-L938 PolarHBondContact O-N 3.26Å; K935-L938 PolarHBondContact O-N 2.62Å; L938-T941 PolarHBondContact O-OG1 3.22Å
939	T	54.3	Low	62.9	Low	113 Å²	113	140.6 Å²	140.6	69%	0.693	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-2.6	174.6	46.6	0	0	0	0	113.4	K935 M936 I937	K935-T939 PolarHBondContact O-N 3.07Å; K935-T939 VanDerWaalsContact O-N 3.13Å; K935-T939 PolarHBondContact O-OG1 3.34Å; K935-T939 VanDerWaalsContact O-OG1 3.11Å; M936-T939 VanDerWaalsContact CA-OG1 3.32Å; M936-T939 WeakPolarHBondContact CA-OG1 3.44Å; M936-T939 PolarHBondContact O-N 2.84Å; M936-T939 PolarHBondContact O-OG1 3.24Å; I937-T939 VanDerWaalsContact C-N 3.28Å; I937-T939 PolarHBondContact O-N 2.79Å
940	L	48.9	Very low	62.1	Low	152 Å²	152	142.5 Å²	142.5	80%	0.796	68%	0.684	S	S	*	*			trans	-109.2	4.2	179.4	-90	156.2	0	0	0	112.9	M936 I937	M936-L940 PolarHBondContact O-N 2.92Å; I937-L940 PolarHBondContact O-N 3.22Å
941	T	41.9	Very low	61.4	Low	166 Å²	166	138.2 Å²	138.2	100%	1.018	68%	0.681	S	S	*	*			trans	-115.8	0	168.1	52.1	0	0	0	0	108.3	L938	L938-T941 PolarHBondContact O-OG1 3.22Å

Retrieved 941 of 941 residues in 614.1 ms (Link to these results)

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