G4LYU7_SCHMA Loading...

WD-repeat protein, putative

AlphaFold DB , UniProt , Accession G4LYU7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,219 aa.

						>G4LYU7_SCHMA|G4LYU7
MRLLKPTWVSHGFLSKDKAVGRPIYSLDIHPDGSRLATGGVIDTCGVVVLWNMAPIRDPTLESSDNSCLKLFQMDSHQACVNCVRWSPSGRWLASAGMDKVIMLWSKTAGTSRPVQVFGSKEPTKFTEHWRCVSTLRGHSGDIIDLSWSHDGSRLASTSVDNSVIVWCRQKLPNGSGYTNNSFYLQATLTGHKGFVKGVTWDPVGRYLASQGDDLTVKIWRTADWQEEASISKPFTKASGQSQVMRLSWSLDGSTLASPHAINNGFPTAKLIDRTNWSPSLDLVGHRKHVICARYNPNVLRKQDGSGIPGAVCLALGSKDRSVSVWSTAGRRARVVVHDLFTNSVCDLSWSSDGRELMACSLDGSVCYMGFTHKELGTPWSLKEVIQLHYKIYGQSLLDKFRPITSNGLSMELDPSDENKDNSSILNQSDILLETPEALALQKTQAELRTKLKHSPTRDKQAKCLPKGPSKQIETVSKDGRRRITPKFLGHLDSPDEDANSNPQFSSPQSNRCESKLNSENSSDLISDINKINPIVAVSTTGTNVTTTTTHSINSVMPNTVATDDAIPTVTLVQVDNTVSMSVDKTCTSNVVVPTPISTVNTVDSKGNETALPSTSVTVCSSHSPVESKVNSESQSLATFVQAPSKKLPLDSTTFTTTTTTAMDQETGVELKRPRLDNNDDDTDHIKPISDETNKQVTSTGNKQRKRRIRLFTEEEKSPKSGLDVSKSSVSQNKKPCFTPESSPPKPKLTLGSTLESTDNTSSSVQNPPSGATSFAPFLITTSDQLGNASKVQFVCSNLIDGPIIVQLINSSNSSTRSEEIPKLSNSVPRIIASRSDRRLWELICSDRLTSYAYSDEVIAVGDNKGRIQLIYSTGGHICPNLLLDCVHTLALTTETTESSQSSLTTSNRFFSTCTESTTNNSNLSRLHAVVSGNEQQQQQTTLQNGNNNHFTLPNNSIMNKFNVNRKYRLAALCRSGRLIIWNFCLNNCGFGSISTVFNNCIFPQVLIETNIKDVLNGGHNSRFSSLTFGPNGFPVVYLQDNSSYLFHIESRIWIELFDASDIVRCQFAMNSSRGCPPGPLSACQQLNKMTTNVQRSNHFTSSNSNVISASCRKVSNQNFLESQTQLALSFGSSNEYRYWLTRWFRQLIEDNEEERVRQIIQDLIGPVQATTKLHSTWQSEVKGISRLVLAKELLSLFALNLHLQRLYVELKEMLNESR
					

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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	86.4	Confident	91	Very high	79 Å²	79	56.1 Å²	56.1	39%	0.389	28%	0.277	S	S	.	.				0	126.3	0	-177.1	-175.1	76.1	0	0	107.8	L3 V335 V337 M369 G370 F371 E375	M1-L3 HydrophobicContact CE-CB 4.48Å; M1-L3 HydrophobicContact CE-CD1 4.49Å; M1-V335 HydrophobicContact CE-CG1 4.15Å; M1-V335 HydrophobicContact SD-CG1 3.87Å; M1-V335 HydrophobicContact SD-CG2 4.12Å; M1-V337 HydrophobicContact CE-CG2 4.21Å; M1-M369 HydrophobicContact SD-CB 4.43Å; M1-M369 HydrophobicContact SD-CG 4.29Å; M1-G370 CarbonylContact C-O 3.56Å; M1-G370 WeakPolarHBondContact CA-O 3.41Å; M1-F371 HydrophobicContact CB-CD1 4.18Å; M1-F371 HydrophobicContact CB-CE1 4.16Å; M1-F371 HydrophobicContact CG-CD1 4.05Å; M1-F371 HydrophobicContact CG-CE1 3.72Å; M1-F371 HydrophobicContact CG-CZ 4.1Å; M1-F371 HydrophobicContact SD-CD1 4.49Å; M1-F371 HydrophobicContact SD-CE1 3.59Å; M1-F371 VanDerWaalsContact SD-CE1 3.59Å; M1-F371 HydrophobicContact SD-CZ 3.75Å; M1-E375 PolarHBondContact N-OE1 3.38Å; M1-E375 PolarHBondContact N-OE2 2.97Å; M1-E375 VanDerWaalsContact N-OE2 3.1Å
2	R	92.5	Very high	90.7	Very high	117 Å²	117	53.6 Å²	53.6	44%	0.442	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.8	169.9	-171.8	-179	-174.5	178.4	1.5	107.4	L4 R57 D58 M369 G370	R2-L4 HydrophobicContact CG-CD1 4.45Å; R2-L4 HydrophobicContact CG-CG 4.23Å; R2-R57 VanDerWaalsContact CZ-O 3.25Å; R2-R57 PolarHBondContact NH1-O 2.87Å; R2-D58 IonicContact CZ-OD1 3.79Å; R2-D58 IonicContact NH1-OD1 3.76Å; R2-D58 IonicContact NH2-OD1 2.71Å; R2-D58 PolarHBondContact NH2-OD1 2.77Å; R2-M369 WeakPolarHBondContact O-CA 3.35Å; R2-G370 PolarHBondContact N-O 3.47Å; R2-G370 PolarHBondContact O-N 3.07Å
3	L	94	Very high	90.1	Very high	77 Å²	77	56.2 Å²	56.2	40%	0.403	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126	177.2	-171.3	72.3	0	0	0	108.5	M1 V337 L340 C367 Y368 M369	M1-L3 HydrophobicContact CE-CB 4.48Å; M1-L3 HydrophobicContact CE-CD1 4.49Å; L3-V337 HydrophobicContact CD2-CG1 4.31Å; L3-L340 HydrophobicContact CD1-CD1 4.29Å; L3-L340 HydrophobicContact CD2-CD1 4.26Å; L3-C367 WeakPolarHBondContact CD1-SG 3.46Å; L3-Y368 WeakPolarHBondContact CA-O 3.47Å; L3-M369 HydrophobicContact CD1-CG 3.42Å; L3-M369 VanDerWaalsContact CD1-CG 3.42Å; L3-M369 HydrophobicContact CD1-SD 4.33Å
4	L	94.5	Very high	88.8	Confident	36 Å²	36	60.2 Å²	60.2	19%	0.188	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	150.4	177.6	-61.6	173.1	0	0	0	110.4	R2 I56 P59 C367 Y368	R2-L4 HydrophobicContact CG-CD1 4.45Å; R2-L4 HydrophobicContact CG-CG 4.23Å; L4-I56 WeakPolarHBondContact CD1-O 3.47Å; L4-P59 HydrophobicContact CD1-CG 4.12Å; L4-P59 HydrophobicContact CD2-CG 4.23Å; L4-C367 WeakPolarHBondContact O-CA 3.32Å; L4-C367 PolarHBondContact O-SG 3.18Å; L4-Y368 HydrophobicContact CB-CD1 4.13Å; L4-Y368 HydrophobicContact CD1-CD1 3.96Å; L4-Y368 HydrophobicContact CD1-CE1 4.32Å; L4-Y368 HydrophobicContact CG-CD1 4.2Å; L4-Y368 PolarHBondContact N-O 3.25Å; L4-Y368 PolarHBondContact O-N 2.99Å
5	K	92.3	Very high	87.3	Confident	90 Å²	90	58.9 Å²	58.9	39%	0.391	30%	0.304	S	S	.	.			trans	-136	82.4	179.7	-173	161	-169.2	171.7	0	109.8	T7 L340 S365 V366	K5-T7 PolarHBondContact O-N 3.33Å; K5-L340 PolarHBondContact NZ-O 3.34Å; K5-S365 WeakPolarHBondContact CE-OG 3.48Å; K5-S365 PolarHBondContact NZ-OG 3.2Å; K5-V366 WeakPolarHBondContact CG-O 3.47Å
6	P	92.1	Very high	85.6	Confident	10 Å²	10	67.8 Å²	67.8	7%	0.065	34%	0.34	C	S	.	.			trans	-67.8	119.3	-176.1	28.4	-34.8	0	0	0	110.3	W8 V9 I56 V366	P6-W8 VanDerWaalsContact C-N 3.32Å; P6-W8 HydrophobicContact CB-CD2 4.44Å; P6-W8 HydrophobicContact CB-CZ2 4.19Å; P6-W8 PolarHBondContact O-N 2.78Å; P6-V9 HydrophobicContact CB-CG2 3.98Å; P6-V9 HydrophobicContact CG-CB 4.23Å; P6-V9 HydrophobicContact CG-CG2 3.81Å; P6-I56 HydrophobicContact CG-CG1 4.4Å; P6-I56 HydrophobicContact CG-CG2 4.32Å; P6-V366 HydrophobicContact CG-CG2 3.88Å
7	T	86.5	Confident	84.1	Confident	127 Å²	127	71.8 Å²	71.8	78%	0.779	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-20.8	-175.8	51	0	0	0	0	113.3	K5	K5-T7 PolarHBondContact O-N 3.33Å
8	W	89	Confident	83.2	Confident	48 Å²	48	75.7 Å²	75.7	18%	0.182	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-16.6	-180	53.6	-96.8	0	0	0	113.9	P6 S10 W51 P55 I56 E62 L69	P6-W8 VanDerWaalsContact C-N 3.32Å; P6-W8 HydrophobicContact CB-CD2 4.44Å; P6-W8 HydrophobicContact CB-CZ2 4.19Å; P6-W8 PolarHBondContact O-N 2.78Å; W8-S10 VanDerWaalsContact C-N 3.33Å; W8-S10 PolarHBondContact O-N 3.37Å; W8-W51 AromaticContact CE3-CE3 3.97Å; W8-W51 HydrophobicContact CE3-CE3 3.97Å; W8-W51 HydrophobicContact CE3-CZ3 4.16Å; W8-W51 AromaticContact CZ3-CE3 3.84Å; W8-W51 HydrophobicContact CZ3-CE3 3.84Å; W8-W51 HydrophobicContact CZ3-CZ3 4.49Å; W8-W51 WeakPolarHBondContact O-CH2 3.29Å; W8-W51 WeakPolarHBondContact O-CZ3 3.4Å; W8-P55 HydrophobicContact CH2-CB 4.12Å; W8-P55 HydrophobicContact CZ2-CB 3.8Å; W8-I56 HydrophobicContact CH2-CD1 4.14Å; W8-I56 HydrophobicContact CH2-CG1 3.5Å; W8-I56 HydrophobicContact CZ2-CG1 3.72Å; W8-I56 HydrophobicContact CZ3-CG1 4.47Å; W8-E62 PolarHBondContact NE1-OE1 3.41Å; W8-E62 PolarHBondContact NE1-OE2 2.95Å; W8-L69 HydrophobicContact CD2-CB 4.46Å; W8-L69 HydrophobicContact CD2-CD1 3.98Å; W8-L69 HydrophobicContact CE3-CB 3.8Å; W8-L69 HydrophobicContact CE3-CD1 4.12Å; W8-L69 HydrophobicContact CE3-CG 4.41Å; W8-L69 HydrophobicContact CG-CD1 4.17Å; W8-L69 HydrophobicContact CH2-CB 4.25Å; W8-L69 HydrophobicContact CH2-CD2 4.19Å; W8-L69 HydrophobicContact CZ2-CD2 4.23Å; W8-L69 HydrophobicContact CZ3-CB 3.67Å; W8-L69 HydrophobicContact CZ3-CD2 4.42Å; W8-L69 HydrophobicContact CZ3-CG 4.45Å
9	V	92.3	Very high	82.2	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.006	39%	0.393	C	S	.	.			trans	-80.5	82.6	173.3	-177.7	0	0	0	0	108.8	P6 L36 T38 W51 I56 V366	P6-V9 HydrophobicContact CB-CG2 3.98Å; P6-V9 HydrophobicContact CG-CB 4.23Å; P6-V9 HydrophobicContact CG-CG2 3.81Å; V9-L36 HydrophobicContact CG1-CD2 4.1Å; V9-T38 HydrophobicContact CG1-CG2 4.47Å; V9-W51 HydrophobicContact CB-CD2 4.48Å; V9-W51 HydrophobicContact CG1-CD2 3.97Å; V9-W51 HydrophobicContact CG1-CG 4.08Å; V9-W51 HydrophobicContact CG1-CZ2 4.26Å; V9-W51 HydrophobicContact CG2-CD2 4.36Å; V9-W51 HydrophobicContact CG2-CE3 4.4Å; V9-I56 HydrophobicContact CG2-CD1 3.87Å; V9-I56 HydrophobicContact CG2-CG1 4.17Å; V9-V366 HydrophobicContact CB-CG2 3.73Å; V9-V366 HydrophobicContact CG1-CB 4.47Å; V9-V366 HydrophobicContact CG1-CG1 4.03Å; V9-V366 HydrophobicContact CG1-CG2 3.56Å; V9-V366 HydrophobicContact CG2-CG2 4.4Å
10	S	90.7	Very high	81.8	Confident	22 Å²	22	76.1 Å²	76.1	15%	0.154	40%	0.396	C	S	.	.	S	Bend	trans	-149.7	154.2	-177.7	-168.3	0	0	0	0	112.3	W8 G12 W51 G364	W8-S10 VanDerWaalsContact C-N 3.33Å; W8-S10 PolarHBondContact O-N 3.37Å; S10-G12 PolarHBondContact O-N 3.19Å; S10-G12 PolarHBondContact OG-N 3.29Å; S10-W51 VanDerWaalsContact O-CH2 3.28Å; S10-W51 WeakPolarHBondContact O-CH2 3.39Å; S10-W51 WeakPolarHBondContact O-CZ2 3.27Å; S10-G364 PolarHBondContact OG-O 3.13Å
11	H	91.2	Very high	81.9	Confident	10 Å²	10	72.9 Å²	72.9	5%	0.046	38%	0.382	C	S	.	.	S	Bend	trans	-84.9	8.4	172.2	-63.3	159.7	0	0	0	113.3	R22 P23 T38 G39 G40 I42 V47	H11-R22 HydrophobicContact CB-CB 4.11Å; H11-R22 WeakPolarHBondContact O-CD 3.37Å; H11-P23 PolarHBondContact CE1-O 3.37Å; H11-T38 PolarHBondContact NE2-O 2.98Å; H11-G39 WeakPolarHBondContact NE2-CA 3.34Å; H11-G39 PolarHBondContact NE2-N 3.44Å; H11-G39 VanDerWaalsContact NE2-N 3.13Å; H11-G39 PolarHBondContact NE2-O 3.31Å; H11-G40 WeakPolarHBondContact CE1-CA 3.34Å; H11-G40 VanDerWaalsContact NE2-CA 3.25Å; H11-G40 WeakPolarHBondContact NE2-CA 3.46Å; H11-G40 PolarHBondContact NE2-N 3.05Å; H11-I42 HydrophobicContact CB-CG1 4.27Å; H11-V47 HydrophobicContact CB-CG1 4.32Å
12	G	86.4	Confident	82.2	Confident	26 Å²	26	70.8 Å²	70.8	27%	0.268	37%	0.37	S	S	.	.			trans	100.1	-164.2	-177.2	0	0	0	0	0	112	S10 G21 R22	S10-G12 PolarHBondContact O-N 3.19Å; S10-G12 PolarHBondContact OG-N 3.29Å; G12-G21 CarbonylContact O-C 3.5Å; G12-G21 WeakPolarHBondContact O-CA 3.37Å; G12-R22 PolarHBondContact O-N 3.11Å
13	F	82.8	Confident	82.2	Confident	87 Å²	87	66.2 Å²	66.2	38%	0.382	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-117.3	154	-171.6	-59.5	-83.1	0	0	0	112.4	K18 V20 R22	F13-K18 HydrophobicContact CB-CB 4.48Å; F13-K18 HydrophobicContact CD1-CB 3.8Å; F13-K18 WeakPolarHBondContact CD1-O 3.33Å; F13-K18 HydrophobicContact CD2-CB 3.95Å; F13-K18 HydrophobicContact CD2-CD 4.19Å; F13-K18 HydrophobicContact CD2-CG 3.77Å; F13-K18 HydrophobicContact CE1-CB 3.95Å; F13-K18 VanDerWaalsContact CE1-O 3.23Å; F13-K18 WeakPolarHBondContact CE1-O 3.36Å; F13-K18 HydrophobicContact CE2-CB 4.1Å; F13-K18 HydrophobicContact CE2-CD 4.06Å; F13-K18 HydrophobicContact CE2-CG 4.08Å; F13-K18 HydrophobicContact CG-CB 3.8Å; F13-K18 HydrophobicContact CG-CG 4.01Å; F13-K18 HydrophobicContact CZ-CB 4.1Å; F13-V20 CarbonylContact C-O 3.6Å; F13-V20 WeakPolarHBondContact CA-O 3.27Å; F13-R22 PolarHBondContact O-NE 3.13Å
14	L	73.2	Confident	82.3	Confident	113 Å²	113	62.5 Å²	62.5	59%	0.592	34%	0.336	S	S	*	.	S	Bend	trans	-83.8	-35.3	174.7	-71	170.5	0	0	0	112.2	V20 R22	L14-V20 HydrophobicContact CD1-CG1 4.06Å; L14-V20 PolarHBondContact N-O 3.46Å; L14-R22 HydrophobicContact CD2-CG 3.9Å; L14-R22 HydrophobicContact CG-CG 4.03Å
15	S	65.2	Low	82.3	Confident	40 Å²	40	63.4 Å²	63.4	28%	0.28	34%	0.337	S	S	.	.	S	Bend	trans	-107.5	155.4	176.6	72.8	0	0	0	0	112.6	D17 K18	S15-D17 PolarHBondContact O-N 3.34Å; S15-K18 PolarHBondContact O-N 2.88Å; S15-K18 VanDerWaalsContact O-N 3.15Å
16	K	61.2	Low	82.6	Confident	202 Å²	202	59.1 Å²	59.1	88%	0.878	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.7	173	-70.7	-177	177.5	178.3	0	112.2	K18	K16-K18 PolarHBondContact O-N 3.42Å
17	D	58.7	Low	82.9	Confident	135 Å²	135	58.6 Å²	58.6	72%	0.722	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-1.9	-179.3	-33.3	-66.4	0	0	0	112.9	S15 A19	S15-D17 PolarHBondContact O-N 3.34Å; D17-A19 PolarHBondContact O-N 2.91Å; D17-A19 VanDerWaalsContact O-N 3.08Å
18	K	68	Low	83.4	Confident	143 Å²	143	53.6 Å²	53.6	62%	0.622	28%	0.284	S	S	*	.			trans	58.8	18.4	178.6	-54	-179.4	-176.5	175.5	0	114.9	F13 S15 K16 V20	F13-K18 HydrophobicContact CB-CB 4.48Å; F13-K18 HydrophobicContact CD1-CB 3.8Å; F13-K18 WeakPolarHBondContact CD1-O 3.33Å; F13-K18 HydrophobicContact CD2-CB 3.95Å; F13-K18 HydrophobicContact CD2-CD 4.19Å; F13-K18 HydrophobicContact CD2-CG 3.77Å; F13-K18 HydrophobicContact CE1-CB 3.95Å; F13-K18 VanDerWaalsContact CE1-O 3.23Å; F13-K18 WeakPolarHBondContact CE1-O 3.36Å; F13-K18 HydrophobicContact CE2-CB 4.1Å; F13-K18 HydrophobicContact CE2-CD 4.06Å; F13-K18 HydrophobicContact CE2-CG 4.08Å; F13-K18 HydrophobicContact CG-CB 3.8Å; F13-K18 HydrophobicContact CG-CG 4.01Å; F13-K18 HydrophobicContact CZ-CB 4.1Å; S15-K18 PolarHBondContact O-N 2.88Å; S15-K18 VanDerWaalsContact O-N 3.15Å; K16-K18 PolarHBondContact O-N 3.42Å; K18-V20 PolarHBondContact O-N 3.14Å
19	A	64.2	Low	83.8	Confident	83 Å²	83	51.8 Å²	51.8	69%	0.686	28%	0.277	S	S	*	.			trans	-73	-23.8	-176	0	0	0	0	0	114.1	D17	D17-A19 PolarHBondContact O-N 2.91Å; D17-A19 VanDerWaalsContact O-N 3.08Å
20	V	74.3	Confident	84	Confident	75 Å²	75	52.2 Å²	52.2	46%	0.455	28%	0.279	S	S	.	.	S	Bend	trans	-135	124.2	-177.8	-169.3	0	0	0	0	109.9	F13 L14 K18	F13-V20 CarbonylContact C-O 3.6Å; F13-V20 WeakPolarHBondContact CA-O 3.27Å; L14-V20 HydrophobicContact CD1-CG1 4.06Å; L14-V20 PolarHBondContact N-O 3.46Å; K18-V20 PolarHBondContact O-N 3.14Å
21	G	84.9	Confident	84.1	Confident	9 Å²	9	52.8 Å²	52.8	9%	0.093	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-74.3	157.9	174.9	0	0	0	0	0	112.6	G12 D363	G12-G21 CarbonylContact O-C 3.5Å; G12-G21 WeakPolarHBondContact O-CA 3.37Å; G21-D363 VanDerWaalsContact CA-O 3.28Å; G21-D363 WeakPolarHBondContact CA-O 3.24Å; G21-D363 PolarHBondContact N-O 3.2Å
22	R	91.5	Very high	84.1	Confident	36 Å²	36	56.2 Å²	56.2	14%	0.136	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-75.4	130.4	173.1	-70.4	176.8	-178.5	-159.5	-12.5	109.6	H11 G12 F13 L14 D43 G364	H11-R22 HydrophobicContact CB-CB 4.11Å; H11-R22 WeakPolarHBondContact O-CD 3.37Å; G12-R22 PolarHBondContact O-N 3.11Å; F13-R22 PolarHBondContact O-NE 3.13Å; L14-R22 HydrophobicContact CD2-CG 3.9Å; L14-R22 HydrophobicContact CG-CG 4.03Å; R22-D43 IonicContact CZ-OD1 2.72Å; R22-D43 IonicContact CZ-OD2 3.7Å; R22-D43 VanDerWaalsContact NH1-CG 3.27Å; R22-D43 IonicContact NH1-OD1 2.99Å; R22-D43 IonicContact NH1-OD2 3.86Å; R22-D43 PolarHBondContact NH1-OD2 3.36Å; R22-D43 VanDerWaalsContact NH2-CG 3.31Å; R22-D43 IonicContact NH2-OD1 2.76Å; R22-D43 PolarHBondContact NH2-OD1 3.18Å; R22-D43 IonicContact NH2-OD2 3.28Å; R22-D43 PolarHBondContact NH2-OD2 3.19Å; R22-G364 WeakPolarHBondContact O-CA 3.48Å
23	P	92.5	Very high	84.4	Confident	20 Å²	20	55.3 Å²	55.3	13%	0.13	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-54	139.8	-173.1	-28.8	34.9	0	0	0	114.5	H11 Y25 L362	H11-P23 PolarHBondContact CE1-O 3.37Å; P23-Y25 HydrophobicContact CB-CD1 4.22Å; P23-Y25 HydrophobicContact CB-CE1 3.6Å; P23-Y25 HydrophobicContact CB-CE2 4.34Å; P23-Y25 HydrophobicContact CG-CE1 4.41Å; P23-L362 HydrophobicContact CB-CD2 4.22Å
24	I	96	Very high	84.9	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	108.1	168.2	-61.1	172	0	0	0	106.8	S26 T38 C346 C360 S361 V366	I24-S26 WeakPolarHBondContact CG2-O 3.44Å; I24-T38 HydrophobicContact CG2-CG2 4.27Å; I24-C346 PolarHBondContact O-SG 3.22Å; I24-C360 HydrophobicContact CB-CB 4.05Å; I24-C360 HydrophobicContact CG2-CB 3.61Å; I24-S361 PolarHBondContact N-O 2.86Å; I24-V366 HydrophobicContact CD1-CG1 3.78Å
25	Y	96.3	Very high	85.9	Confident	54 Å²	54	48.7 Å²	48.7	21%	0.212	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-25.1	-173.9	-58.4	-61.1	0	0	0	112.7	P23 G39 V41 C80 V81 R246 C346 L362	P23-Y25 HydrophobicContact CB-CD1 4.22Å; P23-Y25 HydrophobicContact CB-CE1 3.6Å; P23-Y25 HydrophobicContact CB-CE2 4.34Å; P23-Y25 HydrophobicContact CG-CE1 4.41Å; Y25-G39 PolarHBondContact N-O 3.47Å; Y25-V41 HydrophobicContact CE2-CB 4.39Å; Y25-V41 HydrophobicContact CE2-CG1 4.08Å; Y25-C80 HydrophobicContact CE2-CB 4.03Å; Y25-V81 WeakPolarHBondContact CD2-O 3.44Å; Y25-R246 PolarHBondContact O-NH2 2.93Å; Y25-C346 WeakPolarHBondContact O-CB 3.05Å; Y25-L362 HydrophobicContact CD1-CD2 3.77Å; Y25-L362 HydrophobicContact CE1-CD2 3.68Å
26	S	97.6	Very high	87.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	149.4	-177.3	-172.4	0	0	0	0	111.5	I24 T38 G39 V84 D347	I24-S26 WeakPolarHBondContact CG2-O 3.44Å; S26-T38 WeakPolarHBondContact O-CA 3.18Å; S26-G39 PolarHBondContact N-O 2.99Å; S26-G39 PolarHBondContact O-N 2.89Å; S26-V84 PolarHBondContact OG-N 3.2Å; S26-V84 PolarHBondContact OG-O 3.38Å; S26-D347 WeakPolarHBondContact CA-OD2 3.44Å; S26-D347 WeakPolarHBondContact CB-OD2 3.42Å; S26-D347 PolarHBondContact OG-OD2 3.32Å
27	L	98.1	Very high	89.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	159.1	167.5	63.3	62.1	0	0	0	111.2	L36 A37 T38 R85 D347 S349 M358 C360 V366	L27-L36 HydrophobicContact CB-CD1 4.24Å; L27-L36 HydrophobicContact CD1-CD1 4.37Å; L27-L36 HydrophobicContact CD2-CD1 4.2Å; L27-A37 CarbonylContact C-O 3.53Å; L27-A37 WeakPolarHBondContact CA-O 3.21Å; L27-A37 WeakPolarHBondContact CB-O 3.35Å; L27-T38 HydrophobicContact CB-CG2 4Å; L27-R85 PolarHBondContact O-NH1 3Å; L27-D347 PolarHBondContact N-OD2 2.97Å; L27-S349 VanDerWaalsContact CD1-CB 3.49Å; L27-M358 HydrophobicContact CD1-CB 3.82Å; L27-M358 HydrophobicContact CD2-CB 3.9Å; L27-C360 HydrophobicContact CD2-CB 3.81Å; L27-C360 HydrophobicContact CG-CB 4.06Å; L27-V366 HydrophobicContact CD2-CB 4.36Å; L27-V366 HydrophobicContact CD2-CG1 4.1Å
28	D	98.1	Very high	91.1	Very high	22 Å²	22	30.8 Å²	30.8	12%	0.118	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	138	171.1	-151.1	18.9	0	0	0	113	A37 R85 W86 S349	D28-A37 PolarHBondContact N-O 3.38Å; D28-A37 PolarHBondContact O-N 3.37Å; D28-R85 WeakPolarHBondContact OD2-CA 3.3Å; D28-W86 PolarHBondContact O-NE1 3.06Å; D28-W86 VanDerWaalsContact O-NE1 3.17Å; D28-W86 PolarHBondContact OD2-N 3.04Å; D28-S349 WeakPolarHBondContact OD1-CB 3.48Å; D28-S349 PolarHBondContact OD1-OG 3.38Å
29	I	97.5	Very high	92.5	Very high	9 Å²	9	24 Å²	24	5%	0.046	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	132.6	178.5	-57.3	168.1	0	0	0	108.6	L36 W86 S349 M358	I29-L36 HydrophobicContact CG1-CD1 3.95Å; I29-W86 VanDerWaalsContact C-CD1 3.41Å; I29-W86 VanDerWaalsContact O-CD1 3.29Å; I29-S349 PolarHBondContact N-OG 3.36Å; I29-S349 VanDerWaalsContact N-OG 3.09Å; I29-M358 HydrophobicContact CD1-CB 4.02Å; I29-M358 HydrophobicContact CD1-CG 3.62Å; I29-M358 HydrophobicContact CG1-CB 4.28Å; I29-M358 HydrophobicContact CG1-CG 3.96Å
30	H	96.7	Very high	94	Very high	11 Å²	11	20 Å²	20	5%	0.051	11%	0.111	C	C	.	.			trans	-67.4	143.9	178.2	-179.1	-94.4	0	0	0	110.9	D32 G33 R35 W86 G90	H30-D32 VanDerWaalsContact C-N 3.26Å; H30-D32 IonicContact CE1-OD1 3.52Å; H30-D32 IonicContact CE1-OD2 2.81Å; H30-D32 PolarHBondContact CE1-OD2 2.87Å; H30-D32 VanDerWaalsContact CE1-OD2 3.24Å; H30-D32 IonicContact CG-OD1 3.43Å; H30-D32 PolarHBondContact ND1-N 3.29Å; H30-D32 IonicContact ND1-OD1 3.61Å; H30-D32 PolarHBondContact ND1-OD1 3.11Å; H30-D32 IonicContact ND1-OD2 2.66Å; H30-D32 PolarHBondContact ND1-OD2 3.39Å; H30-D32 PolarHBondContact O-N 3.11Å; H30-D32 VanDerWaalsContact O-N 3.09Å; H30-G33 WeakPolarHBondContact O-CA 3.48Å; H30-G33 PolarHBondContact O-N 3.05Å; H30-R35 HydrophobicContact CB-CB 3.93Å; H30-R35 PolarHBondContact N-O 3.4Å; H30-W86 HydrophobicContact CB-CD2 4.17Å; H30-W86 HydrophobicContact CB-CG 4.42Å; H30-W86 HydrophobicContact CB-CZ2 4.13Å; H30-W86 AromaticContact CD2-CD2 3.65Å; H30-W86 AromaticContact CD2-CE2 3.87Å; H30-W86 AromaticContact CD2-CE3 3.47Å; H30-W86 VanDerWaalsContact CD2-CE3 3.47Å; H30-W86 AromaticContact CD2-CH2 3.77Å; H30-W86 AromaticContact CD2-CZ2 3.94Å; H30-W86 AromaticContact CD2-CZ3 3.51Å; H30-G90 WeakPolarHBondContact NE2-CA 3.3Å; H30-G90 PolarHBondContact NE2-O 3.27Å
31	P	92.5	Very high	94.8	Very high	33 Å²	33	17.3 Å²	17.3	21%	0.214	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-26	-172.9	-30	37.3	0	0	0	116.7	G33 W86 P88 S352	P31-G33 VanDerWaalsContact C-N 3.28Å; P31-W86 HydrophobicContact CG-CB 4.47Å; P31-P88 WeakPolarHBondContact CG-O 3.48Å; P31-S352 WeakPolarHBondContact O-CB 3.23Å; P31-S352 PolarHBondContact O-OG 3.46Å
32	D	90.6	Very high	94.8	Very high	82 Å²	82	18.7 Å²	18.7	44%	0.439	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-2.3	172.8	74.1	6.2	0	0	0	114.1	H30 S34	H30-D32 VanDerWaalsContact C-N 3.26Å; H30-D32 IonicContact CE1-OD1 3.52Å; H30-D32 IonicContact CE1-OD2 2.81Å; H30-D32 PolarHBondContact CE1-OD2 2.87Å; H30-D32 VanDerWaalsContact CE1-OD2 3.24Å; H30-D32 IonicContact CG-OD1 3.43Å; H30-D32 PolarHBondContact ND1-N 3.29Å; H30-D32 IonicContact ND1-OD1 3.61Å; H30-D32 PolarHBondContact ND1-OD1 3.11Å; H30-D32 IonicContact ND1-OD2 2.66Å; H30-D32 PolarHBondContact ND1-OD2 3.39Å; H30-D32 PolarHBondContact O-N 3.11Å; H30-D32 VanDerWaalsContact O-N 3.09Å; D32-S34 VanDerWaalsContact C-N 3.28Å; D32-S34 VanDerWaalsContact CG-OG 3.23Å; D32-S34 PolarHBondContact O-N 3.11Å; D32-S34 WeakPolarHBondContact OD1-CA 3.25Å; D32-S34 WeakPolarHBondContact OD1-CB 3.38Å; D32-S34 PolarHBondContact OD1-N 3.04Å; D32-S34 PolarHBondContact OD1-OG 2.93Å; D32-S34 PolarHBondContact OD2-OG 3.49Å
33	G	92.3	Very high	94.2	Very high	8 Å²	8	22.7 Å²	22.7	8%	0.082	12%	0.124	C	C	.	.	S	Bend	trans	74	1.8	-177.6	0	0	0	0	0	115.8	H30 P31 M53 R57	H30-G33 WeakPolarHBondContact O-CA 3.48Å; H30-G33 PolarHBondContact O-N 3.05Å; P31-G33 VanDerWaalsContact C-N 3.28Å; G33-M53 VanDerWaalsContact O-CB 3.29Å; G33-M53 WeakPolarHBondContact O-CB 3.31Å; G33-R57 VanDerWaalsContact O-CZ 3.23Å; G33-R57 PolarHBondContact O-NH1 2.71Å; G33-R57 PolarHBondContact O-NH2 3.22Å
34	S	93.2	Very high	93.6	Very high	38 Å²	38	27.1 Å²	27.1	27%	0.266	15%	0.15	S	C	.	.	S	Bend	trans	-80.2	-27.4	-175.2	67.5	0	0	0	0	114.7	D32 M53	D32-S34 VanDerWaalsContact C-N 3.28Å; D32-S34 VanDerWaalsContact CG-OG 3.23Å; D32-S34 PolarHBondContact O-N 3.11Å; D32-S34 WeakPolarHBondContact OD1-CA 3.25Å; D32-S34 WeakPolarHBondContact OD1-CB 3.38Å; D32-S34 PolarHBondContact OD1-N 3.04Å; D32-S34 PolarHBondContact OD1-OG 2.93Å; D32-S34 PolarHBondContact OD2-OG 3.49Å; S34-M53 PolarHBondContact O-N 2.91Å
35	R	94.6	Very high	93.2	Very high	23 Å²	23	29.9 Å²	29.9	9%	0.087	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	153	-177.5	-50.4	109.4	-161.2	-61.9	-18.1	114.1	H30 W51 M53 L71 E128	H30-R35 HydrophobicContact CB-CB 3.93Å; H30-R35 PolarHBondContact N-O 3.4Å; R35-W51 VanDerWaalsContact CA-O 3.31Å; R35-W51 WeakPolarHBondContact CA-O 3.46Å; R35-M53 VanDerWaalsContact C-CG 3.43Å; R35-L71 HydrophobicContact CB-CD1 4.43Å; R35-L71 HydrophobicContact CG-CD1 3.67Å; R35-E128 IonicContact CZ-OE1 3.5Å; R35-E128 IonicContact CZ-OE2 3.83Å; R35-E128 IonicContact NH1-OE1 2.9Å; R35-E128 PolarHBondContact NH1-OE1 2.9Å; R35-E128 IonicContact NH1-OE2 3.28Å; R35-E128 PolarHBondContact NH1-OE2 3.46Å; R35-E128 IonicContact NH2-OE1 2.73Å; R35-E128 PolarHBondContact NH2-OE1 2.79Å; R35-E128 IonicContact NH2-OE2 3.18Å; R35-E128 PolarHBondContact NH2-OE2 3.11Å
36	L	97.5	Very high	93	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.8	154.6	-174.5	76.2	0	0	0	108.8	V9 L27 I29 T38 L50 W51 M53 I56 M358	V9-L36 HydrophobicContact CG1-CD2 4.1Å; L27-L36 HydrophobicContact CB-CD1 4.24Å; L27-L36 HydrophobicContact CD1-CD1 4.37Å; L27-L36 HydrophobicContact CD2-CD1 4.2Å; I29-L36 HydrophobicContact CG1-CD1 3.95Å; L36-T38 HydrophobicContact CD2-CG2 3.62Å; L36-T38 HydrophobicContact CG-CG2 4.04Å; L36-L50 CarbonylContact O-C 3.47Å; L36-L50 WeakPolarHBondContact O-CA 3.41Å; L36-W51 HydrophobicContact CB-CB 4.3Å; L36-W51 PolarHBondContact N-O 2.93Å; L36-W51 PolarHBondContact O-N 2.91Å; L36-M53 HydrophobicContact CB-CG 4.44Å; L36-M53 HydrophobicContact CB-SD 3.95Å; L36-I56 HydrophobicContact CB-CD1 4.5Å; L36-I56 HydrophobicContact CD2-CD1 4.3Å; L36-M358 HydrophobicContact CD1-CB 4.28Å; L36-M358 HydrophobicContact CD1-CE 3.89Å; L36-M358 HydrophobicContact CD1-CG 4.14Å; L36-M358 HydrophobicContact CD2-CE 3.5Å; L36-M358 HydrophobicContact CG-CE 4.27Å
37	A	98.2	Very high	92.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	139.3	161.5	0	0	0	0	0	109.5	L27 D28 V49 L50 V84 W86 L93	L27-A37 CarbonylContact C-O 3.53Å; L27-A37 WeakPolarHBondContact CA-O 3.21Å; L27-A37 WeakPolarHBondContact CB-O 3.35Å; D28-A37 PolarHBondContact N-O 3.38Å; D28-A37 PolarHBondContact O-N 3.37Å; A37-V49 CarbonylContact C-O 3.39Å; A37-V49 WeakPolarHBondContact CA-O 3.37Å; A37-L50 HydrophobicContact CB-CD2 3.77Å; A37-V84 HydrophobicContact CB-CG2 4.36Å; A37-W86 HydrophobicContact CB-CZ2 4.04Å; A37-L93 HydrophobicContact CB-CD1 3.98Å; A37-L93 HydrophobicContact CB-CD2 3.87Å
38	T	98.2	Very high	92.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.7	171	59.8	0	0	0	0	110.9	V9 H11 I24 S26 L27 L36 V48 V49 W51 V366	V9-T38 HydrophobicContact CG1-CG2 4.47Å; H11-T38 PolarHBondContact NE2-O 2.98Å; I24-T38 HydrophobicContact CG2-CG2 4.27Å; S26-T38 WeakPolarHBondContact O-CA 3.18Å; L27-T38 HydrophobicContact CB-CG2 4Å; L36-T38 HydrophobicContact CD2-CG2 3.62Å; L36-T38 HydrophobicContact CG-CG2 4.04Å; T38-V48 WeakPolarHBondContact O-CA 3.3Å; T38-V49 PolarHBondContact N-O 3.45Å; T38-V49 PolarHBondContact O-N 2.91Å; T38-W51 PolarHBondContact OG1-NE1 3.46Å; T38-V366 HydrophobicContact CG2-CG1 4.48Å
39	G	97.3	Very high	92.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	138.5	177.3	0	0	0	0	0	112	H11 Y25 S26 V81	H11-G39 WeakPolarHBondContact NE2-CA 3.34Å; H11-G39 PolarHBondContact NE2-N 3.44Å; H11-G39 VanDerWaalsContact NE2-N 3.13Å; H11-G39 PolarHBondContact NE2-O 3.31Å; Y25-G39 PolarHBondContact N-O 3.47Å; S26-G39 PolarHBondContact N-O 2.99Å; S26-G39 PolarHBondContact O-N 2.89Å; G39-V81 CarbonylContact C-O 3.49Å
40	G	95.1	Very high	92.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	-148.3	-177	0	0	0	0	0	113.7	H11 V47 V81	H11-G40 WeakPolarHBondContact CE1-CA 3.34Å; H11-G40 VanDerWaalsContact NE2-CA 3.25Å; H11-G40 WeakPolarHBondContact NE2-CA 3.46Å; H11-G40 PolarHBondContact NE2-N 3.05Å; G40-V47 PolarHBondContact N-O 3.09Å; G40-V47 PolarHBondContact O-N 2.8Å; G40-V81 PolarHBondContact O-N 2.93Å
41	V	91.6	Very high	92.7	Very high	19 Å²	19	25.7 Å²	25.7	12%	0.115	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.2	-178.5	60.9	0	0	0	0	111.7	Y25 C45 C80	Y25-V41 HydrophobicContact CE2-CB 4.39Å; Y25-V41 HydrophobicContact CE2-CG1 4.08Å; V41-C45 WeakPolarHBondContact CA-O 3.28Å; V41-C45 WeakPolarHBondContact CG2-O 3.3Å; V41-C80 HydrophobicContact CB-CB 4.34Å
42	I	85.6	Confident	92.7	Very high	38 Å²	38	25.8 Å²	25.8	20%	0.195	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	113.3	170.2	-81.4	177.8	0	0	0	107.9	H11 T44 C45 V47	H11-I42 HydrophobicContact CB-CG1 4.27Å; I42-T44 VanDerWaalsContact C-N 3.3Å; I42-T44 PolarHBondContact O-N 3.19Å; I42-C45 PolarHBondContact N-O 2.97Å; I42-C45 PolarHBondContact O-N 3.04Å; I42-V47 HydrophobicContact CB-CB 4.38Å; I42-V47 HydrophobicContact CB-CG1 4.35Å; I42-V47 HydrophobicContact CD1-CB 3.91Å; I42-V47 HydrophobicContact CD1-CG1 3.86Å; I42-V47 HydrophobicContact CD1-CG2 3.85Å; I42-V47 HydrophobicContact CG1-CB 4.11Å; I42-V47 HydrophobicContact CG1-CG1 3.75Å
43	D	79.5	Confident	92.9	Very high	120 Å²	120	21.9 Å²	21.9	64%	0.642	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	-77.8	-177.2	-59.4	-78.1	0	0	0	113.2	R22	R22-D43 IonicContact CZ-OD1 2.72Å; R22-D43 IonicContact CZ-OD2 3.7Å; R22-D43 VanDerWaalsContact NH1-CG 3.27Å; R22-D43 IonicContact NH1-OD1 2.99Å; R22-D43 IonicContact NH1-OD2 3.86Å; R22-D43 PolarHBondContact NH1-OD2 3.36Å; R22-D43 VanDerWaalsContact NH2-CG 3.31Å; R22-D43 IonicContact NH2-OD1 2.76Å; R22-D43 PolarHBondContact NH2-OD1 3.18Å; R22-D43 IonicContact NH2-OD2 3.28Å; R22-D43 PolarHBondContact NH2-OD2 3.19Å
44	T	80	Confident	92.9	Very high	113 Å²	113	23.3 Å²	23.3	69%	0.693	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-133.1	-12.3	172.1	52.5	0	0	0	0	113.5	I42	I42-T44 VanDerWaalsContact C-N 3.3Å; I42-T44 PolarHBondContact O-N 3.19Å
45	C	87.2	Confident	92.8	Very high	58 Å²	58	21.5 Å²	21.5	39%	0.392	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	154.9	-174.9	-62.1	0	0	0	0	111.6	V41 I42	V41-C45 WeakPolarHBondContact CA-O 3.28Å; V41-C45 WeakPolarHBondContact CG2-O 3.3Å; I42-C45 PolarHBondContact N-O 2.97Å; I42-C45 PolarHBondContact O-N 3.04Å
46	G	92	Very high	92.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	130.2	173.8	0	0	0	0	0	111.6	H77 A79	G46-H77 PolarHBondContact N-O 2.78Å; G46-A79 WeakPolarHBondContact CA-O 3.45Å; G46-A79 PolarHBondContact N-O 3.27Å
47	V	95.6	Very high	92.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	142.2	174.9	65.6	0	0	0	0	111.3	H11 G40 I42 V49 Q73 D75	H11-V47 HydrophobicContact CB-CG1 4.32Å; G40-V47 PolarHBondContact N-O 3.09Å; G40-V47 PolarHBondContact O-N 2.8Å; I42-V47 HydrophobicContact CB-CB 4.38Å; I42-V47 HydrophobicContact CB-CG1 4.35Å; I42-V47 HydrophobicContact CD1-CB 3.91Å; I42-V47 HydrophobicContact CD1-CG1 3.86Å; I42-V47 HydrophobicContact CD1-CG2 3.85Å; I42-V47 HydrophobicContact CG1-CB 4.11Å; I42-V47 HydrophobicContact CG1-CG1 3.75Å; V47-V49 HydrophobicContact CG2-CG2 3.61Å; V47-Q73 HydrophobicContact CG2-CG 3.83Å; V47-D75 WeakPolarHBondContact CG2-OD1 3.47Å
48	V	97.1	Very high	92	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.1	158.4	-174.8	0	0	0	0	109.4	T38 M74 V81 V84 L93	T38-V48 WeakPolarHBondContact O-CA 3.3Å; V48-M74 HydrophobicContact CB-CB 4.29Å; V48-M74 HydrophobicContact CB-CE 3.98Å; V48-M74 HydrophobicContact CG1-CE 3.68Å; V48-M74 PolarHBondContact N-O 3.07Å; V48-M74 PolarHBondContact O-N 2.92Å; V48-V81 HydrophobicContact CG2-CB 4.44Å; V48-V81 HydrophobicContact CG2-CG1 3.99Å; V48-V81 HydrophobicContact CG2-CG2 4.05Å; V48-V84 HydrophobicContact CG1-CG1 3.99Å; V48-V84 HydrophobicContact CG2-CG1 3.89Å; V48-L93 HydrophobicContact CG1-CD2 3.86Å
49	V	96	Very high	91.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	139.2	177.6	-171.8	0	0	0	0	110.5	A37 T38 V47 W51 K70 F72 Q73	A37-V49 CarbonylContact C-O 3.39Å; A37-V49 WeakPolarHBondContact CA-O 3.37Å; T38-V49 PolarHBondContact N-O 3.45Å; T38-V49 PolarHBondContact O-N 2.91Å; V47-V49 HydrophobicContact CG2-CG2 3.61Å; V49-W51 HydrophobicContact CB-CZ2 3.89Å; V49-W51 HydrophobicContact CG1-CD2 3.84Å; V49-W51 HydrophobicContact CG1-CE3 4.33Å; V49-W51 HydrophobicContact CG1-CG 4.41Å; V49-W51 HydrophobicContact CG1-CH2 4.04Å; V49-W51 HydrophobicContact CG1-CZ2 3.48Å; V49-W51 VanDerWaalsContact CG1-CZ2 3.48Å; V49-W51 HydrophobicContact CG1-CZ3 4.43Å; V49-W51 HydrophobicContact CG2-CZ2 4.29Å; V49-K70 HydrophobicContact CG1-CD 4.08Å; V49-K70 HydrophobicContact CG1-CG 3.68Å; V49-F72 WeakPolarHBondContact CG1-O 3.5Å; V49-Q73 HydrophobicContact CG2-CG 4.35Å
50	L	96.6	Very high	91	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.5	169.3	-59	-173.3	0	0	0	110.1	L36 A37 K70 L71 F72 M74 W86 L93 W130	L36-L50 CarbonylContact O-C 3.47Å; L36-L50 WeakPolarHBondContact O-CA 3.41Å; A37-L50 HydrophobicContact CB-CD2 3.77Å; L50-K70 CarbonylContact O-C 3.6Å; L50-L71 HydrophobicContact CB-CB 4.09Å; L50-L71 PolarHBondContact O-N 3.39Å; L50-F72 HydrophobicContact CB-CB 4.35Å; L50-F72 HydrophobicContact CD1-CB 4.31Å; L50-F72 PolarHBondContact N-O 3.28Å; L50-F72 PolarHBondContact O-N 2.83Å; L50-M74 HydrophobicContact CD1-CE 4.22Å; L50-M74 HydrophobicContact CD2-CE 4.09Å; L50-M74 HydrophobicContact CG-CE 3.84Å; L50-W86 HydrophobicContact CD2-CH2 4.19Å; L50-W86 HydrophobicContact CD2-CZ2 3.82Å; L50-L93 HydrophobicContact CD2-CD2 4Å; L50-W130 HydrophobicContact CD1-CD2 3.83Å; L50-W130 HydrophobicContact CD1-CG 3.87Å; L50-W130 HydrophobicContact CD1-CZ2 4.27Å
51	W	95.7	Very high	90.6	Very high	8 Å²	8	36.8 Å²	36.8	3%	0.03	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	150.5	-179	-48	90	0	0	0	111.2	W8 V9 S10 R35 L36 T38 V49 I56 L69 K70	W8-W51 AromaticContact CE3-CE3 3.97Å; W8-W51 HydrophobicContact CE3-CE3 3.97Å; W8-W51 HydrophobicContact CE3-CZ3 4.16Å; W8-W51 AromaticContact CZ3-CE3 3.84Å; W8-W51 HydrophobicContact CZ3-CE3 3.84Å; W8-W51 HydrophobicContact CZ3-CZ3 4.49Å; W8-W51 WeakPolarHBondContact O-CH2 3.29Å; W8-W51 WeakPolarHBondContact O-CZ3 3.4Å; V9-W51 HydrophobicContact CB-CD2 4.48Å; V9-W51 HydrophobicContact CG1-CD2 3.97Å; V9-W51 HydrophobicContact CG1-CG 4.08Å; V9-W51 HydrophobicContact CG1-CZ2 4.26Å; V9-W51 HydrophobicContact CG2-CD2 4.36Å; V9-W51 HydrophobicContact CG2-CE3 4.4Å; S10-W51 VanDerWaalsContact O-CH2 3.28Å; S10-W51 WeakPolarHBondContact O-CH2 3.39Å; S10-W51 WeakPolarHBondContact O-CZ2 3.27Å; R35-W51 VanDerWaalsContact CA-O 3.31Å; R35-W51 WeakPolarHBondContact CA-O 3.46Å; L36-W51 HydrophobicContact CB-CB 4.3Å; L36-W51 PolarHBondContact N-O 2.93Å; L36-W51 PolarHBondContact O-N 2.91Å; T38-W51 PolarHBondContact OG1-NE1 3.46Å; V49-W51 HydrophobicContact CB-CZ2 3.89Å; V49-W51 HydrophobicContact CG1-CD2 3.84Å; V49-W51 HydrophobicContact CG1-CE3 4.33Å; V49-W51 HydrophobicContact CG1-CG 4.41Å; V49-W51 HydrophobicContact CG1-CH2 4.04Å; V49-W51 HydrophobicContact CG1-CZ2 3.48Å; V49-W51 VanDerWaalsContact CG1-CZ2 3.48Å; V49-W51 HydrophobicContact CG1-CZ3 4.43Å; V49-W51 HydrophobicContact CG2-CZ2 4.29Å; W51-I56 HydrophobicContact CB-CD1 4.47Å; W51-L69 WeakPolarHBondContact CA-O 3.32Å; W51-K70 HydrophobicContact CE3-CB 3.89Å; W51-K70 HydrophobicContact CE3-CG 4.07Å; W51-K70 HydrophobicContact CH2-CD 4.21Å; W51-K70 HydrophobicContact CH2-CG 4.4Å; W51-K70 HydrophobicContact CZ3-CB 3.83Å; W51-K70 HydrophobicContact CZ3-CD 4.03Å; W51-K70 HydrophobicContact CZ3-CG 3.89Å
52	N	93.5	Very high	90	Very high	35 Å²	35	39 Å²	39	19%	0.187	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	124.3	176.4	-173.4	-14.9	0	0	0	110.3	A54 P55 C68 L69 L71	N52-A54 PolarHBondContact OD1-N 3.46Å; N52-P55 WeakPolarHBondContact OD1-CD 3.45Å; N52-C68 VanDerWaalsContact CB-O 3.32Å; N52-C68 WeakPolarHBondContact CB-O 3.41Å; N52-C68 PolarHBondContact ND2-O 3.42Å; N52-L69 PolarHBondContact N-O 3.38Å; N52-L71 HydrophobicContact CB-CD1 4.31Å; N52-L71 HydrophobicContact CB-CD2 4.08Å; N52-L71 HydrophobicContact CB-CG 4.06Å
53	M	94.1	Very high	89.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-75.6	-19.7	179.2	-79.2	-69.8	-65.9	0	0	113.8	G33 S34 R35 L36 I56 R57 Y368	G33-M53 VanDerWaalsContact O-CB 3.29Å; G33-M53 WeakPolarHBondContact O-CB 3.31Å; S34-M53 PolarHBondContact O-N 2.91Å; R35-M53 VanDerWaalsContact C-CG 3.43Å; L36-M53 HydrophobicContact CB-CG 4.44Å; L36-M53 HydrophobicContact CB-SD 3.95Å; M53-I56 PolarHBondContact O-N 3.14Å; M53-I56 HydrophobicContact SD-CB 4.46Å; M53-I56 HydrophobicContact SD-CD1 4Å; M53-I56 HydrophobicContact SD-CG2 4.49Å; M53-R57 WeakPolarHBondContact O-CG 3.26Å; M53-R57 PolarHBondContact O-N 3.31Å; M53-Y368 HydrophobicContact CE-CD2 4.39Å; M53-Y368 HydrophobicContact CE-CE2 4.34Å
54	A	92.7	Very high	88.7	Confident	37 Å²	37	39.5 Å²	39.5	31%	0.306	24%	0.236	S	C	.	.	H	α-helix	trans	-64.2	-49	-177.1	0	0	0	0	0	112.6	N52 I56 R57 D58 L61	N52-A54 PolarHBondContact OD1-N 3.46Å; A54-I56 VanDerWaalsContact C-N 3.3Å; A54-I56 PolarHBondContact O-N 3.18Å; A54-R57 PolarHBondContact O-N 2.89Å; A54-D58 PolarHBondContact O-N 3.46Å; A54-L61 HydrophobicContact CB-CD1 4.06Å
55	P	91.5	Very high	87.5	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-28.5	173	-22.7	35.5	0	0	0	114.1	W8 N52 D58 L61 E62 L69	W8-P55 HydrophobicContact CH2-CB 4.12Å; W8-P55 HydrophobicContact CZ2-CB 3.8Å; N52-P55 WeakPolarHBondContact OD1-CD 3.45Å; P55-D58 CarbonylContact O-C 3.56Å; P55-D58 VanDerWaalsContact O-C 3.22Å; P55-L61 HydrophobicContact CG-CB 4.4Å; P55-E62 HydrophobicContact CB-CG 3.95Å; P55-L69 HydrophobicContact CB-CD2 3.72Å; P55-L69 HydrophobicContact CG-CD2 3.7Å
56	I	92.6	Very high	85.9	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-67.3	-38.5	174.6	-61.1	176.6	0	0	0	111.1	L4 P6 W8 V9 L36 W51 M53 A54 M358 Y368	L4-I56 WeakPolarHBondContact CD1-O 3.47Å; P6-I56 HydrophobicContact CG-CG1 4.4Å; P6-I56 HydrophobicContact CG-CG2 4.32Å; W8-I56 HydrophobicContact CH2-CD1 4.14Å; W8-I56 HydrophobicContact CH2-CG1 3.5Å; W8-I56 HydrophobicContact CZ2-CG1 3.72Å; W8-I56 HydrophobicContact CZ3-CG1 4.47Å; V9-I56 HydrophobicContact CG2-CD1 3.87Å; V9-I56 HydrophobicContact CG2-CG1 4.17Å; L36-I56 HydrophobicContact CB-CD1 4.5Å; L36-I56 HydrophobicContact CD2-CD1 4.3Å; W51-I56 HydrophobicContact CB-CD1 4.47Å; M53-I56 PolarHBondContact O-N 3.14Å; M53-I56 HydrophobicContact SD-CB 4.46Å; M53-I56 HydrophobicContact SD-CD1 4Å; M53-I56 HydrophobicContact SD-CG2 4.49Å; A54-I56 VanDerWaalsContact C-N 3.3Å; A54-I56 PolarHBondContact O-N 3.18Å; I56-M358 HydrophobicContact CD1-CE 4.26Å; I56-M358 HydrophobicContact CG2-CE 4.07Å; I56-M358 HydrophobicContact CG2-SD 4.2Å; I56-Y368 HydrophobicContact CG2-CD2 4.04Å; I56-Y368 HydrophobicContact CG2-CG 4.14Å
57	R	91.6	Very high	84.4	Confident	66 Å²	66	48.6 Å²	48.6	25%	0.249	28%	0.278	C	S	.	.	H	α-helix	trans	-71.3	-41.8	175.1	-72.6	174.2	177.3	112.7	16	112.1	R2 G33 M53 A54 E356 Y368	R2-R57 VanDerWaalsContact CZ-O 3.25Å; R2-R57 PolarHBondContact NH1-O 2.87Å; G33-R57 VanDerWaalsContact O-CZ 3.23Å; G33-R57 PolarHBondContact O-NH1 2.71Å; G33-R57 PolarHBondContact O-NH2 3.22Å; M53-R57 WeakPolarHBondContact O-CG 3.26Å; M53-R57 PolarHBondContact O-N 3.31Å; A54-R57 PolarHBondContact O-N 2.89Å; R57-E356 IonicContact CZ-OE1 3.9Å; R57-E356 IonicContact CZ-OE2 2.96Å; R57-E356 VanDerWaalsContact NE-CD 3.34Å; R57-E356 IonicContact NE-OE1 3.61Å; R57-E356 PolarHBondContact NE-OE1 2.84Å; R57-E356 IonicContact NE-OE2 2.7Å; R57-E356 PolarHBondContact NE-OE2 2.84Å; R57-E356 IonicContact NH2-OE1 2.97Å; R57-E356 IonicContact NH2-OE2 2.82Å; R57-E356 PolarHBondContact NH2-OE2 3.39Å; R57-Y368 HydrophobicContact CG-CE2 4.12Å
58	D	89.4	Confident	83.1	Confident	55 Å²	55	50 Å²	50	29%	0.294	29%	0.287	S	S	.	.			trans	-134.8	101.1	-179.8	-158.3	12.9	0	0	0	113.1	R2 A54 P55 T60 L61	R2-D58 IonicContact CZ-OD1 3.79Å; R2-D58 IonicContact NH1-OD1 3.76Å; R2-D58 IonicContact NH2-OD1 2.71Å; R2-D58 PolarHBondContact NH2-OD1 2.77Å; A54-D58 PolarHBondContact O-N 3.46Å; P55-D58 CarbonylContact O-C 3.56Å; P55-D58 VanDerWaalsContact O-C 3.22Å; D58-T60 PolarHBondContact O-N 2.97Å; D58-T60 PolarHBondContact OD1-OG1 3.47Å; D58-T60 PolarHBondContact OD2-OG1 3.1Å; D58-L61 HydrophobicContact CB-CD1 4.42Å; D58-L61 HydrophobicContact CB-CG 4.47Å; D58-L61 WeakPolarHBondContact O-CB 3.05Å; D58-L61 PolarHBondContact O-N 2.76Å
59	P	87.9	Confident	82.7	Confident	48 Å²	48	52.1 Å²	52.1	31%	0.312	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-60.4	-15.3	-179.6	-27.8	36.8	0	0	0	115.1	L4 L61 E62	L4-P59 HydrophobicContact CD1-CG 4.12Å; L4-P59 HydrophobicContact CD2-CG 4.23Å; P59-L61 PolarHBondContact O-N 3.24Å; P59-E62 WeakPolarHBondContact O-CB 3.4Å; P59-E62 WeakPolarHBondContact O-CG 3.2Å; P59-E62 PolarHBondContact O-N 3.07Å; P59-E62 VanDerWaalsContact O-N 3.15Å
60	T	86.3	Confident	82.4	Confident	102 Å²	102	55.2 Å²	55.2	63%	0.626	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-60.3	-25.8	173	62.5	0	0	0	0	112.3	D58	D58-T60 PolarHBondContact O-N 2.97Å; D58-T60 PolarHBondContact OD1-OG1 3.47Å; D58-T60 PolarHBondContact OD2-OG1 3.1Å
61	L	85.4	Confident	82.1	Confident	70 Å²	70	55.8 Å²	55.8	37%	0.366	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-78.8	-16.6	179.2	-59.8	177.1	0	0	0	113.2	A54 P55 D58 P59 S63 S64 S67	A54-L61 HydrophobicContact CB-CD1 4.06Å; P55-L61 HydrophobicContact CG-CB 4.4Å; D58-L61 HydrophobicContact CB-CD1 4.42Å; D58-L61 HydrophobicContact CB-CG 4.47Å; D58-L61 WeakPolarHBondContact O-CB 3.05Å; D58-L61 PolarHBondContact O-N 2.76Å; P59-L61 PolarHBondContact O-N 3.24Å; L61-S63 PolarHBondContact O-N 3.16Å; L61-S64 WeakPolarHBondContact O-CB 3.4Å; L61-S64 PolarHBondContact O-N 3.29Å; L61-S64 PolarHBondContact O-OG 3.1Å; L61-S67 WeakPolarHBondContact O-CB 3.4Å; L61-S67 PolarHBondContact O-OG 3Å
62	E	81	Confident	81.9	Confident	66 Å²	66	56.7 Å²	56.7	31%	0.308	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-59.9	-29.7	-176.6	-68.1	179.4	-169.5	0	0	113.4	W8 P55 P59 L69	W8-E62 PolarHBondContact NE1-OE1 3.41Å; W8-E62 PolarHBondContact NE1-OE2 2.95Å; P55-E62 HydrophobicContact CB-CG 3.95Å; P59-E62 WeakPolarHBondContact O-CB 3.4Å; P59-E62 WeakPolarHBondContact O-CG 3.2Å; P59-E62 PolarHBondContact O-N 3.07Å; P59-E62 VanDerWaalsContact O-N 3.15Å; E62-L69 HydrophobicContact CG-CD2 4.47Å
63	S	71.8	Confident	81.9	Confident	118 Å²	118	57 Å²	57	83%	0.825	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-88.4	3.2	179.6	-56	0	0	0	0	114.1	L61	L61-S63 PolarHBondContact O-N 3.16Å
64	S	66	Low	81.8	Confident	51 Å²	51	57.2 Å²	57.2	36%	0.357	32%	0.321	S	S	.	.			trans	-88.9	129.5	-177.3	68.4	0	0	0	0	111.7	L61 N66 S67	L61-S64 WeakPolarHBondContact O-CB 3.4Å; L61-S64 PolarHBondContact O-N 3.29Å; L61-S64 PolarHBondContact O-OG 3.1Å; S64-N66 PolarHBondContact O-N 2.67Å; S64-S67 WeakPolarHBondContact O-CB 3.44Å; S64-S67 PolarHBondContact O-N 2.74Å; S64-S67 PolarHBondContact O-OG 3.43Å; S64-S67 VanDerWaalsContact OG-CB 3.32Å; S64-S67 WeakPolarHBondContact OG-CB 3.49Å; S64-S67 PolarHBondContact OG-OG 2.91Å
65	D	54.5	Low	81.7	Confident	175 Å²	175	59.4 Å²	59.4	94%	0.936	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.4	-177.1	-84.5	-49.8	0	0	0	114.4
66	N	51.9	Low	81.7	Confident	167 Å²	167	62.6 Å²	62.6	89%	0.893	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-8.8	177.4	-71.9	-34	0	0	0	113.9	S64 C68	S64-N66 PolarHBondContact O-N 2.67Å; N66-C68 PolarHBondContact O-N 2.82Å; N66-C68 VanDerWaalsContact O-N 3.16Å
67	S	60.4	Low	81.7	Confident	20 Å²	20	62.6 Å²	62.6	14%	0.14	35%	0.35	C	S	.	.			trans	-85.7	84.6	-177.3	67.8	0	0	0	0	112.4	L61 S64 L69	L61-S67 WeakPolarHBondContact O-CB 3.4Å; L61-S67 PolarHBondContact O-OG 3Å; S64-S67 WeakPolarHBondContact O-CB 3.44Å; S64-S67 PolarHBondContact O-N 2.74Å; S64-S67 PolarHBondContact O-OG 3.43Å; S64-S67 VanDerWaalsContact OG-CB 3.32Å; S64-S67 WeakPolarHBondContact OG-CB 3.49Å; S64-S67 PolarHBondContact OG-OG 2.91Å; S67-L69 PolarHBondContact O-N 2.83Å
68	C	69.7	Low	81.8	Confident	28 Å²	28	67.3 Å²	67.3	19%	0.189	38%	0.375	C	S	.	.			trans	-67.6	99.6	164.9	-169.6	0	0	0	0	109.7	N52 N66 K70 K125 T127	N52-C68 VanDerWaalsContact CB-O 3.32Å; N52-C68 WeakPolarHBondContact CB-O 3.41Å; N52-C68 PolarHBondContact ND2-O 3.42Å; N66-C68 PolarHBondContact O-N 2.82Å; N66-C68 VanDerWaalsContact O-N 3.16Å; C68-K70 VanDerWaalsContact C-N 3.33Å; C68-K70 PolarHBondContact O-N 3.16Å; C68-K70 PolarHBondContact SG-O 3.36Å; C68-K125 PolarHBondContact SG-O 3.27Å; C68-T127 WeakPolarHBondContact CB-OG1 3.49Å
69	L	87.4	Confident	81.9	Confident	45 Å²	45	66 Å²	66	24%	0.236	37%	0.371	C	S	.	.	S	Bend	trans	-60.9	-41.8	-178.9	-58.4	-175.4	0	0	0	111.9	W8 W51 N52 P55 E62 S67	W8-L69 HydrophobicContact CD2-CB 4.46Å; W8-L69 HydrophobicContact CD2-CD1 3.98Å; W8-L69 HydrophobicContact CE3-CB 3.8Å; W8-L69 HydrophobicContact CE3-CD1 4.12Å; W8-L69 HydrophobicContact CE3-CG 4.41Å; W8-L69 HydrophobicContact CG-CD1 4.17Å; W8-L69 HydrophobicContact CH2-CB 4.25Å; W8-L69 HydrophobicContact CH2-CD2 4.19Å; W8-L69 HydrophobicContact CZ2-CD2 4.23Å; W8-L69 HydrophobicContact CZ3-CB 3.67Å; W8-L69 HydrophobicContact CZ3-CD2 4.42Å; W8-L69 HydrophobicContact CZ3-CG 4.45Å; W51-L69 WeakPolarHBondContact CA-O 3.32Å; N52-L69 PolarHBondContact N-O 3.38Å; P55-L69 HydrophobicContact CB-CD2 3.72Å; P55-L69 HydrophobicContact CG-CD2 3.7Å; E62-L69 HydrophobicContact CG-CD2 4.47Å; S67-L69 PolarHBondContact O-N 2.83Å
70	K	89.9	Confident	82.2	Confident	65 Å²	65	64.7 Å²	64.7	28%	0.283	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	94.2	-175.3	-174.8	177.7	176.5	173.9	0	109.3	V49 L50 W51 C68 Q73 F126	V49-K70 HydrophobicContact CG1-CD 4.08Å; V49-K70 HydrophobicContact CG1-CG 3.68Å; L50-K70 CarbonylContact O-C 3.6Å; W51-K70 HydrophobicContact CE3-CB 3.89Å; W51-K70 HydrophobicContact CE3-CG 4.07Å; W51-K70 HydrophobicContact CH2-CD 4.21Å; W51-K70 HydrophobicContact CH2-CG 4.4Å; W51-K70 HydrophobicContact CZ3-CB 3.83Å; W51-K70 HydrophobicContact CZ3-CD 4.03Å; W51-K70 HydrophobicContact CZ3-CG 3.89Å; C68-K70 VanDerWaalsContact C-N 3.33Å; C68-K70 PolarHBondContact O-N 3.16Å; C68-K70 PolarHBondContact SG-O 3.36Å; K70-Q73 VanDerWaalsContact CE-OE1 3.25Å; K70-F126 HydrophobicContact CD-CE1 4.35Å; K70-F126 HydrophobicContact CG-CE1 4.22Å; K70-F126 WeakPolarHBondContact O-CD1 3.22Å
71	L	90.4	Very high	82.7	Confident	13 Å²	13	59.8 Å²	59.8	7%	0.068	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	-45.9	-171.3	-68.1	178	0	0	0	113.1	R35 L50 N52 F126 T127 E128	R35-L71 HydrophobicContact CB-CD1 4.43Å; R35-L71 HydrophobicContact CG-CD1 3.67Å; L50-L71 HydrophobicContact CB-CB 4.09Å; L50-L71 PolarHBondContact O-N 3.39Å; N52-L71 HydrophobicContact CB-CD1 4.31Å; N52-L71 HydrophobicContact CB-CD2 4.08Å; N52-L71 HydrophobicContact CB-CG 4.06Å; L71-F126 WeakPolarHBondContact O-CA 3.36Å; L71-F126 WeakPolarHBondContact O-CB 3.16Å; L71-T127 PolarHBondContact O-N 3.06Å; L71-E128 HydrophobicContact CB-CB 4.28Å; L71-E128 HydrophobicContact CB-CG 4.04Å; L71-E128 HydrophobicContact CD2-CG 4.21Å; L71-E128 PolarHBondContact O-N 2.95Å
72	F	92	Very high	83.2	Confident	26 Å²	26	57.2 Å²	57.2	11%	0.114	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	161.9	-179.7	-165.4	-122	0	0	0	111.9	V49 L50 M74 F126 E128 W130	V49-F72 WeakPolarHBondContact CG1-O 3.5Å; L50-F72 HydrophobicContact CB-CB 4.35Å; L50-F72 HydrophobicContact CD1-CB 4.31Å; L50-F72 PolarHBondContact N-O 3.28Å; L50-F72 PolarHBondContact O-N 2.83Å; F72-M74 HydrophobicContact CD1-CE 4.47Å; F72-M74 HydrophobicContact CD1-CG 3.58Å; F72-M74 HydrophobicContact CD1-SD 3.97Å; F72-M74 HydrophobicContact CE1-CG 3.42Å; F72-M74 VanDerWaalsContact CE1-CG 3.42Å; F72-M74 HydrophobicContact CE1-SD 4.09Å; F72-F126 HydrophobicContact CD2-CB 4.08Å; F72-F126 HydrophobicContact CD2-CD2 4.08Å; F72-F126 HydrophobicContact CD2-CG 4.04Å; F72-F126 HydrophobicContact CE2-CD2 4.42Å; F72-E128 HydrophobicContact CB-CB 4.3Å; F72-E128 WeakPolarHBondContact CD2-O 3.43Å; F72-W130 HydrophobicContact CD1-CB 3.68Å; F72-W130 HydrophobicContact CD1-CG 4.19Å; F72-W130 HydrophobicContact CE1-CB 3.69Å; F72-W130 WeakPolarHBondContact CE1-O 3.21Å; F72-W130 WeakPolarHBondContact CZ-O 3.42Å
73	Q	92.8	Very high	84	Confident	41 Å²	41	54.1 Å²	54.1	19%	0.192	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	142.8	173.2	179.3	173.1	-55.9	0	0	110.4	V47 V49 K70 D75 F126	V47-Q73 HydrophobicContact CG2-CG 3.83Å; V49-Q73 HydrophobicContact CG2-CG 4.35Å; K70-Q73 VanDerWaalsContact CE-OE1 3.25Å; Q73-D75 VanDerWaalsContact CG-OD1 3.29Å; Q73-D75 WeakPolarHBondContact CG-OD1 3.28Å; Q73-D75 PolarHBondContact NE2-OD1 2.68Å; Q73-D75 PolarHBondContact NE2-OD2 3.48Å; Q73-F126 HydrophobicContact CB-CE1 4.26Å; Q73-F126 HydrophobicContact CB-CE2 4.47Å; Q73-F126 HydrophobicContact CB-CZ 3.77Å
74	M	93.2	Very high	85.3	Confident	6 Å²	6	48.5 Å²	48.5	3%	0.03	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	110.3	-176.1	-70	166.1	-64.3	0	0	109.5	V48 L50 F72 L93 W105 W130	V48-M74 HydrophobicContact CB-CB 4.29Å; V48-M74 HydrophobicContact CB-CE 3.98Å; V48-M74 HydrophobicContact CG1-CE 3.68Å; V48-M74 PolarHBondContact N-O 3.07Å; V48-M74 PolarHBondContact O-N 2.92Å; L50-M74 HydrophobicContact CD1-CE 4.22Å; L50-M74 HydrophobicContact CD2-CE 4.09Å; L50-M74 HydrophobicContact CG-CE 3.84Å; F72-M74 HydrophobicContact CD1-CE 4.47Å; F72-M74 HydrophobicContact CD1-CG 3.58Å; F72-M74 HydrophobicContact CD1-SD 3.97Å; F72-M74 HydrophobicContact CE1-CG 3.42Å; F72-M74 VanDerWaalsContact CE1-CG 3.42Å; F72-M74 HydrophobicContact CE1-SD 4.09Å; M74-L93 HydrophobicContact CE-CD2 4.16Å; M74-W105 HydrophobicContact CB-CE3 4.29Å; M74-W105 HydrophobicContact CB-CH2 3.73Å; M74-W105 HydrophobicContact CB-CZ2 4.05Å; M74-W105 HydrophobicContact CB-CZ3 3.85Å; M74-W105 HydrophobicContact CG-CD2 4.32Å; M74-W105 HydrophobicContact CG-CE3 3.8Å; M74-W105 HydrophobicContact CG-CH2 4.1Å; M74-W105 HydrophobicContact CG-CZ3 3.67Å; M74-W105 HydrophobicContact SD-CB 4.23Å; M74-W105 HydrophobicContact SD-CD2 3.49Å; M74-W105 HydrophobicContact SD-CE3 3.34Å; M74-W105 HydrophobicContact SD-CG 3.88Å; M74-W105 HydrophobicContact SD-CZ3 3.89Å; M74-W130 HydrophobicContact SD-CB 3.84Å
75	D	90.4	Very high	86.8	Confident	82 Å²	82	46.7 Å²	46.7	44%	0.439	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	27.5	-170.5	-54	-52.2	0	0	0	112.9	V47 Q73	V47-D75 WeakPolarHBondContact CG2-OD1 3.47Å; Q73-D75 VanDerWaalsContact CG-OD1 3.29Å; Q73-D75 WeakPolarHBondContact CG-OD1 3.28Å; Q73-D75 PolarHBondContact NE2-OD1 2.68Å; Q73-D75 PolarHBondContact NE2-OD2 3.48Å
76	S	90.7	Very high	88.8	Confident	69 Å²	69	38.9 Å²	38.9	48%	0.483	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-11.9	-174.8	-52.9	0	0	0	0	114.6	M103	S76-M103 WeakPolarHBondContact O-CE 3.47Å
77	H	93.3	Very high	90.8	Very high	2 Å²	2	31 Å²	31	1%	0.009	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129.6	176.1	-87.7	-78.3	0	0	0	110.4	G46 A79 V81 S95 D99	G46-H77 PolarHBondContact N-O 2.78Å; H77-A79 VanDerWaalsContact C-N 3.27Å; H77-A79 PolarHBondContact O-N 2.88Å; H77-V81 HydrophobicContact CB-CG2 3.81Å; H77-S95 PolarHBondContact CD2-OG 2.88Å; H77-S95 PolarHBondContact NE2-OG 3.13Å; H77-D99 WeakPolarHBondContact CA-OD2 3.44Å; H77-D99 WeakPolarHBondContact CB-OD2 3.47Å; H77-D99 IonicContact CE1-OD1 3.19Å; H77-D99 IonicContact CG-OD1 2.65Å; H77-D99 IonicContact CG-OD2 3.48Å; H77-D99 VanDerWaalsContact ND1-CG 3.28Å; H77-D99 IonicContact ND1-OD1 3Å; H77-D99 PolarHBondContact ND1-OD1 3.5Å; H77-D99 IonicContact ND1-OD2 2.74Å; H77-D99 PolarHBondContact ND1-OD2 2.92Å
78	Q	92.6	Very high	92.2	Very high	165 Å²	165	31.4 Å²	31.4	77%	0.771	17%	0.168	S	C	*	.	S	Bend	trans	-80.1	-8.6	-174.5	-64.4	-174.5	-13.5	0	0	113.4	D99	Q78-D99 HydrophobicContact CB-CB 4.03Å; Q78-D99 PolarHBondContact N-OD2 3.25Å
79	A	92.8	Very high	92.9	Very high	26 Å²	26	32 Å²	32	22%	0.215	17%	0.173	C	C	.	.	S	Bend	trans	-153.1	174	174.9	0	0	0	0	0	110.4	G46 H77 V81 M98 D99	G46-A79 WeakPolarHBondContact CA-O 3.45Å; G46-A79 PolarHBondContact N-O 3.27Å; H77-A79 VanDerWaalsContact C-N 3.27Å; H77-A79 PolarHBondContact O-N 2.88Å; A79-V81 PolarHBondContact O-N 3.38Å; A79-M98 HydrophobicContact CB-CB 3.81Å; A79-D99 HydrophobicContact CB-CB 4.23Å
80	C	93	Very high	93	Very high	21 Å²	21	30 Å²	30	14%	0.142	16%	0.163	C	C	.	.			trans	-42.6	132.2	-173.7	-55.1	0	0	0	0	115	Y25 V41 N82 G97 M98	Y25-C80 HydrophobicContact CE2-CB 4.03Å; V41-C80 HydrophobicContact CB-CB 4.34Å; C80-N82 PolarHBondContact O-N 3.34Å; C80-G97 CarbonylContact O-C 3.58Å; C80-G97 WeakPolarHBondContact O-CA 3.43Å; C80-M98 HydrophobicContact CB-CG 4.15Å; C80-M98 HydrophobicContact CB-SD 3.7Å; C80-M98 PolarHBondContact O-N 2.85Å
81	V	97.2	Very high	93	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	107.4	174.7	-174.2	0	0	0	0	110.4	Y25 G39 G40 V48 H77 A79 V84 A96	Y25-V81 WeakPolarHBondContact CD2-O 3.44Å; G39-V81 CarbonylContact C-O 3.49Å; G40-V81 PolarHBondContact O-N 2.93Å; V48-V81 HydrophobicContact CG2-CB 4.44Å; V48-V81 HydrophobicContact CG2-CG1 3.99Å; V48-V81 HydrophobicContact CG2-CG2 4.05Å; H77-V81 HydrophobicContact CB-CG2 3.81Å; A79-V81 PolarHBondContact O-N 3.38Å; V81-V84 HydrophobicContact CG1-CG1 3.87Å; V81-A96 CarbonylContact C-O 3.58Å; V81-A96 WeakPolarHBondContact CG1-O 3.1Å
82	N	96.4	Very high	93.1	Very high	16 Å²	16	31.5 Å²	31.5	9%	0.086	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-28.5	-176.2	-66.5	-33.4	0	0	0	113.2	C80 A96 I143 R246	C80-N82 PolarHBondContact O-N 3.34Å; N82-A96 PolarHBondContact N-O 3.12Å; N82-I143 WeakPolarHBondContact CB-O 3.47Å; N82-I143 PolarHBondContact ND2-O 2.8Å; N82-R246 PolarHBondContact O-NH2 3.21Å
83	C	97.6	Very high	93.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	140	-178.2	-165.1	0	0	0	0	113	S95 A96 D145 L146 R246	C83-S95 WeakPolarHBondContact O-CA 3.49Å; C83-A96 PolarHBondContact N-O 2.91Å; C83-A96 PolarHBondContact O-N 3.28Å; C83-D145 PolarHBondContact SG-OD1 2.88Å; C83-L146 HydrophobicContact CB-CB 4.49Å; C83-L146 HydrophobicContact CB-CD1 4.43Å; C83-L146 HydrophobicContact CB-CG 4.19Å; C83-L146 PolarHBondContact SG-N 2.89Å; C83-L146 VanDerWaalsContact SG-N 3.44Å; C83-R246 PolarHBondContact SG-NH1 3.42Å; C83-R246 VanDerWaalsContact SG-NH1 3.37Å
84	V	98.2	Very high	93.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135.2	167.7	-64.5	0	0	0	0	109.9	S26 A37 V48 V81 L93 A94	S26-V84 PolarHBondContact OG-N 3.2Å; S26-V84 PolarHBondContact OG-O 3.38Å; A37-V84 HydrophobicContact CB-CG2 4.36Å; V48-V84 HydrophobicContact CG1-CG1 3.99Å; V48-V84 HydrophobicContact CG2-CG1 3.89Å; V81-V84 HydrophobicContact CG1-CG1 3.87Å; V84-L93 HydrophobicContact CB-CD1 4.29Å; V84-A94 CarbonylContact C-O 3.53Å; V84-A94 VanDerWaalsContact CA-O 3.32Å; V84-A94 WeakPolarHBondContact CA-O 3.38Å
85	R	97.8	Very high	93.8	Very high	13 Å²	13	28 Å²	28	5%	0.049	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	125.2	-179.7	-65.9	-63.9	167.5	-127.2	-6.6	113.5	L27 D28 A94 D145 L146 W148 D347	L27-R85 PolarHBondContact O-NH1 3Å; D28-R85 WeakPolarHBondContact OD2-CA 3.3Å; R85-A94 PolarHBondContact N-O 2.79Å; R85-A94 PolarHBondContact O-N 2.62Å; R85-D145 IonicContact NH2-OD1 2.74Å; R85-L146 HydrophobicContact CB-CB 4.44Å; R85-L146 HydrophobicContact CG-CB 3.87Å; R85-L146 WeakPolarHBondContact CG-O 3.46Å; R85-W148 PolarHBondContact O-NE1 3.02Å; R85-W148 VanDerWaalsContact O-NE1 3.16Å; R85-D347 IonicContact CZ-OD1 3.91Å; R85-D347 IonicContact CZ-OD2 2.83Å; R85-D347 VanDerWaalsContact CZ-OD2 3.3Å; R85-D347 IonicContact NH1-OD1 3.92Å; R85-D347 IonicContact NH1-OD2 3.33Å; R85-D347 PolarHBondContact NH1-OD2 2.96Å; R85-D347 VanDerWaalsContact NH2-CG 3.26Å; R85-D347 IonicContact NH2-OD1 3.17Å; R85-D347 PolarHBondContact NH2-OD1 2.92Å; R85-D347 IonicContact NH2-OD2 2.71Å; R85-D347 PolarHBondContact NH2-OD2 2.83Å
86	W	97.1	Very high	94.1	Very high	12 Å²	12	24.1 Å²	24.1	5%	0.045	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	138	168.8	-69.1	107	0	0	0	110.8	D28 I29 H30 P31 A37 L50 L93 W130	D28-W86 PolarHBondContact O-NE1 3.06Å; D28-W86 VanDerWaalsContact O-NE1 3.17Å; D28-W86 PolarHBondContact OD2-N 3.04Å; I29-W86 VanDerWaalsContact C-CD1 3.41Å; I29-W86 VanDerWaalsContact O-CD1 3.29Å; H30-W86 HydrophobicContact CB-CD2 4.17Å; H30-W86 HydrophobicContact CB-CG 4.42Å; H30-W86 HydrophobicContact CB-CZ2 4.13Å; H30-W86 AromaticContact CD2-CD2 3.65Å; H30-W86 AromaticContact CD2-CE2 3.87Å; H30-W86 AromaticContact CD2-CE3 3.47Å; H30-W86 VanDerWaalsContact CD2-CE3 3.47Å; H30-W86 AromaticContact CD2-CH2 3.77Å; H30-W86 AromaticContact CD2-CZ2 3.94Å; H30-W86 AromaticContact CD2-CZ3 3.51Å; P31-W86 HydrophobicContact CG-CB 4.47Å; A37-W86 HydrophobicContact CB-CZ2 4.04Å; L50-W86 HydrophobicContact CD2-CH2 4.19Å; L50-W86 HydrophobicContact CD2-CZ2 3.82Å; W86-L93 HydrophobicContact CD2-CB 4.3Å; W86-L93 HydrophobicContact CD2-CD1 3.83Å; W86-L93 HydrophobicContact CE3-CB 3.74Å; W86-L93 HydrophobicContact CE3-CD1 4.14Å; W86-L93 HydrophobicContact CE3-CG 4.5Å; W86-L93 HydrophobicContact CG-CD1 4.19Å; W86-L93 HydrophobicContact CH2-CB 3.93Å; W86-L93 HydrophobicContact CH2-CD2 4.24Å; W86-L93 HydrophobicContact CH2-CG 4.5Å; W86-L93 HydrophobicContact CZ2-CB 4.45Å; W86-L93 HydrophobicContact CZ2-CD1 4.29Å; W86-L93 HydrophobicContact CZ2-CD2 4.22Å; W86-L93 HydrophobicContact CZ3-CB 3.55Å; W86-L93 HydrophobicContact CZ3-CG 4.46Å; W86-W130 HydrophobicContact CH2-CE3 4.48Å; W86-W130 AromaticContact CH2-CH2 3.47Å; W86-W130 HydrophobicContact CH2-CH2 3.47Å; W86-W130 VanDerWaalsContact CH2-CH2 3.47Å; W86-W130 AromaticContact CH2-CZ2 4Å; W86-W130 HydrophobicContact CH2-CZ2 4Å; W86-W130 AromaticContact CH2-CZ3 3.75Å; W86-W130 HydrophobicContact CH2-CZ3 3.75Å; W86-W130 AromaticContact CZ3-CH2 3.42Å; W86-W130 HydrophobicContact CZ3-CH2 3.42Å; W86-W130 VanDerWaalsContact CZ3-CH2 3.42Å; W86-W130 HydrophobicContact CZ3-CZ2 4.37Å; W86-W130 AromaticContact CZ3-CZ3 3.54Å; W86-W130 HydrophobicContact CZ3-CZ3 3.54Å
87	S	94	Very high	94.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.			trans	-62.5	145.9	161	53.5	0	0	0	0	109.4	S89 G90 W92	S87-S89 PolarHBondContact O-N 3.14Å; S87-G90 PolarHBondContact O-N 2.62Å; S87-W92 WeakPolarHBondContact CB-O 3.36Å; S87-W92 PolarHBondContact N-O 2.91Å; S87-W92 PolarHBondContact OG-N 2.85Å; S87-W92 PolarHBondContact OG-O 3.17Å
88	P	89.5	Confident	94.3	Very high	29 Å²	29	24.2 Å²	24.2	19%	0.188	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-25.9	180	-29.3	36.3	0	0	0	114.3	P31 W148 F401	P31-P88 WeakPolarHBondContact CG-O 3.48Å; P88-W148 HydrophobicContact CG-CB 4.4Å; P88-F401 HydrophobicContact CB-CD2 3.95Å; P88-F401 HydrophobicContact CB-CE2 3.45Å; P88-F401 VanDerWaalsContact CB-CE2 3.45Å; P88-F401 HydrophobicContact CB-CZ 4.17Å; P88-F401 WeakPolarHBondContact O-CE2 3.21Å; P88-F401 WeakPolarHBondContact O-CZ 3.4Å
89	S	85.3	Confident	94.4	Very high	40 Å²	40	17.7 Å²	17.7	28%	0.28	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	0.9	177.1	61.1	0	0	0	0	114.6	S87 R91 I404	S87-S89 PolarHBondContact O-N 3.14Å; S89-R91 PolarHBondContact O-N 3.45Å; S89-I404 WeakPolarHBondContact O-CD1 3.35Å; S89-I404 WeakPolarHBondContact O-CG1 3.44Å
90	G	89.8	Confident	94.5	Very high	3 Å²	3	20.8 Å²	20.8	3%	0.031	10%	0.102	C	C	.	.	S	Bend	trans	67.3	-20.3	-176.7	0	0	0	0	0	115.8	H30 S87 W92	H30-G90 WeakPolarHBondContact NE2-CA 3.3Å; H30-G90 PolarHBondContact NE2-O 3.27Å; S87-G90 PolarHBondContact O-N 2.62Å; G90-W92 PolarHBondContact O-N 3.35Å; G90-W92 VanDerWaalsContact O-N 3.14Å
91	R	88.6	Confident	94.7	Very high	103 Å²	103	20.4 Å²	20.4	39%	0.389	10%	0.099	S	C	.	.	S	Bend	trans	-55.5	-35.8	-174.1	-170.1	175.2	-169.5	148.9	5.1	113.6	S89	S89-R91 PolarHBondContact O-N 3.45Å
92	W	92.3	Very high	94.7	Very high	7 Å²	7	20.4 Å²	20.4	3%	0.027	10%	0.099	C	C	.	.			trans	-123.3	140.7	176.8	-49	-64.2	0	0	0	112.9	S87 G90 W105 W148 N181 F183	S87-W92 WeakPolarHBondContact CB-O 3.36Å; S87-W92 PolarHBondContact N-O 2.91Å; S87-W92 PolarHBondContact OG-N 2.85Å; S87-W92 PolarHBondContact OG-O 3.17Å; G90-W92 PolarHBondContact O-N 3.35Å; G90-W92 VanDerWaalsContact O-N 3.14Å; W92-W105 VanDerWaalsContact CA-O 3.22Å; W92-W105 WeakPolarHBondContact CA-O 3.44Å; W92-W148 HydrophobicContact CB-CH2 4.5Å; W92-W148 HydrophobicContact CB-CZ2 4.34Å; W92-W148 AromaticContact CE3-CH2 3.89Å; W92-W148 HydrophobicContact CE3-CH2 3.89Å; W92-W148 HydrophobicContact CE3-CZ3 4.27Å; W92-N181 PolarHBondContact NE1-OD1 3.2Å; W92-N181 VanDerWaalsContact NE1-OD1 3.1Å; W92-F183 HydrophobicContact CE3-CZ 4.12Å; W92-F183 HydrophobicContact CH2-CZ 4.32Å; W92-F183 HydrophobicContact CZ3-CZ 4.02Å
93	L	97	Very high	94.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	131.3	157	179.9	59.7	0	0	0	108.3	A37 V48 L50 M74 V84 W86 L104 W105	A37-L93 HydrophobicContact CB-CD1 3.98Å; A37-L93 HydrophobicContact CB-CD2 3.87Å; V48-L93 HydrophobicContact CG1-CD2 3.86Å; L50-L93 HydrophobicContact CD2-CD2 4Å; M74-L93 HydrophobicContact CE-CD2 4.16Å; V84-L93 HydrophobicContact CB-CD1 4.29Å; W86-L93 HydrophobicContact CD2-CB 4.3Å; W86-L93 HydrophobicContact CD2-CD1 3.83Å; W86-L93 HydrophobicContact CE3-CB 3.74Å; W86-L93 HydrophobicContact CE3-CD1 4.14Å; W86-L93 HydrophobicContact CE3-CG 4.5Å; W86-L93 HydrophobicContact CG-CD1 4.19Å; W86-L93 HydrophobicContact CH2-CB 3.93Å; W86-L93 HydrophobicContact CH2-CD2 4.24Å; W86-L93 HydrophobicContact CH2-CG 4.5Å; W86-L93 HydrophobicContact CZ2-CB 4.45Å; W86-L93 HydrophobicContact CZ2-CD1 4.29Å; W86-L93 HydrophobicContact CZ2-CD2 4.22Å; W86-L93 HydrophobicContact CZ3-CB 3.55Å; W86-L93 HydrophobicContact CZ3-CG 4.46Å; L93-L104 CarbonylContact O-C 3.6Å; L93-L104 WeakPolarHBondContact O-CA 3.26Å; L93-W105 HydrophobicContact CB-CB 4.27Å; L93-W105 PolarHBondContact N-O 2.89Å; L93-W105 PolarHBondContact O-N 3.26Å
94	A	97.7	Very high	94.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	137.3	165.4	0	0	0	0	0	109.6	V84 R85 I102 M103 L104 L146 W148 L155	V84-A94 CarbonylContact C-O 3.53Å; V84-A94 VanDerWaalsContact CA-O 3.32Å; V84-A94 WeakPolarHBondContact CA-O 3.38Å; R85-A94 PolarHBondContact N-O 2.79Å; R85-A94 PolarHBondContact O-N 2.62Å; A94-I102 HydrophobicContact CB-CG2 4.45Å; A94-M103 WeakPolarHBondContact CA-O 3.18Å; A94-L104 HydrophobicContact CB-CD2 3.57Å; A94-L146 HydrophobicContact CB-CD1 3.86Å; A94-W148 HydrophobicContact CB-CZ2 3.96Å; A94-L155 HydrophobicContact CB-CD2 4.28Å
95	S	98.2	Very high	94.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.7	168.5	61.8	0	0	0	0	110.5	H77 C83 I102 M103 W105	H77-S95 PolarHBondContact CD2-OG 2.88Å; H77-S95 PolarHBondContact NE2-OG 3.13Å; C83-S95 WeakPolarHBondContact O-CA 3.49Å; S95-I102 CarbonylContact O-C 3.59Å; S95-I102 VanDerWaalsContact O-CA 3.28Å; S95-I102 WeakPolarHBondContact O-CA 3.47Å; S95-I102 WeakPolarHBondContact O-CG2 3.49Å; S95-M103 PolarHBondContact N-O 3.27Å; S95-M103 PolarHBondContact O-N 2.95Å; S95-W105 PolarHBondContact OG-NE1 3.11Å
96	A	97.2	Very high	94.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	150	176.3	0	0	0	0	0	112	V81 N82 C83 V101 I102 I143 L146	V81-A96 CarbonylContact C-O 3.58Å; V81-A96 WeakPolarHBondContact CG1-O 3.1Å; N82-A96 PolarHBondContact N-O 3.12Å; C83-A96 PolarHBondContact N-O 2.91Å; C83-A96 PolarHBondContact O-N 3.28Å; A96-V101 WeakPolarHBondContact CA-O 3.22Å; A96-I102 HydrophobicContact CB-CB 4.45Å; A96-I102 HydrophobicContact CB-CG1 4.08Å; A96-I102 HydrophobicContact CB-CG2 4.4Å; A96-I143 HydrophobicContact CB-CB 3.88Å; A96-I143 HydrophobicContact CB-CD1 4.32Å; A96-I143 HydrophobicContact CB-CG2 3.57Å; A96-L146 HydrophobicContact CB-CD1 3.82Å; A96-L146 HydrophobicContact CB-CD2 4.02Å; A96-L146 HydrophobicContact CB-CG 4.02Å
97	G	93.2	Very high	93.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	-170.2	-171.1	0	0	0	0	0	115.6	C80 D99 K100 I143	C80-G97 CarbonylContact O-C 3.58Å; C80-G97 WeakPolarHBondContact O-CA 3.43Å; G97-D99 PolarHBondContact O-N 3.39Å; G97-K100 PolarHBondContact O-N 3.37Å; G97-I143 PolarHBondContact O-N 3.34Å; G97-I143 VanDerWaalsContact O-N 3.13Å
98	M	95.1	Very high	93.5	Very high	74 Å²	74	26 Å²	26	37%	0.365	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-13.5	177.2	-62.4	178.9	163.2	0	0	112.9	A79 C80 K100 D142	A79-M98 HydrophobicContact CB-CB 3.81Å; C80-M98 HydrophobicContact CB-CG 4.15Å; C80-M98 HydrophobicContact CB-SD 3.7Å; C80-M98 PolarHBondContact O-N 2.85Å; M98-K100 WeakPolarHBondContact O-CG 3.33Å; M98-K100 PolarHBondContact O-N 2.84Å; M98-D142 HydrophobicContact CB-CB 4.44Å; M98-D142 WeakPolarHBondContact CB-OD2 3.49Å; M98-D142 HydrophobicContact CG-CB 4.32Å; M98-D142 VanDerWaalsContact CG-OD2 3.28Å; M98-D142 WeakPolarHBondContact CG-OD2 3.3Å
99	D	94.5	Very high	92.6	Very high	28 Å²	28	29 Å²	29	15%	0.15	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	10.5	171.8	62.7	-12.9	0	0	0	113.7	H77 Q78 A79 G97 V101	H77-D99 WeakPolarHBondContact CA-OD2 3.44Å; H77-D99 WeakPolarHBondContact CB-OD2 3.47Å; H77-D99 IonicContact CE1-OD1 3.19Å; H77-D99 IonicContact CG-OD1 2.65Å; H77-D99 IonicContact CG-OD2 3.48Å; H77-D99 VanDerWaalsContact ND1-CG 3.28Å; H77-D99 IonicContact ND1-OD1 3Å; H77-D99 PolarHBondContact ND1-OD1 3.5Å; H77-D99 IonicContact ND1-OD2 2.74Å; H77-D99 PolarHBondContact ND1-OD2 2.92Å; Q78-D99 HydrophobicContact CB-CB 4.03Å; Q78-D99 PolarHBondContact N-OD2 3.25Å; A79-D99 HydrophobicContact CB-CB 4.23Å; G97-D99 PolarHBondContact O-N 3.39Å; D99-V101 HydrophobicContact CB-CG2 4.38Å; D99-V101 VanDerWaalsContact CG-CG2 3.48Å; D99-V101 PolarHBondContact O-N 2.82Å; D99-V101 WeakPolarHBondContact OD1-CG2 3.46Å; D99-V101 WeakPolarHBondContact OD2-CG2 3.24Å
100	K	95.9	Very high	91.2	Very high	90 Å²	90	31.1 Å²	31.1	39%	0.391	19%	0.186	S	C	.	.	S	Bend	trans	64	14.5	167.9	-43.9	-175.7	175.9	-170	0	114.7	G97 M98 S140	G97-K100 PolarHBondContact O-N 3.37Å; M98-K100 WeakPolarHBondContact O-CG 3.33Å; M98-K100 PolarHBondContact O-N 2.84Å; K100-S140 WeakPolarHBondContact CD-O 3.22Å; K100-S140 WeakPolarHBondContact CE-O 3.34Å; K100-S140 PolarHBondContact NZ-O 3.19Å
101	V	96.1	Very high	89.2	Confident	14 Å²	14	34.4 Å²	34.4	9%	0.085	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	152	178.1	-66.5	0	0	0	0	111.6	A96 D99 M103 T135 R137	A96-V101 WeakPolarHBondContact CA-O 3.22Å; D99-V101 HydrophobicContact CB-CG2 4.38Å; D99-V101 VanDerWaalsContact CG-CG2 3.48Å; D99-V101 PolarHBondContact O-N 2.82Å; D99-V101 WeakPolarHBondContact OD1-CG2 3.46Å; D99-V101 WeakPolarHBondContact OD2-CG2 3.24Å; V101-M103 HydrophobicContact CG2-CE 3.8Å; V101-M103 HydrophobicContact CG2-CG 4.5Å; V101-T135 HydrophobicContact CB-CG2 3.91Å; V101-T135 HydrophobicContact CG1-CG2 4.03Å; V101-R137 HydrophobicContact CG1-CG 3.81Å
102	I	97.6	Very high	87.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124.1	166.4	-47.4	170.5	0	0	0	106.9	A94 S95 A96 L104 T135 L136 I143 L146 L155 W167	A94-I102 HydrophobicContact CB-CG2 4.45Å; S95-I102 CarbonylContact O-C 3.59Å; S95-I102 VanDerWaalsContact O-CA 3.28Å; S95-I102 WeakPolarHBondContact O-CA 3.47Å; S95-I102 WeakPolarHBondContact O-CG2 3.49Å; A96-I102 HydrophobicContact CB-CB 4.45Å; A96-I102 HydrophobicContact CB-CG1 4.08Å; A96-I102 HydrophobicContact CB-CG2 4.4Å; I102-L104 HydrophobicContact CG2-CD2 4.34Å; I102-T135 CarbonylContact O-C 3.6Å; I102-T135 WeakPolarHBondContact O-CA 3.18Å; I102-L136 HydrophobicContact CB-CB 4.03Å; I102-L136 HydrophobicContact CB-CD1 4.22Å; I102-L136 HydrophobicContact CB-CG 4.18Å; I102-L136 HydrophobicContact CD1-CB 4.35Å; I102-L136 HydrophobicContact CD1-CD1 4.21Å; I102-L136 HydrophobicContact CG1-CB 4.49Å; I102-L136 HydrophobicContact CG2-CD1 4.31Å; I102-L136 PolarHBondContact N-O 2.89Å; I102-L136 VanDerWaalsContact N-O 3.09Å; I102-L136 PolarHBondContact O-N 3.22Å; I102-I143 HydrophobicContact CD1-CD1 4.29Å; I102-I143 HydrophobicContact CG1-CD1 3.56Å; I102-L146 HydrophobicContact CD1-CD2 4.07Å; I102-L146 HydrophobicContact CG1-CD2 4.34Å; I102-L146 HydrophobicContact CG2-CD1 4.3Å; I102-L146 HydrophobicContact CG2-CD2 4.26Å; I102-L155 HydrophobicContact CG2-CD2 4.27Å; I102-W167 HydrophobicContact CD1-CZ2 4.14Å; I102-W167 VanDerWaalsContact CD1-NE1 3.34Å
103	M	96.7	Very high	85	Confident	16 Å²	16	44.7 Å²	44.7	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.9	173	-62	-168	-170	0	0	109.7	S76 A94 S95 V101 W105 T135	S76-M103 WeakPolarHBondContact O-CE 3.47Å; A94-M103 WeakPolarHBondContact CA-O 3.18Å; S95-M103 PolarHBondContact N-O 3.27Å; S95-M103 PolarHBondContact O-N 2.95Å; V101-M103 HydrophobicContact CG2-CE 3.8Å; V101-M103 HydrophobicContact CG2-CG 4.5Å; M103-W105 HydrophobicContact CB-CZ2 3.94Å; M103-W105 HydrophobicContact CG-CZ2 4.44Å; M103-W105 HydrophobicContact SD-CH2 4.21Å; M103-W105 HydrophobicContact SD-CZ2 3.69Å; M103-T135 HydrophobicContact CG-CG2 4.39Å
104	L	95.6	Very high	82.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.4	170.7	-57.8	-173.3	0	0	0	108.7	L93 A94 I102 C132 V133 S134 L136 W148 L155 F183	L93-L104 CarbonylContact O-C 3.6Å; L93-L104 WeakPolarHBondContact O-CA 3.26Å; A94-L104 HydrophobicContact CB-CD2 3.57Å; I102-L104 HydrophobicContact CG2-CD2 4.34Å; L104-C132 CarbonylContact O-C 3.6Å; L104-C132 WeakPolarHBondContact O-CA 3.42Å; L104-V133 HydrophobicContact CB-CG2 4.22Å; L104-V133 WeakPolarHBondContact O-CG2 3.5Å; L104-V133 PolarHBondContact O-N 3.45Å; L104-S134 PolarHBondContact N-O 3.03Å; L104-S134 PolarHBondContact O-N 3Å; L104-L136 HydrophobicContact CD1-CD1 4.32Å; L104-L136 HydrophobicContact CD1-CD2 4.37Å; L104-L136 HydrophobicContact CG-CD1 4.44Å; L104-W148 HydrophobicContact CD2-CH2 4.34Å; L104-W148 HydrophobicContact CD2-CZ2 4.15Å; L104-L155 HydrophobicContact CD2-CD2 4.01Å; L104-F183 HydrophobicContact CD1-CD1 4.4Å; L104-F183 HydrophobicContact CD1-CD2 3.42Å; L104-F183 VanDerWaalsContact CD1-CD2 3.42Å; L104-F183 HydrophobicContact CD1-CE1 4.35Å; L104-F183 HydrophobicContact CD1-CE2 3.38Å; L104-F183 HydrophobicContact CD1-CG 3.96Å; L104-F183 HydrophobicContact CD1-CZ 3.87Å
105	W	94.9	Very high	80.3	Confident	7 Å²	7	52.6 Å²	52.6	3%	0.027	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140.1	-176.5	-51.8	84.4	0	0	0	110.8	M74 W92 L93 S95 M103 W130 R131 C132	M74-W105 HydrophobicContact CB-CE3 4.29Å; M74-W105 HydrophobicContact CB-CH2 3.73Å; M74-W105 HydrophobicContact CB-CZ2 4.05Å; M74-W105 HydrophobicContact CB-CZ3 3.85Å; M74-W105 HydrophobicContact CG-CD2 4.32Å; M74-W105 HydrophobicContact CG-CE3 3.8Å; M74-W105 HydrophobicContact CG-CH2 4.1Å; M74-W105 HydrophobicContact CG-CZ3 3.67Å; M74-W105 HydrophobicContact SD-CB 4.23Å; M74-W105 HydrophobicContact SD-CD2 3.49Å; M74-W105 HydrophobicContact SD-CE3 3.34Å; M74-W105 HydrophobicContact SD-CG 3.88Å; M74-W105 HydrophobicContact SD-CZ3 3.89Å; W92-W105 VanDerWaalsContact CA-O 3.22Å; W92-W105 WeakPolarHBondContact CA-O 3.44Å; L93-W105 HydrophobicContact CB-CB 4.27Å; L93-W105 PolarHBondContact N-O 2.89Å; L93-W105 PolarHBondContact O-N 3.26Å; S95-W105 PolarHBondContact OG-NE1 3.11Å; M103-W105 HydrophobicContact CB-CZ2 3.94Å; M103-W105 HydrophobicContact CG-CZ2 4.44Å; M103-W105 HydrophobicContact SD-CH2 4.21Å; M103-W105 HydrophobicContact SD-CZ2 3.69Å; W105-W130 HydrophobicContact CB-CE3 4.29Å; W105-R131 WeakPolarHBondContact CA-O 3.35Å; W105-C132 HydrophobicContact CD2-CB 4.4Å; W105-C132 HydrophobicContact CE3-CB 4Å; W105-C132 VanDerWaalsContact CE3-N 3.28Å; W105-C132 HydrophobicContact CH2-CB 4.3Å; W105-C132 HydrophobicContact CZ3-CB 3.95Å
106	S	92.8	Very high	77.8	Confident	21 Å²	21	60 Å²	60	15%	0.147	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	149.2	171.6	-175.4	0	0	0	0	110.1	W130 R131	S106-W130 WeakPolarHBondContact O-CA 3.43Å; S106-R131 PolarHBondContact N-O 2.82Å; S106-R131 PolarHBondContact O-N 3.29Å
107	K	90.5	Very high	75.4	Confident	69 Å²	69	63 Å²	63	30%	0.3	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	137.6	170	-169.5	169	171.9	168.8	0	110	E128 W130	K107-E128 VanDerWaalsContact CD-OE2 3.3Å; K107-E128 WeakPolarHBondContact CD-OE2 3.4Å; K107-E128 WeakPolarHBondContact CE-OE2 3.46Å; K107-E128 IonicContact NZ-OE1 2.95Å; K107-E128 PolarHBondContact NZ-OE1 3.43Å; K107-E128 IonicContact NZ-OE2 3.94Å; K107-E128 PolarHBondContact NZ-OE2 2.86Å; K107-E128 VanDerWaalsContact NZ-OE2 3.12Å; K107-W130 HydrophobicContact CB-CD2 4Å; K107-W130 HydrophobicContact CB-CE3 4.3Å; K107-W130 HydrophobicContact CB-CH2 3.92Å; K107-W130 HydrophobicContact CB-CZ2 3.62Å; K107-W130 HydrophobicContact CB-CZ3 4.25Å; K107-W130 HydrophobicContact CD-CZ2 4.15Å; K107-W130 HydrophobicContact CG-CZ2 4.15Å
108	T	85.4	Confident	72.8	Confident	45 Å²	45	68.1 Å²	68.1	28%	0.276	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-85.5	129	172.3	-59.2	0	0	0	0	109.3	H129	T108-H129 PolarHBondContact N-O 3.47Å
109	A	70.2	Confident	70.6	Confident	93 Å²	93	67.7 Å²	67.7	77%	0.769	40%	0.4	S	S	*	.	S	Bend	trans	-77.3	147.2	176	0	0	0	0	0	111.8	T111	A109-T111 PolarHBondContact O-N 3.14Å
110	G	56.9	Low	68.2	Low	84 Å²	84	69.3 Å²	69.3	87%	0.866	41%	0.414	S	S	*	.	S	Bend	trans	84.9	-0.1	162.3	0	0	0	0	0	118.6
111	T	46.3	Very low	65.7	Low	72 Å²	72	75.2 Å²	75.2	44%	0.442	44%	0.439	S	S	.	.			trans	-120.3	90.8	-179.5	58	0	0	0	0	113.2	A109 H129	A109-T111 PolarHBondContact O-N 3.14Å; T111-H129 PolarHBondContact O-CD2 3.41Å; T111-H129 VanDerWaalsContact O-CD2 3.31Å
112	S	46.5	Very low	63.2	Low	112 Å²	112	81.7 Å²	81.7	78%	0.783	47%	0.469	S	S	*	.			trans	-101.6	9.3	166.5	53.5	0	0	0	0	113.2
113	R	47.4	Very low	60.7	Low	214 Å²	214	84.6 Å²	84.6	81%	0.808	49%	0.488	S	S	*	.	S	Bend	trans	-77.4	128.7	172.7	-70.5	-174	175.3	-168	-1.9	109.3	V115	R113-V115 PolarHBondContact O-N 3.11Å
114	P	47.9	Very low	58.6	Low	88 Å²	88	86 Å²	86	57%	0.571	50%	0.497	S	S	*	.			trans	-65.2	111.7	-179.6	26.4	-33.9	0	0	0	110.2	Q116	P114-Q116 PolarHBondContact O-N 3.13Å; P114-Q116 VanDerWaalsContact O-N 3.15Å
115	V	46.7	Very low	57	Low	77 Å²	77	94.2 Å²	94.2	47%	0.467	53%	0.533	S	S	.	.			trans	-70.1	109.8	173.7	179.2	0	0	0	0	108.1	R113 V117 T124	R113-V115 PolarHBondContact O-N 3.11Å; V115-V117 PolarHBondContact O-N 3.13Å; V115-T124 PolarHBondContact O-OG1 2.95Å
116	Q	47.1	Very low	56.1	Low	155 Å²	155	96.2 Å²	96.2	72%	0.724	54%	0.542	S	S	*	.			trans	-67.9	103.4	166.1	-73.9	-175.5	-12.9	0	0	108.4	P114 F118 P123	P114-Q116 PolarHBondContact O-N 3.13Å; P114-Q116 VanDerWaalsContact O-N 3.15Å; Q116-F118 PolarHBondContact O-N 3.12Å; Q116-P123 HydrophobicContact CG-CB 4.33Å
117	V	46.9	Very low	55.5	Low	63 Å²	63	99.3 Å²	99.3	38%	0.382	56%	0.56	S	S	.	*			trans	-61.5	110.6	167.2	176.2	0	0	0	0	107.4	V115 G119 S120 T124	V115-V117 PolarHBondContact O-N 3.13Å; V117-G119 PolarHBondContact O-N 3.49Å; V117-S120 VanDerWaalsContact O-CB 3.29Å; V117-S120 WeakPolarHBondContact O-CB 3.17Å; V117-S120 PolarHBondContact O-N 3.26Å; V117-T124 HydrophobicContact CB-CG2 4.49Å; V117-T124 HydrophobicContact CG2-CG2 4.1Å
118	F	39.1	Very low	55.3	Low	109 Å²	109	96.9 Å²	96.9	48%	0.478	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	135	-174.2	-175.6	-81.5	0	0	0	111.3	Q116 S120 Q1005 V1006	Q116-F118 PolarHBondContact O-N 3.12Å; F118-S120 VanDerWaalsContact C-N 3.33Å; F118-Q1005 HydrophobicContact CD1-CG 4.27Å; F118-Q1005 HydrophobicContact CE1-CB 4.4Å; F118-Q1005 HydrophobicContact CE1-CG 3.26Å; F118-Q1005 HydrophobicContact CZ-CB 4.35Å; F118-Q1005 HydrophobicContact CZ-CG 3.6Å; F118-V1006 HydrophobicContact CB-CB 4.35Å; F118-V1006 HydrophobicContact CD1-CB 4.47Å; F118-V1006 WeakPolarHBondContact CD1-O 3.27Å; F118-V1006 HydrophobicContact CD2-CB 3.5Å; F118-V1006 HydrophobicContact CD2-CG2 3.87Å; F118-V1006 HydrophobicContact CE2-CB 3.9Å; F118-V1006 HydrophobicContact CE2-CG2 4.01Å; F118-V1006 HydrophobicContact CG-CB 3.81Å; F118-V1006 VanDerWaalsContact CG-O 3.24Å; F118-V1006 WeakPolarHBondContact CG-O 3.37Å
119	G	47.8	Very low	55.4	Low	64 Å²	64	96.5 Å²	96.5	66%	0.66	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	-14.2	-176.9	0	0	0	0	0	114.4	V117	V117-G119 PolarHBondContact O-N 3.49Å
120	S	44.2	Very low	56.5	Low	62 Å²	62	92.8 Å²	92.8	43%	0.434	51%	0.511	S	S	.	.			trans	-72.7	134.7	168.2	-172.4	0	0	0	0	110.7	V117 F118 E122	V117-S120 VanDerWaalsContact O-CB 3.29Å; V117-S120 WeakPolarHBondContact O-CB 3.17Å; V117-S120 PolarHBondContact O-N 3.26Å; F118-S120 VanDerWaalsContact C-N 3.33Å; S120-E122 VanDerWaalsContact CB-O 3.3Å; S120-E122 WeakPolarHBondContact CB-O 3.48Å; S120-E122 PolarHBondContact OG-N 3.3Å; S120-E122 PolarHBondContact OG-O 2.92Å
121	K	43.9	Very low	58.1	Low	214 Å²	214	94.9 Å²	94.9	93%	0.93	49%	0.493	S	S	*	.	S	Bend	trans	-74.4	-16.2	171.3	-69.9	-173.1	177.1	-177.3	0	112.9
122	E	43.6	Very low	60.4	Low	151 Å²	151	93.3 Å²	93.3	71%	0.706	48%	0.484	S	S	*	.	S	Bend	trans	-118.8	135.9	177.4	-64.1	-179.4	175.7	0	0	109.8	S120 T124	S120-E122 VanDerWaalsContact CB-O 3.3Å; S120-E122 WeakPolarHBondContact CB-O 3.48Å; S120-E122 PolarHBondContact OG-N 3.3Å; S120-E122 PolarHBondContact OG-O 2.92Å; E122-T124 PolarHBondContact O-N 2.83Å
123	P	44.9	Very low	62.5	Low	61 Å²	61	89.2 Å²	89.2	40%	0.396	46%	0.455	S	S	.	.			trans	-64.4	124.9	168.7	28.4	-32.8	0	0	0	108.6	Q116 K125	Q116-P123 HydrophobicContact CG-CB 4.33Å; P123-K125 WeakPolarHBondContact O-CG 3.04Å; P123-K125 PolarHBondContact O-N 3.14Å
124	T	52.2	Low	64.5	Low	46 Å²	46	80.2 Å²	80.2	28%	0.282	42%	0.424	S	S	.	.			trans	-64.6	98.4	175	44.5	0	0	0	0	109.2	V115 V117 E122 F126	V115-T124 PolarHBondContact O-OG1 2.95Å; V117-T124 HydrophobicContact CB-CG2 4.49Å; V117-T124 HydrophobicContact CG2-CG2 4.1Å; E122-T124 PolarHBondContact O-N 2.83Å; T124-F126 HydrophobicContact CG2-CE2 4.47Å; T124-F126 PolarHBondContact O-N 2.9Å
125	K	62	Low	66.8	Low	171 Å²	171	78.9 Å²	78.9	74%	0.743	42%	0.415	S	S	*	.			trans	-69.6	33.2	-173.1	-64.4	-171.7	177.5	-177.4	0	114.6	C68 P123 T127	C68-K125 PolarHBondContact SG-O 3.27Å; P123-K125 WeakPolarHBondContact O-CG 3.04Å; P123-K125 PolarHBondContact O-N 3.14Å; K125-T127 PolarHBondContact O-N 3.46Å
126	F	76.6	Confident	69.1	Low	50 Å²	50	75.6 Å²	75.6	22%	0.219	39%	0.394	C	S	.	.			trans	-64.6	121.5	172.4	-63.1	-46.5	0	0	0	109.6	K70 L71 F72 Q73 T124	K70-F126 HydrophobicContact CD-CE1 4.35Å; K70-F126 HydrophobicContact CG-CE1 4.22Å; K70-F126 WeakPolarHBondContact O-CD1 3.22Å; L71-F126 WeakPolarHBondContact O-CA 3.36Å; L71-F126 WeakPolarHBondContact O-CB 3.16Å; F72-F126 HydrophobicContact CD2-CB 4.08Å; F72-F126 HydrophobicContact CD2-CD2 4.08Å; F72-F126 HydrophobicContact CD2-CG 4.04Å; F72-F126 HydrophobicContact CE2-CD2 4.42Å; Q73-F126 HydrophobicContact CB-CE1 4.26Å; Q73-F126 HydrophobicContact CB-CE2 4.47Å; Q73-F126 HydrophobicContact CB-CZ 3.77Å; T124-F126 HydrophobicContact CG2-CE2 4.47Å; T124-F126 PolarHBondContact O-N 2.9Å
127	T	79.4	Confident	71.3	Confident	86 Å²	86	77.5 Å²	77.5	53%	0.528	40%	0.395	S	S	.	.	S	Bend	trans	-78.7	-12.3	176.8	-47.8	0	0	0	0	111.8	C68 L71 K125	C68-T127 WeakPolarHBondContact CB-OG1 3.49Å; L71-T127 PolarHBondContact O-N 3.06Å; K125-T127 PolarHBondContact O-N 3.46Å
128	E	86.8	Confident	73.4	Confident	18 Å²	18	76.8 Å²	76.8	8%	0.084	40%	0.4	C	S	.	.			trans	-129.5	148.8	-169.1	-71.8	-94	160	0	0	110	R35 L71 F72 K107 W130	R35-E128 IonicContact CZ-OE1 3.5Å; R35-E128 IonicContact CZ-OE2 3.83Å; R35-E128 IonicContact NH1-OE1 2.9Å; R35-E128 PolarHBondContact NH1-OE1 2.9Å; R35-E128 IonicContact NH1-OE2 3.28Å; R35-E128 PolarHBondContact NH1-OE2 3.46Å; R35-E128 IonicContact NH2-OE1 2.73Å; R35-E128 PolarHBondContact NH2-OE1 2.79Å; R35-E128 IonicContact NH2-OE2 3.18Å; R35-E128 PolarHBondContact NH2-OE2 3.11Å; L71-E128 HydrophobicContact CB-CB 4.28Å; L71-E128 HydrophobicContact CB-CG 4.04Å; L71-E128 HydrophobicContact CD2-CG 4.21Å; L71-E128 PolarHBondContact O-N 2.95Å; F72-E128 HydrophobicContact CB-CB 4.3Å; F72-E128 WeakPolarHBondContact CD2-O 3.43Å; K107-E128 VanDerWaalsContact CD-OE2 3.3Å; K107-E128 WeakPolarHBondContact CD-OE2 3.4Å; K107-E128 WeakPolarHBondContact CE-OE2 3.46Å; K107-E128 IonicContact NZ-OE1 2.95Å; K107-E128 PolarHBondContact NZ-OE1 3.43Å; K107-E128 IonicContact NZ-OE2 3.94Å; K107-E128 PolarHBondContact NZ-OE2 2.86Å; K107-E128 VanDerWaalsContact NZ-OE2 3.12Å; E128-W130 PolarHBondContact OE2-NE1 2.94Å
129	H	87.7	Confident	76.1	Confident	36 Å²	36	72.2 Å²	72.2	17%	0.167	38%	0.38	C	S	.	.			trans	-130.1	128.3	173.4	-72.1	-88.4	0	0	0	109.5	T108 T111	T108-H129 PolarHBondContact N-O 3.47Å; T111-H129 PolarHBondContact O-CD2 3.41Å; T111-H129 VanDerWaalsContact O-CD2 3.31Å
130	W	91.7	Very high	78.4	Confident	16 Å²	16	73.4 Å²	73.4	6%	0.061	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	148.3	177.8	-68.7	64.3	0	0	0	109.2	L50 F72 M74 W86 W105 S106 K107 E128	L50-W130 HydrophobicContact CD1-CD2 3.83Å; L50-W130 HydrophobicContact CD1-CG 3.87Å; L50-W130 HydrophobicContact CD1-CZ2 4.27Å; F72-W130 HydrophobicContact CD1-CB 3.68Å; F72-W130 HydrophobicContact CD1-CG 4.19Å; F72-W130 HydrophobicContact CE1-CB 3.69Å; F72-W130 WeakPolarHBondContact CE1-O 3.21Å; F72-W130 WeakPolarHBondContact CZ-O 3.42Å; M74-W130 HydrophobicContact SD-CB 3.84Å; W86-W130 HydrophobicContact CH2-CE3 4.48Å; W86-W130 AromaticContact CH2-CH2 3.47Å; W86-W130 HydrophobicContact CH2-CH2 3.47Å; W86-W130 VanDerWaalsContact CH2-CH2 3.47Å; W86-W130 AromaticContact CH2-CZ2 4Å; W86-W130 HydrophobicContact CH2-CZ2 4Å; W86-W130 AromaticContact CH2-CZ3 3.75Å; W86-W130 HydrophobicContact CH2-CZ3 3.75Å; W86-W130 AromaticContact CZ3-CH2 3.42Å; W86-W130 HydrophobicContact CZ3-CH2 3.42Å; W86-W130 VanDerWaalsContact CZ3-CH2 3.42Å; W86-W130 HydrophobicContact CZ3-CZ2 4.37Å; W86-W130 AromaticContact CZ3-CZ3 3.54Å; W86-W130 HydrophobicContact CZ3-CZ3 3.54Å; W105-W130 HydrophobicContact CB-CE3 4.29Å; S106-W130 WeakPolarHBondContact O-CA 3.43Å; K107-W130 HydrophobicContact CB-CD2 4Å; K107-W130 HydrophobicContact CB-CE3 4.3Å; K107-W130 HydrophobicContact CB-CH2 3.92Å; K107-W130 HydrophobicContact CB-CZ2 3.62Å; K107-W130 HydrophobicContact CB-CZ3 4.25Å; K107-W130 HydrophobicContact CD-CZ2 4.15Å; K107-W130 HydrophobicContact CG-CZ2 4.15Å; E128-W130 PolarHBondContact OE2-NE1 2.94Å
131	R	91.7	Very high	80.8	Confident	127 Å²	127	70.7 Å²	70.7	48%	0.479	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	147.1	178.1	68.7	-175.9	-172.5	93.4	-9.5	110.7	W105 S106 V133	W105-R131 WeakPolarHBondContact CA-O 3.35Å; S106-R131 PolarHBondContact N-O 2.82Å; S106-R131 PolarHBondContact O-N 3.29Å; R131-V133 HydrophobicContact CG-CG1 4.09Å; R131-V133 PolarHBondContact O-N 3.48Å
132	C	93.3	Very high	83.3	Confident	40 Å²	40	62.7 Å²	62.7	27%	0.27	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	128.5	165.7	-172.7	0	0	0	0	108.1	L104 W105 S134 T135	L104-C132 CarbonylContact O-C 3.6Å; L104-C132 WeakPolarHBondContact O-CA 3.42Å; W105-C132 HydrophobicContact CD2-CB 4.4Å; W105-C132 HydrophobicContact CE3-CB 4Å; W105-C132 VanDerWaalsContact CE3-N 3.28Å; W105-C132 HydrophobicContact CH2-CB 4.3Å; W105-C132 HydrophobicContact CZ3-CB 3.95Å; C132-S134 PolarHBondContact SG-O 2.8Å; C132-S134 VanDerWaalsContact SG-O 3.35Å; C132-T135 PolarHBondContact SG-OG1 3.06Å
133	V	90.8	Very high	85.8	Confident	26 Å²	26	55.6 Å²	55.6	16%	0.158	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-16.2	178.2	-64.4	0	0	0	0	112.7	L104 R131 N181	L104-V133 HydrophobicContact CB-CG2 4.22Å; L104-V133 WeakPolarHBondContact O-CG2 3.5Å; L104-V133 PolarHBondContact O-N 3.45Å; R131-V133 HydrophobicContact CG-CG1 4.09Å; R131-V133 PolarHBondContact O-N 3.48Å; V133-N181 HydrophobicContact CB-CB 3.95Å; V133-N181 HydrophobicContact CG2-CB 4.02Å
134	S	91.1	Very high	88.3	Confident	25 Å²	25	53.6 Å²	53.6	18%	0.175	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	143.1	175.4	-167.7	0	0	0	0	110.8	L104 C132 N181	L104-S134 PolarHBondContact N-O 3.03Å; L104-S134 PolarHBondContact O-N 3Å; C132-S134 PolarHBondContact SG-O 2.8Å; C132-S134 VanDerWaalsContact SG-O 3.35Å; S134-N181 WeakPolarHBondContact CB-O 3.49Å
135	T	94.2	Very high	90.4	Very high	60 Å²	60	51.4 Å²	51.4	37%	0.368	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	108.3	176.6	-57.8	0	0	0	0	109.1	V101 I102 M103 C132	V101-T135 HydrophobicContact CB-CG2 3.91Å; V101-T135 HydrophobicContact CG1-CG2 4.03Å; I102-T135 CarbonylContact O-C 3.6Å; I102-T135 WeakPolarHBondContact O-CA 3.18Å; M103-T135 HydrophobicContact CG-CG2 4.39Å; C132-T135 PolarHBondContact SG-OG1 3.06Å
136	L	95.3	Very high	92.1	Very high	7 Å²	7	43.2 Å²	43.2	4%	0.037	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.4	-176.8	-36.5	-179.4	0	0	0	109.5	I102 L104 L155 W167 F183	I102-L136 HydrophobicContact CB-CB 4.03Å; I102-L136 HydrophobicContact CB-CD1 4.22Å; I102-L136 HydrophobicContact CB-CG 4.18Å; I102-L136 HydrophobicContact CD1-CB 4.35Å; I102-L136 HydrophobicContact CD1-CD1 4.21Å; I102-L136 HydrophobicContact CG1-CB 4.49Å; I102-L136 HydrophobicContact CG2-CD1 4.31Å; I102-L136 PolarHBondContact N-O 2.89Å; I102-L136 VanDerWaalsContact N-O 3.09Å; I102-L136 PolarHBondContact O-N 3.22Å; L104-L136 HydrophobicContact CD1-CD1 4.32Å; L104-L136 HydrophobicContact CD1-CD2 4.37Å; L104-L136 HydrophobicContact CG-CD1 4.44Å; L136-L155 HydrophobicContact CD1-CD2 4.04Å; L136-W167 HydrophobicContact CB-CD2 4.11Å; L136-W167 HydrophobicContact CB-CE3 3.94Å; L136-W167 HydrophobicContact CB-CH2 4.01Å; L136-W167 HydrophobicContact CB-CZ2 4.14Å; L136-W167 HydrophobicContact CB-CZ3 3.89Å; L136-W167 HydrophobicContact CD1-CB 4.1Å; L136-W167 HydrophobicContact CD1-CD2 3.76Å; L136-W167 HydrophobicContact CD1-CE3 4.12Å; L136-W167 HydrophobicContact CD1-CG 3.74Å; L136-W167 HydrophobicContact CG-CD2 4.49Å; L136-W167 HydrophobicContact CG-CE3 4.45Å; L136-F183 HydrophobicContact CD2-CB 3.77Å
137	R	94.5	Very high	93.1	Very high	195 Å²	195	41.9 Å²	41.9	74%	0.736	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	131.1	-176.4	-78.1	172.9	175.2	-177.5	-1.3	109.2	V101 W167	V101-R137 HydrophobicContact CG1-CG 3.81Å; R137-W167 WeakPolarHBondContact O-CH2 3.34Å
138	G	91.1	Very high	93.8	Very high	48 Å²	48	38.6 Å²	38.6	50%	0.495	21%	0.207	S	C	.	.			trans	172.3	-27.4	-179	0	0	0	0	0	114.5	I165	G138-I165 VanDerWaalsContact C-CD1 3.49Å
139	H	95.8	Very high	94.1	Very high	13 Å²	13	37.8 Å²	37.8	6%	0.06	20%	0.203	C	C	.	.			trans	-71.9	142.9	168.5	-79.4	-62.6	0	0	0	111.1	I143 S157 S159 D161 S163 I165	H139-I143 HydrophobicContact CB-CD1 4.21Å; H139-I143 HydrophobicContact CB-CG1 4.04Å; H139-S157 PolarHBondContact CD2-OG 3.32Å; H139-S157 PolarHBondContact NE2-O 2.95Å; H139-S157 PolarHBondContact NE2-OG 2.99Å; H139-S159 WeakPolarHBondContact ND1-CB 3.47Å; H139-D161 WeakPolarHBondContact CA-OD2 3.44Å; H139-D161 VanDerWaalsContact CB-OD2 3.31Å; H139-D161 WeakPolarHBondContact CB-OD2 3.15Å; H139-D161 IonicContact CE1-OD1 2.75Å; H139-D161 IonicContact CG-OD2 3.72Å; H139-D161 IonicContact ND1-OD1 2.75Å; H139-D161 PolarHBondContact ND1-OD1 2.97Å; H139-D161 IonicContact ND1-OD2 3.16Å; H139-D161 PolarHBondContact ND1-OD2 3.37Å; H139-S163 PolarHBondContact CE1-OG 3.29Å; H139-S163 VanDerWaalsContact CE1-OG 3.32Å; H139-S163 PolarHBondContact ND1-OG 3.38Å; H139-I165 HydrophobicContact CB-CD1 4.44Å; H139-I165 VanDerWaalsContact CE1-CG1 3.5Å; H139-I165 WeakPolarHBondContact CE1-CG1 3.46Å
140	S	95.3	Very high	94.1	Very high	89 Å²	89	38.5 Å²	38.5	62%	0.622	21%	0.206	S	C	*	.	S	Bend	trans	-97.3	-9.3	177.3	66.5	0	0	0	0	113.1	K100 D161	K100-S140 WeakPolarHBondContact CD-O 3.22Å; K100-S140 WeakPolarHBondContact CE-O 3.34Å; K100-S140 PolarHBondContact NZ-O 3.19Å; S140-D161 PolarHBondContact N-OD2 3.43Å; S140-D161 WeakPolarHBondContact OG-CB 3.35Å
141	G	94.5	Very high	93.6	Very high	6 Å²	6	39.2 Å²	39.2	6%	0.062	21%	0.211	C	C	.	.	S	Bend	trans	-130.2	170.2	174.7	0	0	0	0	0	113.3	S159	G141-S159 WeakPolarHBondContact CA-OG 3.25Å; G141-S159 PolarHBondContact O-OG 2.87Å
142	D	95.6	Very high	93.2	Very high	46 Å²	46	33.5 Å²	33.5	25%	0.246	19%	0.192	C	C	.	.			trans	-45.4	130.8	175.7	-55.8	29.9	0	0	0	112.8	M98 S159 V160	M98-D142 HydrophobicContact CB-CB 4.44Å; M98-D142 WeakPolarHBondContact CB-OD2 3.49Å; M98-D142 HydrophobicContact CG-CB 4.32Å; M98-D142 VanDerWaalsContact CG-OD2 3.28Å; M98-D142 WeakPolarHBondContact CG-OD2 3.3Å; D142-S159 VanDerWaalsContact O-CA 3.25Å; D142-S159 WeakPolarHBondContact O-CA 3.33Å; D142-S159 WeakPolarHBondContact O-CB 3.35Å; D142-S159 PolarHBondContact O-OG 2.7Å; D142-S159 VanDerWaalsContact O-OG 3.05Å; D142-V160 HydrophobicContact CB-CG1 4.39Å; D142-V160 HydrophobicContact CB-CG2 3.94Å; D142-V160 PolarHBondContact O-N 3.37Å; D142-V160 VanDerWaalsContact O-N 3.12Å
143	I	97.7	Very high	92.8	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.7	-177.7	-54.8	177.4	0	0	0	109	N82 A96 G97 I102 H139 L146 T158	N82-I143 WeakPolarHBondContact CB-O 3.47Å; N82-I143 PolarHBondContact ND2-O 2.8Å; A96-I143 HydrophobicContact CB-CB 3.88Å; A96-I143 HydrophobicContact CB-CD1 4.32Å; A96-I143 HydrophobicContact CB-CG2 3.57Å; G97-I143 PolarHBondContact O-N 3.34Å; G97-I143 VanDerWaalsContact O-N 3.13Å; I102-I143 HydrophobicContact CD1-CD1 4.29Å; I102-I143 HydrophobicContact CG1-CD1 3.56Å; H139-I143 HydrophobicContact CB-CD1 4.21Å; H139-I143 HydrophobicContact CB-CG1 4.04Å; I143-L146 HydrophobicContact CG2-CD2 4.36Å; I143-T158 CarbonylContact C-O 3.55Å; I143-T158 WeakPolarHBondContact CA-O 3.18Å; I143-T158 WeakPolarHBondContact CG2-O 3.46Å
144	I	96.6	Very high	92.7	Very high	18 Å²	18	32.4 Å²	32.4	9%	0.092	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-47.3	-167.7	-55.7	-58.7	0	0	0	113.3	T158 V160 K197 V244	I144-T158 PolarHBondContact N-O 2.69Å; I144-V160 HydrophobicContact CD1-CG1 4.02Å; I144-V160 HydrophobicContact CG1-CG1 4.14Å; I144-K197 HydrophobicContact CG2-CB 4.3Å; I144-K197 HydrophobicContact CG2-CG 4.26Å; I144-V244 HydrophobicContact CG2-CG1 4.11Å
145	D	97.4	Very high	92.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	154.8	-178.9	-157.8	29.9	0	0	0	111.1	C83 R85 T158 G198 V199 R246	C83-D145 PolarHBondContact SG-OD1 2.88Å; R85-D145 IonicContact NH2-OD1 2.74Å; D145-T158 PolarHBondContact N-OG1 3Å; D145-T158 PolarHBondContact O-N 3.24Å; D145-T158 VanDerWaalsContact O-N 3.14Å; D145-G198 WeakPolarHBondContact OD2-CA 3.45Å; D145-V199 PolarHBondContact OD2-N 2.8Å; D145-R246 IonicContact OD1-CZ 3.81Å; D145-R246 IonicContact OD1-NH1 2.72Å; D145-R246 PolarHBondContact OD1-NH1 2.89Å
146	L	97.7	Very high	93	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.4	177.9	-65.8	175.9	0	0	0	109.4	C83 R85 A94 A96 I102 I143 A156	C83-L146 HydrophobicContact CB-CB 4.49Å; C83-L146 HydrophobicContact CB-CD1 4.43Å; C83-L146 HydrophobicContact CB-CG 4.19Å; C83-L146 PolarHBondContact SG-N 2.89Å; C83-L146 VanDerWaalsContact SG-N 3.44Å; R85-L146 HydrophobicContact CB-CB 4.44Å; R85-L146 HydrophobicContact CG-CB 3.87Å; R85-L146 WeakPolarHBondContact CG-O 3.46Å; A94-L146 HydrophobicContact CB-CD1 3.86Å; A96-L146 HydrophobicContact CB-CD1 3.82Å; A96-L146 HydrophobicContact CB-CD2 4.02Å; A96-L146 HydrophobicContact CB-CG 4.02Å; I102-L146 HydrophobicContact CD1-CD2 4.07Å; I102-L146 HydrophobicContact CG1-CD2 4.34Å; I102-L146 HydrophobicContact CG2-CD1 4.3Å; I102-L146 HydrophobicContact CG2-CD2 4.26Å; I143-L146 HydrophobicContact CG2-CD2 4.36Å; L146-A156 WeakPolarHBondContact CA-O 3.37Å
147	S	97	Very high	93.2	Very high	21 Å²	21	28 Å²	28	15%	0.147	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	133.4	169.4	-164.3	0	0	0	0	111.5	A156 V199 W201	S147-A156 PolarHBondContact N-O 2.69Å; S147-A156 PolarHBondContact O-N 2.8Å; S147-V199 WeakPolarHBondContact CB-O 3.4Å; S147-W201 PolarHBondContact O-NE1 3.44Å
148	W	93.8	Very high	93.3	Very high	18 Å²	18	18.7 Å²	18.7	7%	0.068	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	145	173.3	-71.9	98.9	0	0	0	111	R85 P88 W92 A94 L104 L155 F183	R85-W148 PolarHBondContact O-NE1 3.02Å; R85-W148 VanDerWaalsContact O-NE1 3.16Å; P88-W148 HydrophobicContact CG-CB 4.4Å; W92-W148 HydrophobicContact CB-CH2 4.5Å; W92-W148 HydrophobicContact CB-CZ2 4.34Å; W92-W148 AromaticContact CE3-CH2 3.89Å; W92-W148 HydrophobicContact CE3-CH2 3.89Å; W92-W148 HydrophobicContact CE3-CZ3 4.27Å; A94-W148 HydrophobicContact CB-CZ2 3.96Å; L104-W148 HydrophobicContact CD2-CH2 4.34Å; L104-W148 HydrophobicContact CD2-CZ2 4.15Å; W148-L155 HydrophobicContact CD2-CB 4.38Å; W148-L155 HydrophobicContact CD2-CD1 3.86Å; W148-L155 HydrophobicContact CE3-CB 3.98Å; W148-L155 HydrophobicContact CE3-CD1 4.33Å; W148-L155 HydrophobicContact CG-CD1 4.09Å; W148-L155 HydrophobicContact CH2-CD2 4.47Å; W148-L155 HydrophobicContact CZ2-CD1 4.43Å; W148-L155 HydrophobicContact CZ2-CD2 4.41Å; W148-L155 HydrophobicContact CZ3-CB 4.05Å; W148-F183 HydrophobicContact CH2-CE1 4.15Å; W148-F183 AromaticContact CH2-CZ 3.93Å; W148-F183 HydrophobicContact CH2-CZ 3.93Å; W148-F183 AromaticContact CZ3-CE1 3.94Å; W148-F183 HydrophobicContact CZ3-CE1 3.94Å; W148-F183 HydrophobicContact CZ3-CZ 4.04Å
149	S	92.4	Very high	93.6	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.007	10%	0.096	C	C	.	.			trans	-65.1	148.4	164.8	68.6	0	0	0	0	109.7	D151 G152 S153 R154	S149-D151 VanDerWaalsContact CB-OD1 3.29Å; S149-D151 WeakPolarHBondContact CB-OD1 3.18Å; S149-D151 PolarHBondContact O-N 3.39Å; S149-D151 VanDerWaalsContact O-N 3.13Å; S149-D151 PolarHBondContact OG-OD1 3.13Å; S149-G152 WeakPolarHBondContact O-CA 3.11Å; S149-G152 PolarHBondContact O-N 3.13Å; S149-S153 PolarHBondContact OG-N 3.39Å; S149-R154 PolarHBondContact N-O 2.91Å; S149-R154 PolarHBondContact OG-N 2.93Å; S149-R154 PolarHBondContact OG-O 3.49Å; S149-R154 VanDerWaalsContact OG-O 3.12Å
150	H	88.5	Confident	93.6	Very high	50 Å²	50	17.5 Å²	17.5	23%	0.231	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.9	-170.6	-70.3	89.3	0	0	0	114.4	W201 P203 L397 L398	H150-W201 PolarHBondContact CE1-O 3.17Å; H150-W201 VanDerWaalsContact CE1-O 3.24Å; H150-P203 WeakPolarHBondContact ND1-CA 3.38Å; H150-L397 HydrophobicContact CB-CD2 4.17Å; H150-L398 HydrophobicContact CB-CD2 3.74Å
151	D	81	Confident	93.6	Very high	31 Å²	31	15 Å²	15	17%	0.166	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-8.8	170.6	66.4	-25.5	0	0	0	113.7	S149 S153 L397 K400	S149-D151 VanDerWaalsContact CB-OD1 3.29Å; S149-D151 WeakPolarHBondContact CB-OD1 3.18Å; S149-D151 PolarHBondContact O-N 3.39Å; S149-D151 VanDerWaalsContact O-N 3.13Å; S149-D151 PolarHBondContact OG-OD1 3.13Å; D151-S153 VanDerWaalsContact C-N 3.34Å; D151-S153 VanDerWaalsContact CG-OG 3.22Å; D151-S153 PolarHBondContact O-N 2.88Å; D151-S153 PolarHBondContact OD1-N 3.06Å; D151-S153 PolarHBondContact OD1-OG 2.81Å; D151-S153 WeakPolarHBondContact OD2-CB 3.47Å; D151-S153 PolarHBondContact OD2-OG 3.37Å; D151-L397 HydrophobicContact CB-CD1 4.12Å; D151-L397 HydrophobicContact CB-CG 4.07Å; D151-K400 HydrophobicContact CB-CB 3.98Å
152	G	84.5	Confident	93.8	Very high	7 Å²	7	17.3 Å²	17.3	7%	0.072	9%	0.094	C	C	.	.	S	Bend	trans	73.9	14.2	-177.5	0	0	0	0	0	115.5	S149	S149-G152 WeakPolarHBondContact O-CA 3.11Å; S149-G152 PolarHBondContact O-N 3.13Å
153	S	82.9	Confident	93.8	Very high	21 Å²	21	15.6 Å²	15.6	15%	0.147	9%	0.086	C	C	.	.	S	Bend	trans	-88.6	-24.9	-178.4	71.8	0	0	0	0	114.6	S149 D151 C168	S149-S153 PolarHBondContact OG-N 3.39Å; D151-S153 VanDerWaalsContact C-N 3.34Å; D151-S153 VanDerWaalsContact CG-OG 3.22Å; D151-S153 PolarHBondContact O-N 2.88Å; D151-S153 PolarHBondContact OD1-N 3.06Å; D151-S153 PolarHBondContact OD1-OG 2.81Å; D151-S153 WeakPolarHBondContact OD2-CB 3.47Å; D151-S153 PolarHBondContact OD2-OG 3.37Å; S153-C168 PolarHBondContact O-SG 3.14Å
154	R	89.2	Confident	93.9	Very high	22 Å²	22	15.5 Å²	15.5	8%	0.083	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.5	179	-53.2	-179.8	-173.8	-161.4	-7.6	110.5	S149 V166 W167 W201 T222 W225 E434	S149-R154 PolarHBondContact N-O 2.91Å; S149-R154 PolarHBondContact OG-N 2.93Å; S149-R154 PolarHBondContact OG-O 3.49Å; S149-R154 VanDerWaalsContact OG-O 3.12Å; R154-V166 HydrophobicContact CB-CG1 4.44Å; R154-W167 CarbonylContact C-O 3.55Å; R154-W167 VanDerWaalsContact CA-O 3.31Å; R154-W167 WeakPolarHBondContact CA-O 3.36Å; R154-W201 HydrophobicContact CB-CH2 3.34Å; R154-W201 HydrophobicContact CB-CZ2 3.53Å; R154-W201 HydrophobicContact CB-CZ3 4.13Å; R154-W201 HydrophobicContact CG-CH2 4.04Å; R154-T222 PolarHBondContact NH1-O 2.95Å; R154-T222 VanDerWaalsContact NH1-O 3.13Å; R154-W225 VanDerWaalsContact NH1-CZ2 3.26Å; R154-E434 IonicContact CZ-OE1 2.65Å; R154-E434 IonicContact NH1-OE1 3.81Å; R154-E434 IonicContact NH2-OE1 3.4Å; R154-E434 PolarHBondContact NH2-OE1 2.97Å
155	L	95.3	Very high	93.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	138.7	172.5	172	67.5	0	0	0	108	A94 I102 L104 L136 W148 V166 W167	A94-L155 HydrophobicContact CB-CD2 4.28Å; I102-L155 HydrophobicContact CG2-CD2 4.27Å; L104-L155 HydrophobicContact CD2-CD2 4.01Å; L136-L155 HydrophobicContact CD1-CD2 4.04Å; W148-L155 HydrophobicContact CD2-CB 4.38Å; W148-L155 HydrophobicContact CD2-CD1 3.86Å; W148-L155 HydrophobicContact CE3-CB 3.98Å; W148-L155 HydrophobicContact CE3-CD1 4.33Å; W148-L155 HydrophobicContact CG-CD1 4.09Å; W148-L155 HydrophobicContact CH2-CD2 4.47Å; W148-L155 HydrophobicContact CZ2-CD1 4.43Å; W148-L155 HydrophobicContact CZ2-CD2 4.41Å; W148-L155 HydrophobicContact CZ3-CB 4.05Å; L155-V166 CarbonylContact O-C 3.6Å; L155-V166 WeakPolarHBondContact O-CA 3.49Å; L155-W167 HydrophobicContact CB-CB 4.34Å; L155-W167 PolarHBondContact N-O 2.88Å; L155-W167 PolarHBondContact O-N 3.29Å
156	A	97.6	Very high	93.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	142.3	174.1	0	0	0	0	0	110.7	L146 S147 V164 I165 V199 W201 L208	L146-A156 WeakPolarHBondContact CA-O 3.37Å; S147-A156 PolarHBondContact N-O 2.69Å; S147-A156 PolarHBondContact O-N 2.8Å; A156-V164 HydrophobicContact CB-CG1 4.49Å; A156-I165 WeakPolarHBondContact CA-O 3.44Å; A156-V199 HydrophobicContact CB-CG1 4.45Å; A156-V199 HydrophobicContact CB-CG2 3.79Å; A156-W201 HydrophobicContact CB-CZ2 3.84Å; A156-L208 HydrophobicContact CB-CD1 3.9Å; A156-L208 HydrophobicContact CB-CD2 4Å
157	S	98	Very high	93.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	147.8	178.8	56.6	0	0	0	0	111.6	H139 V164 I165 W167	H139-S157 PolarHBondContact CD2-OG 3.32Å; H139-S157 PolarHBondContact NE2-O 2.95Å; H139-S157 PolarHBondContact NE2-OG 2.99Å; S157-V164 CarbonylContact O-C 3.46Å; S157-V164 VanDerWaalsContact O-CA 3.28Å; S157-V164 WeakPolarHBondContact O-CA 3.31Å; S157-V164 WeakPolarHBondContact O-CG1 3.06Å; S157-I165 PolarHBondContact N-O 3.32Å; S157-I165 PolarHBondContact O-N 3.32Å; S157-I165 PolarHBondContact OG-O 2.66Å; S157-W167 PolarHBondContact OG-NE1 2.83Å
158	T	97.7	Very high	93.4	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	148.2	178	74	0	0	0	0	111.8	I143 I144 D145 V164 V196 V199	I143-T158 CarbonylContact C-O 3.55Å; I143-T158 WeakPolarHBondContact CA-O 3.18Å; I143-T158 WeakPolarHBondContact CG2-O 3.46Å; I144-T158 PolarHBondContact N-O 2.69Å; D145-T158 PolarHBondContact N-OG1 3Å; D145-T158 PolarHBondContact O-N 3.24Å; D145-T158 VanDerWaalsContact O-N 3.14Å; T158-V164 HydrophobicContact CG2-CG1 4.35Å; T158-V164 HydrophobicContact CG2-CG2 4.17Å; T158-V196 WeakPolarHBondContact CB-O 3.22Å; T158-V196 HydrophobicContact CG2-CB 4.39Å; T158-V196 HydrophobicContact CG2-CG1 3.75Å; T158-V196 PolarHBondContact OG1-O 3.13Å; T158-V199 HydrophobicContact CG2-CB 3.47Å; T158-V199 VanDerWaalsContact CG2-CB 3.47Å; T158-V199 HydrophobicContact CG2-CG1 3.58Å; T158-V199 HydrophobicContact CG2-CG2 4.42Å
159	S	97.4	Very high	92.9	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	164.7	-176.6	172.6	0	0	0	0	113.5	H139 G141 D142 D161 N162 S163 V196	H139-S159 WeakPolarHBondContact ND1-CB 3.47Å; G141-S159 WeakPolarHBondContact CA-OG 3.25Å; G141-S159 PolarHBondContact O-OG 2.87Å; D142-S159 VanDerWaalsContact O-CA 3.25Å; D142-S159 WeakPolarHBondContact O-CA 3.33Å; D142-S159 WeakPolarHBondContact O-CB 3.35Å; D142-S159 PolarHBondContact O-OG 2.7Å; D142-S159 VanDerWaalsContact O-OG 3.05Å; S159-D161 WeakPolarHBondContact CB-OD1 3.47Å; S159-D161 PolarHBondContact O-N 2.82Å; S159-D161 VanDerWaalsContact OG-CG 3.28Å; S159-D161 PolarHBondContact OG-N 3.36Å; S159-D161 PolarHBondContact OG-OD2 2.81Å; S159-N162 PolarHBondContact O-N 2.78Å; S159-S163 PolarHBondContact N-O 2.93Å; S159-V196 PolarHBondContact O-N 3.12Å
160	V	95.9	Very high	92	Very high	36 Å²	36	20.6 Å²	20.6	22%	0.218	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-4.3	164.6	-54.6	0	0	0	0	113.3	D142 I144 N162 F195	D142-V160 HydrophobicContact CB-CG1 4.39Å; D142-V160 HydrophobicContact CB-CG2 3.94Å; D142-V160 PolarHBondContact O-N 3.37Å; D142-V160 VanDerWaalsContact O-N 3.12Å; I144-V160 HydrophobicContact CD1-CG1 4.02Å; I144-V160 HydrophobicContact CG1-CG1 4.14Å; V160-N162 PolarHBondContact O-N 2.72Å; V160-F195 HydrophobicContact CB-CB 4.25Å; V160-F195 HydrophobicContact CB-CD1 3.63Å; V160-F195 HydrophobicContact CB-CD2 4.26Å; V160-F195 HydrophobicContact CB-CE1 3.94Å; V160-F195 HydrophobicContact CB-CG 3.8Å; V160-F195 HydrophobicContact CB-CZ 4.38Å; V160-F195 HydrophobicContact CG1-CB 4.12Å; V160-F195 HydrophobicContact CG1-CD1 4.26Å; V160-F195 HydrophobicContact CG1-CD2 4.05Å; V160-F195 HydrophobicContact CG1-CG 3.9Å; V160-F195 WeakPolarHBondContact O-CD1 3.28Å; V160-F195 VanDerWaalsContact O-CE1 3.31Å; V160-F195 WeakPolarHBondContact O-CE1 3.39Å
161	D	95.9	Very high	90.9	Very high	35 Å²	35	23 Å²	23	19%	0.187	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	7.9	167.6	68	24.5	0	0	0	114.6	H139 S140 S159 S163	H139-D161 WeakPolarHBondContact CA-OD2 3.44Å; H139-D161 VanDerWaalsContact CB-OD2 3.31Å; H139-D161 WeakPolarHBondContact CB-OD2 3.15Å; H139-D161 IonicContact CE1-OD1 2.75Å; H139-D161 IonicContact CG-OD2 3.72Å; H139-D161 IonicContact ND1-OD1 2.75Å; H139-D161 PolarHBondContact ND1-OD1 2.97Å; H139-D161 IonicContact ND1-OD2 3.16Å; H139-D161 PolarHBondContact ND1-OD2 3.37Å; S140-D161 PolarHBondContact N-OD2 3.43Å; S140-D161 WeakPolarHBondContact OG-CB 3.35Å; S159-D161 WeakPolarHBondContact CB-OD1 3.47Å; S159-D161 PolarHBondContact O-N 2.82Å; S159-D161 VanDerWaalsContact OG-CG 3.28Å; S159-D161 PolarHBondContact OG-N 3.36Å; S159-D161 PolarHBondContact OG-OD2 2.81Å; D161-S163 PolarHBondContact O-N 3.05Å; D161-S163 VanDerWaalsContact OD1-CB 3.26Å; D161-S163 WeakPolarHBondContact OD1-CB 3.17Å; D161-S163 PolarHBondContact OD1-N 3.27Å; D161-S163 PolarHBondContact OD1-OG 3.35Å
162	N	96.9	Very high	90.1	Very high	56 Å²	56	24.3 Å²	24.3	30%	0.299	12%	0.122	S	C	.	.	S	Bend	trans	66.8	8.7	-178.7	-48.7	-38.5	0	0	0	115	S159 V160 G194 F195	S159-N162 PolarHBondContact O-N 2.78Å; V160-N162 PolarHBondContact O-N 2.72Å; N162-G194 WeakPolarHBondContact OD1-CA 3.15Å; N162-G194 PolarHBondContact OD1-O 3.12Å; N162-F195 PolarHBondContact OD1-N 3.48Å; N162-F195 VanDerWaalsContact OD1-N 3.1Å
163	S	97.3	Very high	88.8	Confident	10 Å²	10	30.6 Å²	30.6	7%	0.07	16%	0.162	C	C	.	.			trans	-106	163.1	179.2	79.8	0	0	0	0	113.8	H139 S159 D161 L189	H139-S163 PolarHBondContact CE1-OG 3.29Å; H139-S163 VanDerWaalsContact CE1-OG 3.32Å; H139-S163 PolarHBondContact ND1-OG 3.38Å; S159-S163 PolarHBondContact N-O 2.93Å; D161-S163 PolarHBondContact O-N 3.05Å; D161-S163 VanDerWaalsContact OD1-CB 3.26Å; D161-S163 WeakPolarHBondContact OD1-CB 3.17Å; D161-S163 PolarHBondContact OD1-N 3.27Å; D161-S163 PolarHBondContact OD1-OG 3.35Å; S163-L189 WeakPolarHBondContact CA-O 3.28Å
164	V	98	Very high	87.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.6	162.3	-174.7	0	0	0	0	107.5	A156 S157 T158 L189 V196 V199 L208	A156-V164 HydrophobicContact CB-CG1 4.49Å; S157-V164 CarbonylContact O-C 3.46Å; S157-V164 VanDerWaalsContact O-CA 3.28Å; S157-V164 WeakPolarHBondContact O-CA 3.31Å; S157-V164 WeakPolarHBondContact O-CG1 3.06Å; T158-V164 HydrophobicContact CG2-CG1 4.35Å; T158-V164 HydrophobicContact CG2-CG2 4.17Å; V164-L189 HydrophobicContact CB-CB 4.13Å; V164-L189 HydrophobicContact CB-CD1 4.16Å; V164-L189 HydrophobicContact CB-CG 4.3Å; V164-L189 HydrophobicContact CG1-CD1 4.27Å; V164-L189 PolarHBondContact N-O 3Å; V164-L189 VanDerWaalsContact N-O 3.12Å; V164-L189 PolarHBondContact O-N 2.89Å; V164-V196 HydrophobicContact CG2-CG1 3.87Å; V164-V199 HydrophobicContact CG1-CG2 4.29Å; V164-L208 HydrophobicContact CG1-CD2 3.92Å
165	I	97.9	Very high	86.4	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.015	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	136.1	175.8	-61.3	176.9	0	0	0	109.6	G138 H139 A156 S157 W167 L185 T188	G138-I165 VanDerWaalsContact C-CD1 3.49Å; H139-I165 HydrophobicContact CB-CD1 4.44Å; H139-I165 VanDerWaalsContact CE1-CG1 3.5Å; H139-I165 WeakPolarHBondContact CE1-CG1 3.46Å; A156-I165 WeakPolarHBondContact CA-O 3.44Å; S157-I165 PolarHBondContact N-O 3.32Å; S157-I165 PolarHBondContact O-N 3.32Å; S157-I165 PolarHBondContact OG-O 2.66Å; I165-W167 HydrophobicContact CB-CZ2 4.07Å; I165-W167 HydrophobicContact CD1-CZ2 4.29Å; I165-W167 HydrophobicContact CG2-CD2 4.01Å; I165-W167 VanDerWaalsContact CG2-CE2 3.43Å; I165-W167 HydrophobicContact CG2-CH2 4.02Å; I165-W167 HydrophobicContact CG2-CZ2 3.46Å; I165-W167 VanDerWaalsContact CG2-CZ2 3.46Å; I165-L185 HydrophobicContact CD1-CD1 4.25Å; I165-L185 HydrophobicContact CG2-CD1 3.61Å; I165-L185 HydrophobicContact CG2-CG 3.66Å; I165-T188 HydrophobicContact CG1-CG2 4.04Å
166	V	97.2	Very high	84.4	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127	174.6	-178.2	0	0	0	0	109.4	R154 L155 Q186 A187 L189 W201 L208 W225	R154-V166 HydrophobicContact CB-CG1 4.44Å; L155-V166 CarbonylContact O-C 3.6Å; L155-V166 WeakPolarHBondContact O-CA 3.49Å; V166-Q186 HydrophobicContact CG1-CB 4.43Å; V166-Q186 PolarHBondContact O-N 2.91Å; V166-A187 HydrophobicContact CB-CB 4.42Å; V166-A187 PolarHBondContact N-O 2.88Å; V166-A187 PolarHBondContact O-N 3.36Å; V166-L189 HydrophobicContact CG2-CD1 4.32Å; V166-W201 HydrophobicContact CG1-CH2 3.84Å; V166-W201 HydrophobicContact CG1-CZ2 4.14Å; V166-L208 HydrophobicContact CG2-CD2 4.07Å; V166-W225 HydrophobicContact CB-CH2 4.29Å; V166-W225 HydrophobicContact CB-CZ2 4.38Å; V166-W225 HydrophobicContact CG1-CH2 3.79Å; V166-W225 HydrophobicContact CG1-CZ2 3.85Å; V166-W225 HydrophobicContact CG2-CE3 4.33Å; V166-W225 HydrophobicContact CG2-CH2 3.85Å; V166-W225 HydrophobicContact CG2-CZ2 4.36Å; V166-W225 HydrophobicContact CG2-CZ3 3.83Å
167	W	95.1	Very high	82.6	Confident	9 Å²	9	40.7 Å²	40.7	3%	0.034	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.2	-179.7	-47.9	88.4	0	0	0	109.5	I102 L136 R137 R154 L155 S157 I165 Y184 L185	I102-W167 HydrophobicContact CD1-CZ2 4.14Å; I102-W167 VanDerWaalsContact CD1-NE1 3.34Å; L136-W167 HydrophobicContact CB-CD2 4.11Å; L136-W167 HydrophobicContact CB-CE3 3.94Å; L136-W167 HydrophobicContact CB-CH2 4.01Å; L136-W167 HydrophobicContact CB-CZ2 4.14Å; L136-W167 HydrophobicContact CB-CZ3 3.89Å; L136-W167 HydrophobicContact CD1-CB 4.1Å; L136-W167 HydrophobicContact CD1-CD2 3.76Å; L136-W167 HydrophobicContact CD1-CE3 4.12Å; L136-W167 HydrophobicContact CD1-CG 3.74Å; L136-W167 HydrophobicContact CG-CD2 4.49Å; L136-W167 HydrophobicContact CG-CE3 4.45Å; R137-W167 WeakPolarHBondContact O-CH2 3.34Å; R154-W167 CarbonylContact C-O 3.55Å; R154-W167 VanDerWaalsContact CA-O 3.31Å; R154-W167 WeakPolarHBondContact CA-O 3.36Å; L155-W167 HydrophobicContact CB-CB 4.34Å; L155-W167 PolarHBondContact N-O 2.88Å; L155-W167 PolarHBondContact O-N 3.29Å; S157-W167 PolarHBondContact OG-NE1 2.83Å; I165-W167 HydrophobicContact CB-CZ2 4.07Å; I165-W167 HydrophobicContact CD1-CZ2 4.29Å; I165-W167 HydrophobicContact CG2-CD2 4.01Å; I165-W167 VanDerWaalsContact CG2-CE2 3.43Å; I165-W167 HydrophobicContact CG2-CH2 4.02Å; I165-W167 HydrophobicContact CG2-CZ2 3.46Å; I165-W167 VanDerWaalsContact CG2-CZ2 3.46Å; W167-Y184 CarbonylContact C-O 3.56Å; W167-Y184 VanDerWaalsContact CA-O 3.3Å; W167-Y184 WeakPolarHBondContact CA-O 3.4Å; W167-L185 HydrophobicContact CE3-CB 4.12Å; W167-L185 HydrophobicContact CH2-CD1 4.21Å; W167-L185 HydrophobicContact CZ3-CB 3.89Å; W167-L185 HydrophobicContact CZ3-CD1 4.31Å; W167-L185 HydrophobicContact CZ3-CG 4.42Å
168	C	89.9	Confident	80.9	Confident	14 Å²	14	44.8 Å²	44.8	10%	0.095	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	154.1	177.8	-169.7	0	0	0	0	110.9	S153 F183 Y184 Q186	S153-C168 PolarHBondContact O-SG 3.14Å; C168-F183 CarbonylContact O-C 3.55Å; C168-F183 VanDerWaalsContact O-CA 3.26Å; C168-F183 WeakPolarHBondContact O-CA 3.22Å; C168-Y184 HydrophobicContact CB-CD1 4.48Å; C168-Y184 HydrophobicContact CB-CE1 3.78Å; C168-Y184 PolarHBondContact N-O 2.93Å; C168-Y184 WeakPolarHBondContact O-CD1 3.42Å; C168-Y184 WeakPolarHBondContact O-CE1 3.44Å; C168-Y184 PolarHBondContact O-N 3.21Å; C168-Q186 HydrophobicContact CB-CB 4.07Å
169	R	82.3	Confident	79.1	Confident	49 Å²	49	46.2 Å²	46.2	19%	0.185	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	131.9	174.7	-66.6	-175.1	66.4	-157	-0.7	110.7	K171 Y178 F183	R169-K171 PolarHBondContact O-N 2.99Å; R169-K171 VanDerWaalsContact O-N 3.13Å; R169-Y178 HydrophobicContact CB-CD1 3.51Å; R169-Y178 HydrophobicContact CB-CE1 3.96Å; R169-Y178 HydrophobicContact CB-CG 4.22Å; R169-F183 HydrophobicContact CG-CD1 3.93Å; R169-F183 HydrophobicContact CG-CD2 4.45Å; R169-F183 HydrophobicContact CG-CE1 3.43Å; R169-F183 VanDerWaalsContact CG-CE1 3.43Å; R169-F183 HydrophobicContact CG-CE2 4.01Å; R169-F183 HydrophobicContact CG-CG 4.42Å; R169-F183 HydrophobicContact CG-CZ 3.49Å; R169-F183 VanDerWaalsContact CG-CZ 3.49Å
170	Q	73.1	Confident	77.3	Confident	89 Å²	89	52.9 Å²	52.9	42%	0.416	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	108	179.3	177.8	-179.9	13.7	0	0	110.5	T179 S182 Y184	Q170-T179 HydrophobicContact CB-CG2 4.48Å; Q170-T179 WeakPolarHBondContact CB-OG1 3.5Å; Q170-T179 HydrophobicContact CG-CG2 4.09Å; Q170-T179 PolarHBondContact O-N 3.1Å; Q170-T179 PolarHBondContact O-OG1 3.4Å; Q170-S182 PolarHBondContact N-O 3.48Å; Q170-S182 PolarHBondContact OE1-OG 3.02Å; Q170-Y184 HydrophobicContact CB-CD1 3.94Å
171	K	67	Low	75.8	Confident	101 Å²	101	52.7 Å²	52.7	44%	0.439	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	147.8	169.6	-78.6	-169.9	177.3	-176	0	109.5	R169 G177 Y178 D430	R169-K171 PolarHBondContact O-N 2.99Å; R169-K171 VanDerWaalsContact O-N 3.13Å; K171-G177 WeakPolarHBondContact CA-O 3.42Å; K171-Y178 HydrophobicContact CG-CD1 4.09Å; K171-Y178 HydrophobicContact CG-CE1 3.73Å; K171-D430 VanDerWaalsContact NZ-CG 3.34Å; K171-D430 IonicContact NZ-OD1 3.75Å; K171-D430 PolarHBondContact NZ-OD1 2.83Å; K171-D430 IonicContact NZ-OD2 2.88Å; K171-D430 PolarHBondContact NZ-OD2 2.84Å
172	L	62.6	Low	74.6	Confident	59 Å²	59	52.9 Å²	52.9	31%	0.309	30%	0.301	S	S	.	.			trans	-71.9	151.5	172.2	-73.1	164.7	0	0	0	110.8	N174 G175 G177 T179	L172-N174 WeakPolarHBondContact CB-OD1 3.47Å; L172-N174 PolarHBondContact O-N 3.2Å; L172-N174 VanDerWaalsContact O-N 3.12Å; L172-G175 PolarHBondContact O-N 2.77Å; L172-G177 PolarHBondContact N-O 3.2Å; L172-T179 HydrophobicContact CD2-CG2 3.71Å; L172-T179 HydrophobicContact CG-CG2 4.41Å
173	P	58.6	Low	74.1	Confident	139 Å²	139	51 Å²	51	90%	0.903	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.5	-177.8	-24.7	34.8	0	0	0	115.1
174	N	61.5	Low	73.7	Confident	115 Å²	115	55.4 Å²	55.4	62%	0.615	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	2	176.4	68.8	-17.9	0	0	0	113.4	L172 S176	L172-N174 WeakPolarHBondContact CB-OD1 3.47Å; L172-N174 PolarHBondContact O-N 3.2Å; L172-N174 VanDerWaalsContact O-N 3.12Å; N174-S176 PolarHBondContact ND2-OG 2.89Å; N174-S176 PolarHBondContact O-N 3.27Å; N174-S176 VanDerWaalsContact O-N 3.16Å; N174-S176 PolarHBondContact OD1-N 3.3Å; N174-S176 PolarHBondContact OD1-OG 2.79Å
175	G	58.7	Low	73.4	Confident	53 Å²	53	58.9 Å²	58.9	55%	0.546	32%	0.324	S	S	.	.	S	Bend	trans	73.9	-9.3	-178.8	0	0	0	0	0	116.4	L172 G177	L172-G175 PolarHBondContact O-N 2.77Å; G175-G177 PolarHBondContact O-N 2.96Å
176	S	53.1	Low	73.2	Confident	63 Å²	63	60.9 Å²	60.9	44%	0.441	33%	0.333	S	S	.	.	S	Bend	trans	-78.6	51.3	-173.1	78.7	0	0	0	0	113.3	N174	N174-S176 PolarHBondContact ND2-OG 2.89Å; N174-S176 PolarHBondContact O-N 3.27Å; N174-S176 VanDerWaalsContact O-N 3.16Å; N174-S176 PolarHBondContact OD1-N 3.3Å; N174-S176 PolarHBondContact OD1-OG 2.79Å
177	G	59.6	Low	73	Confident	23 Å²	23	61.5 Å²	61.5	24%	0.237	34%	0.338	C	S	.	.	S	Bend	trans	103.6	-146.4	-178.3	0	0	0	0	0	113.8	K171 L172 G175	K171-G177 WeakPolarHBondContact CA-O 3.42Å; L172-G177 PolarHBondContact N-O 3.2Å; G175-G177 PolarHBondContact O-N 2.96Å
178	Y	63.6	Low	73.1	Confident	87 Å²	87	64.2 Å²	64.2	34%	0.341	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	147.4	-166.2	-60.7	-91.1	0	0	0	111.2	R169 K171	R169-Y178 HydrophobicContact CB-CD1 3.51Å; R169-Y178 HydrophobicContact CB-CE1 3.96Å; R169-Y178 HydrophobicContact CB-CG 4.22Å; K171-Y178 HydrophobicContact CG-CD1 4.09Å; K171-Y178 HydrophobicContact CG-CE1 3.73Å
179	T	59.7	Low	73.4	Confident	29 Å²	29	63.9 Å²	63.9	18%	0.178	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	150.7	169.5	53.9	0	0	0	0	111.8	Q170 L172 N181 S182	Q170-T179 HydrophobicContact CB-CG2 4.48Å; Q170-T179 WeakPolarHBondContact CB-OG1 3.5Å; Q170-T179 HydrophobicContact CG-CG2 4.09Å; Q170-T179 PolarHBondContact O-N 3.1Å; Q170-T179 PolarHBondContact O-OG1 3.4Å; L172-T179 HydrophobicContact CD2-CG2 3.71Å; L172-T179 HydrophobicContact CG-CG2 4.41Å; T179-N181 PolarHBondContact O-N 3.27Å; T179-N181 VanDerWaalsContact O-N 3.08Å; T179-S182 WeakPolarHBondContact OG1-CB 3.48Å
180	N	59.6	Low	74	Confident	141 Å²	141	66.6 Å²	66.6	75%	0.754	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	103.1	-177.6	-85.4	-34.9	0	0	0	111.3	S182	N180-S182 VanDerWaalsContact C-N 3.27Å; N180-S182 PolarHBondContact O-N 3.06Å
181	N	64.5	Low	74.8	Confident	31 Å²	31	64 Å²	64	17%	0.166	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	65.6	6.4	176.6	-47.7	-67.5	0	0	0	117.2	W92 V133 S134 T179	W92-N181 PolarHBondContact NE1-OD1 3.2Å; W92-N181 VanDerWaalsContact NE1-OD1 3.1Å; V133-N181 HydrophobicContact CB-CB 3.95Å; V133-N181 HydrophobicContact CG2-CB 4.02Å; S134-N181 WeakPolarHBondContact CB-O 3.49Å; T179-N181 PolarHBondContact O-N 3.27Å; T179-N181 VanDerWaalsContact O-N 3.08Å
182	S	70.8	Confident	76.2	Confident	40 Å²	40	59.9 Å²	59.9	28%	0.28	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131.7	171.6	-171.6	0	0	0	0	111.6	Q170 T179 N180	Q170-S182 PolarHBondContact N-O 3.48Å; Q170-S182 PolarHBondContact OE1-OG 3.02Å; T179-S182 WeakPolarHBondContact OG1-CB 3.48Å; N180-S182 VanDerWaalsContact C-N 3.27Å; N180-S182 PolarHBondContact O-N 3.06Å
183	F	86.3	Confident	77.7	Confident	17 Å²	17	66.1 Å²	66.1	8%	0.075	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.8	172	-76.5	-107.5	0	0	0	108.1	W92 L104 L136 W148 C168 R169	W92-F183 HydrophobicContact CE3-CZ 4.12Å; W92-F183 HydrophobicContact CH2-CZ 4.32Å; W92-F183 HydrophobicContact CZ3-CZ 4.02Å; L104-F183 HydrophobicContact CD1-CD1 4.4Å; L104-F183 HydrophobicContact CD1-CD2 3.42Å; L104-F183 VanDerWaalsContact CD1-CD2 3.42Å; L104-F183 HydrophobicContact CD1-CE1 4.35Å; L104-F183 HydrophobicContact CD1-CE2 3.38Å; L104-F183 HydrophobicContact CD1-CG 3.96Å; L104-F183 HydrophobicContact CD1-CZ 3.87Å; L136-F183 HydrophobicContact CD2-CB 3.77Å; W148-F183 HydrophobicContact CH2-CE1 4.15Å; W148-F183 AromaticContact CH2-CZ 3.93Å; W148-F183 HydrophobicContact CH2-CZ 3.93Å; W148-F183 AromaticContact CZ3-CE1 3.94Å; W148-F183 HydrophobicContact CZ3-CE1 3.94Å; W148-F183 HydrophobicContact CZ3-CZ 4.04Å; C168-F183 CarbonylContact O-C 3.55Å; C168-F183 VanDerWaalsContact O-CA 3.26Å; C168-F183 WeakPolarHBondContact O-CA 3.22Å; R169-F183 HydrophobicContact CG-CD1 3.93Å; R169-F183 HydrophobicContact CG-CD2 4.45Å; R169-F183 HydrophobicContact CG-CE1 3.43Å; R169-F183 VanDerWaalsContact CG-CE1 3.43Å; R169-F183 HydrophobicContact CG-CE2 4.01Å; R169-F183 HydrophobicContact CG-CG 4.42Å; R169-F183 HydrophobicContact CG-CZ 3.49Å; R169-F183 VanDerWaalsContact CG-CZ 3.49Å
184	Y	87.7	Confident	79.3	Confident	102 Å²	102	60.1 Å²	60.1	40%	0.4	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	157.2	178.3	71.9	-78.1	0	0	0	110.5	W167 C168 Q170 Q186	W167-Y184 CarbonylContact C-O 3.56Å; W167-Y184 VanDerWaalsContact CA-O 3.3Å; W167-Y184 WeakPolarHBondContact CA-O 3.4Å; C168-Y184 HydrophobicContact CB-CD1 4.48Å; C168-Y184 HydrophobicContact CB-CE1 3.78Å; C168-Y184 PolarHBondContact N-O 2.93Å; C168-Y184 WeakPolarHBondContact O-CD1 3.42Å; C168-Y184 WeakPolarHBondContact O-CE1 3.44Å; C168-Y184 PolarHBondContact O-N 3.21Å; Q170-Y184 HydrophobicContact CB-CD1 3.94Å; Y184-Q186 HydrophobicContact CE2-CB 4.24Å; Y184-Q186 PolarHBondContact O-N 3.45Å
185	L	92.9	Very high	80.9	Confident	73 Å²	73	59.1 Å²	59.1	38%	0.382	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	114.7	173	-171.8	153.9	0	0	0	108.7	I165 W167	I165-L185 HydrophobicContact CD1-CD1 4.25Å; I165-L185 HydrophobicContact CG2-CD1 3.61Å; I165-L185 HydrophobicContact CG2-CG 3.66Å; W167-L185 HydrophobicContact CE3-CB 4.12Å; W167-L185 HydrophobicContact CH2-CD1 4.21Å; W167-L185 HydrophobicContact CZ3-CB 3.89Å; W167-L185 HydrophobicContact CZ3-CD1 4.31Å; W167-L185 HydrophobicContact CZ3-CG 4.42Å
186	Q	92.3	Very high	82.7	Confident	44 Å²	44	56.6 Å²	56.6	21%	0.206	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-41	177.7	-170.9	-174.9	3	0	0	111.4	V166 C168 Y184 E434	V166-Q186 HydrophobicContact CG1-CB 4.43Å; V166-Q186 PolarHBondContact O-N 2.91Å; C168-Q186 HydrophobicContact CB-CB 4.07Å; Y184-Q186 HydrophobicContact CE2-CB 4.24Å; Y184-Q186 PolarHBondContact O-N 3.45Å; Q186-E434 PolarHBondContact NE2-OE1 2.84Å
187	A	94.4	Very high	84.8	Confident	13 Å²	13	54.4 Å²	54.4	11%	0.107	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	150.2	-179.6	0	0	0	0	0	112.3	V166 L189 W225	V166-A187 HydrophobicContact CB-CB 4.42Å; V166-A187 PolarHBondContact N-O 2.88Å; V166-A187 PolarHBondContact O-N 3.36Å; A187-L189 HydrophobicContact CB-CD2 4.04Å; A187-W225 HydrophobicContact CB-CB 4.26Å; A187-W225 HydrophobicContact CB-CD2 3.97Å; A187-W225 HydrophobicContact CB-CG 3.68Å
188	T	96.7	Very high	86.5	Confident	67 Å²	67	53.3 Å²	53.3	41%	0.411	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	112.4	167	-60	0	0	0	0	108.5	I165 T190	I165-T188 HydrophobicContact CG1-CG2 4.04Å; T188-T190 HydrophobicContact CG2-CG2 4.19Å
189	L	97.2	Very high	88.2	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	111.7	-177.4	-41.1	-178	0	0	0	108.4	S163 V164 V166 A187 L208 W220 W225	S163-L189 WeakPolarHBondContact CA-O 3.28Å; V164-L189 HydrophobicContact CB-CB 4.13Å; V164-L189 HydrophobicContact CB-CD1 4.16Å; V164-L189 HydrophobicContact CB-CG 4.3Å; V164-L189 HydrophobicContact CG1-CD1 4.27Å; V164-L189 PolarHBondContact N-O 3Å; V164-L189 VanDerWaalsContact N-O 3.12Å; V164-L189 PolarHBondContact O-N 2.89Å; V166-L189 HydrophobicContact CG2-CD1 4.32Å; A187-L189 HydrophobicContact CB-CD2 4.04Å; L189-L208 HydrophobicContact CD1-CD2 3.77Å; L189-W220 HydrophobicContact CB-CD2 4.08Å; L189-W220 HydrophobicContact CB-CE3 4.03Å; L189-W220 HydrophobicContact CB-CH2 4.15Å; L189-W220 HydrophobicContact CB-CZ2 4.18Å; L189-W220 HydrophobicContact CB-CZ3 4.07Å; L189-W220 HydrophobicContact CD1-CB 3.98Å; L189-W220 HydrophobicContact CD1-CD2 3.82Å; L189-W220 HydrophobicContact CD1-CE3 4.34Å; L189-W220 HydrophobicContact CD1-CG 3.63Å; L189-W220 HydrophobicContact CG-CD2 4.47Å; L189-W225 HydrophobicContact CD1-CE3 4.15Å; L189-W225 HydrophobicContact CD2-CB 3.67Å; L189-W225 HydrophobicContact CD2-CD2 4.09Å; L189-W225 HydrophobicContact CD2-CE3 3.8Å; L189-W225 HydrophobicContact CD2-CG 4.08Å
190	T	93.9	Very high	90	Very high	107 Å²	107	48.3 Å²	48.3	66%	0.656	26%	0.257	S	S	*	.			trans	-110.3	139.6	178.1	55.8	0	0	0	0	109.5	T188	T188-T190 HydrophobicContact CG2-CG2 4.19Å
191	G	90.3	Very high	91.6	Very high	35 Å²	35	41.8 Å²	41.8	36%	0.361	22%	0.222	S	C	.	.			trans	151	-16.7	-179.9	0	0	0	0	0	115.3	K218	G191-K218 WeakPolarHBondContact O-CE 3.35Å; G191-K218 PolarHBondContact O-NZ 2.98Å
192	H	96.1	Very high	93.1	Very high	13 Å²	13	40.3 Å²	40.3	6%	0.06	21%	0.214	C	C	.	.			trans	-67.8	147.8	161.3	-85.1	-65.8	0	0	0	110.3	V196 S210 D214 T216	H192-V196 HydrophobicContact CB-CG2 3.67Å; H192-V196 VanDerWaalsContact CD2-CG2 3.46Å; H192-V196 WeakPolarHBondContact CD2-CG2 3.17Å; H192-S210 PolarHBondContact CD2-OG 3.33Å; H192-S210 PolarHBondContact NE2-OG 3.07Å; H192-D214 WeakPolarHBondContact CA-OD2 3.45Å; H192-D214 IonicContact CE1-OD1 2.78Å; H192-D214 IonicContact CG-OD2 3.48Å; H192-D214 IonicContact ND1-OD1 3.58Å; H192-D214 PolarHBondContact ND1-OD1 3.29Å; H192-D214 VanDerWaalsContact ND1-OD1 3.14Å; H192-D214 IonicContact ND1-OD2 3.29Å; H192-D214 PolarHBondContact ND1-OD2 2.99Å; H192-T216 PolarHBondContact CE1-OG1 3.31Å; H192-T216 PolarHBondContact ND1-OG1 3.38Å
193	K	94.2	Very high	94.1	Very high	191 Å²	191	38.4 Å²	38.4	83%	0.83	20%	0.201	S	C	*	.	S	Bend	trans	-107.8	12.9	-178.7	-60.9	-171.1	177.2	-172.5	0	113.8	D214	K193-D214 HydrophobicContact CB-CB 3.93Å; K193-D214 PolarHBondContact N-OD2 3.47Å
194	G	92.9	Very high	94.2	Very high	12 Å²	12	37.6 Å²	37.6	12%	0.124	20%	0.197	C	C	.	.	S	Bend	trans	-169.9	169	-177.7	0	0	0	0	0	110.1	N162 V196	N162-G194 WeakPolarHBondContact OD1-CA 3.15Å; N162-G194 PolarHBondContact OD1-O 3.12Å; G194-V196 PolarHBondContact O-N 3.03Å
195	F	95	Very high	94.3	Very high	94 Å²	94	32.9 Å²	32.9	41%	0.412	18%	0.179	S	C	.	.			trans	-53	131.4	-166.5	-53.9	-25.1	0	0	0	112.5	V160 N162 K197 G212 D213	V160-F195 HydrophobicContact CB-CB 4.25Å; V160-F195 HydrophobicContact CB-CD1 3.63Å; V160-F195 HydrophobicContact CB-CD2 4.26Å; V160-F195 HydrophobicContact CB-CE1 3.94Å; V160-F195 HydrophobicContact CB-CG 3.8Å; V160-F195 HydrophobicContact CB-CZ 4.38Å; V160-F195 HydrophobicContact CG1-CB 4.12Å; V160-F195 HydrophobicContact CG1-CD1 4.26Å; V160-F195 HydrophobicContact CG1-CD2 4.05Å; V160-F195 HydrophobicContact CG1-CG 3.9Å; V160-F195 WeakPolarHBondContact O-CD1 3.28Å; V160-F195 VanDerWaalsContact O-CE1 3.31Å; V160-F195 WeakPolarHBondContact O-CE1 3.39Å; N162-F195 PolarHBondContact OD1-N 3.48Å; N162-F195 VanDerWaalsContact OD1-N 3.1Å; F195-K197 HydrophobicContact CB-CG 4.49Å; F195-G212 CarbonylContact O-C 3.6Å; F195-G212 WeakPolarHBondContact O-CA 3.29Å; F195-D213 WeakPolarHBondContact CD2-OD2 3.29Å; F195-D213 PolarHBondContact O-N 2.94Å
196	V	96.8	Very high	94.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	117.1	-177.2	-167	0	0	0	0	109.4	T158 S159 V164 H192 G194 Q211	T158-V196 WeakPolarHBondContact CB-O 3.22Å; T158-V196 HydrophobicContact CG2-CB 4.39Å; T158-V196 HydrophobicContact CG2-CG1 3.75Å; T158-V196 PolarHBondContact OG1-O 3.13Å; S159-V196 PolarHBondContact O-N 3.12Å; V164-V196 HydrophobicContact CG2-CG1 3.87Å; H192-V196 HydrophobicContact CB-CG2 3.67Å; H192-V196 VanDerWaalsContact CD2-CG2 3.46Å; H192-V196 WeakPolarHBondContact CD2-CG2 3.17Å; G194-V196 PolarHBondContact O-N 3.03Å; V196-Q211 WeakPolarHBondContact CG1-O 3Å
197	K	95.8	Very high	94.2	Very high	18 Å²	18	28.6 Å²	28.6	8%	0.078	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	5	-161.4	-74.8	177.1	165.9	172.4	0	114.6	I144 F195 Q211 D213 S242 Q243 M245	I144-K197 HydrophobicContact CG2-CB 4.3Å; I144-K197 HydrophobicContact CG2-CG 4.26Å; F195-K197 HydrophobicContact CB-CG 4.49Å; K197-Q211 PolarHBondContact N-O 3.1Å; K197-D213 WeakPolarHBondContact CD-OD1 3.42Å; K197-D213 WeakPolarHBondContact CE-OD2 3.5Å; K197-D213 IonicContact NZ-OD1 2.78Å; K197-D213 PolarHBondContact NZ-OD1 3.09Å; K197-D213 IonicContact NZ-OD2 3.26Å; K197-D213 PolarHBondContact NZ-OD2 3.45Å; K197-S242 PolarHBondContact NZ-O 2.81Å; K197-Q243 VanDerWaalsContact CD-O 3.31Å; K197-Q243 WeakPolarHBondContact CD-O 3.36Å; K197-Q243 VanDerWaalsContact CE-O 3.32Å; K197-Q243 WeakPolarHBondContact CE-O 3.27Å; K197-Q243 WeakPolarHBondContact CG-O 3.46Å; K197-M245 HydrophobicContact CB-CB 4.1Å; K197-M245 HydrophobicContact CB-CG 3.97Å; K197-M245 HydrophobicContact CD-CE 4.08Å; K197-M245 CarbonylContact O-C 3.51Å; K197-M245 PolarHBondContact O-N 3.31Å
198	G	96.4	Very high	94.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	148.4	173.9	0	0	0	0	0	112.9	D145 S210 Q211 M245	D145-G198 WeakPolarHBondContact OD2-CA 3.45Å; G198-S210 VanDerWaalsContact O-CA 3.3Å; G198-S210 WeakPolarHBondContact O-CA 3.19Å; G198-Q211 PolarHBondContact N-O 3.43Å; G198-Q211 PolarHBondContact O-N 3.37Å; G198-M245 WeakPolarHBondContact CA-O 3.39Å
199	V	97.8	Very high	94.4	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	148.7	177.6	60	0	0	0	0	111.9	D145 S147 A156 T158 V164 L208 A209	D145-V199 PolarHBondContact OD2-N 2.8Å; S147-V199 WeakPolarHBondContact CB-O 3.4Å; A156-V199 HydrophobicContact CB-CG1 4.45Å; A156-V199 HydrophobicContact CB-CG2 3.79Å; T158-V199 HydrophobicContact CG2-CB 3.47Å; T158-V199 VanDerWaalsContact CG2-CB 3.47Å; T158-V199 HydrophobicContact CG2-CG1 3.58Å; T158-V199 HydrophobicContact CG2-CG2 4.42Å; V164-V199 HydrophobicContact CG1-CG2 4.29Å; V199-L208 HydrophobicContact CG2-CD1 3.72Å; V199-L208 HydrophobicContact CG2-CD2 4.05Å; V199-L208 HydrophobicContact CG2-CG 3.87Å; V199-A209 CarbonylContact C-O 3.59Å; V199-A209 VanDerWaalsContact CA-O 3.29Å; V199-A209 WeakPolarHBondContact CA-O 3.5Å
200	T	97.4	Very high	94.4	Very high	10 Å²	10	24.5 Å²	24.5	6%	0.061	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	142.8	175.5	-175	0	0	0	0	112.6	A209 L247 W249 L256	T200-A209 HydrophobicContact CG2-CB 4.03Å; T200-A209 PolarHBondContact N-O 2.82Å; T200-A209 PolarHBondContact O-N 3.41Å; T200-L247 HydrophobicContact CG2-CB 3.4Å; T200-L247 VanDerWaalsContact CG2-CB 3.4Å; T200-L247 HydrophobicContact CG2-CD1 4.04Å; T200-L247 HydrophobicContact CG2-CG 4.36Å; T200-W249 VanDerWaalsContact CG2-CD1 3.49Å; T200-W249 HydrophobicContact CG2-CG 4.43Å; T200-W249 PolarHBondContact OG1-N 3.24Å; T200-L256 HydrophobicContact CG2-CD1 3.54Å
201	W	94.9	Very high	94.6	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.015	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	145.1	177.2	-68.1	86.3	0	0	0	112.9	S147 H150 R154 A156 V166 L208 T222 W225	S147-W201 PolarHBondContact O-NE1 3.44Å; H150-W201 PolarHBondContact CE1-O 3.17Å; H150-W201 VanDerWaalsContact CE1-O 3.24Å; R154-W201 HydrophobicContact CB-CH2 3.34Å; R154-W201 HydrophobicContact CB-CZ2 3.53Å; R154-W201 HydrophobicContact CB-CZ3 4.13Å; R154-W201 HydrophobicContact CG-CH2 4.04Å; A156-W201 HydrophobicContact CB-CZ2 3.84Å; V166-W201 HydrophobicContact CG1-CH2 3.84Å; V166-W201 HydrophobicContact CG1-CZ2 4.14Å; W201-L208 HydrophobicContact CD2-CD1 3.44Å; W201-L208 VanDerWaalsContact CD2-CD1 3.44Å; W201-L208 HydrophobicContact CE3-CD1 3.87Å; W201-L208 HydrophobicContact CG-CD1 3.73Å; W201-L208 HydrophobicContact CH2-CD1 4.37Å; W201-L208 HydrophobicContact CZ2-CD1 4.01Å; W201-L208 HydrophobicContact CZ3-CD1 4.3Å; W201-T222 HydrophobicContact CE3-CG2 4.42Å; W201-T222 HydrophobicContact CZ3-CG2 3.97Å; W201-W225 AromaticContact CH2-CH2 3.83Å; W201-W225 HydrophobicContact CH2-CH2 3.83Å; W201-W225 HydrophobicContact CZ3-CH2 4.01Å
202	D	94.2	Very high	94.8	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.083	C	C	.	.			trans	-69.5	132.4	168.3	170.2	20.3	0	0	0	111.7	V204 G205 R206 Y207 R274	D202-V204 PolarHBondContact O-N 3.11Å; D202-V204 VanDerWaalsContact OD1-CB 3.29Å; D202-V204 WeakPolarHBondContact OD1-CB 3.41Å; D202-V204 PolarHBondContact OD1-N 3.43Å; D202-G205 VanDerWaalsContact CG-N 3.34Å; D202-G205 WeakPolarHBondContact O-CA 3.37Å; D202-G205 PolarHBondContact O-N 3.09Å; D202-G205 PolarHBondContact OD2-N 3.33Å; D202-R206 PolarHBondContact OD2-N 3.23Å; D202-Y207 WeakPolarHBondContact CB-O 3.33Å; D202-Y207 PolarHBondContact N-O 3.16Å; D202-Y207 VanDerWaalsContact N-O 3.11Å; D202-Y207 PolarHBondContact OD2-N 3.14Å; D202-R274 IonicContact OD1-CZ 3.88Å; D202-R274 IonicContact OD1-NH1 3.56Å; D202-R274 PolarHBondContact OD1-NH1 2.78Å; D202-R274 IonicContact OD1-NH2 3.59Å; D202-R274 PolarHBondContact OD1-NH2 3.46Å; D202-R274 IonicContact OD2-CZ 2.68Å; D202-R274 IonicContact OD2-NH1 3.12Å; D202-R274 PolarHBondContact OD2-NH1 2.88Å; D202-R274 IonicContact OD2-NH2 2.72Å; D202-R274 PolarHBondContact OD2-NH2 3.37Å
203	P	92.1	Very high	94.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-10.9	174	30.8	-37.4	0	0	0	114.6	H150 S250 L251 L397	H150-P203 WeakPolarHBondContact ND1-CA 3.38Å; P203-S250 WeakPolarHBondContact CG-O 3.39Å; P203-L251 VanDerWaalsContact CG-O 3.24Å; P203-L251 WeakPolarHBondContact CG-O 3.22Å; P203-L397 VanDerWaalsContact O-CB 3.27Å; P203-L397 WeakPolarHBondContact O-CB 3.07Å; P203-L397 PolarHBondContact O-N 2.79Å
204	V	89.8	Confident	94.6	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-12.7	167.7	-179.7	0	0	0	0	110.8	D202 R206 Y393 Q395	D202-V204 PolarHBondContact O-N 3.11Å; D202-V204 VanDerWaalsContact OD1-CB 3.29Å; D202-V204 WeakPolarHBondContact OD1-CB 3.41Å; D202-V204 PolarHBondContact OD1-N 3.43Å; V204-R206 HydrophobicContact CG1-CG 4.39Å; V204-R206 PolarHBondContact O-N 3.4Å; V204-Y393 HydrophobicContact CB-CD2 4.44Å; V204-Y393 HydrophobicContact CG1-CD2 4.23Å; V204-Y393 HydrophobicContact CG1-CG 4.16Å; V204-Y393 HydrophobicContact CG2-CD2 3.34Å; V204-Y393 HydrophobicContact CG2-CE2 3.65Å; V204-Y393 HydrophobicContact CG2-CG 3.99Å; V204-Q395 HydrophobicContact CG1-CG 3.54Å; V204-Q395 PolarHBondContact O-NE2 2.87Å
205	G	88.6	Confident	94.6	Very high	2 Å²	2	13 Å²	13	2%	0.021	6%	0.063	C	C	.	.	S	Bend	trans	78.4	0.2	173.1	0	0	0	0	0	116.8	D202 Y207 T222 L433	D202-G205 VanDerWaalsContact CG-N 3.34Å; D202-G205 WeakPolarHBondContact O-CA 3.37Å; D202-G205 PolarHBondContact O-N 3.09Å; D202-G205 PolarHBondContact OD2-N 3.33Å; G205-Y207 VanDerWaalsContact C-N 3.35Å; G205-T222 WeakPolarHBondContact O-CB 3.18Å; G205-T222 WeakPolarHBondContact O-CG2 3.31Å; G205-T222 PolarHBondContact O-OG1 3.45Å; G205-L433 WeakPolarHBondContact O-CD2 3.33Å
206	R	89.8	Confident	94.6	Very high	26 Å²	26	9.3 Å²	9.3	10%	0.098	5%	0.048	C	C	.	.	S	Bend	trans	-76.6	-19.4	-176.8	-71.9	-172.8	175.3	144.6	9.7	114.1	D202 V204 T222 Y393 Q395	D202-R206 PolarHBondContact OD2-N 3.23Å; V204-R206 HydrophobicContact CG1-CG 4.39Å; V204-R206 PolarHBondContact O-N 3.4Å; R206-T222 WeakPolarHBondContact CA-OG1 3.26Å; R206-T222 PolarHBondContact O-N 3.34Å; R206-T222 PolarHBondContact O-OG1 3.01Å; R206-T222 VanDerWaalsContact O-OG1 3.05Å; R206-Y393 PolarHBondContact NH1-O 3.06Å; R206-Y393 PolarHBondContact NH2-O 3.04Å; R206-Q395 VanDerWaalsContact NE-CD 3.31Å
207	Y	94.9	Very high	94.6	Very high	2 Å²	2	9.3 Å²	9.3	1%	0.008	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	151.7	-171.7	-55.1	-79.5	0	0	0	113.5	D202 G205 I219 W220 R221 E228 W277 R449	D202-Y207 WeakPolarHBondContact CB-O 3.33Å; D202-Y207 PolarHBondContact N-O 3.16Å; D202-Y207 VanDerWaalsContact N-O 3.11Å; D202-Y207 PolarHBondContact OD2-N 3.14Å; G205-Y207 VanDerWaalsContact C-N 3.35Å; Y207-I219 HydrophobicContact CD1-CG2 3.75Å; Y207-I219 HydrophobicContact CG-CG2 4.1Å; Y207-W220 CarbonylContact C-O 3.51Å; Y207-W220 VanDerWaalsContact CA-O 3.22Å; Y207-W220 WeakPolarHBondContact CA-O 3.39Å; Y207-R221 HydrophobicContact CD1-CG 4.32Å; Y207-R221 HydrophobicContact CE1-CG 4.02Å; Y207-E228 HydrophobicContact CE1-CB 4.31Å; Y207-E228 HydrophobicContact CE1-CG 3.94Å; Y207-W277 HydrophobicContact CD1-CZ2 4.1Å; Y207-W277 HydrophobicContact CD2-CH2 4.14Å; Y207-W277 HydrophobicContact CD2-CZ2 4.1Å; Y207-W277 HydrophobicContact CE1-CZ2 4.03Å; Y207-W277 HydrophobicContact CE2-CH2 4.47Å; Y207-W277 HydrophobicContact CE2-CZ2 4.04Å; Y207-W277 HydrophobicContact CG-CH2 4.18Å; Y207-W277 HydrophobicContact CG-CZ2 4.13Å; Y207-W277 AromaticContact CZ-CZ2 4Å; Y207-R449 PolarHBondContact OH-NH1 3.32Å
208	L	96.6	Very high	94.7	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	140.9	163.1	-170.8	74.9	0	0	0	107.9	A156 V164 V166 L189 V199 W201 W220 W225	A156-L208 HydrophobicContact CB-CD1 3.9Å; A156-L208 HydrophobicContact CB-CD2 4Å; V164-L208 HydrophobicContact CG1-CD2 3.92Å; V166-L208 HydrophobicContact CG2-CD2 4.07Å; L189-L208 HydrophobicContact CD1-CD2 3.77Å; V199-L208 HydrophobicContact CG2-CD1 3.72Å; V199-L208 HydrophobicContact CG2-CD2 4.05Å; V199-L208 HydrophobicContact CG2-CG 3.87Å; W201-L208 HydrophobicContact CD2-CD1 3.44Å; W201-L208 VanDerWaalsContact CD2-CD1 3.44Å; W201-L208 HydrophobicContact CE3-CD1 3.87Å; W201-L208 HydrophobicContact CG-CD1 3.73Å; W201-L208 HydrophobicContact CH2-CD1 4.37Å; W201-L208 HydrophobicContact CZ2-CD1 4.01Å; W201-L208 HydrophobicContact CZ3-CD1 4.3Å; L208-W220 HydrophobicContact CB-CB 4.38Å; L208-W220 PolarHBondContact N-O 2.95Å; L208-W220 PolarHBondContact O-N 3.4Å; L208-W225 HydrophobicContact CB-CZ3 4.44Å; L208-W225 HydrophobicContact CD2-CZ3 4.48Å
209	A	97.8	Very high	94.8	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	139.2	175.2	0	0	0	0	0	111.1	V199 T200 K218 I219 L247 L256	V199-A209 CarbonylContact C-O 3.59Å; V199-A209 VanDerWaalsContact CA-O 3.29Å; V199-A209 WeakPolarHBondContact CA-O 3.5Å; T200-A209 HydrophobicContact CG2-CB 4.03Å; T200-A209 PolarHBondContact N-O 2.82Å; T200-A209 PolarHBondContact O-N 3.41Å; A209-K218 WeakPolarHBondContact CA-O 3.49Å; A209-I219 HydrophobicContact CB-CD1 3.71Å; A209-L247 HydrophobicContact CB-CD1 4.08Å; A209-L247 WeakPolarHBondContact O-CD1 3.33Å; A209-L256 HydrophobicContact CB-CD1 4.2Å; A209-L256 HydrophobicContact CB-CD2 3.59Å
210	S	97.9	Very high	94.7	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	152.2	178	61.1	0	0	0	0	112.2	H192 G198 V217 K218 W220	H192-S210 PolarHBondContact CD2-OG 3.33Å; H192-S210 PolarHBondContact NE2-OG 3.07Å; G198-S210 VanDerWaalsContact O-CA 3.3Å; G198-S210 WeakPolarHBondContact O-CA 3.19Å; S210-V217 CarbonylContact O-C 3.53Å; S210-V217 VanDerWaalsContact O-CA 3.28Å; S210-V217 WeakPolarHBondContact O-CA 3.28Å; S210-K218 PolarHBondContact N-O 3.43Å; S210-K218 PolarHBondContact O-N 3.22Å; S210-W220 PolarHBondContact OG-NE1 3.44Å
211	Q	96.4	Very high	94.5	Very high	3 Å²	3	10.4 Å²	10.4	1%	0.014	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.7	178.5	-171.8	172.5	-7.6	0	0	110.6	V196 K197 G198 V217 M245 L247 S258 P259	V196-Q211 WeakPolarHBondContact CG1-O 3Å; K197-Q211 PolarHBondContact N-O 3.1Å; G198-Q211 PolarHBondContact N-O 3.43Å; G198-Q211 PolarHBondContact O-N 3.37Å; Q211-V217 HydrophobicContact CB-CG2 4.04Å; Q211-V217 HydrophobicContact CG-CG2 3.78Å; Q211-M245 HydrophobicContact CB-CB 4.38Å; Q211-M245 HydrophobicContact CG-CB 4.15Å; Q211-M245 HydrophobicContact CG-SD 3.78Å; Q211-L247 HydrophobicContact CB-CD1 4.06Å; Q211-L247 HydrophobicContact CB-CD2 4.08Å; Q211-L247 HydrophobicContact CB-CG 4.06Å; Q211-S258 VanDerWaalsContact CD-OG 3.26Å; Q211-S258 PolarHBondContact NE2-OG 2.96Å; Q211-S258 PolarHBondContact OE1-OG 3.5Å; Q211-P259 PolarHBondContact NE2-O 3.21Å
212	G	94.8	Very high	94.4	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.01	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	175.4	-176.9	0	0	0	0	0	115.5	F195 D214 L215 T216	F195-G212 CarbonylContact O-C 3.6Å; F195-G212 WeakPolarHBondContact O-CA 3.29Å; G212-D214 PolarHBondContact O-N 3.39Å; G212-L215 PolarHBondContact O-N 3.45Å; G212-T216 PolarHBondContact N-O 3.27Å
213	D	93.2	Very high	94.1	Very high	42 Å²	42	11.1 Å²	11.1	23%	0.225	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-13.1	179.9	-79.9	-25.3	0	0	0	114.1	F195 K197 L215 M245	F195-D213 WeakPolarHBondContact CD2-OD2 3.29Å; F195-D213 PolarHBondContact O-N 2.94Å; K197-D213 WeakPolarHBondContact CD-OD1 3.42Å; K197-D213 WeakPolarHBondContact CE-OD2 3.5Å; K197-D213 IonicContact NZ-OD1 2.78Å; K197-D213 PolarHBondContact NZ-OD1 3.09Å; K197-D213 IonicContact NZ-OD2 3.26Å; K197-D213 PolarHBondContact NZ-OD2 3.45Å; D213-L215 PolarHBondContact O-N 3.02Å; D213-M245 WeakPolarHBondContact OD1-CE 3.49Å
214	D	92.7	Very high	93.9	Very high	37 Å²	37	13 Å²	13	20%	0.198	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	4.9	170.4	69.8	5.3	0	0	0	114.1	H192 K193 G212 T216	H192-D214 WeakPolarHBondContact CA-OD2 3.45Å; H192-D214 IonicContact CE1-OD1 2.78Å; H192-D214 IonicContact CG-OD2 3.48Å; H192-D214 IonicContact ND1-OD1 3.58Å; H192-D214 PolarHBondContact ND1-OD1 3.29Å; H192-D214 VanDerWaalsContact ND1-OD1 3.14Å; H192-D214 IonicContact ND1-OD2 3.29Å; H192-D214 PolarHBondContact ND1-OD2 2.99Å; K193-D214 HydrophobicContact CB-CB 3.93Å; K193-D214 PolarHBondContact N-OD2 3.47Å; G212-D214 PolarHBondContact O-N 3.39Å; D214-T216 VanDerWaalsContact C-N 3.26Å; D214-T216 VanDerWaalsContact CG-OG1 3.3Å; D214-T216 PolarHBondContact O-N 3.36Å; D214-T216 WeakPolarHBondContact OD1-CB 3.39Å; D214-T216 PolarHBondContact OD1-N 3.45Å; D214-T216 PolarHBondContact OD1-OG1 3.4Å; D214-T216 PolarHBondContact OD2-OG1 2.91Å
215	L	93.8	Very high	94.1	Very high	33 Å²	33	14.6 Å²	14.6	17%	0.173	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	34.3	179.5	-48.8	-179.7	0	0	0	112.1	G212 D213 S232 F235	G212-L215 PolarHBondContact O-N 3.45Å; D213-L215 PolarHBondContact O-N 3.02Å; L215-S232 WeakPolarHBondContact O-CA 3.17Å; L215-F235 HydrophobicContact CB-CB 4.08Å
216	T	95.3	Very high	94.3	Very high	16 Å²	16	19.6 Å²	19.6	10%	0.098	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	145.3	172.7	75.3	0	0	0	0	112.4	H192 G212 D214 S230 I231	H192-T216 PolarHBondContact CE1-OG1 3.31Å; H192-T216 PolarHBondContact ND1-OG1 3.38Å; G212-T216 PolarHBondContact N-O 3.27Å; D214-T216 VanDerWaalsContact C-N 3.26Å; D214-T216 VanDerWaalsContact CG-OG1 3.3Å; D214-T216 PolarHBondContact O-N 3.36Å; D214-T216 WeakPolarHBondContact OD1-CB 3.39Å; D214-T216 PolarHBondContact OD1-N 3.45Å; D214-T216 PolarHBondContact OD1-OG1 3.4Å; D214-T216 PolarHBondContact OD2-OG1 2.91Å; T216-S230 WeakPolarHBondContact CB-OG 3.49Å; T216-S230 WeakPolarHBondContact CG2-OG 3.35Å; T216-I231 WeakPolarHBondContact CA-O 3.25Å
217	V	96.9	Very high	94.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.8	152.6	173.9	0	0	0	0	107.2	S210 Q211 I219 S230 I231 F235 L247 L256 S258 I272	S210-V217 CarbonylContact O-C 3.53Å; S210-V217 VanDerWaalsContact O-CA 3.28Å; S210-V217 WeakPolarHBondContact O-CA 3.28Å; Q211-V217 HydrophobicContact CB-CG2 4.04Å; Q211-V217 HydrophobicContact CG-CG2 3.78Å; V217-I219 HydrophobicContact CG1-CD1 4.25Å; V217-S230 WeakPolarHBondContact O-CA 3.44Å; V217-I231 HydrophobicContact CB-CB 4.38Å; V217-I231 PolarHBondContact N-O 2.85Å; V217-I231 PolarHBondContact O-N 2.8Å; V217-F235 HydrophobicContact CB-CE2 4.24Å; V217-F235 HydrophobicContact CG2-CE1 4.41Å; V217-F235 HydrophobicContact CG2-CE2 3.61Å; V217-F235 HydrophobicContact CG2-CZ 3.56Å; V217-L247 HydrophobicContact CG2-CD2 4.46Å; V217-L256 HydrophobicContact CG1-CD2 3.98Å; V217-S258 WeakPolarHBondContact CG2-OG 3.38Å; V217-I272 HydrophobicContact CB-CD1 4.38Å; V217-I272 HydrophobicContact CG1-CD1 4.21Å; V217-I272 HydrophobicContact CG2-CD1 4.35Å
218	K	97.5	Very high	94.5	Very high	16 Å²	16	22.9 Å²	22.9	7%	0.07	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	145.1	174.2	-75.7	177.7	-178.7	-88.1	0	110.9	G191 A209 S210 W220 E227 A229	G191-K218 WeakPolarHBondContact O-CE 3.35Å; G191-K218 PolarHBondContact O-NZ 2.98Å; A209-K218 WeakPolarHBondContact CA-O 3.49Å; S210-K218 PolarHBondContact N-O 3.43Å; S210-K218 PolarHBondContact O-N 3.22Å; K218-W220 HydrophobicContact CB-CZ2 4Å; K218-W220 HydrophobicContact CD-CH2 4.12Å; K218-W220 HydrophobicContact CD-CZ2 3.68Å; K218-W220 HydrophobicContact CG-CZ2 4.48Å; K218-E227 IonicContact NZ-OE1 2.72Å; K218-E227 PolarHBondContact NZ-OE1 2.89Å; K218-E227 IonicContact NZ-OE2 3.97Å; K218-E227 PolarHBondContact NZ-OE2 3.43Å; K218-A229 WeakPolarHBondContact CA-O 3.32Å
219	I	97.7	Very high	94.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.2	176.1	-51.3	-61.6	0	0	0	108.1	Y207 A209 V217 E227 E228 A229 L256 W277	Y207-I219 HydrophobicContact CD1-CG2 3.75Å; Y207-I219 HydrophobicContact CG-CG2 4.1Å; A209-I219 HydrophobicContact CB-CD1 3.71Å; V217-I219 HydrophobicContact CG1-CD1 4.25Å; I219-E227 WeakPolarHBondContact O-CA 3.41Å; I219-E228 HydrophobicContact CB-CB 4.38Å; I219-E228 HydrophobicContact CG2-CB 4.19Å; I219-E228 PolarHBondContact O-N 2.96Å; I219-A229 HydrophobicContact CB-CB 4.35Å; I219-A229 HydrophobicContact CG1-CB 4.25Å; I219-A229 PolarHBondContact N-O 3.15Å; I219-L256 HydrophobicContact CD1-CD2 3.82Å; I219-W277 HydrophobicContact CD1-CE3 3.96Å; I219-W277 HydrophobicContact CD1-CH2 4.32Å; I219-W277 HydrophobicContact CD1-CZ3 3.73Å; I219-W277 HydrophobicContact CG1-CD2 4.01Å; I219-W277 HydrophobicContact CG1-CE3 3.75Å; I219-W277 HydrophobicContact CG1-CH2 4.29Å; I219-W277 HydrophobicContact CG1-CZ3 3.88Å; I219-W277 HydrophobicContact CG2-CH2 3.64Å; I219-W277 HydrophobicContact CG2-CZ2 3.62Å; I219-W277 HydrophobicContact CG2-CZ3 4.11Å
220	W	96.7	Very high	94.2	Very high	7 Å²	7	26.2 Å²	26.2	3%	0.027	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.5	-178.2	-48	90.1	0	0	0	109.6	L189 Y207 L208 S210 K218 Q226 E227	L189-W220 HydrophobicContact CB-CD2 4.08Å; L189-W220 HydrophobicContact CB-CE3 4.03Å; L189-W220 HydrophobicContact CB-CH2 4.15Å; L189-W220 HydrophobicContact CB-CZ2 4.18Å; L189-W220 HydrophobicContact CB-CZ3 4.07Å; L189-W220 HydrophobicContact CD1-CB 3.98Å; L189-W220 HydrophobicContact CD1-CD2 3.82Å; L189-W220 HydrophobicContact CD1-CE3 4.34Å; L189-W220 HydrophobicContact CD1-CG 3.63Å; L189-W220 HydrophobicContact CG-CD2 4.47Å; Y207-W220 CarbonylContact C-O 3.51Å; Y207-W220 VanDerWaalsContact CA-O 3.22Å; Y207-W220 WeakPolarHBondContact CA-O 3.39Å; L208-W220 HydrophobicContact CB-CB 4.38Å; L208-W220 PolarHBondContact N-O 2.95Å; L208-W220 PolarHBondContact O-N 3.4Å; S210-W220 PolarHBondContact OG-NE1 3.44Å; K218-W220 HydrophobicContact CB-CZ2 4Å; K218-W220 HydrophobicContact CD-CH2 4.12Å; K218-W220 HydrophobicContact CD-CZ2 3.68Å; K218-W220 HydrophobicContact CG-CZ2 4.48Å; W220-Q226 CarbonylContact C-O 3.59Å; W220-Q226 WeakPolarHBondContact CA-O 3.45Å; W220-E227 HydrophobicContact CE3-CB 4.25Å; W220-E227 HydrophobicContact CZ3-CB 4.15Å
221	R	94.1	Very high	94.1	Very high	30 Å²	30	26.8 Å²	26.8	11%	0.113	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.7	172	-68.6	-173.2	-63.7	-97.8	7.3	109.8	Y207 A223 D224 W225 Q226 E228 Q442	Y207-R221 HydrophobicContact CD1-CG 4.32Å; Y207-R221 HydrophobicContact CE1-CG 4.02Å; R221-A223 PolarHBondContact O-N 3.36Å; R221-D224 VanDerWaalsContact CB-OD1 3.22Å; R221-D224 WeakPolarHBondContact CB-OD1 3.37Å; R221-D224 IonicContact CZ-OD1 3.5Å; R221-D224 IonicContact CZ-OD2 2.85Å; R221-D224 IonicContact NE-OD1 2.63Å; R221-D224 PolarHBondContact NE-OD1 3.04Å; R221-D224 IonicContact NE-OD2 3.25Å; R221-D224 PolarHBondContact NE-OD2 3.34Å; R221-D224 IonicContact NH2-OD1 2.74Å; R221-D224 IonicContact NH2-OD2 2.67Å; R221-D224 PolarHBondContact NH2-OD2 3.07Å; R221-W225 WeakPolarHBondContact O-CA 3.19Å; R221-W225 PolarHBondContact O-N 3.34Å; R221-Q226 PolarHBondContact N-O 3.41Å; R221-Q226 VanDerWaalsContact NH2-CB 3.27Å; R221-E228 WeakPolarHBondContact CD-OE2 3.5Å; R221-E228 HydrophobicContact CG-CB 4.1Å; R221-E228 IonicContact CZ-OE2 3.4Å; R221-E228 IonicContact NH1-OE2 2.71Å; R221-E228 PolarHBondContact NH1-OE2 2.74Å; R221-Q442 VanDerWaalsContact CD-OE1 3.26Å
222	T	91.1	Very high	94	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-0.6	180	53.5	0	0	0	0	114.5	R154 W201 G205 R206 W225	R154-T222 PolarHBondContact NH1-O 2.95Å; R154-T222 VanDerWaalsContact NH1-O 3.13Å; W201-T222 HydrophobicContact CE3-CG2 4.42Å; W201-T222 HydrophobicContact CZ3-CG2 3.97Å; G205-T222 WeakPolarHBondContact O-CB 3.18Å; G205-T222 WeakPolarHBondContact O-CG2 3.31Å; G205-T222 PolarHBondContact O-OG1 3.45Å; R206-T222 WeakPolarHBondContact CA-OG1 3.26Å; R206-T222 PolarHBondContact O-N 3.34Å; R206-T222 PolarHBondContact O-OG1 3.01Å; R206-T222 VanDerWaalsContact O-OG1 3.05Å; T222-W225 HydrophobicContact CG2-CH2 3.96Å; T222-W225 HydrophobicContact CG2-CZ3 3.95Å
223	A	88.1	Confident	93.8	Very high	19 Å²	19	37.7 Å²	37.7	16%	0.157	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-41.1	-178.4	0	0	0	0	0	113.7	R221 L433 L439	R221-A223 PolarHBondContact O-N 3.36Å; A223-L433 VanDerWaalsContact CA-O 3.29Å; A223-L433 WeakPolarHBondContact CA-O 3.28Å; A223-L433 WeakPolarHBondContact CB-O 3.21Å; A223-L439 HydrophobicContact CB-CD1 4.46Å
224	D	89	Confident	93.8	Very high	38 Å²	38	36.3 Å²	36.3	20%	0.203	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	3	179.7	66.1	-9.5	0	0	0	113.3	R221 Q226 L439	R221-D224 VanDerWaalsContact CB-OD1 3.22Å; R221-D224 WeakPolarHBondContact CB-OD1 3.37Å; R221-D224 IonicContact CZ-OD1 3.5Å; R221-D224 IonicContact CZ-OD2 2.85Å; R221-D224 IonicContact NE-OD1 2.63Å; R221-D224 PolarHBondContact NE-OD1 3.04Å; R221-D224 IonicContact NE-OD2 3.25Å; R221-D224 PolarHBondContact NE-OD2 3.34Å; R221-D224 IonicContact NH2-OD1 2.74Å; R221-D224 IonicContact NH2-OD2 2.67Å; R221-D224 PolarHBondContact NH2-OD2 3.07Å; D224-Q226 HydrophobicContact CB-CG 4.11Å; D224-Q226 VanDerWaalsContact CG-CG 3.48Å; D224-Q226 WeakPolarHBondContact O-CG 3.47Å; D224-Q226 PolarHBondContact O-N 3.13Å; D224-Q226 PolarHBondContact O-NE2 3.46Å; D224-Q226 PolarHBondContact OD1-N 3.05Å; D224-Q226 WeakPolarHBondContact OD2-CG 3.3Å; D224-L439 HydrophobicContact CB-CD1 3.93Å
225	W	93.7	Very high	93.7	Very high	34 Å²	34	34.7 Å²	34.7	13%	0.129	18%	0.178	C	C	.	.			trans	56.2	18.6	-178.8	-65.9	116.9	0	0	0	115.1	R154 V166 A187 L189 W201 L208 R221 T222	R154-W225 VanDerWaalsContact NH1-CZ2 3.26Å; V166-W225 HydrophobicContact CB-CH2 4.29Å; V166-W225 HydrophobicContact CB-CZ2 4.38Å; V166-W225 HydrophobicContact CG1-CH2 3.79Å; V166-W225 HydrophobicContact CG1-CZ2 3.85Å; V166-W225 HydrophobicContact CG2-CE3 4.33Å; V166-W225 HydrophobicContact CG2-CH2 3.85Å; V166-W225 HydrophobicContact CG2-CZ2 4.36Å; V166-W225 HydrophobicContact CG2-CZ3 3.83Å; A187-W225 HydrophobicContact CB-CB 4.26Å; A187-W225 HydrophobicContact CB-CD2 3.97Å; A187-W225 HydrophobicContact CB-CG 3.68Å; L189-W225 HydrophobicContact CD1-CE3 4.15Å; L189-W225 HydrophobicContact CD2-CB 3.67Å; L189-W225 HydrophobicContact CD2-CD2 4.09Å; L189-W225 HydrophobicContact CD2-CE3 3.8Å; L189-W225 HydrophobicContact CD2-CG 4.08Å; W201-W225 AromaticContact CH2-CH2 3.83Å; W201-W225 HydrophobicContact CH2-CH2 3.83Å; W201-W225 HydrophobicContact CZ3-CH2 4.01Å; L208-W225 HydrophobicContact CB-CZ3 4.44Å; L208-W225 HydrophobicContact CD2-CZ3 4.48Å; R221-W225 WeakPolarHBondContact O-CA 3.19Å; R221-W225 PolarHBondContact O-N 3.34Å; T222-W225 HydrophobicContact CG2-CH2 3.96Å; T222-W225 HydrophobicContact CG2-CZ3 3.95Å
226	Q	93.3	Very high	93.5	Very high	108 Å²	108	37.2 Å²	37.2	51%	0.505	20%	0.195	S	C	.	.			trans	-89.2	159	179.5	-59.9	-51.4	-64.8	0	0	112.6	W220 R221 D224 E228	W220-Q226 CarbonylContact C-O 3.59Å; W220-Q226 WeakPolarHBondContact CA-O 3.45Å; R221-Q226 PolarHBondContact N-O 3.41Å; R221-Q226 VanDerWaalsContact NH2-CB 3.27Å; D224-Q226 HydrophobicContact CB-CG 4.11Å; D224-Q226 VanDerWaalsContact CG-CG 3.48Å; D224-Q226 WeakPolarHBondContact O-CG 3.47Å; D224-Q226 PolarHBondContact O-N 3.13Å; D224-Q226 PolarHBondContact O-NE2 3.46Å; D224-Q226 PolarHBondContact OD1-N 3.05Å; D224-Q226 WeakPolarHBondContact OD2-CG 3.3Å; Q226-E228 PolarHBondContact O-N 3.43Å
227	E	94.4	Very high	93	Very high	69 Å²	69	43.6 Å²	43.6	32%	0.322	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125	174.2	-169.8	169.5	157.3	0	0	111.4	K218 I219 W220 S230	K218-E227 IonicContact NZ-OE1 2.72Å; K218-E227 PolarHBondContact NZ-OE1 2.89Å; K218-E227 IonicContact NZ-OE2 3.97Å; K218-E227 PolarHBondContact NZ-OE2 3.43Å; I219-E227 WeakPolarHBondContact O-CA 3.41Å; W220-E227 HydrophobicContact CE3-CB 4.25Å; W220-E227 HydrophobicContact CZ3-CB 4.15Å; E227-S230 WeakPolarHBondContact OE1-CB 3.48Å
228	E	92.6	Very high	92.2	Very high	28 Å²	28	43.6 Å²	43.6	13%	0.131	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	-37.7	173	178.4	63.2	-164.8	0	0	111.4	Y207 I219 R221 Q226 R449	Y207-E228 HydrophobicContact CE1-CB 4.31Å; Y207-E228 HydrophobicContact CE1-CG 3.94Å; I219-E228 HydrophobicContact CB-CB 4.38Å; I219-E228 HydrophobicContact CG2-CB 4.19Å; I219-E228 PolarHBondContact O-N 2.96Å; R221-E228 WeakPolarHBondContact CD-OE2 3.5Å; R221-E228 HydrophobicContact CG-CB 4.1Å; R221-E228 IonicContact CZ-OE2 3.4Å; R221-E228 IonicContact NH1-OE2 2.71Å; R221-E228 PolarHBondContact NH1-OE2 2.74Å; Q226-E228 PolarHBondContact O-N 3.43Å; E228-R449 IonicContact OE1-CZ 3.36Å; E228-R449 IonicContact OE1-NH1 2.68Å; E228-R449 PolarHBondContact OE1-NH1 2.97Å
229	A	94.4	Very high	91	Very high	14 Å²	14	46.5 Å²	46.5	12%	0.116	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	147.4	-178.4	0	0	0	0	0	112.1	K218 I219 W277	K218-A229 WeakPolarHBondContact CA-O 3.32Å; I219-A229 HydrophobicContact CB-CB 4.35Å; I219-A229 HydrophobicContact CG1-CB 4.25Å; I219-A229 PolarHBondContact N-O 3.15Å; A229-W277 HydrophobicContact CB-CB 3.96Å; A229-W277 HydrophobicContact CB-CG 3.78Å
230	S	95.5	Very high	89.5	Confident	55 Å²	55	49.5 Å²	49.5	39%	0.385	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134.6	160.7	167.9	0	0	0	0	109.9	T216 V217 E227	T216-S230 WeakPolarHBondContact CB-OG 3.49Å; T216-S230 WeakPolarHBondContact CG2-OG 3.35Å; V217-S230 WeakPolarHBondContact O-CA 3.44Å; E227-S230 WeakPolarHBondContact OE1-CB 3.48Å
231	I	95.8	Very high	88.2	Confident	12 Å²	12	53.7 Å²	53.7	6%	0.062	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	102.4	-173.8	-52.6	168.1	0	0	0	107.7	T216 V217 P234 F235 I272 W277 P279	T216-I231 WeakPolarHBondContact CA-O 3.25Å; V217-I231 HydrophobicContact CB-CB 4.38Å; V217-I231 PolarHBondContact N-O 2.85Å; V217-I231 PolarHBondContact O-N 2.8Å; I231-P234 HydrophobicContact CG2-CG 4.42Å; I231-F235 HydrophobicContact CG2-CE2 4.34Å; I231-F235 WeakPolarHBondContact O-CD2 3.41Å; I231-F235 WeakPolarHBondContact O-CE2 3.09Å; I231-I272 HydrophobicContact CD1-CD1 3.91Å; I231-I272 HydrophobicContact CD1-CG1 4.27Å; I231-I272 HydrophobicContact CD1-CG2 3.58Å; I231-W277 HydrophobicContact CD1-CB 4.12Å; I231-W277 HydrophobicContact CG1-CB 4.5Å; I231-P279 HydrophobicContact CG2-CG 4.44Å
232	S	94	Very high	87.4	Confident	52 Å²	52	52.5 Å²	52.5	36%	0.364	29%	0.291	S	S	.	.			trans	-106.2	-33.4	-177.1	58.6	0	0	0	0	114.6	L215 P234 F235 T236	L215-S232 WeakPolarHBondContact O-CA 3.17Å; S232-P234 VanDerWaalsContact C-CD 3.41Å; S232-P234 VanDerWaalsContact O-N 3.08Å; S232-F235 PolarHBondContact O-N 2.84Å; S232-T236 WeakPolarHBondContact O-CG2 3.21Å; S232-T236 PolarHBondContact O-N 3.31Å
233	K	91.2	Very high	86.8	Confident	181 Å²	181	59 Å²	59	79%	0.787	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-41.2	-168.9	-64.7	-172.9	179.4	-176.1	0	115.6	F235	K233-F235 VanDerWaalsContact C-N 3.32Å; K233-F235 PolarHBondContact O-N 2.97Å
234	P	91.5	Very high	86.8	Confident	13 Å²	13	59.3 Å²	59.3	8%	0.084	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-15.8	179.3	-16.9	32.4	0	0	0	115.4	I231 S232 A261 I262 K270 P279	I231-P234 HydrophobicContact CG2-CG 4.42Å; S232-P234 VanDerWaalsContact C-CD 3.41Å; S232-P234 VanDerWaalsContact O-N 3.08Å; P234-A261 HydrophobicContact CB-CB 4.04Å; P234-I262 PolarHBondContact O-N 2.92Å; P234-K270 HydrophobicContact CB-CB 4.45Å; P234-K270 HydrophobicContact CB-CD 4.12Å; P234-K270 HydrophobicContact CB-CG 4.02Å; P234-K270 HydrophobicContact CG-CD 4.37Å; P234-K270 HydrophobicContact CG-CG 4.01Å; P234-P279 HydrophobicContact CG-CB 3.58Å; P234-P279 HydrophobicContact CG-CG 3.71Å
235	F	92.4	Very high	87.1	Confident	3 Å²	3	57.6 Å²	57.6	1%	0.013	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-10.3	-166.4	-47.2	-72	0	0	0	113.4	L215 V217 I231 S232 K233 K237 A238 S258 A261	L215-F235 HydrophobicContact CB-CB 4.08Å; V217-F235 HydrophobicContact CB-CE2 4.24Å; V217-F235 HydrophobicContact CG2-CE1 4.41Å; V217-F235 HydrophobicContact CG2-CE2 3.61Å; V217-F235 HydrophobicContact CG2-CZ 3.56Å; I231-F235 HydrophobicContact CG2-CE2 4.34Å; I231-F235 WeakPolarHBondContact O-CD2 3.41Å; I231-F235 WeakPolarHBondContact O-CE2 3.09Å; S232-F235 PolarHBondContact O-N 2.84Å; K233-F235 VanDerWaalsContact C-N 3.32Å; K233-F235 PolarHBondContact O-N 2.97Å; F235-K237 PolarHBondContact O-N 3.49Å; F235-A238 WeakPolarHBondContact O-CB 3.11Å; F235-A238 PolarHBondContact O-N 2.65Å; F235-S258 WeakPolarHBondContact CE1-OG 3.27Å; F235-S258 WeakPolarHBondContact CZ-OG 3.29Å; F235-A261 HydrophobicContact CD1-CB 4.03Å; F235-A261 HydrophobicContact CE1-CB 3.82Å
236	T	88.4	Confident	87.1	Confident	86 Å²	86	56 Å²	56	53%	0.528	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-18.5	-174.5	56.8	0	0	0	0	115.8	S232	S232-T236 WeakPolarHBondContact O-CG2 3.21Å; S232-T236 PolarHBondContact O-N 3.31Å
237	K	85.2	Confident	87.3	Confident	150 Å²	150	50.9 Å²	50.9	65%	0.652	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-0	178.1	-63.2	-173	176.5	-174.8	0	114.3	F235 I262	F235-K237 PolarHBondContact O-N 3.49Å; K237-I262 HydrophobicContact CB-CB 4.36Å; K237-I262 HydrophobicContact CB-CD1 4.18Å; K237-I262 HydrophobicContact CB-CG2 4.34Å; K237-I262 WeakPolarHBondContact O-CD1 3.45Å
238	A	80.7	Confident	87.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.271	C	S	.	.			trans	-96.3	16.4	-168.6	0	0	0	0	0	114.9	F235 G240 Q241 H260 I262	F235-A238 WeakPolarHBondContact O-CB 3.11Å; F235-A238 PolarHBondContact O-N 2.65Å; A238-G240 PolarHBondContact O-N 2.94Å; A238-Q241 PolarHBondContact O-N 2.89Å; A238-H260 VanDerWaalsContact CB-O 3.22Å; A238-H260 WeakPolarHBondContact CB-O 3.47Å; A238-H260 PolarHBondContact O-CE1 2.79Å; A238-I262 HydrophobicContact CB-CD1 4.16Å; A238-I262 HydrophobicContact CB-CG1 4.24Å
239	S	72.1	Confident	87.5	Confident	77 Å²	77	47.3 Å²	47.3	54%	0.538	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	123.3	-172.6	52.5	0	0	0	0	114.9	Q241	S239-Q241 VanDerWaalsContact C-N 3.3Å; S239-Q241 WeakPolarHBondContact O-CG 3.15Å; S239-Q241 PolarHBondContact O-N 3.41Å; S239-Q241 PolarHBondContact O-NE2 2.83Å
240	G	64.7	Low	87.5	Confident	63 Å²	63	46.7 Å²	46.7	65%	0.649	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	0.5	170	0	0	0	0	0	116.7	A238 S242	A238-G240 PolarHBondContact O-N 2.94Å; G240-S242 PolarHBondContact O-N 3.4Å
241	Q	69.7	Low	87.3	Confident	96 Å²	96	45 Å²	45	45%	0.449	25%	0.248	S	C	.	.			trans	-83.8	-0.4	-164.8	-59.6	-53.3	-50	0	0	116.4	A238 S239 H260 H289 K319	A238-Q241 PolarHBondContact O-N 2.89Å; S239-Q241 VanDerWaalsContact C-N 3.3Å; S239-Q241 WeakPolarHBondContact O-CG 3.15Å; S239-Q241 PolarHBondContact O-N 3.41Å; S239-Q241 PolarHBondContact O-NE2 2.83Å; Q241-H260 VanDerWaalsContact C-NE2 3.27Å; Q241-H260 WeakPolarHBondContact CB-NE2 3.4Å; Q241-H289 WeakPolarHBondContact CB-CE1 3.24Å; Q241-K319 WeakPolarHBondContact O-CE 3.32Å; Q241-K319 PolarHBondContact O-NZ 2.93Å
242	S	77.4	Confident	87.1	Confident	4 Å²	4	45.8 Å²	45.8	3%	0.028	25%	0.252	C	S	.	.			trans	-149.7	152.1	175.5	-168.4	0	0	0	0	114	K197 G240 V244 H260 I291	K197-S242 PolarHBondContact NZ-O 2.81Å; G240-S242 PolarHBondContact O-N 3.4Å; S242-V244 WeakPolarHBondContact CB-O 3.43Å; S242-V244 PolarHBondContact OG-N 2.95Å; S242-V244 PolarHBondContact OG-O 3.39Å; S242-H260 VanDerWaalsContact CB-CD2 3.48Å; S242-H260 WeakPolarHBondContact CB-CD2 3.31Å; S242-H260 VanDerWaalsContact CB-NE2 3.27Å; S242-H260 WeakPolarHBondContact CB-NE2 3.48Å; S242-H260 PolarHBondContact N-NE2 3.06Å; S242-I291 VanDerWaalsContact OG-CG2 3.23Å; S242-I291 WeakPolarHBondContact OG-CG2 3.31Å
243	Q	78.7	Confident	86.9	Confident	137 Å²	137	43.3 Å²	43.3	64%	0.64	23%	0.234	S	C	*	.	S	Bend	trans	-87.4	-21.6	170.6	-74	168.3	-42.8	0	0	112.6	K197	K197-Q243 VanDerWaalsContact CD-O 3.31Å; K197-Q243 WeakPolarHBondContact CD-O 3.36Å; K197-Q243 VanDerWaalsContact CE-O 3.32Å; K197-Q243 WeakPolarHBondContact CE-O 3.27Å; K197-Q243 WeakPolarHBondContact CG-O 3.46Å
244	V	89	Confident	86.9	Confident	26 Å²	26	36.2 Å²	36.2	16%	0.158	21%	0.207	C	C	.	.			trans	-136.1	148.4	-177.6	-155.1	0	0	0	0	110	I144 S242 R246	I144-V244 HydrophobicContact CG2-CG1 4.11Å; S242-V244 WeakPolarHBondContact CB-O 3.43Å; S242-V244 PolarHBondContact OG-N 2.95Å; S242-V244 PolarHBondContact OG-O 3.39Å; V244-R246 HydrophobicContact CG1-CG 3.48Å; V244-R246 VanDerWaalsContact CG1-CG 3.48Å
245	M	93.6	Very high	87	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	21%	0.21	C	C	.	.			trans	-141	57.5	-178.8	-58.3	-170.6	-164.3	0	0	110.6	K197 G198 Q211 D213 L247 P259 H260 I291	K197-M245 HydrophobicContact CB-CB 4.1Å; K197-M245 HydrophobicContact CB-CG 3.97Å; K197-M245 HydrophobicContact CD-CE 4.08Å; K197-M245 CarbonylContact O-C 3.51Å; K197-M245 PolarHBondContact O-N 3.31Å; G198-M245 WeakPolarHBondContact CA-O 3.39Å; Q211-M245 HydrophobicContact CB-CB 4.38Å; Q211-M245 HydrophobicContact CG-CB 4.15Å; Q211-M245 HydrophobicContact CG-SD 3.78Å; D213-M245 WeakPolarHBondContact OD1-CE 3.49Å; M245-L247 PolarHBondContact O-N 2.9Å; M245-P259 HydrophobicContact CB-CG 4.31Å; M245-H260 HydrophobicContact CG-CB 4.32Å; M245-H260 HydrophobicContact SD-CB 4.18Å; M245-I291 CarbonylContact C-O 3.34Å; M245-I291 WeakPolarHBondContact CA-O 3.48Å
246	R	95.5	Very high	87.2	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-65.1	104.8	-170	-52	-169.6	-169.6	-88.7	6.4	111.3	Y25 N82 C83 D145 V244 I291 C292 A293 C346 D347	Y25-R246 PolarHBondContact O-NH2 2.93Å; N82-R246 PolarHBondContact O-NH2 3.21Å; C83-R246 PolarHBondContact SG-NH1 3.42Å; C83-R246 VanDerWaalsContact SG-NH1 3.37Å; D145-R246 IonicContact OD1-CZ 3.81Å; D145-R246 IonicContact OD1-NH1 2.72Å; D145-R246 PolarHBondContact OD1-NH1 2.89Å; V244-R246 HydrophobicContact CG1-CG 3.48Å; V244-R246 VanDerWaalsContact CG1-CG 3.48Å; R246-I291 PolarHBondContact N-O 2.91Å; R246-C292 HydrophobicContact CB-CB 3.93Å; R246-C292 HydrophobicContact CG-CB 4.22Å; R246-A293 PolarHBondContact O-N 3.09Å; R246-C346 PolarHBondContact NE-O 2.77Å; R246-D347 WeakPolarHBondContact CD-OD1 3.27Å; R246-D347 IonicContact CZ-OD2 3.18Å; R246-D347 IonicContact NE-OD1 2.78Å; R246-D347 PolarHBondContact NE-OD1 2.95Å; R246-D347 IonicContact NE-OD2 3.24Å
247	L	96.4	Very high	87.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.185	C	C	.	.			trans	-71.5	158.8	176.1	-68.1	176.1	0	0	0	112.3	T200 A209 Q211 V217 M245 L256 R294	T200-L247 HydrophobicContact CG2-CB 3.4Å; T200-L247 VanDerWaalsContact CG2-CB 3.4Å; T200-L247 HydrophobicContact CG2-CD1 4.04Å; T200-L247 HydrophobicContact CG2-CG 4.36Å; A209-L247 HydrophobicContact CB-CD1 4.08Å; A209-L247 WeakPolarHBondContact O-CD1 3.33Å; Q211-L247 HydrophobicContact CB-CD1 4.06Å; Q211-L247 HydrophobicContact CB-CD2 4.08Å; Q211-L247 HydrophobicContact CB-CG 4.06Å; V217-L247 HydrophobicContact CG2-CD2 4.46Å; M245-L247 PolarHBondContact O-N 2.9Å; L247-L256 HydrophobicContact CB-CD1 4.31Å; L247-L256 HydrophobicContact CD2-CD1 4.37Å; L247-R294 PolarHBondContact O-NH1 2.98Å
248	S	96.8	Very high	88	Confident	13 Å²	13	25.3 Å²	25.3	9%	0.091	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	133.2	165.4	-172.8	0	0	0	0	112.2	A257 A293 Y295	S248-A257 PolarHBondContact N-O 2.84Å; S248-A257 VanDerWaalsContact N-O 3.16Å; S248-A257 PolarHBondContact O-N 3.36Å; S248-A293 VanDerWaalsContact CB-O 3.27Å; S248-A293 WeakPolarHBondContact CB-O 3.48Å; S248-Y295 WeakPolarHBondContact O-CD2 3.3Å; S248-Y295 VanDerWaalsContact O-CE2 3.32Å; S248-Y295 WeakPolarHBondContact O-CE2 3.41Å; S248-Y295 PolarHBondContact OG-N 2.72Å
249	W	95.5	Very high	88.7	Confident	9 Å²	9	25.3 Å²	25.3	3%	0.034	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	152.3	161.6	-81.5	98.5	0	0	0	112.1	T200 G253 L256 R274 W277 Y295	T200-W249 VanDerWaalsContact CG2-CD1 3.49Å; T200-W249 HydrophobicContact CG2-CG 4.43Å; T200-W249 PolarHBondContact OG1-N 3.24Å; W249-G253 WeakPolarHBondContact CZ3-O 3.48Å; W249-L256 HydrophobicContact CD2-CB 4.19Å; W249-L256 HydrophobicContact CD2-CD1 4.41Å; W249-L256 HydrophobicContact CE3-CB 4.2Å; W249-L256 HydrophobicContact CG-CD1 4.34Å; W249-L256 HydrophobicContact CH2-CB 4.29Å; W249-L256 HydrophobicContact CZ2-CB 4.26Å; W249-L256 HydrophobicContact CZ3-CB 4.25Å; W249-R274 HydrophobicContact CH2-CB 4.1Å; W249-R274 HydrophobicContact CH2-CG 4.23Å; W249-R274 HydrophobicContact CZ3-CB 4.06Å; W249-R274 HydrophobicContact CZ3-CG 4.43Å; W249-W277 AromaticContact CH2-CH2 3.65Å; W249-W277 HydrophobicContact CH2-CH2 3.65Å; W249-W277 AromaticContact CH2-CZ3 3.56Å; W249-W277 HydrophobicContact CH2-CZ3 3.56Å; W249-W277 AromaticContact CZ2-CH2 3.89Å; W249-W277 HydrophobicContact CZ2-CH2 3.89Å; W249-W277 AromaticContact CZ2-CZ3 3.86Å; W249-W277 HydrophobicContact CZ2-CZ3 3.86Å; W249-Y295 WeakPolarHBondContact O-CB 3.44Å; W249-Y295 WeakPolarHBondContact O-CD2 3.4Å
250	S	94.2	Very high	89.6	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.128	C	C	.	.			trans	-79.9	143.8	164.2	65.9	0	0	0	0	110.7	P203 D252 G253 S254 T255 Y295	P203-S250 WeakPolarHBondContact CG-O 3.39Å; S250-D252 VanDerWaalsContact C-N 3.29Å; S250-D252 WeakPolarHBondContact CB-OD1 3.42Å; S250-D252 PolarHBondContact O-N 2.78Å; S250-D252 PolarHBondContact OG-OD1 2.93Å; S250-G253 WeakPolarHBondContact O-CA 3.37Å; S250-G253 PolarHBondContact O-N 3.48Å; S250-S254 PolarHBondContact OG-N 3.35Å; S250-S254 PolarHBondContact OG-OG 3.32Å; S250-T255 WeakPolarHBondContact CB-OG1 3.46Å; S250-T255 PolarHBondContact N-O 3.33Å; S250-T255 PolarHBondContact OG-N 3.39Å; S250-T255 PolarHBondContact OG-O 3.04Å; S250-T255 VanDerWaalsContact OG-O 3.14Å; S250-T255 PolarHBondContact OG-OG1 3.19Å; S250-Y295 VanDerWaalsContact CB-CE1 3.46Å
251	L	91.5	Very high	90.9	Very high	21 Å²	21	18.8 Å²	18.8	11%	0.11	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-31.5	-171.8	-166.8	82.1	0	0	0	113.5	P203 G253 P297 V299 V385 H389 L398	P203-L251 VanDerWaalsContact CG-O 3.24Å; P203-L251 WeakPolarHBondContact CG-O 3.22Å; L251-G253 PolarHBondContact O-N 2.98Å; L251-G253 VanDerWaalsContact O-N 3.15Å; L251-P297 VanDerWaalsContact CD2-O 3.27Å; L251-P297 WeakPolarHBondContact CD2-O 3.33Å; L251-V299 HydrophobicContact CB-CG2 4.35Å; L251-V299 HydrophobicContact CD2-CG2 4.31Å; L251-V385 HydrophobicContact CD2-CG1 4.06Å; L251-V385 HydrophobicContact CD2-CG2 4.27Å; L251-V385 HydrophobicContact CG-CG1 4.32Å; L251-H389 PolarHBondContact O-CE1 2.95Å; L251-H389 PolarHBondContact O-NE2 3.21Å; L251-L398 HydrophobicContact CD1-CD1 4.48Å; L251-L398 HydrophobicContact CG-CD1 4.5Å
252	D	89.7	Confident	92	Very high	27 Å²	27	15.6 Å²	15.6	14%	0.144	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	1.4	172.6	70.3	-30.7	0	0	0	113.7	S250 S254 V299 V312 L388 H389 Y393	S250-D252 VanDerWaalsContact C-N 3.29Å; S250-D252 WeakPolarHBondContact CB-OD1 3.42Å; S250-D252 PolarHBondContact O-N 2.78Å; S250-D252 PolarHBondContact OG-OD1 2.93Å; D252-S254 PolarHBondContact O-N 2.83Å; D252-S254 VanDerWaalsContact O-N 3.12Å; D252-S254 PolarHBondContact OD1-N 2.58Å; D252-S254 PolarHBondContact OD1-OG 3.3Å; D252-S254 VanDerWaalsContact OD1-OG 3.12Å; D252-S254 VanDerWaalsContact OD2-CB 3.24Å; D252-S254 WeakPolarHBondContact OD2-CB 3.21Å; D252-S254 PolarHBondContact OD2-OG 2.97Å; D252-V299 HydrophobicContact CB-CG2 4.06Å; D252-V312 HydrophobicContact CB-CG1 4.49Å; D252-L388 HydrophobicContact CB-CD2 3.99Å; D252-H389 WeakPolarHBondContact CA-NE2 3.27Å; D252-Y393 VanDerWaalsContact O-CE2 3.32Å; D252-Y393 WeakPolarHBondContact O-CE2 3.18Å; D252-Y393 PolarHBondContact O-OH 2.67Å
253	G	91	Very high	92.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	67.6	7.4	178.2	0	0	0	0	0	114.9	W249 S250 L251 R274 Y393	W249-G253 WeakPolarHBondContact CZ3-O 3.48Å; S250-G253 WeakPolarHBondContact O-CA 3.37Å; S250-G253 PolarHBondContact O-N 3.48Å; L251-G253 PolarHBondContact O-N 2.98Å; L251-G253 VanDerWaalsContact O-N 3.15Å; G253-R274 WeakPolarHBondContact O-CD 3.15Å; G253-R274 PolarHBondContact O-NH1 3.18Å; G253-Y393 VanDerWaalsContact C-OH 3.23Å; G253-Y393 PolarHBondContact O-OH 2.89Å
254	S	91	Very high	92.9	Very high	32 Å²	32	18.4 Å²	18.4	22%	0.224	10%	0.103	C	C	.	.	S	Bend	trans	-83.2	-35.6	-170.7	67	0	0	0	0	113.7	S250 D252 R274 Y393	S250-S254 PolarHBondContact OG-N 3.35Å; S250-S254 PolarHBondContact OG-OG 3.32Å; D252-S254 PolarHBondContact O-N 2.83Å; D252-S254 VanDerWaalsContact O-N 3.12Å; D252-S254 PolarHBondContact OD1-N 2.58Å; D252-S254 PolarHBondContact OD1-OG 3.3Å; D252-S254 VanDerWaalsContact OD1-OG 3.12Å; D252-S254 VanDerWaalsContact OD2-CB 3.24Å; D252-S254 WeakPolarHBondContact OD2-CB 3.21Å; D252-S254 PolarHBondContact OD2-OG 2.97Å; S254-R274 WeakPolarHBondContact O-CB 3.47Å; S254-R274 PolarHBondContact O-N 2.64Å; S254-Y393 WeakPolarHBondContact CA-OH 3.46Å; S254-Y393 PolarHBondContact N-OH 2.84Å
255	T	93.1	Very high	92.7	Very high	24 Å²	24	19.8 Å²	19.8	15%	0.147	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.2	-170.4	54.2	0	0	0	0	113.2	S250 I272 Y295	S250-T255 WeakPolarHBondContact CB-OG1 3.46Å; S250-T255 PolarHBondContact N-O 3.33Å; S250-T255 PolarHBondContact OG-N 3.39Å; S250-T255 PolarHBondContact OG-O 3.04Å; S250-T255 VanDerWaalsContact OG-O 3.14Å; S250-T255 PolarHBondContact OG-OG1 3.19Å; T255-I272 WeakPolarHBondContact CA-O 3.43Å; T255-Y295 PolarHBondContact OG1-OH 2.83Å
256	L	96.1	Very high	92.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.5	170.9	169.1	64	0	0	0	108.6	T200 A209 V217 I219 L247 W249 I272	T200-L256 HydrophobicContact CG2-CD1 3.54Å; A209-L256 HydrophobicContact CB-CD1 4.2Å; A209-L256 HydrophobicContact CB-CD2 3.59Å; V217-L256 HydrophobicContact CG1-CD2 3.98Å; I219-L256 HydrophobicContact CD1-CD2 3.82Å; L247-L256 HydrophobicContact CB-CD1 4.31Å; L247-L256 HydrophobicContact CD2-CD1 4.37Å; W249-L256 HydrophobicContact CD2-CB 4.19Å; W249-L256 HydrophobicContact CD2-CD1 4.41Å; W249-L256 HydrophobicContact CE3-CB 4.2Å; W249-L256 HydrophobicContact CG-CD1 4.34Å; W249-L256 HydrophobicContact CH2-CB 4.29Å; W249-L256 HydrophobicContact CZ2-CB 4.26Å; W249-L256 HydrophobicContact CZ3-CB 4.25Å; L256-I272 HydrophobicContact CB-CB 4.22Å; L256-I272 HydrophobicContact CD2-CD1 4.23Å; L256-I272 HydrophobicContact CG-CD1 4.49Å; L256-I272 PolarHBondContact N-O 2.84Å; L256-I272 PolarHBondContact O-N 2.89Å
257	A	96.3	Very high	92.3	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	120.5	171.7	0	0	0	0	0	109.9	S248 L271 A293 Y295 L314	S248-A257 PolarHBondContact N-O 2.84Å; S248-A257 VanDerWaalsContact N-O 3.16Å; S248-A257 PolarHBondContact O-N 3.36Å; A257-L271 HydrophobicContact CB-CD2 3.81Å; A257-A293 HydrophobicContact CB-CB 4.01Å; A257-Y295 HydrophobicContact CB-CD2 4.19Å; A257-Y295 HydrophobicContact CB-CE2 3.38Å; A257-L314 HydrophobicContact CB-CD1 4.07Å; A257-L314 HydrophobicContact CB-CD2 3.66Å
258	S	95.6	Very high	92.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.5	175.6	170.2	0	0	0	0	110.4	Q211 V217 F235 A269 K270	Q211-S258 VanDerWaalsContact CD-OG 3.26Å; Q211-S258 PolarHBondContact NE2-OG 2.96Å; Q211-S258 PolarHBondContact OE1-OG 3.5Å; V217-S258 WeakPolarHBondContact CG2-OG 3.38Å; F235-S258 WeakPolarHBondContact CE1-OG 3.27Å; F235-S258 WeakPolarHBondContact CZ-OG 3.29Å; S258-A269 CarbonylContact O-C 3.53Å; S258-A269 WeakPolarHBondContact O-CA 3.43Å; S258-K270 PolarHBondContact N-O 2.83Å; S258-K270 PolarHBondContact O-N 3.01Å
259	P	94.2	Very high	92	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	-178.5	172.2	33.3	-35.3	0	0	0	110.9	Q211 M245 A261 V290	Q211-P259 PolarHBondContact NE2-O 3.21Å; M245-P259 HydrophobicContact CB-CG 4.31Å; P259-A261 VanDerWaalsContact C-N 3.28Å; P259-A261 PolarHBondContact O-N 2.79Å; P259-V290 HydrophobicContact CB-CB 4.35Å; P259-V290 HydrophobicContact CB-CG1 4.01Å
260	H	91.7	Very high	91.9	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.009	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	66.9	15.8	167.3	-147.4	-108.6	0	0	0	116.9	A238 Q241 S242 M245 H289 V290	A238-H260 VanDerWaalsContact CB-O 3.22Å; A238-H260 WeakPolarHBondContact CB-O 3.47Å; A238-H260 PolarHBondContact O-CE1 2.79Å; Q241-H260 VanDerWaalsContact C-NE2 3.27Å; Q241-H260 WeakPolarHBondContact CB-NE2 3.4Å; S242-H260 VanDerWaalsContact CB-CD2 3.48Å; S242-H260 WeakPolarHBondContact CB-CD2 3.31Å; S242-H260 VanDerWaalsContact CB-NE2 3.27Å; S242-H260 WeakPolarHBondContact CB-NE2 3.48Å; S242-H260 PolarHBondContact N-NE2 3.06Å; M245-H260 HydrophobicContact CG-CB 4.32Å; M245-H260 HydrophobicContact SD-CB 4.18Å; H260-H289 AromaticContact CD2-CG 3.91Å; H260-H289 AromaticContact CD2-ND1 3.35Å; H260-H289 PolarHBondContact CD2-ND1 2.77Å; H260-H289 VanDerWaalsContact CD2-ND1 3.35Å; H260-H289 AromaticContact CE1-ND1 3.87Å; H260-H289 AromaticContact CG-ND1 3.98Å; H260-H289 AromaticContact NE2-CG 3.9Å; H260-H289 AromaticContact NE2-ND1 3.25Å; H260-H289 PolarHBondContact NE2-ND1 3.32Å; H260-V290 WeakPolarHBondContact CA-O 3.43Å; H260-V290 PolarHBondContact N-O 2.94Å
261	A	92.8	Very high	92	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	162.3	171.4	0	0	0	0	0	111.7	P234 F235 P259 T268 K270	P234-A261 HydrophobicContact CB-CB 4.04Å; F235-A261 HydrophobicContact CD1-CB 4.03Å; F235-A261 HydrophobicContact CE1-CB 3.82Å; P259-A261 VanDerWaalsContact C-N 3.28Å; P259-A261 PolarHBondContact O-N 2.79Å; A261-T268 WeakPolarHBondContact CB-OG1 3.25Å; A261-T268 PolarHBondContact N-O 3.12Å; A261-T268 VanDerWaalsContact N-O 3.1Å; A261-T268 PolarHBondContact O-N 3.05Å; A261-K270 HydrophobicContact CB-CB 3.88Å
262	I	91.6	Very high	92.2	Very high	30 Å²	30	26.9 Å²	26.9	15%	0.154	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.2	170.5	-67.2	-176.4	0	0	0	109.6	P234 K237 A238 F266	P234-I262 PolarHBondContact O-N 2.92Å; K237-I262 HydrophobicContact CB-CB 4.36Å; K237-I262 HydrophobicContact CB-CD1 4.18Å; K237-I262 HydrophobicContact CB-CG2 4.34Å; K237-I262 WeakPolarHBondContact O-CD1 3.45Å; A238-I262 HydrophobicContact CB-CD1 4.16Å; A238-I262 HydrophobicContact CB-CG1 4.24Å; I262-F266 WeakPolarHBondContact CA-O 3.48Å
263	N	89.5	Confident	92.3	Very high	57 Å²	57	27.3 Å²	27.3	31%	0.305	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129	167.7	-168.2	-8.8	0	0	0	109.7	G265 F266 T268 D282	N263-G265 PolarHBondContact O-N 3.02Å; N263-F266 PolarHBondContact N-O 2.75Å; N263-F266 PolarHBondContact O-N 2.81Å; N263-T268 HydrophobicContact CB-CG2 3.98Å; N263-D282 PolarHBondContact ND2-OD2 3.15Å
264	N	86.8	Confident	92.4	Very high	143 Å²	143	27.9 Å²	27.9	77%	0.765	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	28.5	-179.4	-63.4	-27.8	0	0	0	115.7	F266	N264-F266 VanDerWaalsContact C-N 3.32Å; N264-F266 HydrophobicContact CB-CD2 4.47Å; N264-F266 WeakPolarHBondContact O-CD2 3.19Å
265	G	84.3	Confident	92.2	Very high	55 Å²	55	30.7 Å²	30.7	57%	0.567	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.5	-7.9	-177.6	0	0	0	0	0	114.7	N263	N263-G265 PolarHBondContact O-N 3.02Å
266	F	88.2	Confident	92	Very high	138 Å²	138	32.8 Å²	32.8	61%	0.605	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	138.3	174.8	-61.1	-83.4	0	0	0	110.7	I262 N263 N264	I262-F266 WeakPolarHBondContact CA-O 3.48Å; N263-F266 PolarHBondContact N-O 2.75Å; N263-F266 PolarHBondContact O-N 2.81Å; N264-F266 VanDerWaalsContact C-N 3.32Å; N264-F266 HydrophobicContact CB-CD2 4.47Å; N264-F266 WeakPolarHBondContact O-CD2 3.19Å
267	P	91.4	Very high	91.9	Very high	17 Å²	17	33.3 Å²	33.3	11%	0.11	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	139.4	175	-17.2	31.5	0	0	0	112.2	K288	P267-K288 WeakPolarHBondContact CB-O 3.14Å
268	T	93.3	Very high	91.6	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	164.2	-179	67.5	0	0	0	0	111.3	A261 N263 D282 L283 V284	A261-T268 WeakPolarHBondContact CB-OG1 3.25Å; A261-T268 PolarHBondContact N-O 3.12Å; A261-T268 VanDerWaalsContact N-O 3.1Å; A261-T268 PolarHBondContact O-N 3.05Å; N263-T268 HydrophobicContact CB-CG2 3.98Å; T268-D282 HydrophobicContact CG2-CB 4.09Å; T268-D282 PolarHBondContact OG1-OD1 3.1Å; T268-L283 WeakPolarHBondContact CA-O 3.45Å; T268-L283 WeakPolarHBondContact CB-O 3.25Å; T268-V284 HydrophobicContact CG2-CB 4.46Å; T268-V284 HydrophobicContact CG2-CG1 4.38Å; T268-V284 HydrophobicContact CG2-CG2 3.84Å
269	A	94.2	Very high	91.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	135.1	154.8	0	0	0	0	0	108.4	S258 L283 V290 L316	S258-A269 CarbonylContact O-C 3.53Å; S258-A269 WeakPolarHBondContact O-CA 3.43Å; A269-L283 HydrophobicContact CB-CB 4.39Å; A269-L283 PolarHBondContact N-O 3.37Å; A269-L283 VanDerWaalsContact N-O 3.13Å; A269-L283 PolarHBondContact O-N 3.16Å; A269-V290 HydrophobicContact CB-CG1 4.31Å; A269-L316 HydrophobicContact CB-CD1 3.73Å; A269-L316 HydrophobicContact CB-CD2 3.8Å; A269-L316 HydrophobicContact CB-CG 4.43Å
270	K	94.5	Very high	90.8	Very high	25 Å²	25	40.3 Å²	40.3	11%	0.109	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132	-179.5	-154.6	71.5	175.7	-176.6	0	110.2	P234 S258 A261 P279 L281 D282	P234-K270 HydrophobicContact CB-CB 4.45Å; P234-K270 HydrophobicContact CB-CD 4.12Å; P234-K270 HydrophobicContact CB-CG 4.02Å; P234-K270 HydrophobicContact CG-CD 4.37Å; P234-K270 HydrophobicContact CG-CG 4.01Å; S258-K270 PolarHBondContact N-O 2.83Å; S258-K270 PolarHBondContact O-N 3.01Å; A261-K270 HydrophobicContact CB-CB 3.88Å; K270-P279 HydrophobicContact CD-CB 4.25Å; K270-P279 WeakPolarHBondContact CE-O 3.28Å; K270-P279 HydrophobicContact CG-CB 3.63Å; K270-L281 WeakPolarHBondContact CD-O 3.3Å; K270-D282 WeakPolarHBondContact CD-OD1 3.24Å; K270-D282 IonicContact NZ-OD1 3.19Å; K270-D282 PolarHBondContact NZ-OD1 3.19Å; K270-D282 IonicContact NZ-OD2 2.81Å; K270-D282 PolarHBondContact NZ-OD2 2.71Å
271	L	94.6	Very high	90.7	Very high	13 Å²	13	45.2 Å²	45.2	7%	0.068	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.5	166.7	-52.3	-173.2	0	0	0	108.4	A257 P279 S280 L281 L283 L314	A257-L271 HydrophobicContact CB-CD2 3.81Å; L271-P279 CarbonylContact O-C 3.59Å; L271-P279 WeakPolarHBondContact O-CA 3.5Å; L271-S280 PolarHBondContact O-N 2.74Å; L271-S280 PolarHBondContact O-OG 3.34Å; L271-L281 HydrophobicContact CB-CB 4.22Å; L271-L281 HydrophobicContact CD1-CB 4.22Å; L271-L281 HydrophobicContact CD1-CD1 4.32Å; L271-L281 HydrophobicContact CG-CB 4.36Å; L271-L281 PolarHBondContact N-O 3.39Å; L271-L283 HydrophobicContact CD1-CD1 4.48Å; L271-L283 HydrophobicContact CD1-CD2 4.4Å; L271-L283 HydrophobicContact CD1-CG 4.46Å; L271-L283 HydrophobicContact CD2-CD1 4.07Å; L271-L283 HydrophobicContact CD2-CG 4.45Å; L271-L283 HydrophobicContact CG-CD1 4.45Å; L271-L283 HydrophobicContact CG-CG 4.36Å; L271-L314 HydrophobicContact CD2-CD2 3.84Å
272	I	95.5	Very high	90.6	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.1	179.3	-66.4	159.2	0	0	0	107.7	V217 I231 T255 L256 W277 S278 P279	V217-I272 HydrophobicContact CB-CD1 4.38Å; V217-I272 HydrophobicContact CG1-CD1 4.21Å; V217-I272 HydrophobicContact CG2-CD1 4.35Å; I231-I272 HydrophobicContact CD1-CD1 3.91Å; I231-I272 HydrophobicContact CD1-CG1 4.27Å; I231-I272 HydrophobicContact CD1-CG2 3.58Å; T255-I272 WeakPolarHBondContact CA-O 3.43Å; L256-I272 HydrophobicContact CB-CB 4.22Å; L256-I272 HydrophobicContact CD2-CD1 4.23Å; L256-I272 HydrophobicContact CG-CD1 4.49Å; L256-I272 PolarHBondContact N-O 2.84Å; L256-I272 PolarHBondContact O-N 2.89Å; I272-W277 HydrophobicContact CG2-CE3 4.16Å; I272-S278 WeakPolarHBondContact CA-O 3.31Å; I272-P279 HydrophobicContact CG1-CB 4.31Å
273	D	92.9	Very high	90.7	Very high	36 Å²	36	46.6 Å²	46.6	19%	0.193	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.6	174.5	172.2	19.4	0	0	0	110.7	T275 N276 W277 S278	D273-T275 VanDerWaalsContact C-N 3.31Å; D273-T275 PolarHBondContact O-N 2.63Å; D273-T275 WeakPolarHBondContact OD1-CG2 3.39Å; D273-T275 PolarHBondContact OD1-N 2.8Å; D273-T275 PolarHBondContact OD1-OG1 3.25Å; D273-T275 PolarHBondContact OD2-OG1 3.25Å; D273-N276 PolarHBondContact OD2-ND2 3.35Å; D273-N276 PolarHBondContact OD2-OD1 2.86Å; D273-W277 WeakPolarHBondContact O-CA 3.42Å; D273-W277 PolarHBondContact O-N 3.1Å; D273-S278 PolarHBondContact N-O 2.94Å
274	R	92.2	Very high	90.7	Very high	13 Å²	13	47.6 Å²	47.6	5%	0.049	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-31.2	175.3	176.3	174.1	-176.3	144.3	14.7	114.5	D202 W249 G253 S254 N276 W277 R449	D202-R274 IonicContact OD1-CZ 3.88Å; D202-R274 IonicContact OD1-NH1 3.56Å; D202-R274 PolarHBondContact OD1-NH1 2.78Å; D202-R274 IonicContact OD1-NH2 3.59Å; D202-R274 PolarHBondContact OD1-NH2 3.46Å; D202-R274 IonicContact OD2-CZ 2.68Å; D202-R274 IonicContact OD2-NH1 3.12Å; D202-R274 PolarHBondContact OD2-NH1 2.88Å; D202-R274 IonicContact OD2-NH2 2.72Å; D202-R274 PolarHBondContact OD2-NH2 3.37Å; W249-R274 HydrophobicContact CH2-CB 4.1Å; W249-R274 HydrophobicContact CH2-CG 4.23Å; W249-R274 HydrophobicContact CZ3-CB 4.06Å; W249-R274 HydrophobicContact CZ3-CG 4.43Å; G253-R274 WeakPolarHBondContact O-CD 3.15Å; G253-R274 PolarHBondContact O-NH1 3.18Å; S254-R274 WeakPolarHBondContact O-CB 3.47Å; S254-R274 PolarHBondContact O-N 2.64Å; R274-N276 VanDerWaalsContact C-N 3.29Å; R274-N276 PolarHBondContact O-N 3.1Å; R274-W277 HydrophobicContact CG-CH2 4.19Å; R274-R449 PolarHBondContact O-NH2 3.38Å
275	T	87.8	Confident	90.7	Very high	91 Å²	91	43.3 Å²	43.3	56%	0.558	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-43.7	-170.5	71.1	0	0	0	0	111.3	D273 R449	D273-T275 VanDerWaalsContact C-N 3.31Å; D273-T275 PolarHBondContact O-N 2.63Å; D273-T275 WeakPolarHBondContact OD1-CG2 3.39Å; D273-T275 PolarHBondContact OD1-N 2.8Å; D273-T275 PolarHBondContact OD1-OG1 3.25Å; D273-T275 PolarHBondContact OD2-OG1 3.25Å; T275-R449 PolarHBondContact O-NE 2.9Å; T275-R449 PolarHBondContact O-NH2 2.81Å
276	N	89.3	Confident	91	Very high	67 Å²	67	41.3 Å²	41.3	36%	0.358	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.5	-0.4	-167.7	55.4	25.6	0	0	0	113.6	D273 R274 S278	D273-N276 PolarHBondContact OD2-ND2 3.35Å; D273-N276 PolarHBondContact OD2-OD1 2.86Å; R274-N276 VanDerWaalsContact C-N 3.29Å; R274-N276 PolarHBondContact O-N 3.1Å; N276-S278 PolarHBondContact ND2-OG 3.12Å; N276-S278 PolarHBondContact O-N 2.92Å; N276-S278 WeakPolarHBondContact OD1-CA 3.46Å; N276-S278 WeakPolarHBondContact OD1-CB 3.37Å; N276-S278 PolarHBondContact OD1-N 2.99Å; N276-S278 PolarHBondContact OD1-OG 3.35Å
277	W	93.1	Very high	91.1	Very high	11 Å²	11	43.3 Å²	43.3	4%	0.042	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	28.9	-173	-54.1	118.6	0	0	0	113.5	Y207 I219 A229 I231 W249 I272 D273 R274	Y207-W277 HydrophobicContact CD1-CZ2 4.1Å; Y207-W277 HydrophobicContact CD2-CH2 4.14Å; Y207-W277 HydrophobicContact CD2-CZ2 4.1Å; Y207-W277 HydrophobicContact CE1-CZ2 4.03Å; Y207-W277 HydrophobicContact CE2-CH2 4.47Å; Y207-W277 HydrophobicContact CE2-CZ2 4.04Å; Y207-W277 HydrophobicContact CG-CH2 4.18Å; Y207-W277 HydrophobicContact CG-CZ2 4.13Å; Y207-W277 AromaticContact CZ-CZ2 4Å; I219-W277 HydrophobicContact CD1-CE3 3.96Å; I219-W277 HydrophobicContact CD1-CH2 4.32Å; I219-W277 HydrophobicContact CD1-CZ3 3.73Å; I219-W277 HydrophobicContact CG1-CD2 4.01Å; I219-W277 HydrophobicContact CG1-CE3 3.75Å; I219-W277 HydrophobicContact CG1-CH2 4.29Å; I219-W277 HydrophobicContact CG1-CZ3 3.88Å; I219-W277 HydrophobicContact CG2-CH2 3.64Å; I219-W277 HydrophobicContact CG2-CZ2 3.62Å; I219-W277 HydrophobicContact CG2-CZ3 4.11Å; A229-W277 HydrophobicContact CB-CB 3.96Å; A229-W277 HydrophobicContact CB-CG 3.78Å; I231-W277 HydrophobicContact CD1-CB 4.12Å; I231-W277 HydrophobicContact CG1-CB 4.5Å; W249-W277 AromaticContact CH2-CH2 3.65Å; W249-W277 HydrophobicContact CH2-CH2 3.65Å; W249-W277 AromaticContact CH2-CZ3 3.56Å; W249-W277 HydrophobicContact CH2-CZ3 3.56Å; W249-W277 AromaticContact CZ2-CH2 3.89Å; W249-W277 HydrophobicContact CZ2-CH2 3.89Å; W249-W277 AromaticContact CZ2-CZ3 3.86Å; W249-W277 HydrophobicContact CZ2-CZ3 3.86Å; I272-W277 HydrophobicContact CG2-CE3 4.16Å; D273-W277 WeakPolarHBondContact O-CA 3.42Å; D273-W277 PolarHBondContact O-N 3.1Å; R274-W277 HydrophobicContact CG-CH2 4.19Å
278	S	90.1	Very high	91.2	Very high	44 Å²	44	48.3 Å²	48.3	31%	0.308	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	136	177.3	74.9	0	0	0	0	111.5	I272 D273 N276 S280	I272-S278 WeakPolarHBondContact CA-O 3.31Å; D273-S278 PolarHBondContact N-O 2.94Å; N276-S278 PolarHBondContact ND2-OG 3.12Å; N276-S278 PolarHBondContact O-N 2.92Å; N276-S278 WeakPolarHBondContact OD1-CA 3.46Å; N276-S278 WeakPolarHBondContact OD1-CB 3.37Å; N276-S278 PolarHBondContact OD1-N 2.99Å; N276-S278 PolarHBondContact OD1-OG 3.35Å; S278-S280 PolarHBondContact O-N 2.9Å
279	P	89.7	Confident	91.1	Very high	44 Å²	44	49.4 Å²	49.4	29%	0.286	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	96.1	176.6	32.6	-33.8	0	0	0	109.8	I231 P234 K270 L271 I272	I231-P279 HydrophobicContact CG2-CG 4.44Å; P234-P279 HydrophobicContact CG-CB 3.58Å; P234-P279 HydrophobicContact CG-CG 3.71Å; K270-P279 HydrophobicContact CD-CB 4.25Å; K270-P279 WeakPolarHBondContact CE-O 3.28Å; K270-P279 HydrophobicContact CG-CB 3.63Å; L271-P279 CarbonylContact O-C 3.59Å; L271-P279 WeakPolarHBondContact O-CA 3.5Å; I272-P279 HydrophobicContact CG1-CB 4.31Å
280	S	84	Confident	91.1	Very high	60 Å²	60	49.4 Å²	49.4	42%	0.42	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-36.7	-160.2	59.8	0	0	0	0	115.4	L271 S278	L271-S280 PolarHBondContact O-N 2.74Å; L271-S280 PolarHBondContact O-OG 3.34Å; S278-S280 PolarHBondContact O-N 2.9Å
281	L	89.4	Confident	91.1	Very high	105 Å²	105	48.6 Å²	48.6	55%	0.55	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	150.1	-176.3	-66.4	172	0	0	0	111.6	K270 L271	K270-L281 WeakPolarHBondContact CD-O 3.3Å; L271-L281 HydrophobicContact CB-CB 4.22Å; L271-L281 HydrophobicContact CD1-CB 4.22Å; L271-L281 HydrophobicContact CD1-CD1 4.32Å; L271-L281 HydrophobicContact CG-CB 4.36Å; L271-L281 PolarHBondContact N-O 3.39Å
282	D	91.1	Very high	91.2	Very high	38 Å²	38	48 Å²	48	20%	0.203	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	136.1	167.3	-66.8	-78.6	0	0	0	110.5	N263 T268 K270 V284	N263-D282 PolarHBondContact ND2-OD2 3.15Å; T268-D282 HydrophobicContact CG2-CB 4.09Å; T268-D282 PolarHBondContact OG1-OD1 3.1Å; K270-D282 WeakPolarHBondContact CD-OD1 3.24Å; K270-D282 IonicContact NZ-OD1 3.19Å; K270-D282 PolarHBondContact NZ-OD1 3.19Å; K270-D282 IonicContact NZ-OD2 2.81Å; K270-D282 PolarHBondContact NZ-OD2 2.71Å; D282-V284 HydrophobicContact CB-CG2 3.72Å
283	L	92.1	Very high	91.2	Very high	21 Å²	21	48 Å²	48	11%	0.11	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	115	163.5	-56.2	-177.3	0	0	0	107.9	T268 A269 L271 L314 L316 W326	T268-L283 WeakPolarHBondContact CA-O 3.45Å; T268-L283 WeakPolarHBondContact CB-O 3.25Å; A269-L283 HydrophobicContact CB-CB 4.39Å; A269-L283 PolarHBondContact N-O 3.37Å; A269-L283 VanDerWaalsContact N-O 3.13Å; A269-L283 PolarHBondContact O-N 3.16Å; L271-L283 HydrophobicContact CD1-CD1 4.48Å; L271-L283 HydrophobicContact CD1-CD2 4.4Å; L271-L283 HydrophobicContact CD1-CG 4.46Å; L271-L283 HydrophobicContact CD2-CD1 4.07Å; L271-L283 HydrophobicContact CD2-CG 4.45Å; L271-L283 HydrophobicContact CG-CD1 4.45Å; L271-L283 HydrophobicContact CG-CG 4.36Å; L283-L314 HydrophobicContact CD1-CD2 3.61Å; L283-L316 HydrophobicContact CB-CD1 3.88Å; L283-L316 HydrophobicContact CD1-CD1 3.96Å; L283-W326 HydrophobicContact CB-CD2 4.39Å; L283-W326 HydrophobicContact CB-CZ2 4.25Å; L283-W326 HydrophobicContact CD1-CB 4.35Å; L283-W326 HydrophobicContact CD1-CD2 4.25Å; L283-W326 HydrophobicContact CD1-CG 4.03Å; L283-W326 HydrophobicContact CD2-CD2 4.04Å; L283-W326 HydrophobicContact CD2-CE3 3.78Å; L283-W326 HydrophobicContact CD2-CZ3 4.15Å; L283-W326 HydrophobicContact CG-CD2 4.46Å
284	V	90.6	Very high	91.4	Very high	78 Å²	78	47.9 Å²	47.9	47%	0.473	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	139.8	-167.3	-166.5	0	0	0	0	109.9	T268 D282 W326	T268-V284 HydrophobicContact CG2-CB 4.46Å; T268-V284 HydrophobicContact CG2-CG1 4.38Å; T268-V284 HydrophobicContact CG2-CG2 3.84Å; D282-V284 HydrophobicContact CB-CG2 3.72Å; V284-W326 WeakPolarHBondContact O-CH2 3.4Å
285	G	85.8	Confident	91.6	Very high	53 Å²	53	48 Å²	48	55%	0.546	26%	0.26	S	S	.	.			trans	151.2	-17.5	174.6	0	0	0	0	0	114.6
286	H	91.8	Very high	91.9	Very high	12 Å²	12	43.9 Å²	43.9	6%	0.056	24%	0.235	C	C	.	.			trans	-73.3	141.2	173.9	-75.9	-72.3	0	0	0	111.6	K288 V290 S318 D320 S322 S324	H286-K288 WeakPolarHBondContact CB-O 2.91Å; H286-V290 HydrophobicContact CB-CG2 3.99Å; H286-S318 WeakPolarHBondContact ND1-CB 3.49Å; H286-D320 WeakPolarHBondContact CA-OD2 3.35Å; H286-D320 WeakPolarHBondContact CB-OD2 3.36Å; H286-D320 IonicContact CG-OD2 3.39Å; H286-D320 IonicContact ND1-OD1 3.51Å; H286-D320 PolarHBondContact ND1-OD1 3.43Å; H286-D320 IonicContact ND1-OD2 3.54Å; H286-D320 PolarHBondContact ND1-OD2 3.26Å; H286-D320 VanDerWaalsContact ND1-OD2 3.1Å; H286-S322 PolarHBondContact CE1-O 3.46Å; H286-S322 PolarHBondContact CE1-OG 3.01Å; H286-S322 PolarHBondContact ND1-OG 3.29Å; H286-S324 PolarHBondContact NE2-OG 3.07Å
287	R	90.5	Very high	92	Very high	180 Å²	180	43 Å²	43	68%	0.679	23%	0.233	S	C	*	.	S	Bend	trans	-84.5	-16.4	-179.1	-61	-179.5	-178.4	168.8	1	112.8	D320	R287-D320 HydrophobicContact CB-CB 4.03Å; R287-D320 PolarHBondContact N-OD2 3Å
288	K	91.9	Very high	91.9	Very high	123 Å²	123	43.7 Å²	43.7	54%	0.535	24%	0.237	S	C	.	.	S	Bend	trans	-137.9	179.7	174.8	-64.5	-176.7	178.6	179.1	0	109.1	P267 H286 V290 S318 K319 D320	P267-K288 WeakPolarHBondContact CB-O 3.14Å; H286-K288 WeakPolarHBondContact CB-O 2.91Å; K288-V290 PolarHBondContact O-N 3.4Å; K288-S318 PolarHBondContact O-OG 3.13Å; K288-K319 HydrophobicContact CB-CB 3.88Å; K288-K319 HydrophobicContact CD-CB 4.27Å; K288-K319 WeakPolarHBondContact CD-O 3.5Å; K288-D320 HydrophobicContact CB-CB 3.99Å; K288-D320 HydrophobicContact CD-CB 4.48Å; K288-D320 HydrophobicContact CG-CB 4.15Å; K288-D320 PolarHBondContact N-OD2 2.93Å
289	H	91.9	Very high	91.9	Very high	24 Å²	24	41.7 Å²	41.7	11%	0.111	22%	0.223	C	C	.	.			trans	-58	125.7	-177.8	-70.2	-110.6	0	0	0	112.3	Q241 H260 I291 S318 K319	Q241-H289 WeakPolarHBondContact CB-CE1 3.24Å; H260-H289 AromaticContact CD2-CG 3.91Å; H260-H289 AromaticContact CD2-ND1 3.35Å; H260-H289 PolarHBondContact CD2-ND1 2.77Å; H260-H289 VanDerWaalsContact CD2-ND1 3.35Å; H260-H289 AromaticContact CE1-ND1 3.87Å; H260-H289 AromaticContact CG-ND1 3.98Å; H260-H289 AromaticContact NE2-CG 3.9Å; H260-H289 AromaticContact NE2-ND1 3.25Å; H260-H289 PolarHBondContact NE2-ND1 3.32Å; H289-I291 HydrophobicContact CB-CG2 4.36Å; H289-I291 WeakPolarHBondContact O-CG2 3.39Å; H289-S318 WeakPolarHBondContact O-CA 3.47Å; H289-S318 PolarHBondContact O-OG 3.22Å; H289-K319 PolarHBondContact O-N 3.29Å
290	V	94.7	Very high	91.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	133.6	159.1	-171.6	0	0	0	0	107.6	P259 H260 A269 H286 K288 L316 G317	P259-V290 HydrophobicContact CB-CB 4.35Å; P259-V290 HydrophobicContact CB-CG1 4.01Å; H260-V290 WeakPolarHBondContact CA-O 3.43Å; H260-V290 PolarHBondContact N-O 2.94Å; A269-V290 HydrophobicContact CB-CG1 4.31Å; H286-V290 HydrophobicContact CB-CG2 3.99Å; K288-V290 PolarHBondContact O-N 3.4Å; V290-L316 HydrophobicContact CG1-CB 3.96Å; V290-L316 HydrophobicContact CG1-CD2 4.24Å; V290-L316 HydrophobicContact CG1-CG 4.47Å; V290-G317 WeakPolarHBondContact CA-O 3.2Å; V290-G317 WeakPolarHBondContact CG1-O 3.36Å
291	I	94.5	Very high	91.8	Very high	8 Å²	8	42 Å²	42	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	-16.4	-176.8	75.6	169.1	0	0	0	114.2	S242 M245 R246 H289 G317 K319 V345	S242-I291 VanDerWaalsContact OG-CG2 3.23Å; S242-I291 WeakPolarHBondContact OG-CG2 3.31Å; M245-I291 CarbonylContact C-O 3.34Å; M245-I291 WeakPolarHBondContact CA-O 3.48Å; R246-I291 PolarHBondContact N-O 2.91Å; H289-I291 HydrophobicContact CB-CG2 4.36Å; H289-I291 WeakPolarHBondContact O-CG2 3.39Å; I291-G317 PolarHBondContact N-O 2.79Å; I291-K319 HydrophobicContact CG2-CD 4.29Å; I291-K319 HydrophobicContact CG2-CG 3.94Å; I291-V345 WeakPolarHBondContact CD1-O 3.31Å
292	C	95.7	Very high	90.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	137.1	175.1	58.6	0	0	0	0	111.4	R246 L316 G317	R246-C292 HydrophobicContact CB-CB 3.93Å; R246-C292 HydrophobicContact CG-CB 4.22Å; C292-L316 WeakPolarHBondContact O-CA 3.46Å; C292-G317 PolarHBondContact N-O 2.98Å; C292-G317 PolarHBondContact O-N 3.36Å; C292-G317 VanDerWaalsContact SG-CA 3.59Å
293	A	96.9	Very high	89.3	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.9	174.9	0	0	0	0	0	109.4	R246 S248 A257 L314 A315 L316	R246-A293 PolarHBondContact O-N 3.09Å; S248-A293 VanDerWaalsContact CB-O 3.27Å; S248-A293 WeakPolarHBondContact CB-O 3.48Å; A257-A293 HydrophobicContact CB-CB 4.01Å; A293-L314 HydrophobicContact CB-CD1 4.24Å; A293-A315 WeakPolarHBondContact CA-O 3.23Å; A293-L316 HydrophobicContact CB-CD2 3.81Å
294	R	97.1	Very high	87.5	Confident	33 Å²	33	49.5 Å²	49.5	13%	0.125	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	109.4	177.9	-72	-72.7	170.9	-109.9	16.7	110.8	L247 L314 A315 D347 L348 W350	L247-R294 PolarHBondContact O-NH1 2.98Å; R294-L314 VanDerWaalsContact C-CD1 3.48Å; R294-A315 PolarHBondContact N-O 2.89Å; R294-A315 PolarHBondContact O-N 3.34Å; R294-D347 IonicContact NE-OD1 3.44Å; R294-L348 HydrophobicContact CB-CB 4.12Å; R294-L348 HydrophobicContact CG-CB 3.68Å; R294-L348 WeakPolarHBondContact CG-O 3.46Å; R294-L348 PolarHBondContact NE-O 3.42Å; R294-W350 PolarHBondContact O-NE1 2.95Å
295	Y	96.4	Very high	85.6	Confident	16 Å²	16	49.8 Å²	49.8	6%	0.063	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	151.2	167.7	-79	-90.3	0	0	0	110.6	S248 W249 S250 T255 A257 V312 C313 L314	S248-Y295 WeakPolarHBondContact O-CD2 3.3Å; S248-Y295 VanDerWaalsContact O-CE2 3.32Å; S248-Y295 WeakPolarHBondContact O-CE2 3.41Å; S248-Y295 PolarHBondContact OG-N 2.72Å; W249-Y295 WeakPolarHBondContact O-CB 3.44Å; W249-Y295 WeakPolarHBondContact O-CD2 3.4Å; S250-Y295 VanDerWaalsContact CB-CE1 3.46Å; T255-Y295 PolarHBondContact OG1-OH 2.83Å; A257-Y295 HydrophobicContact CB-CD2 4.19Å; A257-Y295 HydrophobicContact CB-CE2 3.38Å; Y295-V312 HydrophobicContact CD1-CB 4.14Å; Y295-V312 HydrophobicContact CD1-CG2 4.2Å; Y295-V312 HydrophobicContact CE1-CB 4.26Å; Y295-V312 HydrophobicContact CE1-CG2 3.79Å; Y295-C313 CarbonylContact C-O 3.51Å; Y295-C313 WeakPolarHBondContact CA-O 3.46Å; Y295-C313 WeakPolarHBondContact CD1-O 3.4Å; Y295-L314 HydrophobicContact CD1-CB 3.95Å; Y295-L314 HydrophobicContact CD1-CD1 4.38Å; Y295-L314 HydrophobicContact CD2-CD1 3.87Å; Y295-L314 HydrophobicContact CE1-CB 4Å; Y295-L314 HydrophobicContact CE1-CD2 4.21Å; Y295-L314 HydrophobicContact CE2-CD1 4.11Å; Y295-L314 HydrophobicContact CE2-CD2 4.19Å; Y295-L314 HydrophobicContact CG-CB 4.41Å; Y295-L314 HydrophobicContact CG-CD1 4.03Å
296	N	94.5	Very high	83.6	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.021	26%	0.255	C	S	.	.			trans	-65.1	136.1	167.7	-167.3	-74.3	0	0	0	108.8	N298 C313 W350 G354	N296-N298 PolarHBondContact O-N 3.26Å; N296-N298 PolarHBondContact OD1-N 3.37Å; N296-C313 HydrophobicContact CB-CB 3.87Å; N296-C313 PolarHBondContact N-O 3.03Å; N296-W350 HydrophobicContact CB-CD2 4.36Å; N296-W350 HydrophobicContact CB-CZ2 4.45Å; N296-W350 VanDerWaalsContact ND2-CE3 3.27Å; N296-W350 VanDerWaalsContact ND2-CZ3 3.33Å; N296-W350 WeakPolarHBondContact ND2-CZ3 3.41Å; N296-G354 VanDerWaalsContact ND2-CA 3.35Å; N296-G354 WeakPolarHBondContact ND2-CA 3.35Å; N296-G354 PolarHBondContact ND2-O 3.35Å; N296-G354 WeakPolarHBondContact OD1-CA 3.29Å
297	P	91.3	Very high	81.4	Confident	49 Å²	49	53.8 Å²	53.8	32%	0.318	30%	0.295	S	S	.	.	S	Bend	trans	-75	15.5	-176.4	30.5	-35.5	0	0	0	113.7	L251 W350 S351	L251-P297 VanDerWaalsContact CD2-O 3.27Å; L251-P297 WeakPolarHBondContact CD2-O 3.33Å; P297-W350 VanDerWaalsContact CD-CB 3.49Å; P297-W350 HydrophobicContact CG-CB 4.19Å; P297-S351 WeakPolarHBondContact CG-O 3.49Å
298	N	90.7	Very high	79.5	Confident	25 Å²	25	50.4 Å²	50.4	13%	0.134	29%	0.289	C	S	.	.	S	Bend	trans	-133.5	142	177	-65.9	-89.1	0	0	0	110.9	N296 L300 S352 D353 G354 P379	N296-N298 PolarHBondContact O-N 3.26Å; N296-N298 PolarHBondContact OD1-N 3.37Å; N298-L300 HydrophobicContact CB-CD2 3.82Å; N298-S352 PolarHBondContact ND2-O 3.39Å; N298-D353 VanDerWaalsContact ND2-C 3.29Å; N298-G354 PolarHBondContact ND2-N 3.2Å; N298-P379 HydrophobicContact CB-CB 3.77Å; N298-P379 WeakPolarHBondContact OD1-CB 3.38Å
299	V	90	Very high	78	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.012	30%	0.298	C	S	.	.			trans	-76.7	133.7	159.1	-180	0	0	0	0	107.6	L251 D252 V312 P379 W380 V385	L251-V299 HydrophobicContact CB-CG2 4.35Å; L251-V299 HydrophobicContact CD2-CG2 4.31Å; D252-V299 HydrophobicContact CB-CG2 4.06Å; V299-V312 HydrophobicContact CG2-CG1 4.29Å; V299-P379 CarbonylContact O-C 3.56Å; V299-W380 HydrophobicContact CB-CB 4.29Å; V299-W380 HydrophobicContact CB-CD2 4.07Å; V299-W380 HydrophobicContact CB-CE3 4.33Å; V299-W380 HydrophobicContact CB-CG 4.04Å; V299-W380 HydrophobicContact CG1-CD2 3.66Å; V299-W380 HydrophobicContact CG1-CE3 4Å; V299-W380 HydrophobicContact CG1-CG 4Å; V299-W380 HydrophobicContact CG1-CZ2 4.24Å; V299-W380 HydrophobicContact CG1-CZ3 4.42Å; V299-W380 PolarHBondContact O-N 2.74Å; V299-V385 HydrophobicContact CB-CG2 4.3Å; V299-V385 HydrophobicContact CG2-CG2 4.13Å
300	L	87.7	Confident	77	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.6	-171.7	-55.2	-175.5	0	0	0	112.4	N298 A311 C313 L376 T378 P379	N298-L300 HydrophobicContact CB-CD2 3.82Å; L300-A311 PolarHBondContact N-O 2.91Å; L300-A311 PolarHBondContact O-N 2.84Å; L300-C313 HydrophobicContact CD1-CB 4.3Å; L300-L376 HydrophobicContact CD1-CB 3.81Å; L300-L376 WeakPolarHBondContact CD1-O 3.43Å; L300-T378 CarbonylContact C-O 3.49Å; L300-T378 WeakPolarHBondContact CA-O 3.41Å; L300-P379 HydrophobicContact CD2-CB 4.26Å
301	R	84	Confident	76.3	Confident	105 Å²	105	50.1 Å²	50.1	40%	0.396	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	132.5	172.7	174	155	38.7	-145.1	-13	109.4	G377 T378 E384	R301-G377 WeakPolarHBondContact O-CA 3.49Å; R301-T378 PolarHBondContact N-O 2.66Å; R301-T378 PolarHBondContact O-N 2.95Å; R301-E384 IonicContact CZ-OE1 3.58Å; R301-E384 VanDerWaalsContact CZ-OE1 3.25Å; R301-E384 IonicContact NH1-OE1 3.57Å; R301-E384 PolarHBondContact NH1-OE1 2.93Å; R301-E384 IonicContact NH2-OE1 2.72Å; R301-E384 PolarHBondContact NH2-OE1 3.35Å; R301-E384 IonicContact NH2-OE2 3.93Å; R301-E384 PolarHBondContact NH2-OE2 2.96Å
302	K	67.9	Low	76	Confident	111 Å²	111	50 Å²	50	48%	0.483	31%	0.306	S	S	.	.			trans	-76.5	146.6	171.7	-152.2	-173	-171.3	-155.1	0	109.2	D304	K302-D304 HydrophobicContact CD-CB 4.11Å; K302-D304 WeakPolarHBondContact CE-OD2 3.43Å; K302-D304 HydrophobicContact CG-CB 4.48Å; K302-D304 IonicContact NZ-OD2 2.63Å; K302-D304 PolarHBondContact NZ-OD2 3.07Å
303	Q	58.5	Low	75.8	Confident	117 Å²	117	50 Å²	50	55%	0.547	31%	0.306	S	S	.	.	S	Bend	trans	-78.2	-27.2	176.4	-69.8	-170.8	-24.8	0	0	112.7	G305	Q303-G305 PolarHBondContact O-N 2.88Å
304	D	56.1	Low	75.7	Confident	93 Å²	93	50.2 Å²	50.2	50%	0.497	31%	0.308	S	S	.	.	S	Bend	trans	-65	114.5	174.4	-41	-1.2	0	0	0	109.2	K302 S306	K302-D304 HydrophobicContact CD-CB 4.11Å; K302-D304 WeakPolarHBondContact CE-OD2 3.43Å; K302-D304 HydrophobicContact CG-CB 4.48Å; K302-D304 IonicContact NZ-OD2 2.63Å; K302-D304 PolarHBondContact NZ-OD2 3.07Å; D304-S306 PolarHBondContact O-N 2.82Å; D304-S306 PolarHBondContact O-OG 2.79Å; D304-S306 VanDerWaalsContact O-OG 3.11Å
305	G	49.1	Very low	75.7	Confident	84 Å²	84	48.7 Å²	48.7	87%	0.866	30%	0.302	S	S	*	.			trans	-64.3	14.3	-168.2	0	0	0	0	0	117.7	Q303 G307	Q303-G305 PolarHBondContact O-N 2.88Å; G305-G307 PolarHBondContact O-N 2.99Å
306	S	44.1	Very low	75.7	Confident	62 Å²	62	47.9 Å²	47.9	43%	0.434	30%	0.299	S	S	.	.	S	Bend	trans	-59.1	122.8	160.2	52.4	0	0	0	0	109.9	D304 I308	D304-S306 PolarHBondContact O-N 2.82Å; D304-S306 PolarHBondContact O-OG 2.79Å; D304-S306 VanDerWaalsContact O-OG 3.11Å; S306-I308 PolarHBondContact O-N 3.22Å; S306-I308 WeakPolarHBondContact OG-CD1 3.36Å
307	G	45.7	Very low	75.8	Confident	88 Å²	88	47.7 Å²	47.7	91%	0.907	30%	0.298	S	S	*	.			trans	-70.9	52.6	-178.6	0	0	0	0	0	114.7	G305	G305-G307 PolarHBondContact O-N 2.99Å
308	I	51.6	Low	76	Confident	108 Å²	108	45.4 Å²	45.4	55%	0.554	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-78.8	138.2	-179.5	-58.3	175.8	0	0	0	108.6	S306	S306-I308 PolarHBondContact O-N 3.22Å; S306-I308 WeakPolarHBondContact OG-CD1 3.36Å
309	P	60.4	Low	76.1	Confident	110 Å²	110	47.6 Å²	47.6	71%	0.714	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-58.2	158.1	173.1	25.3	-35.4	0	0	0	112.2	A311	P309-A311 PolarHBondContact O-N 2.98Å
310	G	69.8	Low	76.3	Confident	19 Å²	19	48.1 Å²	48.1	20%	0.196	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-54.9	133	-174.9	0	0	0	0	0	113	W380	G310-W380 VanDerWaalsContact CA-CZ2 3.42Å
311	A	81	Confident	76.7	Confident	13 Å²	13	52.7 Å²	52.7	11%	0.107	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-89.9	140.9	178	0	0	0	0	0	110.5	L300 P309 T328 A329	L300-A311 PolarHBondContact N-O 2.91Å; L300-A311 PolarHBondContact O-N 2.84Å; P309-A311 PolarHBondContact O-N 2.98Å; A311-T328 WeakPolarHBondContact CA-OG1 3.39Å; A311-A329 HydrophobicContact CB-CB 3.85Å
312	V	87.6	Confident	77.3	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.03	29%	0.292	C	S	.	.			trans	-105.2	140	171.1	-66.4	0	0	0	0	109.4	D252 Y295 V299 S327 T328	D252-V312 HydrophobicContact CB-CG1 4.49Å; Y295-V312 HydrophobicContact CD1-CB 4.14Å; Y295-V312 HydrophobicContact CD1-CG2 4.2Å; Y295-V312 HydrophobicContact CE1-CB 4.26Å; Y295-V312 HydrophobicContact CE1-CG2 3.79Å; V299-V312 HydrophobicContact CG2-CG1 4.29Å; V312-S327 WeakPolarHBondContact O-CA 3.32Å; V312-T328 HydrophobicContact CG2-CG2 3.59Å; V312-T328 PolarHBondContact N-OG1 3.28Å; V312-T328 PolarHBondContact O-N 3.28Å
313	C	91	Very high	78.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	148.1	177.2	-75.7	0	0	0	0	110.8	Y295 N296 L300 W326 S327	Y295-C313 CarbonylContact C-O 3.51Å; Y295-C313 WeakPolarHBondContact CA-O 3.46Å; Y295-C313 WeakPolarHBondContact CD1-O 3.4Å; N296-C313 HydrophobicContact CB-CB 3.87Å; N296-C313 PolarHBondContact N-O 3.03Å; L300-C313 HydrophobicContact CD1-CB 4.3Å; C313-W326 CarbonylContact C-O 3.54Å; C313-W326 VanDerWaalsContact CA-O 3.23Å; C313-W326 WeakPolarHBondContact CA-O 3.32Å; C313-S327 VanDerWaalsContact SG-CB 3.56Å; C313-S327 PolarHBondContact SG-OG 2.86Å
314	L	94.5	Very high	80.4	Confident	5 Å²	5	37 Å²	37	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	123.5	-172.5	172.2	57.6	0	0	0	110.8	A257 L271 L283 A293 R294 Y295 L316 V325 W326	A257-L314 HydrophobicContact CB-CD1 4.07Å; A257-L314 HydrophobicContact CB-CD2 3.66Å; L271-L314 HydrophobicContact CD2-CD2 3.84Å; L283-L314 HydrophobicContact CD1-CD2 3.61Å; A293-L314 HydrophobicContact CB-CD1 4.24Å; R294-L314 VanDerWaalsContact C-CD1 3.48Å; Y295-L314 HydrophobicContact CD1-CB 3.95Å; Y295-L314 HydrophobicContact CD1-CD1 4.38Å; Y295-L314 HydrophobicContact CD2-CD1 3.87Å; Y295-L314 HydrophobicContact CE1-CB 4Å; Y295-L314 HydrophobicContact CE1-CD2 4.21Å; Y295-L314 HydrophobicContact CE2-CD1 4.11Å; Y295-L314 HydrophobicContact CE2-CD2 4.19Å; Y295-L314 HydrophobicContact CG-CB 4.41Å; Y295-L314 HydrophobicContact CG-CD1 4.03Å; L314-L316 HydrophobicContact CD1-CD2 4.18Å; L314-L316 HydrophobicContact CD2-CD2 4.19Å; L314-L316 HydrophobicContact CG-CD2 4.02Å; L314-V325 CarbonylContact O-C 3.5Å; L314-V325 WeakPolarHBondContact O-CA 3.23Å; L314-W326 PolarHBondContact N-O 2.8Å; L314-W326 PolarHBondContact O-N 3.36Å
315	A	97.1	Very high	82.3	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	138.6	170.5	0	0	0	0	0	110.9	A293 R294 S324 V325 L348 W350 L357	A293-A315 WeakPolarHBondContact CA-O 3.23Å; R294-A315 PolarHBondContact N-O 2.89Å; R294-A315 PolarHBondContact O-N 3.34Å; A315-S324 CarbonylContact C-O 3.59Å; A315-S324 WeakPolarHBondContact CA-O 3.2Å; A315-V325 HydrophobicContact CB-CG2 4.38Å; A315-L348 HydrophobicContact CB-CD1 3.91Å; A315-W350 HydrophobicContact CB-CZ2 3.89Å; A315-L357 HydrophobicContact CB-CD1 3.88Å; A315-L357 HydrophobicContact CB-CD2 3.65Å; A315-L357 HydrophobicContact CB-CG 4.44Å
316	L	97.2	Very high	84.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.2	175.9	-58.7	-178	0	0	0	110	A269 L283 V290 C292 A293 L314 V323 S324	A269-L316 HydrophobicContact CB-CD1 3.73Å; A269-L316 HydrophobicContact CB-CD2 3.8Å; A269-L316 HydrophobicContact CB-CG 4.43Å; L283-L316 HydrophobicContact CB-CD1 3.88Å; L283-L316 HydrophobicContact CD1-CD1 3.96Å; V290-L316 HydrophobicContact CG1-CB 3.96Å; V290-L316 HydrophobicContact CG1-CD2 4.24Å; V290-L316 HydrophobicContact CG1-CG 4.47Å; C292-L316 WeakPolarHBondContact O-CA 3.46Å; A293-L316 HydrophobicContact CB-CD2 3.81Å; L314-L316 HydrophobicContact CD1-CD2 4.18Å; L314-L316 HydrophobicContact CD2-CD2 4.19Å; L314-L316 HydrophobicContact CG-CD2 4.02Å; L316-V323 WeakPolarHBondContact O-CA 3.44Å; L316-S324 PolarHBondContact N-O 2.65Å; L316-S324 PolarHBondContact O-N 3.5Å
317	G	96.2	Very high	86.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	141.7	176	0	0	0	0	0	111.9	V290 I291 C292	V290-G317 WeakPolarHBondContact CA-O 3.2Å; V290-G317 WeakPolarHBondContact CG1-O 3.36Å; I291-G317 PolarHBondContact N-O 2.79Å; C292-G317 PolarHBondContact N-O 2.98Å; C292-G317 PolarHBondContact O-N 3.36Å; C292-G317 VanDerWaalsContact SG-CA 3.59Å
318	S	95.2	Very high	88.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.4	-165.2	173.1	0	0	0	0	114.4	H286 K288 H289 D320 R321 S322 V345	H286-S318 WeakPolarHBondContact ND1-CB 3.49Å; K288-S318 PolarHBondContact O-OG 3.13Å; H289-S318 WeakPolarHBondContact O-CA 3.47Å; H289-S318 PolarHBondContact O-OG 3.22Å; S318-D320 WeakPolarHBondContact CB-OD1 3.48Å; S318-D320 PolarHBondContact O-N 3.33Å; S318-D320 VanDerWaalsContact O-N 3.14Å; S318-D320 PolarHBondContact OG-N 2.85Å; S318-D320 PolarHBondContact OG-OD1 2.69Å; S318-D320 VanDerWaalsContact OG-OD1 3.06Å; S318-D320 PolarHBondContact OG-OD2 3.33Å; S318-R321 PolarHBondContact O-N 2.65Å; S318-S322 PolarHBondContact N-O 2.93Å; S318-V345 PolarHBondContact O-N 3.4Å
319	K	94.5	Very high	89.5	Confident	71 Å²	71	26.4 Å²	26.4	31%	0.309	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-7.9	170.8	-78.7	-172.1	166.7	-163	0	114.5	Q241 K288 H289 I291 R321 S344	Q241-K319 WeakPolarHBondContact O-CE 3.32Å; Q241-K319 PolarHBondContact O-NZ 2.93Å; K288-K319 HydrophobicContact CB-CB 3.88Å; K288-K319 HydrophobicContact CD-CB 4.27Å; K288-K319 WeakPolarHBondContact CD-O 3.5Å; H289-K319 PolarHBondContact O-N 3.29Å; I291-K319 HydrophobicContact CG2-CD 4.29Å; I291-K319 HydrophobicContact CG2-CG 3.94Å; K319-R321 VanDerWaalsContact C-N 3.28Å; K319-S344 WeakPolarHBondContact CA-OG 3.46Å; K319-S344 WeakPolarHBondContact CG-OG 3.22Å
320	D	93.9	Very high	90.3	Very high	14 Å²	14	23.3 Å²	23.3	8%	0.075	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	13.3	172.4	63.2	24.5	0	0	0	113.9	H286 R287 K288 S318 S322	H286-D320 WeakPolarHBondContact CA-OD2 3.35Å; H286-D320 WeakPolarHBondContact CB-OD2 3.36Å; H286-D320 IonicContact CG-OD2 3.39Å; H286-D320 IonicContact ND1-OD1 3.51Å; H286-D320 PolarHBondContact ND1-OD1 3.43Å; H286-D320 IonicContact ND1-OD2 3.54Å; H286-D320 PolarHBondContact ND1-OD2 3.26Å; H286-D320 VanDerWaalsContact ND1-OD2 3.1Å; R287-D320 HydrophobicContact CB-CB 4.03Å; R287-D320 PolarHBondContact N-OD2 3Å; K288-D320 HydrophobicContact CB-CB 3.99Å; K288-D320 HydrophobicContact CD-CB 4.48Å; K288-D320 HydrophobicContact CG-CB 4.15Å; K288-D320 PolarHBondContact N-OD2 2.93Å; S318-D320 WeakPolarHBondContact CB-OD1 3.48Å; S318-D320 PolarHBondContact O-N 3.33Å; S318-D320 VanDerWaalsContact O-N 3.14Å; S318-D320 PolarHBondContact OG-N 2.85Å; S318-D320 PolarHBondContact OG-OD1 2.69Å; S318-D320 VanDerWaalsContact OG-OD1 3.06Å; S318-D320 PolarHBondContact OG-OD2 3.33Å; D320-S322 VanDerWaalsContact CG-OG 3.27Å; D320-S322 PolarHBondContact O-N 3.11Å; D320-S322 VanDerWaalsContact OD1-CB 3.28Å; D320-S322 WeakPolarHBondContact OD1-CB 3.32Å; D320-S322 PolarHBondContact OD1-N 2.84Å; D320-S322 PolarHBondContact OD1-OG 3.46Å
321	R	95.3	Very high	90.9	Very high	101 Å²	101	34.3 Å²	34.3	38%	0.381	18%	0.179	S	C	.	.	S	Bend	trans	67.7	7.2	-179.2	-49.5	144.5	167.1	179.5	-6.3	114.9	S318 K319 D339 L340 F341 T342 N343	S318-R321 PolarHBondContact O-N 2.65Å; K319-R321 VanDerWaalsContact C-N 3.28Å; R321-D339 VanDerWaalsContact CD-OD1 3.22Å; R321-D339 WeakPolarHBondContact CD-OD1 3.28Å; R321-D339 IonicContact CZ-OD1 2.79Å; R321-D339 IonicContact NE-OD1 2.64Å; R321-D339 IonicContact NH1-OD1 2.94Å; R321-D339 PolarHBondContact NH1-OD1 2.79Å; R321-L340 PolarHBondContact O-N 2.79Å; R321-F341 HydrophobicContact CB-CB 4.24Å; R321-F341 VanDerWaalsContact CB-O 3.24Å; R321-F341 WeakPolarHBondContact CB-O 3.42Å; R321-F341 WeakPolarHBondContact CD-O 3.33Å; R321-F341 WeakPolarHBondContact CG-O 3.3Å; R321-T342 VanDerWaalsContact CZ-O 3.3Å; R321-T342 PolarHBondContact NE-O 3.21Å; R321-T342 PolarHBondContact NH2-O 3.01Å; R321-N343 VanDerWaalsContact CG-O 3.26Å; R321-N343 WeakPolarHBondContact CG-O 3.27Å
322	S	95.9	Very high	91.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.213	C	C	.	.			trans	-105	150	-176.8	73.9	0	0	0	0	113.4	H286 S318 D320 V337 H338	H286-S322 PolarHBondContact CE1-O 3.46Å; H286-S322 PolarHBondContact CE1-OG 3.01Å; H286-S322 PolarHBondContact ND1-OG 3.29Å; S318-S322 PolarHBondContact N-O 2.93Å; D320-S322 VanDerWaalsContact CG-OG 3.27Å; D320-S322 PolarHBondContact O-N 3.11Å; D320-S322 VanDerWaalsContact OD1-CB 3.28Å; D320-S322 WeakPolarHBondContact OD1-CB 3.32Å; D320-S322 PolarHBondContact OD1-N 2.84Å; D320-S322 PolarHBondContact OD1-OG 3.46Å; S322-V337 WeakPolarHBondContact CA-O 3.5Å; S322-V337 WeakPolarHBondContact CB-O 3.39Å; S322-H338 WeakPolarHBondContact CB-ND1 3.43Å
323	V	96.9	Very high	91.2	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.4	170.8	178.4	0	0	0	0	108.1	L316 V337 L340 V345 L348 L357 A359 M369	L316-V323 WeakPolarHBondContact O-CA 3.44Å; V323-V337 PolarHBondContact N-O 3.41Å; V323-V337 VanDerWaalsContact N-O 3.15Å; V323-V337 PolarHBondContact O-N 3.45Å; V323-L340 HydrophobicContact CB-CD2 4.45Å; V323-L340 HydrophobicContact CG2-CD2 4.03Å; V323-V345 HydrophobicContact CG2-CG1 4.41Å; V323-V345 HydrophobicContact CG2-CG2 3.97Å; V323-L348 HydrophobicContact CG1-CD2 4.2Å; V323-L348 HydrophobicContact CG2-CD2 4.26Å; V323-L357 HydrophobicContact CG1-CD2 4.27Å; V323-A359 HydrophobicContact CG2-CB 4.2Å; V323-M369 HydrophobicContact CG1-CE 4.26Å; V323-M369 HydrophobicContact CG1-SD 4.31Å
324	S	96.2	Very high	91	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.021	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.7	172	65	0	0	0	0	111.5	H286 A315 L316 W326 V335	H286-S324 PolarHBondContact NE2-OG 3.07Å; A315-S324 CarbonylContact C-O 3.59Å; A315-S324 WeakPolarHBondContact CA-O 3.2Å; L316-S324 PolarHBondContact N-O 2.65Å; L316-S324 PolarHBondContact O-N 3.5Å; S324-W326 PolarHBondContact OG-NE1 3.32Å; S324-V335 CarbonylContact C-O 3.51Å; S324-V335 WeakPolarHBondContact CA-O 3.43Å
325	V	95.2	Very high	90.9	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.9	178	-177	0	0	0	0	108.9	L314 A315 A333 R334 V335 W350 L357 F371	L314-V325 CarbonylContact O-C 3.5Å; L314-V325 WeakPolarHBondContact O-CA 3.23Å; A315-V325 HydrophobicContact CB-CG2 4.38Å; V325-A333 CarbonylContact O-C 3.6Å; V325-R334 WeakPolarHBondContact O-CA 3.48Å; V325-R334 WeakPolarHBondContact O-CB 3.48Å; V325-R334 PolarHBondContact O-N 2.91Å; V325-V335 HydrophobicContact CB-CB 4.29Å; V325-V335 PolarHBondContact N-O 2.9Å; V325-V335 PolarHBondContact O-N 2.7Å; V325-W350 HydrophobicContact CG1-CH2 4.08Å; V325-W350 HydrophobicContact CG1-CZ2 4.17Å; V325-L357 HydrophobicContact CG2-CD2 3.86Å; V325-F371 HydrophobicContact CG2-CZ 4.19Å
326	W	93.5	Very high	90.7	Very high	33 Å²	33	57 Å²	57	13%	0.125	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	161.7	-175.5	-59.9	78.6	0	0	0	110.3	L283 V284 C313 L314 S324 A333	L283-W326 HydrophobicContact CB-CD2 4.39Å; L283-W326 HydrophobicContact CB-CZ2 4.25Å; L283-W326 HydrophobicContact CD1-CB 4.35Å; L283-W326 HydrophobicContact CD1-CD2 4.25Å; L283-W326 HydrophobicContact CD1-CG 4.03Å; L283-W326 HydrophobicContact CD2-CD2 4.04Å; L283-W326 HydrophobicContact CD2-CE3 3.78Å; L283-W326 HydrophobicContact CD2-CZ3 4.15Å; L283-W326 HydrophobicContact CG-CD2 4.46Å; V284-W326 WeakPolarHBondContact O-CH2 3.4Å; C313-W326 CarbonylContact C-O 3.54Å; C313-W326 VanDerWaalsContact CA-O 3.23Å; C313-W326 WeakPolarHBondContact CA-O 3.32Å; L314-W326 PolarHBondContact N-O 2.8Å; L314-W326 PolarHBondContact O-N 3.36Å; S324-W326 PolarHBondContact OG-NE1 3.32Å; W326-A333 HydrophobicContact CD2-CB 3.94Å; W326-A333 HydrophobicContact CE3-CB 4.14Å; W326-A333 HydrophobicContact CH2-CB 4.12Å; W326-A333 HydrophobicContact CZ2-CB 3.9Å; W326-A333 HydrophobicContact CZ3-CB 4.23Å
327	S	88.4	Confident	90.6	Very high	22 Å²	22	58.1 Å²	58.1	15%	0.154	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	139.8	174.7	-178.2	0	0	0	0	110.2	V312 C313 A329 G330	V312-S327 WeakPolarHBondContact O-CA 3.32Å; C313-S327 VanDerWaalsContact SG-CB 3.56Å; C313-S327 PolarHBondContact SG-OG 2.86Å; S327-A329 PolarHBondContact O-N 2.99Å; S327-A329 VanDerWaalsContact O-N 3.13Å; S327-A329 PolarHBondContact OG-N 3.5Å; S327-G330 PolarHBondContact O-N 2.78Å; S327-G330 VanDerWaalsContact O-N 3.08Å; S327-G330 VanDerWaalsContact O-O 3.09Å
328	T	83.4	Confident	90.5	Very high	88 Å²	88	62.4 Å²	62.4	54%	0.54	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.2	175.3	53.1	0	0	0	0	113.5	A311 V312 G330	A311-T328 WeakPolarHBondContact CA-OG1 3.39Å; V312-T328 HydrophobicContact CG2-CG2 3.59Å; V312-T328 PolarHBondContact N-OG1 3.28Å; V312-T328 PolarHBondContact O-N 3.28Å; T328-G330 PolarHBondContact O-N 2.56Å
329	A	76.8	Confident	90.4	Very high	70 Å²	70	66.7 Å²	66.7	58%	0.579	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-4.2	170.4	0	0	0	0	0	114.5	A311 S327	A311-A329 HydrophobicContact CB-CB 3.85Å; S327-A329 PolarHBondContact O-N 2.99Å; S327-A329 VanDerWaalsContact O-N 3.13Å; S327-A329 PolarHBondContact OG-N 3.5Å
330	G	77	Confident	90.3	Very high	44 Å²	44	64.3 Å²	64.3	45%	0.454	32%	0.318	S	S	.	.			trans	-151.3	158.6	-177.6	0	0	0	0	0	114.7	S327 T328	S327-G330 PolarHBondContact O-N 2.78Å; S327-G330 VanDerWaalsContact O-N 3.08Å; S327-G330 VanDerWaalsContact O-O 3.09Å; T328-G330 PolarHBondContact O-N 2.56Å
331	R	82	Confident	90.3	Very high	251 Å²	251	63.8 Å²	63.8	95%	0.947	32%	0.315	S	S	*	.	S	Bend	trans	-94.4	13.8	178.2	-61.3	-171.6	-179.9	-156.2	0.9	114.2
332	R	85.4	Confident	90.2	Very high	218 Å²	218	63.8 Å²	63.8	82%	0.823	33%	0.327	S	S	*	.	S	Bend	trans	-138.9	153.9	-179.3	-69.3	-177.8	176.2	170.2	-1.6	108.7	R334	R332-R334 PolarHBondContact O-N 3.27Å
333	A	89.4	Confident	90.1	Very high	30 Å²	30	67.3 Å²	67.3	25%	0.248	35%	0.345	C	S	.	.			trans	-54.9	137.6	167.4	0	0	0	0	0	110	V325 W326 V336	V325-A333 CarbonylContact O-C 3.6Å; W326-A333 HydrophobicContact CD2-CB 3.94Å; W326-A333 HydrophobicContact CE3-CB 4.14Å; W326-A333 HydrophobicContact CH2-CB 4.12Å; W326-A333 HydrophobicContact CZ2-CB 3.9Å; W326-A333 HydrophobicContact CZ3-CB 4.23Å; A333-V336 HydrophobicContact CB-CG2 3.62Å
334	R	87.8	Confident	89.9	Confident	150 Å²	150	67.7 Å²	67.7	57%	0.566	35%	0.348	S	S	*	.	S	Bend	trans	-76.8	-33.9	175.5	-167.9	62.6	162.6	168.9	-1.8	111	V325 R332 E375 L376	V325-R334 WeakPolarHBondContact O-CA 3.48Å; V325-R334 WeakPolarHBondContact O-CB 3.48Å; V325-R334 PolarHBondContact O-N 2.91Å; R332-R334 PolarHBondContact O-N 3.27Å; R334-E375 VanDerWaalsContact CZ-O 3.27Å; R334-E375 PolarHBondContact NE-O 3.09Å; R334-E375 PolarHBondContact NH2-O 3.39Å; R334-L376 HydrophobicContact CG-CD2 4.45Å
335	V	91.6	Very high	89.9	Confident	32 Å²	32	67.5 Å²	67.5	19%	0.194	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	144.7	173.5	172.6	0	0	0	0	109.4	M1 S324 V325 V337 F371	M1-V335 HydrophobicContact CE-CG1 4.15Å; M1-V335 HydrophobicContact SD-CG1 3.87Å; M1-V335 HydrophobicContact SD-CG2 4.12Å; S324-V335 CarbonylContact C-O 3.51Å; S324-V335 WeakPolarHBondContact CA-O 3.43Å; V325-V335 HydrophobicContact CB-CB 4.29Å; V325-V335 PolarHBondContact N-O 2.9Å; V325-V335 PolarHBondContact O-N 2.7Å; V335-V337 HydrophobicContact CG1-CG2 3.71Å; V335-F371 HydrophobicContact CG2-CE1 4.02Å
336	V	93.8	Very high	89.9	Confident	70 Å²	70	67.9 Å²	67.9	42%	0.424	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.4	163.3	-174.2	0	0	0	0	107.5	A333 H338	A333-V336 HydrophobicContact CB-CG2 3.62Å; V336-H338 VanDerWaalsContact CG1-CE1 3.48Å; V336-H338 WeakPolarHBondContact CG1-CE1 3.47Å
337	V	94.9	Very high	90.1	Very high	23 Å²	23	66.3 Å²	66.3	14%	0.139	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	105.9	176.5	-169.8	0	0	0	0	108.4	M1 L3 S322 V323 V335 L340	M1-V337 HydrophobicContact CE-CG2 4.21Å; L3-V337 HydrophobicContact CD2-CG1 4.31Å; S322-V337 WeakPolarHBondContact CA-O 3.5Å; S322-V337 WeakPolarHBondContact CB-O 3.39Å; V323-V337 PolarHBondContact N-O 3.41Å; V323-V337 VanDerWaalsContact N-O 3.15Å; V323-V337 PolarHBondContact O-N 3.45Å; V335-V337 HydrophobicContact CG1-CG2 3.71Å; V337-L340 HydrophobicContact CG1-CB 4.19Å; V337-L340 HydrophobicContact CG1-CD1 3.99Å; V337-L340 HydrophobicContact CG1-CD2 4.35Å; V337-L340 HydrophobicContact CG1-CG 4.42Å
338	H	94.1	Very high	90.6	Very high	90 Å²	90	65.2 Å²	65.2	42%	0.417	34%	0.336	S	S	.	.			trans	-84.2	153.4	178.5	-65.6	-56.5	0	0	0	112.4	S322 V336 L340	S322-H338 WeakPolarHBondContact CB-ND1 3.43Å; V336-H338 VanDerWaalsContact CG1-CE1 3.48Å; V336-H338 WeakPolarHBondContact CG1-CE1 3.47Å; H338-L340 PolarHBondContact O-N 2.92Å
339	D	91.6	Very high	91.3	Very high	90 Å²	90	61.3 Å²	61.3	48%	0.481	31%	0.312	S	S	.	.	S	Bend	trans	46	37.8	177.7	-66.7	-80.9	0	0	0	114.3	R321 F341	R321-D339 VanDerWaalsContact CD-OD1 3.22Å; R321-D339 WeakPolarHBondContact CD-OD1 3.28Å; R321-D339 IonicContact CZ-OD1 2.79Å; R321-D339 IonicContact NE-OD1 2.64Å; R321-D339 IonicContact NH1-OD1 2.94Å; R321-D339 PolarHBondContact NH1-OD1 2.79Å; D339-F341 PolarHBondContact O-N 3.19Å
340	L	93.1	Very high	92.2	Very high	20 Å²	20	58.9 Å²	58.9	11%	0.105	29%	0.288	C	S	.	.			trans	-65.3	-19.9	177.7	-174.9	55.5	0	0	0	112.8	L3 K5 R321 V323 V337 H338 C367	L3-L340 HydrophobicContact CD1-CD1 4.29Å; L3-L340 HydrophobicContact CD2-CD1 4.26Å; K5-L340 PolarHBondContact NZ-O 3.34Å; R321-L340 PolarHBondContact O-N 2.79Å; V323-L340 HydrophobicContact CB-CD2 4.45Å; V323-L340 HydrophobicContact CG2-CD2 4.03Å; V337-L340 HydrophobicContact CG1-CB 4.19Å; V337-L340 HydrophobicContact CG1-CD1 3.99Å; V337-L340 HydrophobicContact CG1-CD2 4.35Å; V337-L340 HydrophobicContact CG1-CG 4.42Å; H338-L340 PolarHBondContact O-N 2.92Å; L340-C367 HydrophobicContact CD1-CB 4.27Å; L340-C367 HydrophobicContact CD2-CB 4.07Å; L340-C367 HydrophobicContact CG-CB 4.2Å
341	F	94.5	Very high	93.1	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.018	27%	0.267	C	S	.	.	S	Bend	trans	-137.8	156.1	-173.3	-69.5	-69.3	0	0	0	109.3	R321 D339 N343 V345 A359 S361 D363 S365 C367	R321-F341 HydrophobicContact CB-CB 4.24Å; R321-F341 VanDerWaalsContact CB-O 3.24Å; R321-F341 WeakPolarHBondContact CB-O 3.42Å; R321-F341 WeakPolarHBondContact CD-O 3.33Å; R321-F341 WeakPolarHBondContact CG-O 3.3Å; D339-F341 PolarHBondContact O-N 3.19Å; F341-N343 VanDerWaalsContact C-N 3.35Å; F341-N343 VanDerWaalsContact CB-O 3.31Å; F341-N343 WeakPolarHBondContact CB-O 3.41Å; F341-V345 HydrophobicContact CD2-CG2 3.86Å; F341-V345 HydrophobicContact CE2-CG2 4.19Å; F341-A359 HydrophobicContact CE2-CB 3.93Å; F341-A359 HydrophobicContact CZ-CB 4.02Å; F341-S361 VanDerWaalsContact CG-CB 3.45Å; F341-D363 WeakPolarHBondContact CA-OD2 3.45Å; F341-D363 VanDerWaalsContact CB-OD2 3.27Å; F341-D363 WeakPolarHBondContact CB-OD2 3.24Å; F341-S365 WeakPolarHBondContact CD1-OG 3.24Å; F341-S365 WeakPolarHBondContact CE1-O 3.33Å; F341-C367 HydrophobicContact CE1-CB 4.34Å; F341-C367 HydrophobicContact CE2-CB 4.37Å; F341-C367 HydrophobicContact CZ-CB 3.7Å
342	T	93	Very high	93.4	Very high	101 Å²	101	48 Å²	48	62%	0.62	24%	0.243	S	C	*	.	S	Bend	trans	-83.7	-20	173.4	59.1	0	0	0	0	111.2	R321 D363	R321-T342 VanDerWaalsContact CZ-O 3.3Å; R321-T342 PolarHBondContact NE-O 3.21Å; R321-T342 PolarHBondContact NH2-O 3.01Å; T342-D363 PolarHBondContact N-OD2 2.91Å; T342-D363 WeakPolarHBondContact OG1-CB 3.42Å; T342-D363 PolarHBondContact OG1-OD2 2.96Å
343	N	92.9	Very high	93.5	Very high	74 Å²	74	40 Å²	40	40%	0.396	22%	0.217	S	C	.	.	S	Bend	trans	-127.1	-177.5	177.8	-152.6	-14.9	0	0	0	112.2	R321 F341 S361 L362 D363	R321-N343 VanDerWaalsContact CG-O 3.26Å; R321-N343 WeakPolarHBondContact CG-O 3.27Å; F341-N343 VanDerWaalsContact C-N 3.35Å; F341-N343 VanDerWaalsContact CB-O 3.31Å; F341-N343 WeakPolarHBondContact CB-O 3.41Å; N343-S361 PolarHBondContact O-OG 2.83Å; N343-L362 HydrophobicContact CB-CB 3.94Å; N343-L362 VanDerWaalsContact ND2-CB 3.32Å; N343-L362 WeakPolarHBondContact ND2-CB 3.39Å; N343-D363 HydrophobicContact CB-CB 3.94Å; N343-D363 PolarHBondContact N-OD2 2.83Å
344	S	94.2	Very high	93.5	Very high	8 Å²	8	38.8 Å²	38.8	6%	0.056	21%	0.207	C	C	.	.			trans	-58	138.4	-178.6	-171.9	0	0	0	0	112.6	K319 S361 L362	K319-S344 WeakPolarHBondContact CA-OG 3.46Å; K319-S344 WeakPolarHBondContact CG-OG 3.22Å; S344-S361 VanDerWaalsContact O-CA 3.24Å; S344-S361 WeakPolarHBondContact O-CA 3.28Å; S344-S361 PolarHBondContact O-OG 3.13Å; S344-L362 PolarHBondContact O-N 2.84Å
345	V	96	Very high	93.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	139.6	158.5	-174.2	0	0	0	0	108.3	I291 S318 V323 F341 L348 C360	I291-V345 WeakPolarHBondContact CD1-O 3.31Å; S318-V345 PolarHBondContact O-N 3.4Å; V323-V345 HydrophobicContact CG2-CG1 4.41Å; V323-V345 HydrophobicContact CG2-CG2 3.97Å; F341-V345 HydrophobicContact CD2-CG2 3.86Å; F341-V345 HydrophobicContact CE2-CG2 4.19Å; V345-L348 HydrophobicContact CG1-CD2 4.47Å; V345-C360 CarbonylContact C-O 3.5Å; V345-C360 WeakPolarHBondContact CA-O 3.39Å
346	C	95.6	Very high	93.8	Very high	7 Å²	7	35.9 Å²	35.9	5%	0.047	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-39.5	-178.9	-59.4	0	0	0	0	113.6	I24 Y25 R246 C360 S361 L362	I24-C346 PolarHBondContact O-SG 3.22Å; Y25-C346 WeakPolarHBondContact O-CB 3.05Å; R246-C346 PolarHBondContact NE-O 2.77Å; C346-C360 PolarHBondContact N-O 2.95Å; C346-S361 VanDerWaalsContact SG-C 3.52Å; C346-L362 VanDerWaalsContact SG-CD2 3.54Å; C346-L362 VanDerWaalsContact SG-CG 3.53Å; C346-L362 PolarHBondContact SG-N 2.67Å
347	D	97.4	Very high	94	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	161.2	-170.6	-158.7	8.4	0	0	0	110.6	S26 L27 R85 R246 R294 C360	S26-D347 WeakPolarHBondContact CA-OD2 3.44Å; S26-D347 WeakPolarHBondContact CB-OD2 3.42Å; S26-D347 PolarHBondContact OG-OD2 3.32Å; L27-D347 PolarHBondContact N-OD2 2.97Å; R85-D347 IonicContact CZ-OD1 3.91Å; R85-D347 IonicContact CZ-OD2 2.83Å; R85-D347 VanDerWaalsContact CZ-OD2 3.3Å; R85-D347 IonicContact NH1-OD1 3.92Å; R85-D347 IonicContact NH1-OD2 3.33Å; R85-D347 PolarHBondContact NH1-OD2 2.96Å; R85-D347 VanDerWaalsContact NH2-CG 3.26Å; R85-D347 IonicContact NH2-OD1 3.17Å; R85-D347 PolarHBondContact NH2-OD1 2.92Å; R85-D347 IonicContact NH2-OD2 2.71Å; R85-D347 PolarHBondContact NH2-OD2 2.83Å; R246-D347 WeakPolarHBondContact CD-OD1 3.27Å; R246-D347 IonicContact CZ-OD2 3.18Å; R246-D347 IonicContact NE-OD1 2.78Å; R246-D347 PolarHBondContact NE-OD1 2.95Å; R246-D347 IonicContact NE-OD2 3.24Å; R294-D347 IonicContact NE-OD1 3.44Å; D347-C360 PolarHBondContact O-N 3.41Å
348	L	97.7	Very high	94.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.5	-179.4	-69.1	169.2	0	0	0	109	R294 A315 V323 V345 L357 M358 A359	R294-L348 HydrophobicContact CB-CB 4.12Å; R294-L348 HydrophobicContact CG-CB 3.68Å; R294-L348 WeakPolarHBondContact CG-O 3.46Å; R294-L348 PolarHBondContact NE-O 3.42Å; A315-L348 HydrophobicContact CB-CD1 3.91Å; V323-L348 HydrophobicContact CG1-CD2 4.2Å; V323-L348 HydrophobicContact CG2-CD2 4.26Å; V345-L348 HydrophobicContact CG1-CD2 4.47Å; L348-L357 HydrophobicContact CB-CD1 4.32Å; L348-L357 HydrophobicContact CD2-CD1 4.2Å; L348-M358 WeakPolarHBondContact CA-O 3.22Å; L348-A359 HydrophobicContact CD2-CB 3.54Å
349	S	97.6	Very high	94.3	Very high	5 Å²	5	27.2 Å²	27.2	4%	0.035	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	138.7	170.6	-178.3	0	0	0	0	110.6	L27 D28 I29 L357 M358	L27-S349 VanDerWaalsContact CD1-CB 3.49Å; D28-S349 WeakPolarHBondContact OD1-CB 3.48Å; D28-S349 PolarHBondContact OD1-OG 3.38Å; I29-S349 PolarHBondContact N-OG 3.36Å; I29-S349 VanDerWaalsContact N-OG 3.09Å; S349-L357 WeakPolarHBondContact O-CA 3.27Å; S349-M358 PolarHBondContact N-O 3.24Å; S349-M358 PolarHBondContact O-N 3.14Å
350	W	96.8	Very high	94.5	Very high	19 Å²	19	22.9 Å²	22.9	7%	0.072	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	146.9	174.9	-73.8	99.1	0	0	0	109.9	R294 N296 P297 A315 V325 E356 L357 F371 L376	R294-W350 PolarHBondContact O-NE1 2.95Å; N296-W350 HydrophobicContact CB-CD2 4.36Å; N296-W350 HydrophobicContact CB-CZ2 4.45Å; N296-W350 VanDerWaalsContact ND2-CE3 3.27Å; N296-W350 VanDerWaalsContact ND2-CZ3 3.33Å; N296-W350 WeakPolarHBondContact ND2-CZ3 3.41Å; P297-W350 VanDerWaalsContact CD-CB 3.49Å; P297-W350 HydrophobicContact CG-CB 4.19Å; A315-W350 HydrophobicContact CB-CZ2 3.89Å; V325-W350 HydrophobicContact CG1-CH2 4.08Å; V325-W350 HydrophobicContact CG1-CZ2 4.17Å; W350-E356 CarbonylContact C-O 3.54Å; W350-E356 VanDerWaalsContact CA-O 3.29Å; W350-E356 WeakPolarHBondContact CA-O 3.1Å; W350-L357 HydrophobicContact CD2-CB 4.19Å; W350-L357 HydrophobicContact CD2-CD1 3.92Å; W350-L357 HydrophobicContact CE3-CB 3.88Å; W350-L357 HydrophobicContact CE3-CD1 4.48Å; W350-L357 HydrophobicContact CG-CD1 4.12Å; W350-L357 HydrophobicContact CH2-CB 4.28Å; W350-L357 HydrophobicContact CH2-CD2 4.32Å; W350-L357 HydrophobicContact CZ2-CD1 4.36Å; W350-L357 HydrophobicContact CZ2-CD2 4.19Å; W350-L357 HydrophobicContact CZ3-CB 3.92Å; W350-F371 HydrophobicContact CH2-CD2 4.43Å; W350-F371 HydrophobicContact CH2-CE2 4.1Å; W350-F371 HydrophobicContact CZ3-CD2 4.01Å; W350-F371 HydrophobicContact CZ3-CE2 4.01Å; W350-L376 HydrophobicContact CH2-CD1 4.01Å; W350-L376 HydrophobicContact CZ3-CD1 3.9Å
351	S	94.8	Very high	94.7	Very high	3 Å²	3	22 Å²	22	2%	0.021	12%	0.119	C	C	.	.			trans	-61.6	152.9	164.8	57.8	0	0	0	0	111	P297 D353 G354 R355 E356	P297-S351 WeakPolarHBondContact CG-O 3.49Å; S351-D353 WeakPolarHBondContact CB-OD1 3.26Å; S351-D353 PolarHBondContact O-N 3.16Å; S351-D353 PolarHBondContact OG-OD1 2.94Å; S351-G354 WeakPolarHBondContact O-CA 3.22Å; S351-G354 PolarHBondContact O-N 3.38Å; S351-R355 PolarHBondContact OG-N 2.86Å; S351-E356 PolarHBondContact N-O 2.95Å; S351-E356 PolarHBondContact OG-N 3.14Å; S351-E356 PolarHBondContact OG-O 3.01Å
352	S	89.3	Confident	94.6	Very high	63 Å²	63	23.9 Å²	23.9	44%	0.441	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.3	178.5	48.8	0	0	0	0	113.8	P31 N298 G354	P31-S352 WeakPolarHBondContact O-CB 3.23Å; P31-S352 PolarHBondContact O-OG 3.46Å; N298-S352 PolarHBondContact ND2-O 3.39Å; S352-G354 VanDerWaalsContact C-N 3.34Å
353	D	87.2	Confident	94.6	Very high	51 Å²	51	19.9 Å²	19.9	27%	0.273	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-1.7	175.5	84.6	-26.8	0	0	0	114.4	N298 S351 R355	N298-D353 VanDerWaalsContact ND2-C 3.29Å; S351-D353 WeakPolarHBondContact CB-OD1 3.26Å; S351-D353 PolarHBondContact O-N 3.16Å; S351-D353 PolarHBondContact OG-OD1 2.94Å; D353-R355 VanDerWaalsContact C-N 3.29Å; D353-R355 PolarHBondContact O-N 3.09Å; D353-R355 PolarHBondContact OD1-N 2.72Å; D353-R355 IonicContact OD2-CZ 3.97Å; D353-R355 IonicContact OD2-NE 3.82Å; D353-R355 PolarHBondContact OD2-NE 3.21Å; D353-R355 IonicContact OD2-NH2 3.91Å; D353-R355 PolarHBondContact OD2-NH2 3.22Å
354	G	90.6	Very high	94.5	Very high	5 Å²	5	16.5 Å²	16.5	5%	0.052	9%	0.087	C	C	.	.	S	Bend	trans	71.6	9.7	177.3	0	0	0	0	0	116	N296 N298 S351 S352	N296-G354 VanDerWaalsContact ND2-CA 3.35Å; N296-G354 WeakPolarHBondContact ND2-CA 3.35Å; N296-G354 PolarHBondContact ND2-O 3.35Å; N296-G354 WeakPolarHBondContact OD1-CA 3.29Å; N298-G354 PolarHBondContact ND2-N 3.2Å; S351-G354 WeakPolarHBondContact O-CA 3.22Å; S351-G354 PolarHBondContact O-N 3.38Å; S352-G354 VanDerWaalsContact C-N 3.34Å
355	R	91.2	Very high	94.5	Very high	97 Å²	97	17.2 Å²	17.2	37%	0.366	9%	0.092	S	C	.	.	S	Bend	trans	-91.9	-18.1	-179.2	-76.5	-175.2	-91.9	-168.1	-5.8	114.7	S351 D353 F371 H373	S351-R355 PolarHBondContact OG-N 2.86Å; D353-R355 VanDerWaalsContact C-N 3.29Å; D353-R355 PolarHBondContact O-N 3.09Å; D353-R355 PolarHBondContact OD1-N 2.72Å; D353-R355 IonicContact OD2-CZ 3.97Å; D353-R355 IonicContact OD2-NE 3.82Å; D353-R355 PolarHBondContact OD2-NE 3.21Å; D353-R355 IonicContact OD2-NH2 3.91Å; D353-R355 PolarHBondContact OD2-NH2 3.22Å; R355-F371 WeakPolarHBondContact O-CB 3.29Å; R355-F371 WeakPolarHBondContact O-CD2 3.41Å; R355-F371 PolarHBondContact O-N 3.27Å; R355-H373 VanDerWaalsContact CZ-NE2 3.32Å; R355-H373 PolarHBondContact NH1-NE2 2.94Å
356	E	94.6	Very high	94.6	Very high	24 Å²	24	17.2 Å²	17.2	11%	0.112	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	136.8	-175	-49	179.4	162.3	0	0	110.1	R57 W350 S351 Y368 M369	R57-E356 IonicContact CZ-OE1 3.9Å; R57-E356 IonicContact CZ-OE2 2.96Å; R57-E356 VanDerWaalsContact NE-CD 3.34Å; R57-E356 IonicContact NE-OE1 3.61Å; R57-E356 PolarHBondContact NE-OE1 2.84Å; R57-E356 IonicContact NE-OE2 2.7Å; R57-E356 PolarHBondContact NE-OE2 2.84Å; R57-E356 IonicContact NH2-OE1 2.97Å; R57-E356 IonicContact NH2-OE2 2.82Å; R57-E356 PolarHBondContact NH2-OE2 3.39Å; W350-E356 CarbonylContact C-O 3.54Å; W350-E356 VanDerWaalsContact CA-O 3.29Å; W350-E356 WeakPolarHBondContact CA-O 3.1Å; S351-E356 PolarHBondContact N-O 2.95Å; S351-E356 PolarHBondContact OG-N 3.14Å; S351-E356 PolarHBondContact OG-O 3.01Å; E356-Y368 HydrophobicContact CB-CE2 3.88Å; E356-Y368 HydrophobicContact CG-CE2 3.95Å; E356-Y368 PolarHBondContact OE1-OH 3.09Å; E356-M369 WeakPolarHBondContact CA-O 3.45Å
357	L	96.8	Very high	94.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	126.3	176.2	174.1	65.9	0	0	0	109.2	A315 V323 V325 L348 S349 W350 M369 F371	A315-L357 HydrophobicContact CB-CD1 3.88Å; A315-L357 HydrophobicContact CB-CD2 3.65Å; A315-L357 HydrophobicContact CB-CG 4.44Å; V323-L357 HydrophobicContact CG1-CD2 4.27Å; V325-L357 HydrophobicContact CG2-CD2 3.86Å; L348-L357 HydrophobicContact CB-CD1 4.32Å; L348-L357 HydrophobicContact CD2-CD1 4.2Å; S349-L357 WeakPolarHBondContact O-CA 3.27Å; W350-L357 HydrophobicContact CD2-CB 4.19Å; W350-L357 HydrophobicContact CD2-CD1 3.92Å; W350-L357 HydrophobicContact CE3-CB 3.88Å; W350-L357 HydrophobicContact CE3-CD1 4.48Å; W350-L357 HydrophobicContact CG-CD1 4.12Å; W350-L357 HydrophobicContact CH2-CB 4.28Å; W350-L357 HydrophobicContact CH2-CD2 4.32Å; W350-L357 HydrophobicContact CZ2-CD1 4.36Å; W350-L357 HydrophobicContact CZ2-CD2 4.19Å; W350-L357 HydrophobicContact CZ3-CB 3.92Å; L357-M369 HydrophobicContact CB-CB 4.21Å; L357-M369 HydrophobicContact CD2-CE 3.9Å; L357-M369 HydrophobicContact CD2-SD 4.15Å; L357-M369 HydrophobicContact CG-CE 3.92Å; L357-M369 PolarHBondContact N-O 2.88Å; L357-M369 PolarHBondContact O-N 2.78Å; L357-F371 HydrophobicContact CB-CE2 4.1Å
358	M	97.5	Very high	94.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	144.9	173.7	-72	-70	-80.9	0	0	110.7	L27 I29 L36 I56 L348 S349 V366 C367 Y368	L27-M358 HydrophobicContact CD1-CB 3.82Å; L27-M358 HydrophobicContact CD2-CB 3.9Å; I29-M358 HydrophobicContact CD1-CB 4.02Å; I29-M358 HydrophobicContact CD1-CG 3.62Å; I29-M358 HydrophobicContact CG1-CB 4.28Å; I29-M358 HydrophobicContact CG1-CG 3.96Å; L36-M358 HydrophobicContact CD1-CB 4.28Å; L36-M358 HydrophobicContact CD1-CE 3.89Å; L36-M358 HydrophobicContact CD1-CG 4.14Å; L36-M358 HydrophobicContact CD2-CE 3.5Å; L36-M358 HydrophobicContact CG-CE 4.27Å; I56-M358 HydrophobicContact CD1-CE 4.26Å; I56-M358 HydrophobicContact CG2-CE 4.07Å; I56-M358 HydrophobicContact CG2-SD 4.2Å; L348-M358 WeakPolarHBondContact CA-O 3.22Å; S349-M358 PolarHBondContact N-O 3.24Å; S349-M358 PolarHBondContact O-N 3.14Å; M358-V366 HydrophobicContact CE-CB 4.46Å; M358-V366 HydrophobicContact CE-CG2 4.03Å; M358-C367 CarbonylContact C-O 3.58Å; M358-C367 WeakPolarHBondContact CA-O 3.44Å; M358-Y368 VanDerWaalsContact SD-CA 3.51Å; M358-Y368 VanDerWaalsContact SD-CB 3.52Å; M358-Y368 HydrophobicContact SD-CD2 3.77Å; M358-Y368 HydrophobicContact SD-CG 4.14Å
359	A	97.8	Very high	94.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145	176.5	0	0	0	0	0	111	V323 F341 L348 V366 C367 M369	V323-A359 HydrophobicContact CG2-CB 4.2Å; F341-A359 HydrophobicContact CE2-CB 3.93Å; F341-A359 HydrophobicContact CZ-CB 4.02Å; L348-A359 HydrophobicContact CD2-CB 3.54Å; A359-V366 CarbonylContact O-C 3.57Å; A359-V366 WeakPolarHBondContact O-CA 3.29Å; A359-V366 WeakPolarHBondContact O-CB 3.32Å; A359-C367 PolarHBondContact N-O 2.98Å; A359-C367 PolarHBondContact O-N 2.86Å; A359-M369 HydrophobicContact CB-CE 4.07Å
360	C	97	Very high	94.4	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	162.5	172.4	61.4	0	0	0	0	112.4	I24 L27 V345 C346 D347 V366	I24-C360 HydrophobicContact CB-CB 4.05Å; I24-C360 HydrophobicContact CG2-CB 3.61Å; L27-C360 HydrophobicContact CD2-CB 3.81Å; L27-C360 HydrophobicContact CG-CB 4.06Å; V345-C360 CarbonylContact C-O 3.5Å; V345-C360 WeakPolarHBondContact CA-O 3.39Å; C346-C360 PolarHBondContact N-O 2.95Å; D347-C360 PolarHBondContact O-N 3.41Å; C360-V366 HydrophobicContact CB-CG1 4.04Å
361	S	95.5	Very high	94.3	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	156.7	-175.6	169.9	0	0	0	0	113.6	I24 F341 N343 S344 C346 D363 G364 S365	I24-S361 PolarHBondContact N-O 2.86Å; F341-S361 VanDerWaalsContact CG-CB 3.45Å; N343-S361 PolarHBondContact O-OG 2.83Å; S344-S361 VanDerWaalsContact O-CA 3.24Å; S344-S361 WeakPolarHBondContact O-CA 3.28Å; S344-S361 PolarHBondContact O-OG 3.13Å; C346-S361 VanDerWaalsContact SG-C 3.52Å; S361-D363 WeakPolarHBondContact CB-OD1 3.34Å; S361-D363 WeakPolarHBondContact CB-OD2 3.31Å; S361-D363 PolarHBondContact O-N 3.26Å; S361-D363 VanDerWaalsContact O-N 3.13Å; S361-D363 PolarHBondContact OG-N 2.95Å; S361-D363 VanDerWaalsContact OG-N 3.1Å; S361-D363 PolarHBondContact OG-OD1 2.83Å; S361-D363 PolarHBondContact OG-OD2 2.8Å; S361-G364 PolarHBondContact O-N 3.29Å; S361-G364 VanDerWaalsContact O-N 3.07Å; S361-S365 PolarHBondContact N-O 3.16Å
362	L	93.2	Very high	94.1	Very high	45 Å²	45	21.1 Å²	21.1	24%	0.236	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-9.2	169.3	-68.5	-178.3	0	0	0	113.5	P23 Y25 N343 S344 C346 G364	P23-L362 HydrophobicContact CB-CD2 4.22Å; Y25-L362 HydrophobicContact CD1-CD2 3.77Å; Y25-L362 HydrophobicContact CE1-CD2 3.68Å; N343-L362 HydrophobicContact CB-CB 3.94Å; N343-L362 VanDerWaalsContact ND2-CB 3.32Å; N343-L362 WeakPolarHBondContact ND2-CB 3.39Å; S344-L362 PolarHBondContact O-N 2.84Å; C346-L362 VanDerWaalsContact SG-CD2 3.54Å; C346-L362 VanDerWaalsContact SG-CG 3.53Å; C346-L362 PolarHBondContact SG-N 2.67Å; L362-G364 VanDerWaalsContact C-N 3.3Å
363	D	92.3	Very high	93.8	Very high	16 Å²	16	20.8 Å²	20.8	9%	0.086	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.7	171.6	61.5	41.1	0	0	0	114.3	G21 F341 T342 N343 S361 S365	G21-D363 VanDerWaalsContact CA-O 3.28Å; G21-D363 WeakPolarHBondContact CA-O 3.24Å; G21-D363 PolarHBondContact N-O 3.2Å; F341-D363 WeakPolarHBondContact CA-OD2 3.45Å; F341-D363 VanDerWaalsContact CB-OD2 3.27Å; F341-D363 WeakPolarHBondContact CB-OD2 3.24Å; T342-D363 PolarHBondContact N-OD2 2.91Å; T342-D363 WeakPolarHBondContact OG1-CB 3.42Å; T342-D363 PolarHBondContact OG1-OD2 2.96Å; N343-D363 HydrophobicContact CB-CB 3.94Å; N343-D363 PolarHBondContact N-OD2 2.83Å; S361-D363 WeakPolarHBondContact CB-OD1 3.34Å; S361-D363 WeakPolarHBondContact CB-OD2 3.31Å; S361-D363 PolarHBondContact O-N 3.26Å; S361-D363 VanDerWaalsContact O-N 3.13Å; S361-D363 PolarHBondContact OG-N 2.95Å; S361-D363 VanDerWaalsContact OG-N 3.1Å; S361-D363 PolarHBondContact OG-OD1 2.83Å; S361-D363 PolarHBondContact OG-OD2 2.8Å; D363-S365 WeakPolarHBondContact OD1-CB 3.27Å; D363-S365 PolarHBondContact OD1-N 2.95Å; D363-S365 PolarHBondContact OD1-OG 3.31Å
364	G	92.4	Very high	93.6	Very high	3 Å²	3	26.7 Å²	26.7	3%	0.031	13%	0.131	C	C	.	.	S	Bend	trans	81.7	14.6	177.7	0	0	0	0	0	115.3	S10 R22 S361 L362	S10-G364 PolarHBondContact OG-O 3.13Å; R22-G364 WeakPolarHBondContact O-CA 3.48Å; S361-G364 PolarHBondContact O-N 3.29Å; S361-G364 VanDerWaalsContact O-N 3.07Å; L362-G364 VanDerWaalsContact C-N 3.3Å
365	S	94.3	Very high	93.4	Very high	24 Å²	24	29.3 Å²	29.3	17%	0.168	14%	0.142	C	C	.	.			trans	-111.3	160.8	172.1	71.5	0	0	0	0	113	K5 F341 S361 D363	K5-S365 WeakPolarHBondContact CE-OG 3.48Å; K5-S365 PolarHBondContact NZ-OG 3.2Å; F341-S365 WeakPolarHBondContact CD1-OG 3.24Å; F341-S365 WeakPolarHBondContact CE1-O 3.33Å; S361-S365 PolarHBondContact N-O 3.16Å; D363-S365 WeakPolarHBondContact OD1-CB 3.27Å; D363-S365 PolarHBondContact OD1-N 2.95Å; D363-S365 PolarHBondContact OD1-OG 3.31Å
366	V	96.5	Very high	93.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	161.7	173.1	-52.4	0	0	0	0	111.3	K5 P6 V9 I24 L27 T38 M358 A359 C360	K5-V366 WeakPolarHBondContact CG-O 3.47Å; P6-V366 HydrophobicContact CG-CG2 3.88Å; V9-V366 HydrophobicContact CB-CG2 3.73Å; V9-V366 HydrophobicContact CG1-CB 4.47Å; V9-V366 HydrophobicContact CG1-CG1 4.03Å; V9-V366 HydrophobicContact CG1-CG2 3.56Å; V9-V366 HydrophobicContact CG2-CG2 4.4Å; I24-V366 HydrophobicContact CD1-CG1 3.78Å; L27-V366 HydrophobicContact CD2-CB 4.36Å; L27-V366 HydrophobicContact CD2-CG1 4.1Å; T38-V366 HydrophobicContact CG2-CG1 4.48Å; M358-V366 HydrophobicContact CE-CB 4.46Å; M358-V366 HydrophobicContact CE-CG2 4.03Å; A359-V366 CarbonylContact O-C 3.57Å; A359-V366 WeakPolarHBondContact O-CA 3.29Å; A359-V366 WeakPolarHBondContact O-CB 3.32Å; C360-V366 HydrophobicContact CB-CG1 4.04Å
367	C	96.7	Very high	92.6	Very high	1 Å²	1	25 Å²	25	1%	0.007	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	142	173.8	178.2	0	0	0	0	111.4	L3 L4 L340 F341 M358 A359	L3-C367 WeakPolarHBondContact CD1-SG 3.46Å; L4-C367 WeakPolarHBondContact O-CA 3.32Å; L4-C367 PolarHBondContact O-SG 3.18Å; L340-C367 HydrophobicContact CD1-CB 4.27Å; L340-C367 HydrophobicContact CD2-CB 4.07Å; L340-C367 HydrophobicContact CG-CB 4.2Å; F341-C367 HydrophobicContact CE1-CB 4.34Å; F341-C367 HydrophobicContact CE2-CB 4.37Å; F341-C367 HydrophobicContact CZ-CB 3.7Å; M358-C367 CarbonylContact C-O 3.58Å; M358-C367 WeakPolarHBondContact CA-O 3.44Å; A359-C367 PolarHBondContact N-O 2.98Å; A359-C367 PolarHBondContact O-N 2.86Å
368	Y	97.1	Very high	92	Very high	15 Å²	15	26.9 Å²	26.9	6%	0.059	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	133.2	174.8	170.8	-90.7	0	0	0	111	L3 L4 M53 I56 R57 E356 M358	L3-Y368 WeakPolarHBondContact CA-O 3.47Å; L4-Y368 HydrophobicContact CB-CD1 4.13Å; L4-Y368 HydrophobicContact CD1-CD1 3.96Å; L4-Y368 HydrophobicContact CD1-CE1 4.32Å; L4-Y368 HydrophobicContact CG-CD1 4.2Å; L4-Y368 PolarHBondContact N-O 3.25Å; L4-Y368 PolarHBondContact O-N 2.99Å; M53-Y368 HydrophobicContact CE-CD2 4.39Å; M53-Y368 HydrophobicContact CE-CE2 4.34Å; I56-Y368 HydrophobicContact CG2-CD2 4.04Å; I56-Y368 HydrophobicContact CG2-CG 4.14Å; R57-Y368 HydrophobicContact CG-CE2 4.12Å; E356-Y368 HydrophobicContact CB-CE2 3.88Å; E356-Y368 HydrophobicContact CG-CE2 3.95Å; E356-Y368 PolarHBondContact OE1-OH 3.09Å; M358-Y368 VanDerWaalsContact SD-CA 3.51Å; M358-Y368 VanDerWaalsContact SD-CB 3.52Å; M358-Y368 HydrophobicContact SD-CD2 3.77Å; M358-Y368 HydrophobicContact SD-CG 4.14Å
369	M	96.6	Very high	91.6	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	104.9	174.9	-72.9	160.3	-80.8	0	0	109.7	M1 R2 L3 V323 E356 L357 A359 F371	M1-M369 HydrophobicContact SD-CB 4.43Å; M1-M369 HydrophobicContact SD-CG 4.29Å; R2-M369 WeakPolarHBondContact O-CA 3.35Å; L3-M369 HydrophobicContact CD1-CG 3.42Å; L3-M369 VanDerWaalsContact CD1-CG 3.42Å; L3-M369 HydrophobicContact CD1-SD 4.33Å; V323-M369 HydrophobicContact CG1-CE 4.26Å; V323-M369 HydrophobicContact CG1-SD 4.31Å; E356-M369 WeakPolarHBondContact CA-O 3.45Å; L357-M369 HydrophobicContact CB-CB 4.21Å; L357-M369 HydrophobicContact CD2-CE 3.9Å; L357-M369 HydrophobicContact CD2-SD 4.15Å; L357-M369 HydrophobicContact CG-CE 3.92Å; L357-M369 PolarHBondContact N-O 2.88Å; L357-M369 PolarHBondContact O-N 2.78Å; A359-M369 HydrophobicContact CB-CE 4.07Å; M369-F371 HydrophobicContact CB-CE2 3.89Å; M369-F371 HydrophobicContact CB-CZ 4.17Å
370	G	94.6	Very high	91.1	Very high	10 Å²	10	31.3 Å²	31.3	10%	0.103	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.7	175.4	0	0	0	0	0	112.4	M1 R2	M1-G370 CarbonylContact C-O 3.56Å; M1-G370 WeakPolarHBondContact CA-O 3.41Å; R2-G370 PolarHBondContact N-O 3.47Å; R2-G370 PolarHBondContact O-N 3.07Å
371	F	93.7	Very high	90.6	Very high	13 Å²	13	33.9 Å²	33.9	6%	0.057	18%	0.181	C	C	.	.			trans	-119.6	148.1	-177.5	-62	-85.9	0	0	0	112.1	M1 V325 V335 W350 R355 L357 M369 L376	M1-F371 HydrophobicContact CB-CD1 4.18Å; M1-F371 HydrophobicContact CB-CE1 4.16Å; M1-F371 HydrophobicContact CG-CD1 4.05Å; M1-F371 HydrophobicContact CG-CE1 3.72Å; M1-F371 HydrophobicContact CG-CZ 4.1Å; M1-F371 HydrophobicContact SD-CD1 4.49Å; M1-F371 HydrophobicContact SD-CE1 3.59Å; M1-F371 VanDerWaalsContact SD-CE1 3.59Å; M1-F371 HydrophobicContact SD-CZ 3.75Å; V325-F371 HydrophobicContact CG2-CZ 4.19Å; V335-F371 HydrophobicContact CG2-CE1 4.02Å; W350-F371 HydrophobicContact CH2-CD2 4.43Å; W350-F371 HydrophobicContact CH2-CE2 4.1Å; W350-F371 HydrophobicContact CZ3-CD2 4.01Å; W350-F371 HydrophobicContact CZ3-CE2 4.01Å; R355-F371 WeakPolarHBondContact O-CB 3.29Å; R355-F371 WeakPolarHBondContact O-CD2 3.41Å; R355-F371 PolarHBondContact O-N 3.27Å; L357-F371 HydrophobicContact CB-CE2 4.1Å; M369-F371 HydrophobicContact CB-CE2 3.89Å; M369-F371 HydrophobicContact CB-CZ 4.17Å; F371-L376 HydrophobicContact CB-CD1 3.64Å; F371-L376 HydrophobicContact CB-CG 3.9Å; F371-L376 HydrophobicContact CD1-CD1 4.17Å; F371-L376 HydrophobicContact CD1-CD2 4.24Å; F371-L376 HydrophobicContact CD1-CG 4.12Å; F371-L376 HydrophobicContact CD2-CD1 3.89Å; F371-L376 HydrophobicContact CG-CD1 3.64Å; F371-L376 HydrophobicContact CG-CG 4Å
372	T	90.7	Very high	90.1	Very high	75 Å²	75	37 Å²	37	46%	0.46	20%	0.198	S	C	.	.			trans	-92.8	158.7	172.6	74.4	0	0	0	0	111.9	K374 E375 L376	T372-K374 PolarHBondContact O-N 3.15Å; T372-K374 VanDerWaalsContact O-N 3.11Å; T372-K374 PolarHBondContact OG1-N 3.12Å; T372-E375 PolarHBondContact N-OE2 2.84Å; T372-E375 WeakPolarHBondContact O-CB 3.43Å; T372-E375 PolarHBondContact O-N 3.32Å; T372-E375 WeakPolarHBondContact OG1-CG 3.14Å; T372-E375 PolarHBondContact OG1-OE2 3.21Å; T372-L376 PolarHBondContact O-N 3.26Å
373	H	84.2	Confident	89.8	Confident	56 Å²	56	42.6 Å²	42.6	26%	0.259	22%	0.22	S	C	.	.	H	α-helix	trans	-57	-25.6	173.2	-74.6	-47.7	0	0	0	114.1	R355 E375 G377 T378	R355-H373 VanDerWaalsContact CZ-NE2 3.32Å; R355-H373 PolarHBondContact NH1-NE2 2.94Å; H373-E375 VanDerWaalsContact C-N 3.27Å; H373-E375 PolarHBondContact O-N 3.15Å; H373-G377 WeakPolarHBondContact CA-O 3.12Å; H373-G377 PolarHBondContact ND1-O 2.86Å; H373-G377 CarbonylContact O-C 3.53Å; H373-G377 WeakPolarHBondContact O-CA 3.41Å; H373-G377 PolarHBondContact O-N 3.08Å; H373-T378 HydrophobicContact CB-CG2 4.13Å
374	K	83.2	Confident	89.7	Confident	175 Å²	175	44.4 Å²	44.4	76%	0.761	23%	0.228	S	C	*	.	H	α-helix	trans	-74.1	-19.3	176.2	-61.8	-175.3	179.3	-177.9	0	112.5	T372	T372-K374 PolarHBondContact O-N 3.15Å; T372-K374 VanDerWaalsContact O-N 3.11Å; T372-K374 PolarHBondContact OG1-N 3.12Å
375	E	85.5	Confident	89.5	Confident	60 Å²	60	44.3 Å²	44.3	28%	0.28	23%	0.227	S	C	.	.	H	α-helix	trans	-93.1	-42.7	-175.7	-67.6	173.9	136.7	0	0	112.7	M1 R334 T372 H373	M1-E375 PolarHBondContact N-OE1 3.38Å; M1-E375 PolarHBondContact N-OE2 2.97Å; M1-E375 VanDerWaalsContact N-OE2 3.1Å; R334-E375 VanDerWaalsContact CZ-O 3.27Å; R334-E375 PolarHBondContact NE-O 3.09Å; R334-E375 PolarHBondContact NH2-O 3.39Å; T372-E375 PolarHBondContact N-OE2 2.84Å; T372-E375 WeakPolarHBondContact O-CB 3.43Å; T372-E375 PolarHBondContact O-N 3.32Å; T372-E375 WeakPolarHBondContact OG1-CG 3.14Å; T372-E375 PolarHBondContact OG1-OE2 3.21Å; H373-E375 VanDerWaalsContact C-N 3.27Å; H373-E375 PolarHBondContact O-N 3.15Å
376	L	84.7	Confident	89.2	Confident	24 Å²	24	44.3 Å²	44.3	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-106.3	-37	179.9	-60.9	-177.6	0	0	0	113.7	L300 R334 W350 F371 T372	L300-L376 HydrophobicContact CD1-CB 3.81Å; L300-L376 WeakPolarHBondContact CD1-O 3.43Å; R334-L376 HydrophobicContact CG-CD2 4.45Å; W350-L376 HydrophobicContact CH2-CD1 4.01Å; W350-L376 HydrophobicContact CZ3-CD1 3.9Å; F371-L376 HydrophobicContact CB-CD1 3.64Å; F371-L376 HydrophobicContact CB-CG 3.9Å; F371-L376 HydrophobicContact CD1-CD1 4.17Å; F371-L376 HydrophobicContact CD1-CD2 4.24Å; F371-L376 HydrophobicContact CD1-CG 4.12Å; F371-L376 HydrophobicContact CD2-CD1 3.89Å; F371-L376 HydrophobicContact CG-CD1 3.64Å; F371-L376 HydrophobicContact CG-CG 4Å; T372-L376 PolarHBondContact O-N 3.26Å
377	G	83.4	Confident	88.8	Confident	8 Å²	8	50.5 Å²	50.5	8%	0.082	25%	0.254	C	S	.	.			trans	131.2	-177.8	-174.9	0	0	0	0	0	113.1	R301 H373	R301-G377 WeakPolarHBondContact O-CA 3.49Å; H373-G377 WeakPolarHBondContact CA-O 3.12Å; H373-G377 PolarHBondContact ND1-O 2.86Å; H373-G377 CarbonylContact O-C 3.53Å; H373-G377 WeakPolarHBondContact O-CA 3.41Å; H373-G377 PolarHBondContact O-N 3.08Å
378	T	85.6	Confident	88.4	Confident	39 Å²	39	52.3 Å²	52.3	24%	0.239	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.2	169.5	50.5	0	0	0	0	110.2	L300 R301 H373	L300-T378 CarbonylContact C-O 3.49Å; L300-T378 WeakPolarHBondContact CA-O 3.41Å; R301-T378 PolarHBondContact N-O 2.66Å; R301-T378 PolarHBondContact O-N 2.95Å; H373-T378 HydrophobicContact CB-CG2 4.13Å
379	P	87.6	Confident	88	Confident	43 Å²	43	51.6 Å²	51.6	28%	0.279	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	149.6	179.6	27.7	-34.7	0	0	0	112	N298 V299 L300	N298-P379 HydrophobicContact CB-CB 3.77Å; N298-P379 WeakPolarHBondContact OD1-CB 3.38Å; V299-P379 CarbonylContact O-C 3.56Å; L300-P379 HydrophobicContact CD2-CB 4.26Å
380	W	87.9	Confident	87.6	Confident	49 Å²	49	56.6 Å²	56.6	19%	0.186	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-73.3	148.9	163.4	-72.8	25.9	0	0	0	109.3	V299 G310 E384 V385 L388	V299-W380 HydrophobicContact CB-CB 4.29Å; V299-W380 HydrophobicContact CB-CD2 4.07Å; V299-W380 HydrophobicContact CB-CE3 4.33Å; V299-W380 HydrophobicContact CB-CG 4.04Å; V299-W380 HydrophobicContact CG1-CD2 3.66Å; V299-W380 HydrophobicContact CG1-CE3 4Å; V299-W380 HydrophobicContact CG1-CG 4Å; V299-W380 HydrophobicContact CG1-CZ2 4.24Å; V299-W380 HydrophobicContact CG1-CZ3 4.42Å; V299-W380 PolarHBondContact O-N 2.74Å; G310-W380 VanDerWaalsContact CA-CZ2 3.42Å; W380-E384 HydrophobicContact CB-CB 4.27Å; W380-E384 HydrophobicContact CD2-CB 4.42Å; W380-E384 HydrophobicContact CE3-CB 3.91Å; W380-V385 HydrophobicContact CB-CG2 4Å; W380-V385 HydrophobicContact CE3-CG2 4.33Å; W380-L388 HydrophobicContact CZ3-CB 4.45Å; W380-L388 HydrophobicContact CZ3-CD1 4.39Å; W380-L388 HydrophobicContact CZ3-CD2 4.05Å
381	S	87.1	Confident	87.3	Confident	55 Å²	55	64.9 Å²	64.9	39%	0.385	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-67.3	151.3	169.2	65	0	0	0	0	110.9	K383 E384 V385	S381-K383 PolarHBondContact O-N 3.17Å; S381-K383 VanDerWaalsContact O-N 3.12Å; S381-E384 WeakPolarHBondContact CB-OE2 3.4Å; S381-E384 PolarHBondContact N-OE2 3Å; S381-E384 PolarHBondContact O-N 3.47Å; S381-E384 WeakPolarHBondContact OG-CG 3.21Å; S381-E384 PolarHBondContact OG-N 2.96Å; S381-E384 PolarHBondContact OG-OE2 2.73Å; S381-V385 PolarHBondContact O-N 3.18Å
382	L	84.8	Confident	87	Confident	66 Å²	66	69 Å²	69	35%	0.346	34%	0.335	S	S	.	.	H	α-helix	trans	-55.2	-32.8	175.9	-170.8	63.9	0	0	0	112	V385 I386 L398 F401	L382-V385 PolarHBondContact O-N 3.09Å; L382-I386 HydrophobicContact CD2-CD1 4.46Å; L382-I386 HydrophobicContact CG-CD1 3.9Å; L382-I386 WeakPolarHBondContact O-CB 3.11Å; L382-I386 VanDerWaalsContact O-CG1 3.27Å; L382-I386 WeakPolarHBondContact O-CG1 3.26Å; L382-I386 PolarHBondContact O-N 2.87Å; L382-L398 HydrophobicContact CD1-CB 4.12Å; L382-L398 HydrophobicContact CD1-CD1 4.12Å; L382-F401 HydrophobicContact CD2-CD1 4.06Å
383	K	87.4	Confident	86.8	Confident	162 Å²	162	67.3 Å²	67.3	70%	0.704	32%	0.32	S	S	*	.	H	α-helix	trans	-65.4	-44.2	175.3	-66	-173.1	177.7	-175.3	0	112.7	S381 V385 I386 Q387	S381-K383 PolarHBondContact O-N 3.17Å; S381-K383 VanDerWaalsContact O-N 3.12Å; K383-V385 VanDerWaalsContact C-N 3.29Å; K383-V385 PolarHBondContact O-N 2.81Å; K383-I386 PolarHBondContact O-N 3.13Å; K383-Q387 WeakPolarHBondContact O-CB 3.43Å; K383-Q387 VanDerWaalsContact O-CG 3.26Å; K383-Q387 WeakPolarHBondContact O-CG 3.42Å; K383-Q387 PolarHBondContact O-N 3.21Å
384	E	89.6	Confident	86.8	Confident	53 Å²	53	66.6 Å²	66.6	25%	0.248	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-38.7	174.7	-74.8	162.1	113.8	0	0	111.4	R301 W380 S381 L388	R301-E384 IonicContact CZ-OE1 3.58Å; R301-E384 VanDerWaalsContact CZ-OE1 3.25Å; R301-E384 IonicContact NH1-OE1 3.57Å; R301-E384 PolarHBondContact NH1-OE1 2.93Å; R301-E384 IonicContact NH2-OE1 2.72Å; R301-E384 PolarHBondContact NH2-OE1 3.35Å; R301-E384 IonicContact NH2-OE2 3.93Å; R301-E384 PolarHBondContact NH2-OE2 2.96Å; W380-E384 HydrophobicContact CB-CB 4.27Å; W380-E384 HydrophobicContact CD2-CB 4.42Å; W380-E384 HydrophobicContact CE3-CB 3.91Å; S381-E384 WeakPolarHBondContact CB-OE2 3.4Å; S381-E384 PolarHBondContact N-OE2 3Å; S381-E384 PolarHBondContact O-N 3.47Å; S381-E384 WeakPolarHBondContact OG-CG 3.21Å; S381-E384 PolarHBondContact OG-N 2.96Å; S381-E384 PolarHBondContact OG-OE2 2.73Å; E384-L388 WeakPolarHBondContact O-CB 3.49Å; E384-L388 PolarHBondContact O-N 2.6Å
385	V	87.9	Confident	86.9	Confident	2 Å²	2	59 Å²	59	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-72.3	-41.7	177.8	-176.7	0	0	0	0	111.9	L251 V299 W380 S381 L382 K383 Q387 L388 H389 L398	L251-V385 HydrophobicContact CD2-CG1 4.06Å; L251-V385 HydrophobicContact CD2-CG2 4.27Å; L251-V385 HydrophobicContact CG-CG1 4.32Å; V299-V385 HydrophobicContact CB-CG2 4.3Å; V299-V385 HydrophobicContact CG2-CG2 4.13Å; W380-V385 HydrophobicContact CB-CG2 4Å; W380-V385 HydrophobicContact CE3-CG2 4.33Å; S381-V385 PolarHBondContact O-N 3.18Å; L382-V385 PolarHBondContact O-N 3.09Å; K383-V385 VanDerWaalsContact C-N 3.29Å; K383-V385 PolarHBondContact O-N 2.81Å; V385-Q387 VanDerWaalsContact C-N 3.34Å; V385-Q387 PolarHBondContact O-N 3.49Å; V385-L388 WeakPolarHBondContact O-CB 3.28Å; V385-L388 PolarHBondContact O-N 3.19Å; V385-H389 PolarHBondContact O-CD2 2.55Å; V385-H389 PolarHBondContact O-N 3.31Å; V385-L398 HydrophobicContact CG1-CD1 3.72Å
386	I	87.8	Confident	86.9	Confident	23 Å²	23	56.6 Å²	56.6	12%	0.118	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-43.9	174	-72	164.1	0	0	0	110.6	L382 K383 L388 H389 Y390 L398	L382-I386 HydrophobicContact CD2-CD1 4.46Å; L382-I386 HydrophobicContact CG-CD1 3.9Å; L382-I386 WeakPolarHBondContact O-CB 3.11Å; L382-I386 VanDerWaalsContact O-CG1 3.27Å; L382-I386 WeakPolarHBondContact O-CG1 3.26Å; L382-I386 PolarHBondContact O-N 2.87Å; K383-I386 PolarHBondContact O-N 3.13Å; I386-L388 PolarHBondContact O-N 2.83Å; I386-H389 PolarHBondContact O-N 2.88Å; I386-H389 VanDerWaalsContact O-N 3.16Å; I386-Y390 HydrophobicContact CG2-CD2 3.65Å; I386-Y390 HydrophobicContact CG2-CE2 3.61Å; I386-Y390 WeakPolarHBondContact O-CD2 3.32Å; I386-Y390 PolarHBondContact O-N 3.33Å; I386-L398 HydrophobicContact CD1-CB 4.3Å; I386-L398 HydrophobicContact CG1-CB 3.86Å
387	Q	88.5	Confident	86.9	Confident	131 Å²	131	56 Å²	56	61%	0.612	28%	0.282	S	S	*	.	H	α-helix	trans	-62	-40.2	175	-74.1	172.4	-10.4	0	0	112.4	K383 V385 H389 K391	K383-Q387 WeakPolarHBondContact O-CB 3.43Å; K383-Q387 VanDerWaalsContact O-CG 3.26Å; K383-Q387 WeakPolarHBondContact O-CG 3.42Å; K383-Q387 PolarHBondContact O-N 3.21Å; V385-Q387 VanDerWaalsContact C-N 3.34Å; V385-Q387 PolarHBondContact O-N 3.49Å; Q387-H389 VanDerWaalsContact C-N 3.32Å; Q387-H389 PolarHBondContact O-N 2.94Å; Q387-K391 WeakPolarHBondContact O-CB 3.43Å; Q387-K391 PolarHBondContact O-N 2.94Å
388	L	87.8	Confident	86.9	Confident	39 Å²	39	56 Å²	56	20%	0.204	28%	0.28	C	S	.	.	H	α-helix	trans	-59	-43.5	172.8	-173.6	73.2	0	0	0	111.3	D252 W380 E384 V385 I386 K391 I392	D252-L388 HydrophobicContact CB-CD2 3.99Å; W380-L388 HydrophobicContact CZ3-CB 4.45Å; W380-L388 HydrophobicContact CZ3-CD1 4.39Å; W380-L388 HydrophobicContact CZ3-CD2 4.05Å; E384-L388 WeakPolarHBondContact O-CB 3.49Å; E384-L388 PolarHBondContact O-N 2.6Å; V385-L388 WeakPolarHBondContact O-CB 3.28Å; V385-L388 PolarHBondContact O-N 3.19Å; I386-L388 PolarHBondContact O-N 2.83Å; L388-K391 PolarHBondContact O-N 3.05Å; L388-I392 HydrophobicContact CD1-CD1 3.64Å; L388-I392 HydrophobicContact CD1-CG1 4.39Å; L388-I392 HydrophobicContact CG-CD1 3.9Å; L388-I392 WeakPolarHBondContact O-CG1 3.48Å; L388-I392 PolarHBondContact O-N 3.02Å
389	H	89	Confident	86.3	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-68.3	-43.6	-179.6	-70.3	178.1	0	0	0	113.3	L251 D252 V385 I386 Q387 K391 Y393 G394 Q395 S396	L251-H389 PolarHBondContact O-CE1 2.95Å; L251-H389 PolarHBondContact O-NE2 3.21Å; D252-H389 WeakPolarHBondContact CA-NE2 3.27Å; V385-H389 PolarHBondContact O-CD2 2.55Å; V385-H389 PolarHBondContact O-N 3.31Å; I386-H389 PolarHBondContact O-N 2.88Å; I386-H389 VanDerWaalsContact O-N 3.16Å; Q387-H389 VanDerWaalsContact C-N 3.32Å; Q387-H389 PolarHBondContact O-N 2.94Å; H389-K391 VanDerWaalsContact C-N 3.34Å; H389-Y393 HydrophobicContact CB-CD2 4.31Å; H389-Y393 AromaticContact CD2-CE2 3.93Å; H389-Y393 WeakPolarHBondContact O-CA 3.36Å; H389-Y393 WeakPolarHBondContact O-CB 3.44Å; H389-Y393 PolarHBondContact O-N 2.97Å; H389-G394 PolarHBondContact O-N 2.87Å; H389-Q395 CarbonylContact C-O 3.44Å; H389-Q395 WeakPolarHBondContact CB-O 3.44Å; H389-S396 PolarHBondContact ND1-OG 3.05Å
390	Y	88.1	Confident	85.3	Confident	106 Å²	106	62.1 Å²	62.1	42%	0.416	30%	0.303	S	S	.	.	H	α-helix	trans	-62.2	-41.6	171.6	-80.8	-71.8	0	0	0	111.4	I386 I392 G394 D399	I386-Y390 HydrophobicContact CG2-CD2 3.65Å; I386-Y390 HydrophobicContact CG2-CE2 3.61Å; I386-Y390 WeakPolarHBondContact O-CD2 3.32Å; I386-Y390 PolarHBondContact O-N 3.33Å; Y390-I392 PolarHBondContact O-N 3.5Å; Y390-G394 VanDerWaalsContact O-CA 3.25Å; Y390-G394 WeakPolarHBondContact O-CA 3.02Å; Y390-G394 PolarHBondContact O-N 3.12Å; Y390-D399 PolarHBondContact OH-OD2 2.84Å
391	K	89.2	Confident	84.3	Confident	184 Å²	184	62.1 Å²	62.1	80%	0.8	31%	0.305	S	S	*	.	H	α-helix	trans	-65	-36.6	179.1	-177.6	174.2	-179	174.6	0	114.5	Q387 L388 H389	Q387-K391 WeakPolarHBondContact O-CB 3.43Å; Q387-K391 PolarHBondContact O-N 2.94Å; L388-K391 PolarHBondContact O-N 3.05Å; H389-K391 VanDerWaalsContact C-N 3.34Å
392	I	86.8	Confident	82.9	Confident	99 Å²	99	69 Å²	69	51%	0.508	32%	0.322	S	S	.	.	H	α-helix	trans	-97.4	-35.9	-175	-60.4	178.7	0	0	0	112.1	L388 Y390	L388-I392 HydrophobicContact CD1-CD1 3.64Å; L388-I392 HydrophobicContact CD1-CG1 4.39Å; L388-I392 HydrophobicContact CG-CD1 3.9Å; L388-I392 WeakPolarHBondContact O-CG1 3.48Å; L388-I392 PolarHBondContact O-N 3.02Å; Y390-I392 PolarHBondContact O-N 3.5Å
393	Y	87.4	Confident	81.3	Confident	39 Å²	39	69.6 Å²	69.6	15%	0.153	33%	0.33	C	S	.	.	H	α-helix	trans	-120.6	-14.2	-171.6	-44.8	-69.9	0	0	0	114.2	V204 R206 D252 G253 S254 H389 Q395	V204-Y393 HydrophobicContact CB-CD2 4.44Å; V204-Y393 HydrophobicContact CG1-CD2 4.23Å; V204-Y393 HydrophobicContact CG1-CG 4.16Å; V204-Y393 HydrophobicContact CG2-CD2 3.34Å; V204-Y393 HydrophobicContact CG2-CE2 3.65Å; V204-Y393 HydrophobicContact CG2-CG 3.99Å; R206-Y393 PolarHBondContact NH1-O 3.06Å; R206-Y393 PolarHBondContact NH2-O 3.04Å; D252-Y393 VanDerWaalsContact O-CE2 3.32Å; D252-Y393 WeakPolarHBondContact O-CE2 3.18Å; D252-Y393 PolarHBondContact O-OH 2.67Å; G253-Y393 VanDerWaalsContact C-OH 3.23Å; G253-Y393 PolarHBondContact O-OH 2.89Å; S254-Y393 WeakPolarHBondContact CA-OH 3.46Å; S254-Y393 PolarHBondContact N-OH 2.84Å; H389-Y393 HydrophobicContact CB-CD2 4.31Å; H389-Y393 AromaticContact CD2-CE2 3.93Å; H389-Y393 WeakPolarHBondContact O-CA 3.36Å; H389-Y393 WeakPolarHBondContact O-CB 3.44Å; H389-Y393 PolarHBondContact O-N 2.97Å; Y393-Q395 VanDerWaalsContact C-N 3.35Å
394	G	84.6	Confident	79.5	Confident	42 Å²	42	65.6 Å²	65.6	43%	0.433	32%	0.315	S	S	.	.	S	Bend	trans	80.6	4.3	-178.1	0	0	0	0	0	115.7	H389 Y390	H389-G394 PolarHBondContact O-N 2.87Å; Y390-G394 VanDerWaalsContact O-CA 3.25Å; Y390-G394 WeakPolarHBondContact O-CA 3.02Å; Y390-G394 PolarHBondContact O-N 3.12Å
395	Q	84.2	Confident	76.8	Confident	14 Å²	14	68.2 Å²	68.2	7%	0.065	34%	0.335	C	S	.	.			trans	-157.3	164.9	174.6	72.8	-177	69.9	0	0	110.9	V204 R206 H389 Y393 L432	V204-Q395 HydrophobicContact CG1-CG 3.54Å; V204-Q395 PolarHBondContact O-NE2 2.87Å; R206-Q395 VanDerWaalsContact NE-CD 3.31Å; H389-Q395 CarbonylContact C-O 3.44Å; H389-Q395 WeakPolarHBondContact CB-O 3.44Å; Y393-Q395 VanDerWaalsContact C-N 3.35Å; Q395-L432 HydrophobicContact CB-CD1 3.98Å
396	S	85.4	Confident	73.9	Confident	11 Å²	11	73.9 Å²	73.9	8%	0.077	38%	0.375	C	S	.	.			trans	-140.9	138.7	168.9	-168.3	0	0	0	0	110.5	H389 L398	H389-S396 PolarHBondContact ND1-OG 3.05Å; S396-L398 VanDerWaalsContact C-N 3.34Å; S396-L398 PolarHBondContact OG-N 3.24Å
397	L	84.7	Confident	70.9	Confident	10 Å²	10	79.5 Å²	79.5	5%	0.052	41%	0.405	C	S	.	.	S	Bend	trans	-77.5	-27.8	170.7	-170.7	63.9	0	0	0	111.2	H150 D151 P203 D399 K400 L433	H150-L397 HydrophobicContact CB-CD2 4.17Å; D151-L397 HydrophobicContact CB-CD1 4.12Å; D151-L397 HydrophobicContact CB-CG 4.07Å; P203-L397 VanDerWaalsContact O-CB 3.27Å; P203-L397 WeakPolarHBondContact O-CB 3.07Å; P203-L397 PolarHBondContact O-N 2.79Å; L397-D399 PolarHBondContact O-N 2.91Å; L397-D399 VanDerWaalsContact O-N 3.12Å; L397-K400 PolarHBondContact O-N 3.12Å; L397-L433 HydrophobicContact CD1-CD1 4.25Å
398	L	83.2	Confident	68	Low	8 Å²	8	75.7 Å²	75.7	4%	0.042	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-61.7	-17.3	178.3	-56.3	177.1	0	0	0	113.6	H150 L251 L382 V385 I386 S396 K400 F401	H150-L398 HydrophobicContact CB-CD2 3.74Å; L251-L398 HydrophobicContact CD1-CD1 4.48Å; L251-L398 HydrophobicContact CG-CD1 4.5Å; L382-L398 HydrophobicContact CD1-CB 4.12Å; L382-L398 HydrophobicContact CD1-CD1 4.12Å; V385-L398 HydrophobicContact CG1-CD1 3.72Å; I386-L398 HydrophobicContact CD1-CB 4.3Å; I386-L398 HydrophobicContact CG1-CB 3.86Å; S396-L398 VanDerWaalsContact C-N 3.34Å; S396-L398 PolarHBondContact OG-N 3.24Å; L398-K400 PolarHBondContact O-N 3.41Å; L398-F401 WeakPolarHBondContact O-CB 3.49Å; L398-F401 PolarHBondContact O-N 3.15Å; L398-F401 VanDerWaalsContact O-N 3.1Å
399	D	74	Confident	65.1	Low	89 Å²	89	81.8 Å²	81.8	48%	0.476	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-65.4	-27.4	178.5	-154.1	32.1	0	0	0	112.4	Y390 L397	Y390-D399 PolarHBondContact OH-OD2 2.84Å; L397-D399 PolarHBondContact O-N 2.91Å; L397-D399 VanDerWaalsContact O-N 3.12Å
400	K	66	Low	62	Low	123 Å²	123	86.4 Å²	86.4	54%	0.535	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-90.1	-1.1	175.5	-60.2	-168	178.9	-169.3	0	113.2	D151 L397 L398 R402	D151-K400 HydrophobicContact CB-CB 3.98Å; L397-K400 PolarHBondContact O-N 3.12Å; L398-K400 PolarHBondContact O-N 3.41Å; K400-R402 PolarHBondContact O-N 3.44Å
401	F	67.1	Low	59.1	Low	48 Å²	48	88.4 Å²	88.4	21%	0.211	48%	0.48	C	S	.	.			trans	-82.6	110.7	-179.4	-179.8	-120.9	0	0	0	111.7	P88 L382 L398 P403	P88-F401 HydrophobicContact CB-CD2 3.95Å; P88-F401 HydrophobicContact CB-CE2 3.45Å; P88-F401 VanDerWaalsContact CB-CE2 3.45Å; P88-F401 HydrophobicContact CB-CZ 4.17Å; P88-F401 WeakPolarHBondContact O-CE2 3.21Å; P88-F401 WeakPolarHBondContact O-CZ 3.4Å; L382-F401 HydrophobicContact CD2-CD1 4.06Å; L398-F401 WeakPolarHBondContact O-CB 3.49Å; L398-F401 PolarHBondContact O-N 3.15Å; L398-F401 VanDerWaalsContact O-N 3.1Å; F401-P403 HydrophobicContact CE1-CB 3.77Å; F401-P403 HydrophobicContact CE1-CG 4.49Å; F401-P403 HydrophobicContact CZ-CB 4.02Å; F401-P403 VanDerWaalsContact O-CD 3.3Å; F401-P403 WeakPolarHBondContact O-CD 3.49Å
402	R	57.3	Low	56.1	Low	201 Å²	201	87 Å²	87	76%	0.758	48%	0.477	S	S	*	.			trans	-93.7	104.8	168.2	-64.8	-171.8	-176.5	-179.6	4.5	109.3	K400	K400-R402 PolarHBondContact O-N 3.44Å
403	P	50.9	Low	53.6	Low	77 Å²	77	87.9 Å²	87.9	50%	0.5	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-69.4	156.6	177.1	28.9	-35.2	0	0	0	111.8	F401 T405	F401-P403 HydrophobicContact CE1-CB 3.77Å; F401-P403 HydrophobicContact CE1-CG 4.49Å; F401-P403 HydrophobicContact CZ-CB 4.02Å; F401-P403 VanDerWaalsContact O-CD 3.3Å; F401-P403 WeakPolarHBondContact O-CD 3.49Å; P403-T405 PolarHBondContact O-N 2.61Å
404	I	50.4	Low	50.6	Low	78 Å²	78	92.1 Å²	92.1	40%	0.4	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-67	118.3	169.6	-53	171.2	0	0	0	108.6	S89	S89-I404 WeakPolarHBondContact O-CD1 3.35Å; S89-I404 WeakPolarHBondContact O-CG1 3.44Å
405	T	33.2	Very low	48.1	Very low	108 Å²	108	95.7 Å²	95.7	66%	0.663	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-72.2	133.5	163.3	45.8	0	0	0	0	109.4	P403 N407	P403-T405 PolarHBondContact O-N 2.61Å; T405-N407 PolarHBondContact O-N 3.29Å
406	S	27.3	Very low	45.6	Very low	121 Å²	121	98.3 Å²	98.3	85%	0.846	54%	0.543	S	S	*	.	S	Bend	trans	-63.4	-6.7	-168.2	57.9	0	0	0	0	116.2
407	N	24.3	Very low	43	Very low	141 Å²	141	104 Å²	104	75%	0.754	57%	0.572	S	S	*	*	S	Bend	trans	-114.8	112.7	173.3	-62.3	2.6	0	0	0	108.5	T405	T405-N407 PolarHBondContact O-N 3.29Å
408	G	26.9	Very low	40.6	Very low	52 Å²	52	110.6 Å²	110.6	54%	0.536	60%	0.602	S	S	.	*			trans	139.5	82.3	171	0	0	0	0	0	115.6	S410	G408-S410 PolarHBondContact O-N 3.34Å
409	L	26.8	Very low	38	Very low	167 Å²	167	116.9 Å²	116.9	87%	0.874	64%	0.636	S	S	*	*	S	Bend	trans	-76.9	44	159.5	-79.8	169.1	0	0	0	110.8
410	S	24.3	Very low	35.8	Very low	96 Å²	96	121.2 Å²	121.2	67%	0.671	65%	0.651	S	S	*	*			trans	-164.4	72.1	-165.3	56.5	0	0	0	0	111.8	G408	G408-S410 PolarHBondContact O-N 3.34Å
411	M	26.4	Very low	34	Very low	148 Å²	148	122.7 Å²	122.7	73%	0.729	66%	0.664	S	S	*	*			trans	-136.8	82	156	-83.4	-168.9	74.5	0	0	108.6
412	E	27.9	Very low	32.2	Very low	155 Å²	155	127.7 Å²	127.7	72%	0.724	69%	0.693	S	S	*	*			trans	-65.3	143.3	146	-62.9	-165.1	115.6	0	0	107.3	D414	E412-D414 PolarHBondContact O-N 2.75Å
413	L	32.3	Very low	30.7	Very low	117 Å²	117	124 Å²	124	61%	0.613	70%	0.699	S	S	*	*			trans	-90.7	98.4	-178.2	-77.1	143.7	0	0	0	108	P415	L413-P415 WeakPolarHBondContact O-CD 3.43Å
414	D	25.7	Very low	29.5	Very low	128 Å²	128	125 Å²	125	68%	0.684	71%	0.707	S	S	*	*			trans	-63.5	124.9	164.7	-94.6	-45.1	0	0	0	109.1	E412 S416	E412-D414 PolarHBondContact O-N 2.75Å; D414-S416 PolarHBondContact O-N 2.9Å
415	P	32.6	Very low	28.3	Very low	118 Å²	118	129.4 Å²	129.4	77%	0.766	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	7.8	-178.1	-21.3	34.5	0	0	0	115.6	L413	L413-P415 WeakPolarHBondContact O-CD 3.43Å
416	S	31	Very low	28	Very low	69 Å²	69	130.8 Å²	130.8	48%	0.483	73%	0.732	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.9	-31.7	-172.9	50.5	0	0	0	0	114.6	D414 E418	D414-S416 PolarHBondContact O-N 2.9Å; S416-E418 PolarHBondContact O-N 2.81Å
417	D	31.9	Very low	27.8	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-89.4	-1.1	-158.5	-72.2	11.9	0	0	0	114.5	N419	D417-N419 PolarHBondContact O-N 3.33Å
418	E	33.2	Very low	27.8	Very low	149 Å²	149	134.1 Å²	134.1	70%	0.696	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-73.3	-3	172.6	-63.1	-160.3	137.1	0	0	113.8	S416	S416-E418 PolarHBondContact O-N 2.81Å
419	N	28.9	Very low	27.9	Very low	141 Å²	141	135 Å²	135	75%	0.754	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-105.1	3.7	-173.5	-73.4	-71.8	0	0	0	115.7	D417	D417-N419 PolarHBondContact O-N 3.33Å
420	K	27.8	Very low	28	Very low	180 Å²	180	133.3 Å²	133.3	78%	0.783	73%	0.725	S	S	*	*	S	Bend	trans	-145	86.7	178.8	-68.6	-176.7	-177	173	0	112.6
421	D	28.7	Very low	28.3	Very low	153 Å²	153	132.4 Å²	132.4	82%	0.818	71%	0.712	S	S	*	*	S	Bend		178.9	161.3	125.6	-94.1	-13.5	0	0	0	112.4
422	N	29.1	Very low	29	Very low	153 Å²	153	127.9 Å²	127.9	82%	0.818	69%	0.691	S	S	*	*			trans	67.3	71.9	173.2	-59.3	-56.1	0	0	0	117.1	S424	N422-S424 PolarHBondContact O-N 2.81Å
423	S	25	Very low	29.9	Very low	124 Å²	124	122.4 Å²	122.4	87%	0.867	67%	0.666	S	S	*	*			trans	-70.4	85.6	164.1	56.3	0	0	0	0	113.1
424	S	25.3	Very low	30.7	Very low	98 Å²	98	122.1 Å²	122.1	69%	0.685	66%	0.662	S	S	*	*	S	Bend	trans	-168.9	132.9	148.9	44.5	0	0	0	0	112.9	N422	N422-S424 PolarHBondContact O-N 2.81Å
425	I	25.4	Very low	31.6	Very low	171 Å²	171	117.1 Å²	117.1	88%	0.877	64%	0.636	S	S	*	*	S	Bend	trans	51.6	72.1	166.9	-43	173.6	0	0	0	115.5
426	L	26.6	Very low	32.3	Very low	136 Å²	136	116.9 Å²	116.9	71%	0.712	63%	0.634	S	S	*	*			trans	-157.2	54.1	164.4	-119.7	168.8	0	0	0	115	S429	L426-S429 WeakPolarHBondContact CD2-OG 3.2Å
427	N	23.1	Very low	33.2	Very low	159 Å²	159	119.7 Å²	119.7	85%	0.85	64%	0.639	S	S	*	*			trans	-90.1	150.6	163.7	-77	-31	0	0	0	110.6
428	Q	24.9	Very low	34.3	Very low	173 Å²	173	113.8 Å²	113.8	81%	0.808	61%	0.609	S	S	*	*			trans	83.2	16	172.1	-52.2	-174.6	-24.4	0	0	120.3	D430 I431	Q428-D430 PolarHBondContact O-N 3.27Å; Q428-I431 WeakPolarHBondContact O-CD1 3.2Å; Q428-I431 VanDerWaalsContact O-CG1 3.27Å; Q428-I431 WeakPolarHBondContact O-CG1 3.21Å
429	S	28.7	Very low	35.8	Very low	71 Å²	71	108.5 Å²	108.5	50%	0.497	59%	0.585	S	S	.	*			trans	-93	30.3	-171.7	60.4	0	0	0	0	119	L426 I431	L426-S429 WeakPolarHBondContact CD2-OG 3.2Å; S429-I431 PolarHBondContact O-N 3.09Å; S429-I431 VanDerWaalsContact O-N 3.07Å
430	D	28.3	Very low	37.6	Very low	132 Å²	132	104.1 Å²	104.1	71%	0.706	57%	0.569	S	S	*	*	S	Bend	trans	-82.8	44.1	160.7	-134.7	-1.6	0	0	0	109.9	K171 Q428	K171-D430 VanDerWaalsContact NZ-CG 3.34Å; K171-D430 IonicContact NZ-OD1 3.75Å; K171-D430 PolarHBondContact NZ-OD1 2.83Å; K171-D430 IonicContact NZ-OD2 2.88Å; K171-D430 PolarHBondContact NZ-OD2 2.84Å; Q428-D430 PolarHBondContact O-N 3.27Å
431	I	32.3	Very low	39.6	Very low	77 Å²	77	99.6 Å²	99.6	40%	0.395	55%	0.552	S	S	.	*			trans	-142	144.9	-164.5	-64.7	-168.3	0	0	0	105.9	Q428 S429 T435	Q428-I431 WeakPolarHBondContact O-CD1 3.2Å; Q428-I431 VanDerWaalsContact O-CG1 3.27Å; Q428-I431 WeakPolarHBondContact O-CG1 3.21Å; S429-I431 PolarHBondContact O-N 3.09Å; S429-I431 VanDerWaalsContact O-N 3.07Å; I431-T435 HydrophobicContact CB-CG2 3.97Å; I431-T435 HydrophobicContact CD1-CG2 4.03Å; I431-T435 HydrophobicContact CG1-CG2 3.6Å; I431-T435 HydrophobicContact CG2-CG2 3.78Å
432	L	39.7	Very low	41.4	Very low	53 Å²	53	92.5 Å²	92.5	28%	0.277	51%	0.514	S	S	.	.	S	Bend	cis	-110.9	-9.6	20.9	-74.6	162.9	0	0	0	116.4	Q395 E434 T435 A438	Q395-L432 HydrophobicContact CB-CD1 3.98Å; L432-E434 VanDerWaalsContact C-N 3.27Å; L432-E434 PolarHBondContact O-N 2.79Å; L432-T435 PolarHBondContact O-N 3.35Å; L432-T435 PolarHBondContact O-OG1 3.46Å; L432-A438 HydrophobicContact CB-CB 4.36Å; L432-A438 WeakPolarHBondContact O-CB 3.43Å
433	L	47.2	Very low	43.5	Very low	40 Å²	40	90 Å²	90	21%	0.209	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-28.5	-158.9	-84.4	158.3	0	0	0	115.8	G205 A223 L397	G205-L433 WeakPolarHBondContact O-CD2 3.33Å; A223-L433 VanDerWaalsContact CA-O 3.29Å; A223-L433 WeakPolarHBondContact CA-O 3.28Å; A223-L433 WeakPolarHBondContact CB-O 3.21Å; L397-L433 HydrophobicContact CD1-CD1 4.25Å
434	E	48.5	Very low	45.8	Very low	111 Å²	111	87.6 Å²	87.6	52%	0.519	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	14.9	-176.9	-75.6	157.5	-150.4	0	0	112.3	R154 Q186 L432	R154-E434 IonicContact CZ-OE1 2.65Å; R154-E434 IonicContact NH1-OE1 3.81Å; R154-E434 IonicContact NH2-OE1 3.4Å; R154-E434 PolarHBondContact NH2-OE1 2.97Å; Q186-E434 PolarHBondContact NE2-OE1 2.84Å; L432-E434 VanDerWaalsContact C-N 3.27Å; L432-E434 PolarHBondContact O-N 2.79Å
435	T	44.6	Very low	47.9	Very low	22 Å²	22	86.1 Å²	86.1	14%	0.135	46%	0.459	C	S	.	.			trans	-75.6	148.5	179.3	55	0	0	0	0	113	I431 L432 E437 A438 L439	I431-T435 HydrophobicContact CB-CG2 3.97Å; I431-T435 HydrophobicContact CD1-CG2 4.03Å; I431-T435 HydrophobicContact CG1-CG2 3.6Å; I431-T435 HydrophobicContact CG2-CG2 3.78Å; L432-T435 PolarHBondContact O-N 3.35Å; L432-T435 PolarHBondContact O-OG1 3.46Å; T435-E437 PolarHBondContact O-N 3.02Å; T435-E437 VanDerWaalsContact O-N 3.16Å; T435-A438 PolarHBondContact O-N 2.82Å; T435-A438 VanDerWaalsContact O-N 3.14Å; T435-A438 PolarHBondContact OG1-N 2.54Å; T435-L439 PolarHBondContact O-N 3.12Å
436	P	47.5	Very low	50	Low	113 Å²	113	79.1 Å²	79.1	73%	0.734	43%	0.426	S	S	*	.	H	α-helix	trans	-54.3	-33.2	173.3	-27.6	35.7	0	0	0	113.5	A440	P436-A440 VanDerWaalsContact O-CB 3.24Å; P436-A440 WeakPolarHBondContact O-CB 3.39Å; P436-A440 PolarHBondContact O-N 2.7Å
437	E	49.7	Very low	52.2	Low	128 Å²	128	77.2 Å²	77.2	60%	0.598	41%	0.414	S	S	*	.	H	α-helix	trans	-67.2	-48.1	176.1	-175.2	-176.4	-170	0	0	112.5	T435 L439 A440 L441	T435-E437 PolarHBondContact O-N 3.02Å; T435-E437 VanDerWaalsContact O-N 3.16Å; E437-L439 VanDerWaalsContact C-N 3.29Å; E437-L439 PolarHBondContact O-N 3.17Å; E437-A440 WeakPolarHBondContact O-CB 3.34Å; E437-A440 PolarHBondContact O-N 2.95Å; E437-A440 VanDerWaalsContact O-N 3.14Å; E437-L441 HydrophobicContact CG-CD1 4.38Å; E437-L441 WeakPolarHBondContact O-CG 3.19Å; E437-L441 PolarHBondContact O-N 3.24Å
438	A	55.3	Low	54.4	Low	5 Å²	5	74.2 Å²	74.2	4%	0.041	40%	0.397	C	S	.	.	H	α-helix	trans	-64.8	-36.9	177.4	0	0	0	0	0	111.6	L432 T435 L441 Q442	L432-A438 HydrophobicContact CB-CB 4.36Å; L432-A438 WeakPolarHBondContact O-CB 3.43Å; T435-A438 PolarHBondContact O-N 2.82Å; T435-A438 VanDerWaalsContact O-N 3.14Å; T435-A438 PolarHBondContact OG1-N 2.54Å; A438-L441 PolarHBondContact O-N 3.36Å; A438-Q442 WeakPolarHBondContact O-CB 3.34Å; A438-Q442 VanDerWaalsContact O-CG 3.29Å; A438-Q442 WeakPolarHBondContact O-CG 3.31Å; A438-Q442 PolarHBondContact O-N 3.07Å
439	L	64.6	Low	56.4	Low	38 Å²	38	67.4 Å²	67.4	20%	0.199	36%	0.364	C	S	.	.	H	α-helix	trans	-65.8	-38.7	172.1	-176.2	61.1	0	0	0	112	A223 D224 T435 E437 Q442 K443	A223-L439 HydrophobicContact CB-CD1 4.46Å; D224-L439 HydrophobicContact CB-CD1 3.93Å; T435-L439 PolarHBondContact O-N 3.12Å; E437-L439 VanDerWaalsContact C-N 3.29Å; E437-L439 PolarHBondContact O-N 3.17Å; L439-Q442 PolarHBondContact O-N 3.44Å; L439-K443 HydrophobicContact CD1-CD 4.49Å; L439-K443 HydrophobicContact CG-CD 4.2Å; L439-K443 WeakPolarHBondContact O-CB 3.34Å; L439-K443 VanDerWaalsContact O-CG 3.27Å; L439-K443 WeakPolarHBondContact O-CG 3.26Å; L439-K443 PolarHBondContact O-N 3.45Å
440	A	68	Low	58.3	Low	50 Å²	50	67.5 Å²	67.5	41%	0.413	36%	0.362	S	S	.	.	H	α-helix	trans	-65.8	-44	174.3	0	0	0	0	0	111.7	P436 E437 Q442 K443 T444	P436-A440 VanDerWaalsContact O-CB 3.24Å; P436-A440 WeakPolarHBondContact O-CB 3.39Å; P436-A440 PolarHBondContact O-N 2.7Å; E437-A440 WeakPolarHBondContact O-CB 3.34Å; E437-A440 PolarHBondContact O-N 2.95Å; E437-A440 VanDerWaalsContact O-N 3.14Å; A440-Q442 VanDerWaalsContact C-N 3.35Å; A440-Q442 PolarHBondContact O-N 3.37Å; A440-K443 PolarHBondContact O-N 2.74Å; A440-T444 WeakPolarHBondContact O-CB 3.39Å; A440-T444 PolarHBondContact O-N 2.9Å; A440-T444 PolarHBondContact O-OG1 3Å
441	L	68.9	Low	60.2	Low	84 Å²	84	67.2 Å²	67.2	44%	0.44	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-41.7	174.5	-72.1	171	0	0	0	111.9	E437 A438 Q445	E437-L441 HydrophobicContact CG-CD1 4.38Å; E437-L441 WeakPolarHBondContact O-CG 3.19Å; E437-L441 PolarHBondContact O-N 3.24Å; A438-L441 PolarHBondContact O-N 3.36Å; L441-Q445 WeakPolarHBondContact O-CB 3.42Å; L441-Q445 VanDerWaalsContact O-CG 3.26Å; L441-Q445 WeakPolarHBondContact O-CG 3.27Å; L441-Q445 PolarHBondContact O-N 3.2Å
442	Q	66.9	Low	61.6	Low	4 Å²	4	69.7 Å²	69.7	2%	0.019	37%	0.368	C	S	.	.	H	α-helix	trans	-65.3	-43.1	174.7	-72.5	176.9	18.7	0	0	111.7	R221 A438 L439 A440 Q445 A446	R221-Q442 VanDerWaalsContact CD-OE1 3.26Å; A438-Q442 WeakPolarHBondContact O-CB 3.34Å; A438-Q442 VanDerWaalsContact O-CG 3.29Å; A438-Q442 WeakPolarHBondContact O-CG 3.31Å; A438-Q442 PolarHBondContact O-N 3.07Å; L439-Q442 PolarHBondContact O-N 3.44Å; A440-Q442 VanDerWaalsContact C-N 3.35Å; A440-Q442 PolarHBondContact O-N 3.37Å; Q442-Q445 PolarHBondContact O-N 2.9Å; Q442-A446 PolarHBondContact O-N 3.48Å
443	K	72.9	Confident	62.1	Low	102 Å²	102	74.1 Å²	74.1	44%	0.443	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-45.3	174.8	-75.5	170.5	178.4	175.4	0	112.3	L439 A440 Q445 A446 E447	L439-K443 HydrophobicContact CD1-CD 4.49Å; L439-K443 HydrophobicContact CG-CD 4.2Å; L439-K443 WeakPolarHBondContact O-CB 3.34Å; L439-K443 VanDerWaalsContact O-CG 3.27Å; L439-K443 WeakPolarHBondContact O-CG 3.26Å; L439-K443 PolarHBondContact O-N 3.45Å; A440-K443 PolarHBondContact O-N 2.74Å; K443-Q445 VanDerWaalsContact C-N 3.32Å; K443-Q445 PolarHBondContact O-N 3.06Å; K443-A446 WeakPolarHBondContact O-CB 3.47Å; K443-A446 PolarHBondContact O-N 3.27Å; K443-A446 VanDerWaalsContact O-N 3.16Å; K443-E447 PolarHBondContact O-N 2.82Å
444	T	73.2	Confident	61.9	Low	73 Å²	73	79.3 Å²	79.3	45%	0.448	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-38.5	175.3	-58.7	0	0	0	0	111.6	A440 E447 L448	A440-T444 WeakPolarHBondContact O-CB 3.39Å; A440-T444 PolarHBondContact O-N 2.9Å; A440-T444 PolarHBondContact O-OG1 3Å; T444-E447 PolarHBondContact O-N 2.9Å; T444-L448 HydrophobicContact CG2-CD1 4.18Å; T444-L448 WeakPolarHBondContact O-CB 3.41Å; T444-L448 VanDerWaalsContact O-CG 3.26Å; T444-L448 WeakPolarHBondContact O-CG 3.43Å; T444-L448 PolarHBondContact O-N 3.36Å
445	Q	69.8	Low	61.1	Low	66 Å²	66	78.1 Å²	78.1	31%	0.308	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-41.6	172.8	-74.6	173.3	19.5	0	0	112	L441 Q442 K443 L448 R449	L441-Q445 WeakPolarHBondContact O-CB 3.42Å; L441-Q445 VanDerWaalsContact O-CG 3.26Å; L441-Q445 WeakPolarHBondContact O-CG 3.27Å; L441-Q445 PolarHBondContact O-N 3.2Å; Q442-Q445 PolarHBondContact O-N 2.9Å; K443-Q445 VanDerWaalsContact C-N 3.32Å; K443-Q445 PolarHBondContact O-N 3.06Å; Q445-L448 PolarHBondContact O-N 3.26Å; Q445-R449 WeakPolarHBondContact O-CB 3.37Å; Q445-R449 WeakPolarHBondContact O-CD 3.34Å; Q445-R449 WeakPolarHBondContact O-CG 3.38Å; Q445-R449 PolarHBondContact O-N 2.91Å
446	A	69.3	Low	60.6	Low	24 Å²	24	82.4 Å²	82.4	20%	0.198	44%	0.44	C	S	.	.	H	α-helix	trans	-63.2	-42.1	174.2	0	0	0	0	0	112.1	Q442 K443 R449 T450	Q442-A446 PolarHBondContact O-N 3.48Å; K443-A446 WeakPolarHBondContact O-CB 3.47Å; K443-A446 PolarHBondContact O-N 3.27Å; K443-A446 VanDerWaalsContact O-N 3.16Å; A446-R449 WeakPolarHBondContact O-CB 3.38Å; A446-R449 PolarHBondContact O-N 2.88Å; A446-T450 WeakPolarHBondContact O-CG2 3.45Å; A446-T450 PolarHBondContact O-N 2.78Å; A446-T450 PolarHBondContact O-OG1 3.41Å
447	E	73.5	Confident	59.8	Low	96 Å²	96	83.6 Å²	83.6	45%	0.449	45%	0.445	S	S	.	.	H	α-helix	trans	-63.7	-40.8	173.7	-78.8	-173.2	-143	0	0	113.3	K443 T444 R449 T450 K451	K443-E447 PolarHBondContact O-N 2.82Å; T444-E447 PolarHBondContact O-N 2.9Å; E447-R449 VanDerWaalsContact C-N 3.32Å; E447-T450 WeakPolarHBondContact CA-OG1 3.49Å; E447-T450 PolarHBondContact O-N 2.71Å; E447-T450 PolarHBondContact O-OG1 2.83Å; E447-K451 WeakPolarHBondContact O-CB 3.3Å; E447-K451 WeakPolarHBondContact O-CD 3.47Å; E447-K451 WeakPolarHBondContact O-CG 3.46Å; E447-K451 PolarHBondContact O-N 2.88Å; E447-K451 IonicContact OE2-NZ 3.85Å; E447-K451 PolarHBondContact OE2-NZ 3.35Å
448	L	69.7	Low	59	Low	96 Å²	96	88.7 Å²	88.7	50%	0.503	46%	0.459	S	S	.	.	H	α-helix	trans	-64.8	-40	174.6	-72.7	167.7	0	0	0	110.4	T444 Q445 K451 L452	T444-L448 HydrophobicContact CG2-CD1 4.18Å; T444-L448 WeakPolarHBondContact O-CB 3.41Å; T444-L448 VanDerWaalsContact O-CG 3.26Å; T444-L448 WeakPolarHBondContact O-CG 3.43Å; T444-L448 PolarHBondContact O-N 3.36Å; Q445-L448 PolarHBondContact O-N 3.26Å; L448-K451 PolarHBondContact O-N 3.41Å; L448-L452 WeakPolarHBondContact O-CB 3.16Å; L448-L452 WeakPolarHBondContact O-CD1 3.21Å; L448-L452 WeakPolarHBondContact O-CG 3.47Å; L448-L452 PolarHBondContact O-N 3.31Å
449	R	67	Low	57.9	Low	30 Å²	30	94.5 Å²	94.5	11%	0.113	49%	0.489	C	S	.	.	H	α-helix	trans	-62.3	-39.2	173.3	-73.2	163.1	170.8	159.1	-0.8	112.4	Y207 E228 R274 T275 Q445 A446 E447 K453	Y207-R449 PolarHBondContact OH-NH1 3.32Å; E228-R449 IonicContact OE1-CZ 3.36Å; E228-R449 IonicContact OE1-NH1 2.68Å; E228-R449 PolarHBondContact OE1-NH1 2.97Å; R274-R449 PolarHBondContact O-NH2 3.38Å; T275-R449 PolarHBondContact O-NE 2.9Å; T275-R449 PolarHBondContact O-NH2 2.81Å; Q445-R449 WeakPolarHBondContact O-CB 3.37Å; Q445-R449 WeakPolarHBondContact O-CD 3.34Å; Q445-R449 WeakPolarHBondContact O-CG 3.38Å; Q445-R449 PolarHBondContact O-N 2.91Å; A446-R449 WeakPolarHBondContact O-CB 3.38Å; A446-R449 PolarHBondContact O-N 2.88Å; E447-R449 VanDerWaalsContact C-N 3.32Å; R449-K453 VanDerWaalsContact O-CG 3.3Å; R449-K453 WeakPolarHBondContact O-CG 3.27Å; R449-K453 PolarHBondContact O-N 3.1Å
450	T	67.6	Low	56.5	Low	73 Å²	73	101.1 Å²	101.1	45%	0.448	52%	0.517	S	S	.	.	H	α-helix	trans	-73.2	-41.4	175.9	57.2	0	0	0	0	112	A446 E447 L452 K453 H454	A446-T450 WeakPolarHBondContact O-CG2 3.45Å; A446-T450 PolarHBondContact O-N 2.78Å; A446-T450 PolarHBondContact O-OG1 3.41Å; E447-T450 WeakPolarHBondContact CA-OG1 3.49Å; E447-T450 PolarHBondContact O-N 2.71Å; E447-T450 PolarHBondContact O-OG1 2.83Å; T450-L452 PolarHBondContact O-N 3.01Å; T450-K453 PolarHBondContact O-N 2.73Å; T450-H454 PolarHBondContact O-N 3.46Å; T450-H454 PolarHBondContact O-ND1 3.37Å
451	K	68.3	Low	54.8	Low	126 Å²	126	108.5 Å²	108.5	55%	0.548	54%	0.542	S	S	.	.	H	α-helix	trans	-58.3	-44.5	174	-72.4	161.4	-172.6	158.7	0	111.5	E447 L448 K453 H454	E447-K451 WeakPolarHBondContact O-CB 3.3Å; E447-K451 WeakPolarHBondContact O-CD 3.47Å; E447-K451 WeakPolarHBondContact O-CG 3.46Å; E447-K451 PolarHBondContact O-N 2.88Å; E447-K451 IonicContact OE2-NZ 3.85Å; E447-K451 PolarHBondContact OE2-NZ 3.35Å; L448-K451 PolarHBondContact O-N 3.41Å; K451-K453 PolarHBondContact O-N 3.18Å; K451-H454 PolarHBondContact O-N 3.14Å
452	L	61	Low	53	Low	130 Å²	130	109.1 Å²	109.1	68%	0.681	56%	0.56	S	S	*	*	H	α-helix	trans	-60.5	-42.3	174.4	-85.3	158.3	0	0	0	112.8	L448 T450 H454 S455	L448-L452 WeakPolarHBondContact O-CB 3.16Å; L448-L452 WeakPolarHBondContact O-CD1 3.21Å; L448-L452 WeakPolarHBondContact O-CG 3.47Å; L448-L452 PolarHBondContact O-N 3.31Å; T450-L452 PolarHBondContact O-N 3.01Å; L452-H454 VanDerWaalsContact C-N 3.29Å; L452-H454 PolarHBondContact O-N 3.06Å; L452-S455 PolarHBondContact O-OG 2.95Å; L452-S455 VanDerWaalsContact O-OG 3.04Å
453	K	51.6	Low	51.3	Low	145 Å²	145	119.2 Å²	119.2	63%	0.63	60%	0.604	S	S	*	*	H	α-helix	trans	-68.3	-20.7	179.3	-77.4	172.4	-180	174.5	0	114.4	R449 T450 K451	R449-K453 VanDerWaalsContact O-CG 3.3Å; R449-K453 WeakPolarHBondContact O-CG 3.27Å; R449-K453 PolarHBondContact O-N 3.1Å; T450-K453 PolarHBondContact O-N 2.73Å; K451-K453 PolarHBondContact O-N 3.18Å
454	H	43	Very low	49.1	Very low	149 Å²	149	119.8 Å²	119.8	69%	0.69	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	18.5	-177.4	-68.3	86.9	0	0	0	113.9	T450 K451 L452 P456	T450-H454 PolarHBondContact O-N 3.46Å; T450-H454 PolarHBondContact O-ND1 3.37Å; K451-H454 PolarHBondContact O-N 3.14Å; L452-H454 VanDerWaalsContact C-N 3.29Å; L452-H454 PolarHBondContact O-N 3.06Å; H454-P456 WeakPolarHBondContact O-CD 3.48Å
455	S	31	Very low	47.1	Very low	86 Å²	86	122 Å²	122	60%	0.601	63%	0.628	S	S	*	*			trans	-67.3	117.1	168.3	50.3	0	0	0	0	109.8	L452 T457	L452-S455 PolarHBondContact O-OG 2.95Å; L452-S455 VanDerWaalsContact O-OG 3.04Å; S455-T457 PolarHBondContact O-N 2.53Å
456	P	33.9	Very low	45.4	Very low	113 Å²	113	125 Å²	125	73%	0.734	65%	0.653	S	S	*	*			trans	-76.8	120.9	-168.6	28.6	-33.9	0	0	0	111.6	H454 R458	H454-P456 WeakPolarHBondContact O-CD 3.48Å; P456-R458 VanDerWaalsContact C-N 3.29Å; P456-R458 PolarHBondContact O-N 3.23Å
457	T	31.4	Very low	43.8	Very low	137 Å²	137	131.5 Å²	131.5	84%	0.84	68%	0.676	S	S	*	*			trans	-69.4	83.2	168.9	50.4	0	0	0	0	110.3	S455 D459	S455-T457 PolarHBondContact O-N 2.53Å; T457-D459 PolarHBondContact O-N 3.17Å
458	R	31.5	Very low	42	Very low	235 Å²	235	129.7 Å²	129.7	89%	0.887	68%	0.684	S	S	*	*			trans	-76.8	106.2	169.2	-90.3	-172.3	167.9	-178.9	-3.1	110.2	P456	P456-R458 VanDerWaalsContact C-N 3.29Å; P456-R458 PolarHBondContact O-N 3.23Å
459	D	34	Very low	40.9	Very low	128 Å²	128	132.2 Å²	132.2	68%	0.684	71%	0.706	S	S	*	*			trans	-64.2	132.1	167.2	-105.1	-70.1	0	0	0	111.5	T457	T457-D459 PolarHBondContact O-N 3.17Å
460	K	33.6	Very low	39.7	Very low	177 Å²	177	134.6 Å²	134.6	77%	0.77	73%	0.727	S	S	*	*	S	Bend	trans	38.7	86.2	146.8	-59.3	167.8	-169.7	164	0	118.3
461	Q	32.9	Very low	38.8	Very low	204 Å²	204	140.4 Å²	140.4	95%	0.953	75%	0.746	S	S	*	*				-161.2	158.9	123.9	-107.1	170.2	37.5	0	0	110.4
462	A	30.2	Very low	38.2	Very low	98 Å²	98	140 Å²	140	81%	0.81	75%	0.746	S	S	*	*			trans	-113	134	-155.2	0	0	0	0	0	115.4
463	K	31.2	Very low	38.3	Very low	216 Å²	216	138.1 Å²	138.1	94%	0.939	74%	0.736	S	S	*	*			trans	-164	151.7	139.8	-108.1	162.1	-174.6	178	0	112.3
464	C	27.1	Very low	38.9	Very low	114 Å²	114	135.1 Å²	135.1	77%	0.77	72%	0.724	S	S	*	*			trans	-72.5	168.7	177.5	-78.6	0	0	0	0	112.5
465	L	32.1	Very low	40.4	Very low	119 Å²	119	132 Å²	132	62%	0.623	72%	0.716	S	S	*	*			cis	-161.9	-177.9	-1.3	-112.2	167	0	0	0	106.4	K467	L465-K467 HydrophobicContact CD2-CB 4.29Å; L465-K467 HydrophobicContact CD2-CD 3.79Å; L465-K467 HydrophobicContact CD2-CG 3.61Å
466	P	33.6	Very low	42.3	Very low	129 Å²	129	132.3 Å²	132.3	84%	0.838	71%	0.714	S	S	*	*			cis	-118.9	174.5	24.6	39.5	-24.2	0	0	0	115.9
467	K	35.1	Very low	44.1	Very low	160 Å²	160	129.9 Å²	129.9	70%	0.696	70%	0.699	S	S	*	*			trans	-110.7	131	-178.3	-74.6	158.9	-179.5	169.2	0	110.9	L465	L465-K467 HydrophobicContact CD2-CB 4.29Å; L465-K467 HydrophobicContact CD2-CD 3.79Å; L465-K467 HydrophobicContact CD2-CG 3.61Å
468	G	37	Very low	46.2	Very low	59 Å²	59	134.2 Å²	134.2	61%	0.608	71%	0.707	S	S	*	*	S	Bend	trans	-62.5	158.6	153.5	0	0	0	0	0	110.8	S470	G468-S470 PolarHBondContact O-N 3.49Å
469	P	45.4	Very low	48.4	Very low	149 Å²	149	127.5 Å²	127.5	97%	0.968	69%	0.688	S	S	*	*	S	Bend	trans	-60.9	100.7	-162.6	21.8	-33.3	0	0	0	113.6
470	S	41.9	Very low	50.1	Low	79 Å²	79	124 Å²	124	55%	0.552	68%	0.682	S	S	*	*			trans	-85.7	150.3	-178.7	62.5	0	0	0	0	112.9	G468	G468-S470 PolarHBondContact O-N 3.49Å
471	K	48.9	Very low	51.7	Low	196 Å²	196	123 Å²	123	85%	0.852	67%	0.674	S	S	*	*			trans	67.2	119.3	175.5	-67.1	-173.4	171.4	-173.1	0	115.6
472	Q	55.3	Low	54	Low	116 Å²	116	117.7 Å²	117.7	54%	0.542	65%	0.645	S	S	.	*			trans	-50.2	135.8	153.8	-179.9	172.8	-90.3	0	0	110.1	E474 I484	Q472-E474 PolarHBondContact O-N 2.97Å; Q472-I484 HydrophobicContact CG-CG2 3.75Å
473	I	64.2	Low	55.9	Low	92 Å²	92	122.1 Å²	122.1	47%	0.472	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.1	111.7	179.6	-61	173.3	0	0	0	108.3	T485	I473-T485 PolarHBondContact O-N 3.47Å
474	E	63.5	Low	57.9	Low	82 Å²	82	116.1 Å²	116.1	38%	0.383	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.3	126.1	166.4	-72.7	-171.8	-144.2	0	0	109.8	Q472 R482 R483 I484	Q472-E474 PolarHBondContact O-N 2.97Å; E474-R482 IonicContact OE1-NH2 3.81Å; E474-R482 PolarHBondContact OE1-NH2 3.46Å; E474-R482 IonicContact OE2-CZ 2.89Å; E474-R482 IonicContact OE2-NE 2.8Å; E474-R482 PolarHBondContact OE2-NE 2.58Å; E474-R482 IonicContact OE2-NH2 3.64Å; E474-R482 PolarHBondContact OE2-NH2 3.28Å; E474-R483 WeakPolarHBondContact CA-O 3.44Å; E474-I484 HydrophobicContact CG-CG1 3.9Å
475	T	74.8	Confident	60	Low	82 Å²	82	114.5 Å²	114.5	50%	0.503	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.5	135.6	164.5	6.5	0	0	0	0	109.1	R482 R483	T475-R482 CarbonylContact O-C 3.45Å; T475-R482 WeakPolarHBondContact O-CA 3.42Å; T475-R483 PolarHBondContact N-O 3.09Å; T475-R483 PolarHBondContact O-N 3.32Å
476	V	71.4	Confident	61	Low	93 Å²	93	114 Å²	114	56%	0.564	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116.7	116.9	173.4	-172.9	0	0	0	0	107.5	R482	V476-R482 HydrophobicContact CG2-CG 4.21Å
477	S	70.6	Confident	62.1	Low	62 Å²	62	115.8 Å²	115.8	43%	0.434	60%	0.603	S	S	.	*			trans	-79.4	166.4	174.3	34.7	0	0	0	0	111.6	D479 G480 R481	S477-D479 WeakPolarHBondContact CB-OD1 3.44Å; S477-D479 PolarHBondContact O-N 3.16Å; S477-D479 PolarHBondContact OG-OD1 3.23Å; S477-G480 PolarHBondContact O-N 3.45Å; S477-R481 PolarHBondContact N-O 2.83Å; S477-R481 PolarHBondContact OG-O 2.92Å
478	K	76.8	Confident	62.8	Low	228 Å²	228	117.3 Å²	117.3	99%	0.991	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-11.6	-178.2	-67.8	-174.9	177	-177.6	0	114.5
479	D	77.9	Confident	63.1	Low	94 Å²	94	122.7 Å²	122.7	50%	0.503	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.4	9.4	175.1	67.3	-12.7	0	0	0	113.5	S477 R481	S477-D479 WeakPolarHBondContact CB-OD1 3.44Å; S477-D479 PolarHBondContact O-N 3.16Å; S477-D479 PolarHBondContact OG-OD1 3.23Å; D479-R481 PolarHBondContact O-N 2.82Å; D479-R481 WeakPolarHBondContact OD1-CB 3.43Å; D479-R481 PolarHBondContact OD1-N 2.89Å; D479-R481 VanDerWaalsContact OD1-N 3.09Å; D479-R481 WeakPolarHBondContact OD2-CD 3.44Å; D479-R481 WeakPolarHBondContact OD2-CG 3.32Å; D479-R481 IonicContact OD2-NE 3.84Å; D479-R481 IonicContact OD2-NH1 2.8Å
480	G	68.1	Low	62.8	Low	54 Å²	54	117.9 Å²	117.9	56%	0.557	60%	0.601	S	S	*	*			trans	73.9	-0.3	-179	0	0	0	0	0	114.9	S477 R482	S477-G480 PolarHBondContact O-N 3.45Å; G480-R482 PolarHBondContact O-N 2.97Å; G480-R482 VanDerWaalsContact O-N 3.16Å
481	R	68.3	Low	62.5	Low	156 Å²	156	123 Å²	123	59%	0.589	62%	0.616	S	S	*	*			trans	-75.4	109.8	-177.7	-69.6	-173.2	170.7	160.2	-12.7	111.2	S477 D479	S477-R481 PolarHBondContact N-O 2.83Å; S477-R481 PolarHBondContact OG-O 2.92Å; D479-R481 PolarHBondContact O-N 2.82Å; D479-R481 WeakPolarHBondContact OD1-CB 3.43Å; D479-R481 PolarHBondContact OD1-N 2.89Å; D479-R481 VanDerWaalsContact OD1-N 3.09Å; D479-R481 WeakPolarHBondContact OD2-CD 3.44Å; D479-R481 WeakPolarHBondContact OD2-CG 3.32Å; D479-R481 IonicContact OD2-NE 3.84Å; D479-R481 IonicContact OD2-NH1 2.8Å
482	R	80.5	Confident	61.6	Low	94 Å²	94	120.2 Å²	120.2	36%	0.355	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-63.8	132.4	167.3	-57	171.7	87.2	156.4	0.8	110.1	E474 T475 V476 G480 K629 N631	E474-R482 IonicContact OE1-NH2 3.81Å; E474-R482 PolarHBondContact OE1-NH2 3.46Å; E474-R482 IonicContact OE2-CZ 2.89Å; E474-R482 IonicContact OE2-NE 2.8Å; E474-R482 PolarHBondContact OE2-NE 2.58Å; E474-R482 IonicContact OE2-NH2 3.64Å; E474-R482 PolarHBondContact OE2-NH2 3.28Å; T475-R482 CarbonylContact O-C 3.45Å; T475-R482 WeakPolarHBondContact O-CA 3.42Å; V476-R482 HydrophobicContact CG2-CG 4.21Å; G480-R482 PolarHBondContact O-N 2.97Å; G480-R482 VanDerWaalsContact O-N 3.16Å; R482-K629 PolarHBondContact O-NZ 2.86Å; R482-N631 PolarHBondContact NH1-OD1 2.65Å
483	R	69.9	Low	60.6	Low	190 Å²	190	121.1 Å²	121.1	72%	0.717	62%	0.618	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119.9	137.5	166.7	-102.8	-176.6	170.2	171.4	-2.1	108.8	E474 T475	E474-R483 WeakPolarHBondContact CA-O 3.44Å; T475-R483 PolarHBondContact N-O 3.09Å; T475-R483 PolarHBondContact O-N 3.32Å
484	I	73.1	Confident	59	Low	90 Å²	90	121.9 Å²	121.9	46%	0.462	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117	131.7	177.7	-74.9	160.8	0	0	0	108	Q472 E474	Q472-I484 HydrophobicContact CG-CG2 3.75Å; E474-I484 HydrophobicContact CG-CG1 3.9Å
485	T	72.5	Confident	57.7	Low	80 Å²	80	123.4 Å²	123.4	49%	0.491	65%	0.649	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.7	109	170.5	-55.2	0	0	0	0	109.4	I473	I473-T485 PolarHBondContact O-N 3.47Å
486	P	51.6	Low	55.8	Low	108 Å²	108	127 Å²	127	70%	0.701	67%	0.665	S	S	*	*			trans	-66.4	139.1	170.8	28.9	-33.3	0	0	0	109.6
487	K	57.8	Low	54.1	Low	167 Å²	167	130.5 Å²	130.5	73%	0.726	68%	0.675	S	S	*	*			trans	-106.3	133.5	169.9	-76	-169.4	172.7	-172.1	0	109.6
488	F	49.6	Very low	52.4	Low	192 Å²	192	134.5 Å²	134.5	84%	0.842	69%	0.692	S	S	*	*			trans	-68.1	130	172.6	-175.4	-107.3	0	0	0	109.9
489	L	43.8	Very low	50.4	Low	173 Å²	173	127.4 Å²	127.4	91%	0.906	68%	0.676	S	S	*	*			trans	-121.7	90.2	170	-70.7	175.9	0	0	0	106.6
490	G	38	Very low	48.2	Very low	47 Å²	47	130.7 Å²	130.7	49%	0.485	69%	0.693	S	S	.	*			trans	-119.5	127.3	-178.3	0	0	0	0	0	111.8
491	H	36.9	Very low	46.6	Very low	186 Å²	186	134 Å²	134	86%	0.861	71%	0.708	S	S	*	*			trans	-147.6	144.6	136	-156.4	29.2	0	0	0	108.4
492	L	29.7	Very low	44.8	Very low	139 Å²	139	134.1 Å²	134.1	73%	0.728	72%	0.72	S	S	*	*			trans	-154.1	147.1	-174.1	-97.2	170.3	0	0	0	105.9
493	D	34.3	Very low	42.6	Very low	134 Å²	134	134.3 Å²	134.3	72%	0.717	73%	0.733	S	S	*	*			trans	63.7	154.5	163.7	-46.7	-32.7	0	0	0	115.3
494	S	29.5	Very low	40.6	Very low	108 Å²	108	132.9 Å²	132.9	76%	0.755	74%	0.735	S	S	*	*			cis	-157.5	168.1	-13	44.9	0	0	0	0	108
495	P	37.5	Very low	38.6	Very low	114 Å²	114	138.1 Å²	138.1	74%	0.74	76%	0.755	S	S	*	*			trans	-87.8	165.6	-179.6	36.8	-36.2	0	0	0	113.4
496	D	34.6	Very low	36.7	Very low	157 Å²	157	139 Å²	139	84%	0.84	77%	0.765	S	S	*	*			trans	-167.5	147.4	143.7	-97.5	-27	0	0	0	113
497	E	34.4	Very low	35.6	Very low	167 Å²	167	139 Å²	139	78%	0.78	77%	0.767	S	S	*	*			trans	26.7	155.4	154.1	-62.5	-73.1	68.1	0	0	126.2
498	D	36.4	Very low	34.5	Very low	146 Å²	146	136.6 Å²	136.6	78%	0.781	77%	0.768	S	S	*	*			trans	93	113.2	143.2	-95.7	-31.8	0	0	0	124.9
499	A	35	Very low	33.6	Very low	79 Å²	79	135.9 Å²	135.9	65%	0.653	77%	0.768	S	S	*	*				80.4	110	129.2	0	0	0	0	0	123.6
500	N	30	Very low	33	Very low	164 Å²	164	132.2 Å²	132.2	88%	0.877	76%	0.756	S	S	*	*			trans	47.8	107.6	133.4	-72.4	-32.8	0	0	0	121.5
501	S	35.4	Very low	32.7	Very low	124 Å²	124	136.8 Å²	136.8	87%	0.867	77%	0.77	S	S	*	*				-167.3	118.3	112	51.4	0	0	0	0	113.9
502	N	29.6	Very low	32.4	Very low	158 Å²	158	137.1 Å²	137.1	85%	0.845	76%	0.763	S	S	*	*			trans	-82.8	173.7	153.9	-118.1	-29.1	0	0	0	108.2
503	P	34.8	Very low	32.3	Very low	97 Å²	97	135.5 Å²	135.5	63%	0.63	76%	0.763	S	S	*	*			cis	-141.1	176.1	23.1	43.3	-24.3	0	0	0	117.7
504	Q	28.1	Very low	32.1	Very low	160 Å²	160	135.6 Å²	135.6	75%	0.748	76%	0.758	S	S	*	*			trans	38.5	129.2	139.9	-66.6	166.8	-14.1	0	0	121.3
505	F	31.3	Very low	32.2	Very low	200 Å²	200	134.9 Å²	134.9	88%	0.877	75%	0.754	S	S	*	*				-164.6	-180	102.8	-118.3	-87.9	0	0	0	112.3
506	S	31.6	Very low	31.9	Very low	100 Å²	100	137.9 Å²	137.9	70%	0.699	76%	0.755	S	S	*	*			trans	-102.6	170.4	-157.7	56.9	0	0	0	0	117.3
507	S	28.6	Very low	31.7	Very low	107 Å²	107	137.4 Å²	137.4	75%	0.748	75%	0.752	S	S	*	*			trans	-69.6	168.4	177.9	58	0	0	0	0	115.4
508	P	35.5	Very low	31.6	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	75%	0.749	S	S	*	*				-144.2	138.7	122.7	37.1	-23	0	0	0	117.7
509	Q	31	Very low	31.3	Very low	178 Å²	178	133.4 Å²	133.4	83%	0.832	74%	0.743	S	S	*	*			trans	17.3	139.6	137.5	-53.3	177.6	-22	0	0	122.9
510	S	30.1	Very low	31.2	Very low	95 Å²	95	137.1 Å²	137.1	66%	0.664	75%	0.747	S	S	*	*				141.3	154.2	106.2	66.3	0	0	0	0	116.9
511	N	32.8	Very low	31.3	Very low	144 Å²	144	136 Å²	136	77%	0.77	74%	0.741	S	S	*	*			trans	70.7	150.3	163.3	-58.4	-47.5	0	0	0	118.9
512	R	30.1	Very low	31.1	Very low	193 Å²	193	134.7 Å²	134.7	73%	0.728	73%	0.732	S	S	*	*			cis	-169.9	132.3	-27.9	-161.6	176.1	173.8	179.2	-3.5	105.4	E514	R512-E514 IonicContact CZ-OE1 3.89Å; R512-E514 IonicContact NE-OE1 3Å; R512-E514 PolarHBondContact NE-OE1 3.2Å; R512-E514 IonicContact NH2-OE1 2.79Å; R512-E514 PolarHBondContact NH2-OE1 2.85Å
513	C	28.3	Very low	31.1	Very low	105 Å²	105	132 Å²	132	71%	0.709	73%	0.726	S	S	*	*				-161.8	140.2	72.9	-76.8	0	0	0	0	108.1
514	E	29.2	Very low	31	Very low	135 Å²	135	134.4 Å²	134.4	63%	0.631	73%	0.733	S	S	*	*				57.3	125	81.2	-60.1	-175.6	-121.8	0	0	113.2	R512	R512-E514 IonicContact CZ-OE1 3.89Å; R512-E514 IonicContact NE-OE1 3Å; R512-E514 PolarHBondContact NE-OE1 3.2Å; R512-E514 IonicContact NH2-OE1 2.79Å; R512-E514 PolarHBondContact NH2-OE1 2.85Å
515	S	32	Very low	31.2	Very low	93 Å²	93	133.2 Å²	133.2	65%	0.65	73%	0.731	S	S	*	*			cis	-162.1	146.8	15.9	63.3	0	0	0	0	116.3
516	K	30.5	Very low	31.2	Very low	178 Å²	178	130.8 Å²	130.8	77%	0.774	73%	0.726	S	S	*	*			trans	57.7	145.4	134.5	-63.9	169.5	-176.6	170	0	119.3
517	L	31.6	Very low	31	Very low	147 Å²	147	130.4 Å²	130.4	77%	0.77	72%	0.723	S	S	*	*			cis	-131.9	142.4	15.2	-88.9	99.9	0	0	0	110.6
518	N	31.5	Very low	31.2	Very low	134 Å²	134	131.4 Å²	131.4	72%	0.717	72%	0.72	S	S	*	*				54.3	143.1	96.6	-57	27.8	0	0	0	115.4
519	S	29.9	Very low	31.1	Very low	95 Å²	95	132 Å²	132	66%	0.664	72%	0.715	S	S	*	*			cis	-171.9	170.8	-16.6	48.5	0	0	0	0	106
520	E	33.7	Very low	31	Very low	157 Å²	157	131.4 Å²	131.4	73%	0.734	72%	0.718	S	S	*	*			cis	-159.6	163.6	36.3	-68.4	-175	150.7	0	0	111.1
521	N	31.4	Very low	31.1	Very low	140 Å²	140	135.1 Å²	135.1	75%	0.749	72%	0.722	S	S	*	*			trans	39.2	143.3	138.6	-52	-17.2	0	0	0	121.2
522	S	31.9	Very low	31.1	Very low	97 Å²	97	135.5 Å²	135.5	68%	0.678	72%	0.723	S	S	*	*			cis	-164.3	123.2	-1.6	40.6	0	0	0	0	106.4
523	S	28.8	Very low	31	Very low	102 Å²	102	133.4 Å²	133.4	71%	0.713	73%	0.726	S	S	*	*				45.2	112.1	87.1	70.9	0	0	0	0	114.9
524	D	33.8	Very low	31	Very low	146 Å²	146	133.7 Å²	133.7	78%	0.781	73%	0.727	S	S	*	*			trans	-157.8	133.6	132.1	-105.4	-18.3	0	0	0	113.1
525	L	32.2	Very low	30.9	Very low	136 Å²	136	134.9 Å²	134.9	71%	0.712	74%	0.736	S	S	*	*			trans	46.7	110.6	147.4	-50.6	175.5	0	0	0	119.6
526	I	30.3	Very low	30.6	Very low	149 Å²	149	136 Å²	136	76%	0.764	74%	0.738	S	S	*	*				86.5	126.3	53.9	-66.4	176.8	0	0	0	113.8
527	S	28.3	Very low	30.4	Very low	91 Å²	91	131.8 Å²	131.8	64%	0.636	74%	0.736	S	S	*	*			trans	18.9	141.2	166.5	72.8	0	0	0	0	122.7
528	D	32.8	Very low	30.1	Very low	129 Å²	129	130.6 Å²	130.6	69%	0.69	74%	0.735	S	S	*	*				-167.4	118.9	101	-95	4.1	0	0	0	112
529	I	32.3	Very low	29.9	Very low	127 Å²	127	128.3 Å²	128.3	65%	0.651	73%	0.73	S	S	*	*				93	118.3	99.3	-72.2	174.8	0	0	0	114.1	K531	I529-K531 HydrophobicContact CG2-CG 4.25Å; I529-K531 PolarHBondContact O-N 2.92Å
530	N	29.4	Very low	29.9	Very low	167 Å²	167	130.4 Å²	130.4	89%	0.893	74%	0.739	S	S	*	*			trans	-70.2	120.4	171	-67.1	-49	0	0	0	111.6
531	K	33	Very low	29.5	Very low	172 Å²	172	128.7 Å²	128.7	75%	0.748	74%	0.739	S	S	*	*			trans	-143.9	110	160.5	-77.2	-167.2	179.1	173.5	0	114.9	I529	I529-K531 HydrophobicContact CG2-CG 4.25Å; I529-K531 PolarHBondContact O-N 2.92Å
532	I	32.8	Very low	29.3	Very low	153 Å²	153	124.8 Å²	124.8	79%	0.785	73%	0.732	S	S	*	*				70.5	114.5	125.9	-61.5	163.7	0	0	0	119.2
533	N	26.6	Very low	29.1	Very low	148 Å²	148	127.2 Å²	127.2	79%	0.791	74%	0.743	S	S	*	*			trans	-32.2	151	153.3	-79	-10.9	0	0	0	115.3
534	P	29.5	Very low	29	Very low	112 Å²	112	129.5 Å²	129.5	73%	0.727	75%	0.747	S	S	*	*				-150.9	175.7	64.6	42.6	-23.2	0	0	0	119.2
535	I	26.1	Very low	28.7	Very low	160 Å²	160	129.5 Å²	129.5	82%	0.821	75%	0.752	S	S	*	*			trans	-41.1	130.5	163.4	-60.2	154.2	0	0	0	112.1
536	V	27.2	Very low	28.3	Very low	117 Å²	117	128.4 Å²	128.4	71%	0.709	75%	0.751	S	S	*	*			trans	-136.4	110.7	152	-174.9	0	0	0	0	108.9	V538	V536-V538 HydrophobicContact CG1-CG2 3.74Å
537	A	24.6	Very low	28.1	Very low	88 Å²	88	127 Å²	127	73%	0.727	75%	0.749	S	S	*	*			trans	-83.8	112.3	162.7	0	0	0	0	0	108.2	S539	A537-S539 PolarHBondContact O-N 3.35Å
538	V	27.2	Very low	28	Very low	122 Å²	122	127.9 Å²	127.9	74%	0.739	75%	0.751	S	S	*	*			trans	-89.8	85.9	176	-175.1	0	0	0	0	109.5	V536 T540	V536-V538 HydrophobicContact CG1-CG2 3.74Å; V538-T540 HydrophobicContact CG1-CG2 4.32Å
539	S	25.6	Very low	27.6	Very low	87 Å²	87	127.1 Å²	127.1	61%	0.608	75%	0.752	S	S	*	*			trans	-81.8	113.6	158.2	45.6	0	0	0	0	108.9	A537 T541	A537-S539 PolarHBondContact O-N 3.35Å; S539-T541 VanDerWaalsContact C-N 3.3Å; S539-T541 PolarHBondContact O-N 3.24Å
540	T	29.9	Very low	27.4	Very low	139 Å²	139	125.7 Å²	125.7	85%	0.853	75%	0.749	S	S	*	*			trans	-76	84.5	170.2	48.5	0	0	0	0	109.6	V538	V538-T540 HydrophobicContact CG1-CG2 4.32Å
541	T	26.4	Very low	27.4	Very low	120 Å²	120	124.9 Å²	124.9	74%	0.736	74%	0.739	S	S	*	*			trans	-89.5	152.5	174.4	48.5	0	0	0	0	111.9	S539	S539-T541 VanDerWaalsContact C-N 3.3Å; S539-T541 PolarHBondContact O-N 3.24Å
542	G	27.7	Very low	27.2	Very low	59 Å²	59	121.4 Å²	121.4	61%	0.608	74%	0.737	S	S	*	*			trans	83	86.4	146.2	0	0	0	0	0	118.9
543	T	26.9	Very low	27	Very low	147 Å²	147	120.9 Å²	120.9	90%	0.902	73%	0.734	S	S	*	*				-126.5	99	125.3	52.1	0	0	0	0	108.5
544	N	25.8	Very low	27.1	Very low	150 Å²	150	120.8 Å²	120.8	80%	0.802	73%	0.733	S	S	*	*			trans	-81.7	139	178.3	-63.9	-20	0	0	0	110.8
545	V	27.3	Very low	27	Very low	147 Å²	147	120.3 Å²	120.3	89%	0.891	73%	0.733	S	S	*	*			trans	-137.1	120.8	149.6	-175.9	0	0	0	0	108.4
546	T	24.3	Very low	27.2	Very low	113 Å²	113	119.1 Å²	119.1	69%	0.693	73%	0.733	S	S	*	*			trans	-73	146.7	177.5	-23.9	0	0	0	0	110
547	T	26.9	Very low	27.3	Very low	118 Å²	118	121.5 Å²	121.5	72%	0.724	74%	0.738	S	S	*	*				178.4	132.3	85.8	39	0	0	0	0	108.9
548	T	25	Very low	27.8	Very low	111 Å²	111	121.9 Å²	121.9	68%	0.681	73%	0.733	S	S	*	*				58.3	132.9	77.7	63.3	0	0	0	0	114.8
549	T	26.2	Very low	28	Very low	113 Å²	113	122.6 Å²	122.6	69%	0.693	73%	0.733	S	S	*	*			cis	-171	155.2	7.7	10.6	0	0	0	0	115.6
550	T	26.8	Very low	28.2	Very low	96 Å²	96	124.4 Å²	124.4	59%	0.589	74%	0.741	S	S	*	*			trans	63.3	125.8	142.8	55.9	0	0	0	0	127.1
551	H	30	Very low	28.3	Very low	150 Å²	150	124.2 Å²	124.2	69%	0.694	74%	0.739	S	S	*	*			trans	57.5	165.1	131.7	-54.1	-49.7	0	0	0	121.8
552	S	28.9	Very low	28.5	Very low	100 Å²	100	122.1 Å²	122.1	70%	0.699	73%	0.733	S	S	*	*			cis	-153	135.9	8.4	53.9	0	0	0	0	115.9
553	I	29.3	Very low	28.5	Very low	141 Å²	141	125.2 Å²	125.2	72%	0.723	74%	0.741	S	S	*	*				24	126.6	128.4	-52.4	166.1	0	0	0	120.4
554	N	27.9	Very low	28.7	Very low	146 Å²	146	125.6 Å²	125.6	78%	0.781	74%	0.737	S	S	*	*				-173.8	134.8	121	-104.1	-43	0	0	0	115.8
555	S	27.7	Very low	28.7	Very low	102 Å²	102	126.5 Å²	126.5	71%	0.713	74%	0.742	S	S	*	*			trans	31.3	158	145	65.4	0	0	0	0	122.4
556	V	29.7	Very low	28.7	Very low	135 Å²	135	124.1 Å²	124.1	82%	0.818	74%	0.738	S	S	*	*			cis	-144.2	145.4	32.9	169.3	0	0	0	0	112.2
557	M	29.4	Very low	28.9	Very low	167 Å²	167	126.4 Å²	126.4	82%	0.823	75%	0.745	S	S	*	*			trans	-101.3	174.4	173	-129.4	-159.1	-152	0	0	109.9
558	P	34.7	Very low	29	Very low	97 Å²	97	126 Å²	126	63%	0.63	74%	0.744	S	S	*	*				-161.3	-172.5	56.3	45.3	-22.6	0	0	0	119.1
559	N	31.9	Very low	28.9	Very low	136 Å²	136	126.5 Å²	126.5	73%	0.727	75%	0.747	S	S	*	*			trans	71.4	143.2	151.9	-65.1	-12.9	0	0	0	119.1
560	T	30.7	Very low	29.1	Very low	126 Å²	126	127.6 Å²	127.6	77%	0.773	75%	0.753	S	S	*	*			cis	-172.6	163.5	-0.6	17.4	0	0	0	0	107.9
561	V	30.6	Very low	29	Very low	135 Å²	135	128.7 Å²	128.7	82%	0.818	76%	0.76	S	S	*	*			cis	-162	168.9	-3.9	66.4	0	0	0	0	108.8
562	A	31.7	Very low	28.7	Very low	75 Å²	75	130 Å²	130	62%	0.62	77%	0.771	S	S	*	*			trans	67	129	171.6	0	0	0	0	0	116.3
563	T	27.8	Very low	28.7	Very low	124 Å²	124	132.1 Å²	132.1	76%	0.761	78%	0.779	S	S	*	*			cis	71.1	132.1	38	85.4	0	0	0	0	112.9
564	D	30.1	Very low	28.5	Very low	155 Å²	155	133.4 Å²	133.4	83%	0.829	78%	0.782	S	S	*	*			cis	-139.4	172.2	35.4	-69.3	-38.3	0	0	0	115.7
565	D	26.2	Very low	28.5	Very low	169 Å²	169	133 Å²	133	90%	0.904	79%	0.785	S	S	*	*			trans	-78.4	139.5	168.8	-75.2	-66	0	0	0	113.6
566	A	27.8	Very low	28.3	Very low	98 Å²	98	133.9 Å²	133.9	81%	0.81	78%	0.782	S	S	*	*			trans	-155.4	127	160.6	0	0	0	0	0	113.7
567	I	27	Very low	28.4	Very low	161 Å²	161	134.8 Å²	134.8	83%	0.826	78%	0.782	S	S	*	*			trans	-87.2	123.9	170.7	-61.3	164	0	0	0	109.3	T569	I567-T569 PolarHBondContact O-N 3.12Å
568	P	29	Very low	28.2	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	78%	0.778	S	S	*	*			trans	-90.3	93.4	174.9	33.4	-31.7	0	0	0	112.1	V570	P568-V570 PolarHBondContact O-N 3.47Å
569	T	24	Very low	27.9	Very low	121 Å²	121	134.2 Å²	134.2	74%	0.742	79%	0.786	S	S	*	*			trans	-66.5	117.4	157.4	-59.6	0	0	0	0	108.6	I567 T571	I567-T569 PolarHBondContact O-N 3.12Å; T569-T571 PolarHBondContact O-N 2.92Å
570	V	29.8	Very low	27.6	Very low	137 Å²	137	132.1 Å²	132.1	83%	0.83	78%	0.782	S	S	*	*			trans	-89	99.8	-176.4	-177.7	0	0	0	0	111.4	P568	P568-V570 PolarHBondContact O-N 3.47Å
571	T	25.4	Very low	27.5	Very low	119 Å²	119	134.4 Å²	134.4	73%	0.73	79%	0.786	S	S	*	*			trans	-85	154.8	166.4	8.1	0	0	0	0	111.8	T569 V573	T569-T571 PolarHBondContact O-N 2.92Å; T571-V573 PolarHBondContact O-N 3.48Å
572	L	24.3	Very low	27.4	Very low	177 Å²	177	132.1 Å²	132.1	93%	0.927	78%	0.776	S	S	*	*			trans	-69.9	122.3	174.8	-76.6	158.4	0	0	0	112
573	V	27	Very low	27.2	Very low	144 Å²	144	134.3 Å²	134.3	87%	0.873	78%	0.781	S	S	*	*			trans	-141.1	141.6	156.8	-176.5	0	0	0	0	109.2	T571	T571-V573 PolarHBondContact O-N 3.48Å
574	Q	25	Very low	27.4	Very low	168 Å²	168	134 Å²	134	79%	0.785	78%	0.775	S	S	*	*			trans	-110.4	140.7	178.2	166.1	-167.6	-16.1	0	0	109.2
575	V	28.7	Very low	27.4	Very low	138 Å²	138	134.1 Å²	134.1	84%	0.836	77%	0.768	S	S	*	*			trans	-170.2	145	150.1	139.5	0	0	0	0	109.2
576	D	24.4	Very low	27.4	Very low	121 Å²	121	131.6 Å²	131.6	65%	0.647	76%	0.759	S	S	*	*			trans	-83.1	150.8	-177.1	-44	-99.3	0	0	0	113.5
577	N	31	Very low	27.5	Very low	154 Å²	154	133.1 Å²	133.1	82%	0.824	76%	0.762	S	S	*	*				-169.1	168.2	113.6	-109	-69.2	0	0	0	116.5
578	T	25	Very low	27.5	Very low	120 Å²	120	131.7 Å²	131.7	74%	0.736	76%	0.761	S	S	*	*			trans	-85.6	-167.8	-164	58.2	0	0	0	0	115.6
579	V	29	Very low	27.7	Very low	132 Å²	132	132.2 Å²	132.2	80%	0.8	77%	0.768	S	S	*	*			trans	93.5	135.9	175.2	-175.4	0	0	0	0	115.4
580	S	25.9	Very low	28	Very low	91 Å²	91	133.3 Å²	133.3	64%	0.636	77%	0.769	S	S	*	*				-178.2	173.1	-63.1	56.6	0	0	0	0	109
581	M	27.2	Very low	28	Very low	174 Å²	174	133.3 Å²	133.3	86%	0.857	77%	0.769	S	S	*	*			trans	71.7	143.9	170.3	-56.9	-167.8	76	0	0	116.2
582	S	29.6	Very low	28.2	Very low	88 Å²	88	133.4 Å²	133.4	62%	0.615	77%	0.769	S	S	*	*			cis	-165.6	142	-8.7	46.9	0	0	0	0	112.7
583	V	27.6	Very low	28.5	Very low	121 Å²	121	131.2 Å²	131.2	73%	0.733	76%	0.762	S	S	*	*				55.7	124.5	126.5	-177.9	0	0	0	0	117.1
584	D	31.1	Very low	28.8	Very low	116 Å²	116	129.2 Å²	129.2	62%	0.62	75%	0.753	S	S	*	*				-156.4	156.3	63.8	-137.6	-12.2	0	0	0	119
585	K	30.1	Very low	29.2	Very low	159 Å²	159	126.7 Å²	126.7	69%	0.691	75%	0.749	S	S	*	*			trans	-9.6	165.7	156.1	-72.4	170.1	-145.5	93.1	0	121.7
586	T	27	Very low	29.3	Very low	115 Å²	115	126.3 Å²	126.3	71%	0.706	75%	0.749	S	S	*	*			cis	-175.3	148.4	-21.2	32	0	0	0	0	108.9
587	C	30.2	Very low	29.8	Very low	131 Å²	131	128.2 Å²	128.2	89%	0.885	76%	0.758	S	S	*	*			trans	-168.2	151.1	135.7	-104	0	0	0	0	111.2
588	T	26.9	Very low	30	Very low	130 Å²	130	125.2 Å²	125.2	80%	0.798	75%	0.749	S	S	*	*			trans	-136.8	150.6	-169.5	47	0	0	0	0	113.6
589	S	33.3	Very low	30.5	Very low	121 Å²	121	125.6 Å²	125.6	85%	0.846	75%	0.751	S	S	*	*			trans	-150.3	143.8	156.9	58.5	0	0	0	0	109.5
590	N	29.7	Very low	30.6	Very low	144 Å²	144	124.9 Å²	124.9	77%	0.77	75%	0.747	S	S	*	*			trans	-105.1	-170.5	-160.4	-66.9	-37.3	0	0	0	113.7
591	V	29.1	Very low	31	Very low	137 Å²	137	126.9 Å²	126.9	83%	0.83	75%	0.75	S	S	*	*			trans	88.2	123.7	160.3	-174.8	0	0	0	0	115.1
592	V	30.1	Very low	31.1	Very low	121 Å²	121	124.3 Å²	124.3	73%	0.733	75%	0.745	S	S	*	*			cis	-156	158.8	-8.3	113.4	0	0	0	0	110.8
593	V	29.8	Very low	31.3	Very low	130 Å²	130	126.4 Å²	126.4	79%	0.788	75%	0.754	S	S	*	*			trans	-143.6	135.9	167.4	178.7	0	0	0	0	111
594	P	34.9	Very low	31.3	Very low	103 Å²	103	127.5 Å²	127.5	67%	0.669	76%	0.755	S	S	*	*			trans	-120.5	115.5	157.8	19.6	0.6	0	0	0	111.6
595	T	31.8	Very low	31.3	Very low	114 Å²	114	126.6 Å²	126.6	70%	0.699	76%	0.758	S	S	*	*				68.7	117.3	81.7	60.7	0	0	0	0	116.7
596	P	32.4	Very low	31.2	Very low	131 Å²	131	129 Å²	129	85%	0.851	77%	0.768	S	S	*	*			trans	-84.7	165.1	156.6	36.3	-32.6	0	0	0	111.5
597	I	35	Very low	31.4	Very low	160 Å²	160	127.1 Å²	127.1	82%	0.821	77%	0.772	S	S	*	*			trans	-112.5	153.8	-174.6	-72	177	0	0	0	112.3
598	S	34	Very low	31.3	Very low	92 Å²	92	127.1 Å²	127.1	64%	0.643	76%	0.763	S	S	*	*			trans	-55.5	168.7	174.8	49.5	0	0	0	0	114.7
599	T	35.3	Very low	31.3	Very low	128 Å²	128	128.6 Å²	128.6	79%	0.785	76%	0.761	S	S	*	*				-176.5	167.4	65.1	26.6	0	0	0	0	110.6
600	V	31.4	Very low	31.2	Very low	116 Å²	116	129 Å²	129	70%	0.703	76%	0.759	S	S	*	*			cis	-170.6	-178.7	-30.3	99.7	0	0	0	0	108.9
601	N	34.1	Very low	31.1	Very low	133 Å²	133	125.8 Å²	125.8	71%	0.711	75%	0.752	S	S	*	*			trans	82	106.3	176.8	-61.4	-28.4	0	0	0	115.7
602	T	29.3	Very low	31	Very low	120 Å²	120	127.1 Å²	127.1	74%	0.736	75%	0.753	S	S	*	*				77.4	141.1	65.3	66	0	0	0	0	113.4
603	V	33.8	Very low	31.1	Very low	133 Å²	133	126.7 Å²	126.7	81%	0.806	75%	0.753	S	S	*	*			cis	-143.3	154.5	31.7	-170.9	0	0	0	0	112.1
604	D	27.8	Very low	31.1	Very low	144 Å²	144	125.6 Å²	125.6	77%	0.77	75%	0.751	S	S	*	*			trans	-66	167.7	170.4	-52.9	-88.6	0	0	0	113.6
605	S	31.1	Very low	30.9	Very low	97 Å²	97	127.7 Å²	127.7	68%	0.678	76%	0.763	S	S	*	*				172.8	157.8	56.4	50.2	0	0	0	0	114
606	K	28	Very low	30.7	Very low	209 Å²	209	127 Å²	127	91%	0.909	76%	0.762	S	S	*	*			trans	54.4	131.2	149.5	-67.2	169.6	-179.5	179	0	121.2
607	G	31.8	Very low	30.6	Very low	76 Å²	76	127.6 Å²	127.6	78%	0.784	76%	0.763	S	S	*	*			trans	175	99.1	164	0	0	0	0	0	114.5
608	N	27.9	Very low	30.2	Very low	130 Å²	130	125.8 Å²	125.8	70%	0.695	76%	0.76	S	S	*	*			trans	-53.1	159.1	-179	-75	28.9	0	0	0	117.6
609	E	27.5	Very low	30.1	Very low	162 Å²	162	127.7 Å²	127.7	76%	0.757	77%	0.767	S	S	*	*			trans	51.2	145.1	132.4	-60.9	163.1	146.6	0	0	119.9
610	T	30.6	Very low	29.7	Very low	130 Å²	130	127.7 Å²	127.7	80%	0.798	77%	0.771	S	S	*	*			cis	-160.6	153.7	21.8	-13.5	0	0	0	0	112.9
611	A	27.5	Very low	29.7	Very low	76 Å²	76	127 Å²	127	63%	0.628	77%	0.771	S	S	*	*			trans	41	124	139.5	0	0	0	0	0	124.8
612	L	27.6	Very low	29.4	Very low	164 Å²	164	124.8 Å²	124.8	86%	0.859	77%	0.766	S	S	*	*			trans	71.5	172.1	135.1	-59.7	170.8	0	0	0	118.4
613	P	32.3	Very low	29.5	Very low	112 Å²	112	127.5 Å²	127.5	73%	0.727	77%	0.77	S	S	*	*				-131.9	-172.1	-67.4	40.9	-25.6	0	0	0	113.9
614	S	29.3	Very low	29.2	Very low	107 Å²	107	126.1 Å²	126.1	75%	0.748	77%	0.766	S	S	*	*			trans	-62.2	146.8	178.9	55.8	0	0	0	0	116.2
615	T	30.1	Very low	29.6	Very low	148 Å²	148	125.2 Å²	125.2	91%	0.908	77%	0.768	S	S	*	*			trans	-159.3	165	143.7	-0.6	0	0	0	0	112.6
616	S	28.1	Very low	29.5	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	78%	0.778	S	S	*	*			trans	-114.4	143.6	-171.4	55.2	0	0	0	0	113.9
617	V	31.1	Very low	29.3	Very low	143 Å²	143	126.5 Å²	126.5	87%	0.867	78%	0.777	S	S	*	*			trans	-136.8	108.3	162.1	-178	0	0	0	0	106
618	T	26.6	Very low	29.2	Very low	123 Å²	123	128.8 Å²	128.8	76%	0.755	78%	0.78	S	S	*	*				90.3	130.1	59	-62.2	0	0	0	0	112.5
619	V	30.7	Very low	29	Very low	131 Å²	131	128.7 Å²	128.7	79%	0.794	77%	0.774	S	S	*	*			trans	-85.1	150.5	-172.5	175.2	0	0	0	0	111.3
620	C	28	Very low	28.9	Very low	128 Å²	128	126 Å²	126	87%	0.865	77%	0.768	S	S	*	*			trans	-147.2	159.7	148.1	-138.2	0	0	0	0	112.2
621	S	30.1	Very low	28.7	Very low	101 Å²	101	125.9 Å²	125.9	71%	0.706	76%	0.763	S	S	*	*			trans	-118.4	164.5	-168.4	58.2	0	0	0	0	112.1
622	S	29.2	Very low	28.6	Very low	87 Å²	87	126.9 Å²	126.9	61%	0.608	77%	0.765	S	S	*	*				162.1	164.2	90.2	55.1	0	0	0	0	111.9
623	H	30.2	Very low	28.6	Very low	178 Å²	178	128 Å²	128	82%	0.824	77%	0.766	S	S	*	*			trans	57.2	148.3	159.1	-61.2	-55.3	0	0	0	120.2
624	S	27.8	Very low	28.2	Very low	103 Å²	103	128 Å²	128	72%	0.72	77%	0.769	S	S	*	*			cis	-156.5	165	-10.9	48.5	0	0	0	0	110.1
625	P	36.1	Very low	28.1	Very low	125 Å²	125	131.5 Å²	131.5	81%	0.812	77%	0.773	S	S	*	*			trans	-100.1	153.4	-171.1	37.5	-34.1	0	0	0	114.8
626	V	29.8	Very low	27.8	Very low	147 Å²	147	129.2 Å²	129.2	89%	0.891	76%	0.763	S	S	*	*			trans	-139.5	132.6	163.6	-178.7	0	0	0	0	110.1
627	E	24.3	Very low	27.7	Very low	187 Å²	187	132.2 Å²	132.2	87%	0.874	77%	0.771	S	S	*	*			trans	-81.1	148.4	174.5	-52.8	179.8	116.9	0	0	112.2
628	S	28.2	Very low	27.4	Very low	123 Å²	123	130 Å²	130	86%	0.86	77%	0.767	S	S	*	*			trans	-153.4	142.3	143	41.1	0	0	0	0	113.5
629	K	23.6	Very low	27.3	Very low	129 Å²	129	130.2 Å²	130.2	56%	0.561	77%	0.769	S	S	*	*			trans	-77.1	139.7	-166.2	-82	-179.5	173.1	-176.2	0	114.4	R482	R482-K629 PolarHBondContact O-NZ 2.86Å
630	V	26.6	Very low	27	Very low	105 Å²	105	131.8 Å²	131.8	64%	0.636	77%	0.765	S	S	*	*				39.2	115.6	122.2	-176.6	0	0	0	0	117.6
631	N	26.5	Very low	27	Very low	127 Å²	127	132.9 Å²	132.9	68%	0.679	77%	0.768	S	S	*	*				-151.1	143.8	112.6	-109.8	-22.3	0	0	0	112.1	R482	R482-N631 PolarHBondContact NH1-OD1 2.65Å
632	S	25.2	Very low	26.8	Very low	98 Å²	98	135.5 Å²	135.5	69%	0.685	77%	0.769	S	S	*	*			trans	-109.8	118.1	174.3	56.2	0	0	0	0	109
633	E	27	Very low	26.7	Very low	188 Å²	188	135.6 Å²	135.6	88%	0.879	78%	0.775	S	S	*	*			trans	-114	130.5	159.9	-68.9	-153.6	130.2	0	0	109.8
634	S	25	Very low	26.5	Very low	112 Å²	112	133 Å²	133	78%	0.783	77%	0.774	S	S	*	*			trans	-95.8	119.6	174.7	53.7	0	0	0	0	108.9
635	Q	26.8	Very low	26.4	Very low	180 Å²	180	133.7 Å²	133.7	84%	0.841	78%	0.779	S	S	*	*			trans	-150.7	155.2	159.1	-119.4	158.9	97.3	0	0	111.8
636	S	23.6	Very low	26.1	Very low	99 Å²	99	137.6 Å²	137.6	69%	0.692	78%	0.783	S	S	*	*			trans	-57.7	147.6	174.8	48.8	0	0	0	0	112.6
637	L	24.7	Very low	25.9	Very low	162 Å²	162	140.2 Å²	140.2	85%	0.848	78%	0.782	S	S	*	*				-166.9	149.2	116.6	-101.6	159.7	0	0	0	110.4
638	A	24.7	Very low	26	Very low	97 Å²	97	139 Å²	139	80%	0.802	78%	0.781	S	S	*	*			trans	-103.5	124.7	170	0	0	0	0	0	108.4
639	T	25.8	Very low	25.9	Very low	128 Å²	128	138.4 Å²	138.4	79%	0.785	77%	0.774	S	S	*	*			trans	-133.4	135.8	175.3	-49.4	0	0	0	0	110.1
640	F	24.5	Very low	26.2	Very low	163 Å²	163	140.1 Å²	140.1	72%	0.715	79%	0.788	S	S	*	*			trans	-64.4	153.8	178	-82.8	-129.9	0	0	0	112.3	Q642	F640-Q642 HydrophobicContact CD1-CB 4.15Å; F640-Q642 HydrophobicContact CD1-CG 4.33Å
641	V	28.2	Very low	26.2	Very low	152 Å²	152	142 Å²	142	92%	0.921	80%	0.795	S	S	*	*			trans	-123.6	113.4	137.7	178.6	0	0	0	0	107.1
642	Q	24.4	Very low	26.1	Very low	156 Å²	156	141 Å²	141	73%	0.729	80%	0.798	S	S	*	*			trans	-104.2	120.5	-175.4	-157.5	172.1	-3.3	0	0	109.3	F640	F640-Q642 HydrophobicContact CD1-CB 4.15Å; F640-Q642 HydrophobicContact CD1-CG 4.33Å
643	A	27.2	Very low	26.2	Very low	88 Å²	88	143 Å²	143	73%	0.727	81%	0.806	S	S	*	*			trans	-94.7	124.6	171.6	0	0	0	0	0	109.5
644	P	26.7	Very low	26.1	Very low	125 Å²	125	139.4 Å²	139.4	81%	0.812	80%	0.797	S	S	*	*			trans	-77.3	130.2	-172.7	29.6	-34.4	0	0	0	112.2
645	S	26.4	Very low	26.3	Very low	117 Å²	117	143.8 Å²	143.8	82%	0.818	80%	0.803	S	S	*	*			trans	-85.5	110.4	172.4	-62.7	0	0	0	0	110.7	K647	S645-K647 PolarHBondContact O-N 3.47Å
646	K	28.3	Very low	26.1	Very low	207 Å²	207	140.7 Å²	140.7	90%	0.9	80%	0.796	S	S	*	*			trans	-76	112.8	162.4	-80.4	-170.8	174.2	-176.5	0	109
647	K	25.9	Very low	26.3	Very low	201 Å²	201	142.7 Å²	142.7	87%	0.874	80%	0.804	S	S	*	*			trans	-71.3	136	163.9	-74.9	-176.9	174.4	-177.8	0	109.3	S645	S645-K647 PolarHBondContact O-N 3.47Å
648	L	28	Very low	26.4	Very low	162 Å²	162	140.3 Å²	140.3	85%	0.848	80%	0.796	S	S	*	*			trans	-128.1	123.8	156.1	-92.2	163.2	0	0	0	106.6
649	P	26	Very low	26.6	Very low	110 Å²	110	141 Å²	141	71%	0.714	79%	0.791	S	S	*	*			trans	-80.1	143.9	168	33.9	-31.4	0	0	0	109.2
650	L	28.9	Very low	26.7	Very low	165 Å²	165	142 Å²	142	86%	0.864	80%	0.797	S	S	*	*			trans	-154.5	138	158.2	-120.8	143.8	0	0	0	110.3
651	D	26.8	Very low	26.9	Very low	144 Å²	144	140.8 Å²	140.8	77%	0.77	80%	0.803	S	S	*	*			trans	-76.2	166.4	-154.7	-58.6	-74.5	0	0	0	115.4
652	S	23.9	Very low	27	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	80%	0.795	S	S	*	*			trans	-61.9	132.2	170.6	53.2	0	0	0	0	112.6
653	T	28.3	Very low	27.2	Very low	141 Å²	141	135.4 Å²	135.4	87%	0.865	79%	0.785	S	S	*	*			trans	-127.5	127.8	142.7	34.3	0	0	0	0	109.1
654	T	25.1	Very low	27.4	Very low	112 Å²	112	139.1 Å²	139.1	69%	0.687	79%	0.792	S	S	*	*			trans	-94.8	131.4	-176.4	-55.3	0	0	0	0	109.3	T656	T654-T656 HydrophobicContact CG2-CG2 4.11Å
655	F	27.7	Very low	27.5	Very low	205 Å²	205	139.2 Å²	139.2	90%	0.899	78%	0.782	S	S	*	*			trans	-129.4	121.2	156.5	-98.2	-81.4	0	0	0	110.1
656	T	24	Very low	27.7	Very low	114 Å²	114	143 Å²	143	70%	0.699	79%	0.787	S	S	*	*			trans	-92.3	133.5	-176.4	44.3	0	0	0	0	111.6	T654	T654-T656 HydrophobicContact CG2-CG2 4.11Å
657	T	27	Very low	27.8	Very low	142 Å²	142	138.7 Å²	138.7	87%	0.871	78%	0.778	S	S	*	*			trans	-130.4	93.2	159.5	-42.5	0	0	0	0	110.5
658	T	27.8	Very low	27.9	Very low	111 Å²	111	132.8 Å²	132.8	68%	0.681	77%	0.774	S	S	*	*			trans	-47.6	155.2	158.9	35.4	0	0	0	0	113.5
659	T	27.3	Very low	28	Very low	113 Å²	113	131.3 Å²	131.3	69%	0.693	77%	0.772	S	S	*	*			cis	-174.8	147.7	-17.8	17.9	0	0	0	0	107.3
660	T	29.1	Very low	28	Very low	147 Å²	147	132.8 Å²	132.8	90%	0.902	77%	0.769	S	S	*	*			trans	-165.9	105.2	130.1	17.2	0	0	0	0	109.8
661	T	27.9	Very low	28	Very low	139 Å²	139	132.8 Å²	132.8	85%	0.853	77%	0.769	S	S	*	*			trans	-139.7	138.8	172.5	40	0	0	0	0	109.2
662	A	30.6	Very low	28.2	Very low	90 Å²	90	132.7 Å²	132.7	74%	0.744	76%	0.761	S	S	*	*			trans	-161.3	128.5	176	0	0	0	0	0	107.6
663	M	29.5	Very low	28.2	Very low	105 Å²	105	138.9 Å²	138.9	52%	0.517	77%	0.769	S	S	.	*			cis	-139.5	132.3	-1.3	-61.4	-170.9	167.1	0	0	111.2	L1174 H1175	M663-L1174 HydrophobicContact SD-CD2 3.53Å; M663-L1174 VanDerWaalsContact SD-CD2 3.53Å; M663-H1175 VanDerWaalsContact CE-CD2 3.48Å; M663-H1175 WeakPolarHBondContact CE-CD2 3.43Å
664	D	30.3	Very low	28.4	Very low	166 Å²	166	138.2 Å²	138.2	89%	0.888	77%	0.767	S	S	*	*			trans	-122.9	134.2	147.1	-91.6	-47.3	0	0	0	106.3
665	Q	29	Very low	28.4	Very low	126 Å²	126	143.7 Å²	143.7	59%	0.589	78%	0.775	S	S	*	*			trans	-134.8	77.6	172.6	-78.3	-165.1	-4.1	0	0	110.3	T667 L1174	Q665-T667 PolarHBondContact O-N 3.16Å; Q665-T667 VanDerWaalsContact O-N 3.09Å; Q665-L1174 HydrophobicContact CB-CD1 4.43Å; Q665-L1174 HydrophobicContact CB-CD2 4.43Å; Q665-L1174 HydrophobicContact CG-CD2 4.19Å
666	E	30.9	Very low	28.7	Very low	197 Å²	197	142.1 Å²	142.1	92%	0.921	78%	0.775	S	S	*	*			trans	-69	98.2	157.1	-73.6	-164.8	132.1	0	0	109.1	G668	E666-G668 PolarHBondContact O-N 2.83Å; E666-G668 VanDerWaalsContact O-N 3.12Å
667	T	29.7	Very low	29.2	Very low	117 Å²	117	142.7 Å²	142.7	72%	0.718	77%	0.773	S	S	*	*			trans	-76.9	92.9	167.1	49.4	0	0	0	0	109.3	Q665 V669	Q665-T667 PolarHBondContact O-N 3.16Å; Q665-T667 VanDerWaalsContact O-N 3.09Å; T667-V669 PolarHBondContact O-N 3.03Å
668	G	27.3	Very low	29.4	Very low	77 Å²	77	142.7 Å²	142.7	79%	0.794	77%	0.768	S	S	*	*			trans	-62.5	120.3	177.4	0	0	0	0	0	112.4	E666	E666-G668 PolarHBondContact O-N 2.83Å; E666-G668 VanDerWaalsContact O-N 3.12Å
669	V	30.4	Very low	29.8	Very low	131 Å²	131	143 Å²	143	79%	0.794	77%	0.766	S	S	*	*			trans	-98.9	112.1	168.3	176.9	0	0	0	0	108.8	T667 L671	T667-V669 PolarHBondContact O-N 3.03Å; V669-L671 PolarHBondContact O-N 2.84Å; V669-L671 VanDerWaalsContact O-N 3.1Å
670	E	25.9	Very low	30.2	Very low	141 Å²	141	143.7 Å²	143.7	66%	0.659	77%	0.765	S	S	*	*			trans	-78.1	89.4	-175.4	-170.4	-156.4	169.5	0	0	111.7	K672	E670-K672 VanDerWaalsContact C-N 3.28Å; E670-K672 HydrophobicContact CG-CG 4.21Å; E670-K672 PolarHBondContact O-N 3.36Å; E670-K672 VanDerWaalsContact OE1-CE 3.23Å; E670-K672 WeakPolarHBondContact OE1-CE 3.45Å; E670-K672 VanDerWaalsContact OE1-CG 3.25Å; E670-K672 WeakPolarHBondContact OE1-CG 3.39Å; E670-K672 IonicContact OE1-NZ 2.89Å; E670-K672 PolarHBondContact OE1-NZ 3.25Å; E670-K672 IonicContact OE2-NZ 3.74Å; E670-K672 PolarHBondContact OE2-NZ 3.08Å
671	L	30.5	Very low	30.5	Very low	165 Å²	165	143.2 Å²	143.2	86%	0.864	76%	0.757	S	S	*	*			trans	-74.6	81.3	170.9	-98.4	166.4	0	0	0	111.4	V669	V669-L671 PolarHBondContact O-N 2.84Å; V669-L671 VanDerWaalsContact O-N 3.1Å
672	K	30.1	Very low	31	Very low	141 Å²	141	142.6 Å²	142.6	61%	0.613	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-55.7	139.5	169.5	-76.1	-175.7	166.5	73	0	111	E670	E670-K672 VanDerWaalsContact C-N 3.28Å; E670-K672 HydrophobicContact CG-CG 4.21Å; E670-K672 PolarHBondContact O-N 3.36Å; E670-K672 VanDerWaalsContact OE1-CE 3.23Å; E670-K672 WeakPolarHBondContact OE1-CE 3.45Å; E670-K672 VanDerWaalsContact OE1-CG 3.25Å; E670-K672 WeakPolarHBondContact OE1-CG 3.39Å; E670-K672 IonicContact OE1-NZ 2.89Å; E670-K672 PolarHBondContact OE1-NZ 3.25Å; E670-K672 IonicContact OE2-NZ 3.74Å; E670-K672 PolarHBondContact OE2-NZ 3.08Å
673	R	23.6	Very low	31.2	Very low	237 Å²	237	143.6 Å²	143.6	89%	0.894	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-71.7	128.6	166.8	-52.8	178.4	-166.4	180	3.2	109.4
674	P	33.6	Very low	31.4	Very low	126 Å²	126	144.5 Å²	144.5	82%	0.818	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-71.4	134.1	153.7	-3	20.5	0	0	0	108.4
675	R	24.8	Very low	31.5	Very low	228 Å²	228	143.8 Å²	143.8	86%	0.86	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-90.8	136.9	149.9	-72.6	-179.7	176.8	139.8	-6.4	106.9
676	L	34.3	Very low	31.9	Very low	172 Å²	172	145.7 Å²	145.7	90%	0.901	76%	0.756	S	S	*	*			trans	-153.6	141.9	146.9	-109	163.4	0	0	0	106.6
677	D	32.7	Very low	31.8	Very low	125 Å²	125	145.4 Å²	145.4	67%	0.668	75%	0.752	S	S	*	*			trans	-95.9	173	-162.3	-53.6	-75	0	0	0	112.5
678	N	32.9	Very low	32.1	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	76%	0.755	S	S	*	*			trans	78.6	114.9	153.6	-67.9	-1.6	0	0	0	120.1
679	N	34.6	Very low	32.3	Very low	117 Å²	117	149.9 Å²	149.9	63%	0.626	76%	0.758	S	S	*	*				99.8	121.1	126.2	-75.8	50	0	0	0	120.4
680	D	36.4	Very low	32.3	Very low	127 Å²	127	147.2 Å²	147.2	68%	0.679	75%	0.745	S	S	*	*				62.2	134.4	129.4	-42.2	-11	0	0	0	118.7
681	D	36.4	Very low	32.8	Very low	138 Å²	138	147.2 Å²	147.2	74%	0.738	75%	0.75	S	S	*	*			cis	-160.9	179.9	-11.7	-135.9	-30.4	0	0	0	109.1
682	D	37.7	Very low	33	Very low	125 Å²	125	146.7 Å²	146.7	67%	0.668	74%	0.743	S	S	*	*			trans	60.6	123.6	159.6	-81.3	-45.3	0	0	0	119.5
683	T	34.4	Very low	33.3	Very low	112 Å²	112	145 Å²	145	69%	0.687	74%	0.744	S	S	*	*				60.4	136.2	79.1	79.9	0	0	0	0	114.5
684	D	33.4	Very low	33.8	Very low	124 Å²	124	139.5 Å²	139.5	66%	0.663	73%	0.733	S	S	*	*			cis	-160	173.7	-0.3	-139.1	-33.8	0	0	0	113.9
685	H	34	Very low	33.9	Very low	151 Å²	151	141.6 Å²	141.6	70%	0.699	73%	0.729	S	S	*	*			trans	74.6	153.4	141.6	-80.8	18.3	0	0	0	124.4
686	I	35.5	Very low	34.2	Very low	166 Å²	166	138.7 Å²	138.7	85%	0.851	73%	0.725	S	S	*	*			trans	89.7	150	155.7	-70.9	150.9	0	0	0	120
687	K	29.7	Very low	34.1	Very low	191 Å²	191	136.2 Å²	136.2	83%	0.83	72%	0.717	S	S	*	*			trans	-116.7	165.6	-166.3	-99.1	-179.4	176.3	176.7	0	112
688	P	35.6	Very low	34	Very low	122 Å²	122	136 Å²	136	79%	0.792	72%	0.72	S	S	*	*			trans	-84.8	147.7	-168.7	33.6	-37	0	0	0	115.6
689	I	32.1	Very low	33.9	Very low	165 Å²	165	133.6 Å²	133.6	85%	0.846	72%	0.715	S	S	*	*			trans	-170.2	149.4	167.6	-112.7	159.6	0	0	0	107.4
690	S	31.3	Very low	33.7	Very low	75 Å²	75	134.8 Å²	134.8	52%	0.524	73%	0.726	S	S	.	*			cis	-168	171.6	-30.8	52.4	0	0	0	0	108.9
691	D	35.1	Very low	33.5	Very low	141 Å²	141	132.5 Å²	132.5	75%	0.754	73%	0.733	S	S	*	*			trans	67.2	166	156.6	-49	-39.1	0	0	0	116.9
692	E	34.9	Very low	33.1	Very low	155 Å²	155	133.4 Å²	133.4	72%	0.724	74%	0.738	S	S	*	*			cis	-163.1	170.4	-13.7	-130.8	-165.5	159.4	0	0	112
693	T	36.3	Very low	32.8	Very low	105 Å²	105	137.4 Å²	137.4	64%	0.644	75%	0.749	S	S	*	*			trans	68.8	152.8	146.4	67	0	0	0	0	120.4
694	N	34.4	Very low	32.6	Very low	121 Å²	121	140 Å²	140	65%	0.647	75%	0.754	S	S	*	*			cis	-163	171.8	-19.3	-131.7	-46.5	0	0	0	113.7
695	K	35.8	Very low	32.4	Very low	170 Å²	170	145 Å²	145	74%	0.739	76%	0.763	S	S	*	*			trans	68.3	158	150.2	-71.6	159	-172.6	173.8	0	119.7
696	Q	31.2	Very low	32	Very low	168 Å²	168	147.6 Å²	147.6	79%	0.785	77%	0.772	S	S	*	*			cis	-178	-175.9	-41	-116	-179.8	-7.1	0	0	109.6
697	V	32.4	Very low	31.7	Very low	120 Å²	120	151.9 Å²	151.9	73%	0.727	78%	0.778	S	S	*	*			trans	86.3	77.4	158.9	-161	0	0	0	0	119.8
698	T	30.8	Very low	31.5	Very low	120 Å²	120	151.9 Å²	151.9	74%	0.736	77%	0.773	S	S	*	*				43.7	141.8	122.3	62.9	0	0	0	0	125.8
699	S	30.8	Very low	31.4	Very low	92 Å²	92	154.3 Å²	154.3	64%	0.643	78%	0.777	S	S	*	*				87	113.4	129.6	64.3	0	0	0	0	123.9
700	T	29.7	Very low	31.1	Very low	142 Å²	142	154.9 Å²	154.9	87%	0.871	77%	0.769	S	S	*	*			trans	56.6	130.2	131.3	62.2	0	0	0	0	122.3
701	G	31.6	Very low	31	Very low	79 Å²	79	157.7 Å²	157.7	81%	0.814	78%	0.777	S	S	*	*			trans	168.6	108.2	156.7	0	0	0	0	0	116.2
702	N	27.9	Very low	30.8	Very low	158 Å²	158	160.1 Å²	160.1	85%	0.845	78%	0.781	S	S	*	*			trans	-75.6	131.7	169.5	-80.5	-49.9	0	0	0	111.7
703	K	32.3	Very low	30.4	Very low	208 Å²	208	158.6 Å²	158.6	90%	0.904	78%	0.783	S	S	*	*				174.7	157.8	119.9	-95.9	159.4	-174.7	173	0	115.8
704	Q	29.5	Very low	30.3	Very low	168 Å²	168	163 Å²	163	79%	0.785	80%	0.796	S	S	*	*			trans	-55.8	141.7	173.3	-49.3	164.6	-4.4	0	0	113.7
705	R	29	Very low	30	Very low	228 Å²	228	166 Å²	166	86%	0.86	81%	0.806	S	S	*	*				172.2	146.9	101.5	-97.1	179.1	171.2	-170.6	-4	114.4
706	K	26.4	Very low	29.9	Very low	205 Å²	205	165.3 Å²	165.3	89%	0.891	81%	0.805	S	S	*	*			trans	-23.2	131.6	164.9	-61.3	171.6	175.3	177.7	0	116.4
707	R	29.6	Very low	30	Very low	256 Å²	256	164.9 Å²	164.9	97%	0.966	80%	0.801	S	S	*	*			trans	-135	162.5	135.9	-108.8	177	-179.3	-176	-0.7	110.6
708	R	25.2	Very low	29.9	Very low	192 Å²	192	164.2 Å²	164.2	73%	0.725	80%	0.801	S	S	*	*			trans	-128.4	126.3	-159.4	174.5	-167.6	-168.6	175.3	6.9	109
709	I	33.8	Very low	30.1	Very low	172 Å²	172	163 Å²	163	88%	0.882	80%	0.795	S	S	*	*			trans	-110	155.6	166.2	-59.8	-179.4	0	0	0	107.9
710	R	25.6	Very low	30.3	Very low	178 Å²	178	167.7 Å²	167.7	67%	0.672	81%	0.805	S	S	*	*			trans	-158.8	157.9	-158	-162.5	-178.3	-170.3	-176.2	-0.2	108
711	L	28.1	Very low	30.4	Very low	133 Å²	133	166.3 Å²	166.3	70%	0.696	80%	0.801	S	S	*	*			trans	74.2	152.5	-175.2	-47.2	167.1	0	0	0	111.5
712	F	30.7	Very low	30.4	Very low	192 Å²	192	166.1 Å²	166.1	84%	0.842	80%	0.799	S	S	*	*			cis	-119.6	165.8	14.3	-74.3	-97.1	0	0	0	114.5
713	T	27.9	Very low	30.6	Very low	124 Å²	124	167.1 Å²	167.1	76%	0.761	80%	0.803	S	S	*	*			trans	-130	135.5	170.7	45	0	0	0	0	107.6
714	E	33.7	Very low	30.5	Very low	197 Å²	197	163.8 Å²	163.8	92%	0.921	80%	0.795	S	S	*	*			trans	-125.2	149.4	160.9	-69.4	-168.7	139	0	0	108.8
715	E	28.5	Very low	30.8	Very low	183 Å²	183	161.9 Å²	161.9	86%	0.855	80%	0.795	S	S	*	*			trans	-115	148.6	-171.9	-52	178.8	125.3	0	0	109.7
716	E	33.5	Very low	31	Very low	156 Å²	156	155 Å²	155	73%	0.729	78%	0.781	S	S	*	*			trans	-152.6	118.3	132.3	-114.3	-167.5	159.4	0	0	114.7
717	K	32.5	Very low	31.3	Very low	160 Å²	160	154.4 Å²	154.4	70%	0.696	78%	0.779	S	S	*	*			trans	30	104.4	139.5	-57.4	159.5	-159.1	156.5	0	116.3
718	S	30	Very low	31.5	Very low	105 Å²	105	147.7 Å²	147.7	73%	0.734	77%	0.771	S	S	*	*				66.7	161.2	71.1	88.8	0	0	0	0	114.8
719	P	36.5	Very low	31.7	Very low	94 Å²	94	143.4 Å²	143.4	61%	0.61	77%	0.77	S	S	*	*			cis	-142.9	167.8	6.7	41.8	-23.7	0	0	0	117.8
720	K	34.2	Very low	31.6	Very low	192 Å²	192	141.7 Å²	141.7	84%	0.835	77%	0.768	S	S	*	*			trans	65.9	144.5	153.5	-67.6	154.3	-171.3	177.7	0	118.2
721	S	32.1	Very low	31.8	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	76%	0.762	S	S	*	*			cis	-168.1	155.3	-10.7	42.1	0	0	0	0	109.2
722	G	32.1	Very low	32	Very low	75 Å²	75	138.9 Å²	138.9	77%	0.773	77%	0.767	S	S	*	*			cis	130.7	108.4	-0.5	0	0	0	0	0	112.2
723	L	32	Very low	31.8	Very low	179 Å²	179	136.3 Å²	136.3	94%	0.937	76%	0.762	S	S	*	*			trans	-155	172.1	174.9	-116.4	166.8	0	0	0	109.6
724	D	30.5	Very low	32	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	77%	0.766	S	S	*	*			trans	-141.5	-154.3	-167.6	-160.5	-93	0	0	0	111.6
725	V	34.7	Very low	31.6	Very low	128 Å²	128	139.7 Å²	139.7	78%	0.776	76%	0.763	S	S	*	*			trans	85.2	124.8	173.5	-164.7	0	0	0	0	116.5
726	S	34.4	Very low	31.8	Very low	83 Å²	83	137.4 Å²	137.4	58%	0.58	76%	0.764	S	S	*	*			cis	-169.1	144.7	-48	53.6	0	0	0	0	111.7
727	K	31.7	Very low	31.4	Very low	192 Å²	192	134.7 Å²	134.7	84%	0.835	76%	0.762	S	S	*	*			trans	34.8	126.1	143	-57.9	167.9	-175.7	168.3	0	118.9
728	S	33.1	Very low	31.3	Very low	116 Å²	116	136.9 Å²	136.9	81%	0.811	77%	0.772	S	S	*	*				166	-169	86.9	51.7	0	0	0	0	111.4
729	S	30.2	Very low	31.2	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	77%	0.77	S	S	*	*				-165.2	170.5	-81.5	59.7	0	0	0	0	112.5
730	V	32.8	Very low	31.1	Very low	137 Å²	137	138.3 Å²	138.3	83%	0.83	78%	0.776	S	S	*	*			trans	75.2	152.9	164.7	179.7	0	0	0	0	116.9
731	S	28.9	Very low	30.8	Very low	77 Å²	77	137.8 Å²	137.8	54%	0.538	78%	0.777	S	S	.	*			cis	-170.2	166.7	-47.8	77.8	0	0	0	0	110.8
732	Q	32.5	Very low	30.7	Very low	175 Å²	175	138.6 Å²	138.6	82%	0.818	78%	0.782	S	S	*	*			trans	69.5	157.6	154.4	-73.3	-176.8	72.2	0	0	119.5
733	N	27.1	Very low	30.7	Very low	137 Å²	137	140.4 Å²	140.4	73%	0.733	78%	0.784	S	S	*	*			cis	-168.9	176	-30.1	-157.8	-8.6	0	0	0	110.4
734	K	30.9	Very low	30.7	Very low	192 Å²	192	137.5 Å²	137.5	84%	0.835	78%	0.775	S	S	*	*			trans	90.9	127.8	161.9	-63.1	-179.8	176.8	177.3	0	121.3
735	K	25.7	Very low	30.7	Very low	200 Å²	200	136.9 Å²	136.9	87%	0.87	78%	0.779	S	S	*	*			trans	-93.1	167.2	155.3	-97.5	179.5	178.7	-178.7	0	108.4
736	P	32.5	Very low	30.3	Very low	135 Å²	135	140.3 Å²	140.3	88%	0.877	78%	0.783	S	S	*	*				-150.8	-160.1	67.2	41.7	-18.7	0	0	0	116.3
737	C	25.1	Very low	30.3	Very low	100 Å²	100	141.8 Å²	141.8	68%	0.676	79%	0.791	S	S	*	*			trans	-119.7	158	-170.5	-177.1	0	0	0	0	111
738	F	30.6	Very low	30.2	Very low	206 Å²	206	141.7 Å²	141.7	90%	0.904	79%	0.79	S	S	*	*			trans	-172.9	176.9	135	-100	-62.6	0	0	0	111.8
739	T	27.1	Very low	29.8	Very low	114 Å²	114	143.3 Å²	143.3	70%	0.699	79%	0.789	S	S	*	*			trans	-139.3	-179.5	-161.7	46.5	0	0	0	0	111
740	P	35.4	Very low	29.8	Very low	114 Å²	114	144.6 Å²	144.6	74%	0.74	79%	0.793	S	S	*	*			cis	-129.8	-149.2	-37.5	34.9	-14	0	0	0	112
741	E	26.7	Very low	29.4	Very low	181 Å²	181	146.2 Å²	146.2	85%	0.846	80%	0.796	S	S	*	*			trans	103.5	162.4	160.4	-59.7	-149.1	133.9	0	0	120.6
742	S	31.9	Very low	29.5	Very low	130 Å²	130	145.1 Å²	145.1	91%	0.909	80%	0.797	S	S	*	*			trans	83.4	153.5	-175.5	77.3	0	0	0	0	118.3
743	S	31.1	Very low	29.2	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	80%	0.795	S	S	*	*			trans	-126.3	168.8	-153.9	58	0	0	0	0	114
744	P	31.2	Very low	29.3	Very low	118 Å²	118	140.7 Å²	140.7	77%	0.766	79%	0.792	S	S	*	*			trans	-95.8	162.7	-155.6	37.4	-37.3	0	0	0	116.2
745	P	31.3	Very low	29.2	Very low	124 Å²	124	138.1 Å²	138.1	81%	0.805	79%	0.787	S	S	*	*			trans	-88.4	152.2	173	35.1	-34.5	0	0	0	114.4
746	K	25.5	Very low	29.4	Very low	201 Å²	201	135.8 Å²	135.8	87%	0.874	78%	0.779	S	S	*	*			trans	-140	130.7	164.3	-89.4	-171	177.3	-179.3	0	111.2
747	P	34.3	Very low	29.2	Very low	114 Å²	114	134.3 Å²	134.3	74%	0.74	77%	0.771	S	S	*	*			trans	-106.2	146.1	140.3	-6.6	27.7	0	0	0	109.2
748	K	30.5	Very low	29.5	Very low	190 Å²	190	134.8 Å²	134.8	83%	0.826	77%	0.772	S	S	*	*			cis	61.2	137.3	48.1	-66.2	-171.1	176.4	-177.2	0	112.9
749	L	25.4	Very low	29.4	Very low	150 Å²	150	131.3 Å²	131.3	79%	0.785	76%	0.762	S	S	*	*			cis	-174.9	-172.3	-24.7	-125.4	169.4	0	0	0	105.9
750	T	28.7	Very low	29.4	Very low	127 Å²	127	131.5 Å²	131.5	78%	0.779	76%	0.759	S	S	*	*			trans	76.1	121.2	171.2	-43.4	0	0	0	0	114.6
751	L	24.8	Very low	29.1	Very low	171 Å²	171	132 Å²	132	90%	0.895	76%	0.76	S	S	*	*			cis	106.2	124.3	13.4	-159.3	154.1	0	0	0	114.3
752	G	30.9	Very low	29.2	Very low	55 Å²	55	128.2 Å²	128.2	57%	0.567	75%	0.753	S	S	*	*			trans	139.5	106.4	-173.4	0	0	0	0	0	107.9
753	S	26.9	Very low	29.1	Very low	111 Å²	111	127.2 Å²	127.2	78%	0.776	75%	0.746	S	S	*	*				73	145.9	66.1	86.7	0	0	0	0	112.1
754	T	28.7	Very low	29	Very low	108 Å²	108	126.3 Å²	126.3	66%	0.663	74%	0.74	S	S	*	*			cis	-163.8	155.4	23.6	-22.3	0	0	0	0	110.8
755	L	29.5	Very low	28.9	Very low	138 Å²	138	126.9 Å²	126.9	72%	0.723	74%	0.741	S	S	*	*			trans	68.1	152.9	159.2	-50.6	-179.7	0	0	0	117.6
756	E	29	Very low	28.8	Very low	151 Å²	151	130 Å²	130	71%	0.706	75%	0.745	S	S	*	*			cis	-161.6	154.4	-7.4	-124.4	160.5	178.7	0	0	112.5
757	S	29.2	Very low	28.9	Very low	103 Å²	103	127.3 Å²	127.3	72%	0.72	74%	0.74	S	S	*	*			trans	57.9	144.6	149.6	65.9	0	0	0	0	121.2
758	T	30.4	Very low	29.1	Very low	111 Å²	111	127.7 Å²	127.7	68%	0.681	74%	0.743	S	S	*	*			cis	-164.5	134.4	-12.7	21.7	0	0	0	0	108.7
759	D	28.4	Very low	29.1	Very low	132 Å²	132	124.3 Å²	124.3	71%	0.706	74%	0.74	S	S	*	*				63.2	150.4	127.1	-61.2	21	0	0	0	122.9
760	N	28.2	Very low	29.1	Very low	118 Å²	118	123.3 Å²	123.3	63%	0.631	75%	0.746	S	S	*	*			cis	-169.2	146.2	-24.9	-109.6	-33.1	0	0	0	111.9
761	T	28.3	Very low	29	Very low	125 Å²	125	120.9 Å²	120.9	77%	0.767	75%	0.746	S	S	*	*			trans	58.6	161.1	144.4	61.3	0	0	0	0	121.8
762	S	28.6	Very low	29.2	Very low	101 Å²	101	117.5 Å²	117.5	71%	0.706	74%	0.743	S	S	*	*			cis	-163.6	177.7	-27.1	59.5	0	0	0	0	111.1
763	S	29.7	Very low	29.1	Very low	109 Å²	109	121.5 Å²	121.5	76%	0.762	76%	0.757	S	S	*	*			trans	-101.3	156.5	-171.5	56.6	0	0	0	0	115.7
764	S	28.8	Very low	29.3	Very low	95 Å²	95	121.5 Å²	121.5	66%	0.664	76%	0.756	S	S	*	*			trans	-152.2	98.8	150.6	65.4	0	0	0	0	115.3
765	V	29.7	Very low	29.8	Very low	130 Å²	130	124.8 Å²	124.8	79%	0.788	76%	0.762	S	S	*	*			trans	16.9	127.1	137.9	-176.1	0	0	0	0	119.7
766	Q	29	Very low	30.6	Very low	189 Å²	189	122.2 Å²	122.2	88%	0.883	76%	0.76	S	S	*	*			trans	-145.6	170.5	136.6	-114.5	-179.4	10.1	0	0	111.1
767	N	29.1	Very low	31.9	Very low	145 Å²	145	120.1 Å²	120.1	78%	0.775	76%	0.76	S	S	*	*			trans	-74.8	157.3	-159	-71.1	-33	0	0	0	115.5
768	P	37.8	Very low	33.7	Very low	122 Å²	122	118.1 Å²	118.1	79%	0.792	74%	0.738	S	S	*	*			trans	-87.3	149.4	-169.8	34.5	-36.5	0	0	0	114.4
769	P	29.3	Very low	35.7	Very low	120 Å²	120	117 Å²	117	78%	0.779	73%	0.728	S	S	*	*			trans	-108	151.4	155.6	36.2	-28.3	0	0	0	112.4
770	S	26.4	Very low	37.8	Very low	128 Å²	128	111.1 Å²	111.1	90%	0.895	70%	0.696	S	S	*	*			trans	-63.2	139.1	171.5	50.7	0	0	0	0	113.6
771	G	27.5	Very low	39.9	Very low	76 Å²	76	110.1 Å²	110.1	78%	0.784	69%	0.694	S	S	*	*			trans	168.1	132.7	164	0	0	0	0	0	116.4
772	A	27.6	Very low	42.1	Very low	100 Å²	100	105.3 Å²	105.3	83%	0.826	67%	0.665	S	S	*	*			trans	43.4	95.1	158.2	0	0	0	0	0	118.9	S774	A772-S774 VanDerWaalsContact C-N 3.34Å; A772-S774 PolarHBondContact O-N 3.49Å
773	T	28.6	Very low	44.3	Very low	140 Å²	140	104.7 Å²	104.7	86%	0.859	66%	0.66	S	S	*	*			trans	-66.3	90.2	156.9	39.6	0	0	0	0	110.5	F775	T773-F775 PolarHBondContact O-N 3.28Å
774	S	30.9	Very low	46.7	Very low	110 Å²	110	100.9 Å²	100.9	77%	0.769	63%	0.632	S	S	*	*			trans	-57.9	124.1	172.3	-177.1	0	0	0	0	110.6	A772 A776	A772-S774 VanDerWaalsContact C-N 3.34Å; A772-S774 PolarHBondContact O-N 3.49Å; S774-A776 VanDerWaalsContact C-N 3.3Å; S774-A776 PolarHBondContact O-N 2.85Å
775	F	40	Very low	49.3	Very low	178 Å²	178	98.1 Å²	98.1	78%	0.781	61%	0.608	S	S	*	*			trans	-66.6	87.3	174.3	-85.1	-85.5	0	0	0	110.3	T773	T773-F775 PolarHBondContact O-N 3.28Å
776	A	46.6	Very low	51.9	Low	84 Å²	84	92.5 Å²	92.5	69%	0.694	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-55.6	124.9	171.9	0	0	0	0	0	109.2	S774 F778	S774-A776 VanDerWaalsContact C-N 3.3Å; S774-A776 PolarHBondContact O-N 2.85Å; A776-F778 PolarHBondContact O-N 3.13Å
777	P	55.5	Low	54.3	Low	106 Å²	106	84 Å²	84	69%	0.688	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-64.3	123.5	-179.7	25.6	-33	0	0	0	109	L779	P777-L779 PolarHBondContact O-N 3.1Å
778	F	68	Low	56.3	Low	61 Å²	61	85 Å²	85	27%	0.268	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-49.9	128.4	168.6	167.8	-79.7	0	0	0	109.6	A776 I780 K1013 L1016	A776-F778 PolarHBondContact O-N 3.13Å; F778-I780 HydrophobicContact CE1-CG1 4.15Å; F778-I780 HydrophobicContact CZ-CG1 4.5Å; F778-K1013 HydrophobicContact CB-CD 3.89Å; F778-K1013 HydrophobicContact CB-CG 4.3Å; F778-K1013 HydrophobicContact CD1-CD 3.94Å; F778-K1013 VanDerWaalsContact CD1-CE 3.49Å; F778-K1013 HydrophobicContact CD1-CG 3.57Å; F778-K1013 HydrophobicContact CD2-CD 4.41Å; F778-K1013 HydrophobicContact CD2-CG 3.92Å; F778-K1013 HydrophobicContact CE1-CG 3.83Å; F778-K1013 HydrophobicContact CE2-CG 4.14Å; F778-K1013 HydrophobicContact CG-CD 3.81Å; F778-K1013 HydrophobicContact CG-CG 3.64Å; F778-K1013 HydrophobicContact CZ-CG 4.12Å; F778-L1016 HydrophobicContact CE2-CD1 4.17Å; F778-L1016 HydrophobicContact CZ-CD1 3.58Å
779	L	72.5	Confident	58.2	Low	89 Å²	89	80.7 Å²	80.7	47%	0.466	52%	0.516	S	S	.	.			trans	-131.9	143.7	174.4	-69.4	171.7	0	0	0	109.2	P777 T781 R975	P777-L779 PolarHBondContact O-N 3.1Å; L779-T781 PolarHBondContact O-N 2.89Å; L779-R975 CarbonylContact C-O 3.57Å; L779-R975 VanDerWaalsContact CA-O 3.27Å; L779-R975 WeakPolarHBondContact CA-O 3Å; L779-R975 HydrophobicContact CD2-CG 4.37Å
780	I	72	Confident	60.6	Low	7 Å²	7	77.5 Å²	77.5	4%	0.036	50%	0.497	C	S	.	.			trans	-66.6	120.5	168.9	-55.4	175.8	0	0	0	108.1	F778 T782 H888 L973 C974 R975 I1012 F1024	F778-I780 HydrophobicContact CE1-CG1 4.15Å; F778-I780 HydrophobicContact CZ-CG1 4.5Å; I780-T782 WeakPolarHBondContact CG2-OG1 3.34Å; I780-H888 WeakPolarHBondContact CG2-NE2 3.49Å; I780-L973 HydrophobicContact CD1-CD1 3.99Å; I780-L973 HydrophobicContact CD1-CD2 3.71Å; I780-L973 HydrophobicContact CD1-CG 3.71Å; I780-C974 WeakPolarHBondContact CD1-O 3.36Å; I780-R975 HydrophobicContact CB-CG 4.45Å; I780-R975 PolarHBondContact N-O 2.84Å; I780-R975 PolarHBondContact O-NE 3.41Å; I780-I1012 HydrophobicContact CD1-CD1 3.85Å; I780-I1012 HydrophobicContact CG1-CD1 4.33Å; I780-F1024 HydrophobicContact CG2-CB 4.29Å
781	T	72	Confident	63.4	Low	97 Å²	97	76.3 Å²	76.3	60%	0.595	48%	0.476	S	S	*	.			trans	-93	-8.5	-172.7	51.2	0	0	0	0	114.1	L779	L779-T781 PolarHBondContact O-N 2.89Å
782	T	75.2	Confident	66.2	Low	24 Å²	24	73.5 Å²	73.5	15%	0.147	44%	0.443	C	S	.	.	S	Bend	trans	-71.4	163.6	172.4	44.6	0	0	0	0	111.9	I780 H888 R1023	I780-T782 WeakPolarHBondContact CG2-OG1 3.34Å; T782-H888 PolarHBondContact O-CE1 3.24Å; T782-H888 PolarHBondContact OG1-CE1 2.99Å; T782-H888 PolarHBondContact OG1-NE2 3Å; T782-R1023 HydrophobicContact CG2-CB 4.25Å
783	S	74.1	Confident	69.1	Low	88 Å²	88	74.6 Å²	74.6	62%	0.615	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-60.6	149.9	164.6	-56.4	0	0	0	0	110.7	H888	S783-H888 PolarHBondContact O-CE1 3.32Å; S783-H888 PolarHBondContact O-NE2 3.14Å
784	D	80.1	Confident	71.8	Confident	30 Å²	30	68.5 Å²	68.5	16%	0.16	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-69.7	170.4	170.1	57.6	-9.9	0	0	0	111.9	L786 G787 R848 T850	D784-L786 PolarHBondContact O-N 3.3Å; D784-L786 VanDerWaalsContact O-N 3.15Å; D784-G787 WeakPolarHBondContact O-CA 3.32Å; D784-G787 PolarHBondContact O-N 2.88Å; D784-G787 WeakPolarHBondContact OD1-CA 3.35Å; D784-G787 PolarHBondContact OD1-N 2.89Å; D784-G787 VanDerWaalsContact OD1-N 3.14Å; D784-R848 VanDerWaalsContact CG-NH2 3.3Å; D784-R848 IonicContact OD1-CZ 3.35Å; D784-R848 IonicContact OD1-NH1 3.99Å; D784-R848 IonicContact OD1-NH2 3.53Å; D784-R848 PolarHBondContact OD1-NH2 3.02Å; D784-R848 IonicContact OD2-CZ 3.73Å; D784-R848 VanDerWaalsContact OD2-CZ 3.28Å; D784-R848 IonicContact OD2-NH1 3.37Å; D784-R848 PolarHBondContact OD2-NH1 3.19Å; D784-R848 IonicContact OD2-NH2 3.1Å; D784-R848 PolarHBondContact OD2-NH2 2.75Å; D784-T850 VanDerWaalsContact OD2-CA 3.25Å; D784-T850 WeakPolarHBondContact OD2-CA 3.33Å; D784-T850 WeakPolarHBondContact OD2-CB 3.33Å; D784-T850 VanDerWaalsContact OD2-CG2 3.28Å; D784-T850 WeakPolarHBondContact OD2-CG2 3.23Å
785	Q	83.7	Confident	74.4	Confident	37 Å²	37	67.2 Å²	67.2	17%	0.173	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.1	-171.2	-179.6	-176.3	19.2	0	0	114.9	T850 Y852 H888 T889 L890 H928	Q785-T850 PolarHBondContact N-O 2.96Å; Q785-Y852 HydrophobicContact CG-CD1 4.35Å; Q785-Y852 HydrophobicContact CG-CE1 4.37Å; Q785-Y852 PolarHBondContact NE2-O 2.97Å; Q785-Y852 PolarHBondContact OE1-O 3.42Å; Q785-H888 PolarHBondContact N-O 3.14Å; Q785-T889 HydrophobicContact CB-CG2 4.37Å; Q785-T889 HydrophobicContact CG-CG2 4.4Å; Q785-L890 PolarHBondContact NE2-O 3.17Å; Q785-H928 PolarHBondContact NE2-CE1 2.8Å; Q785-H928 PolarHBondContact NE2-NE2 2.98Å
786	L	84.4	Confident	76.2	Confident	12 Å²	12	58.9 Å²	58.9	6%	0.063	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-27.2	167.7	-98.7	72.8	0	0	0	113.4	D784 N788 A789 V792 L808 N810 L849 T850 Y852	D784-L786 PolarHBondContact O-N 3.3Å; D784-L786 VanDerWaalsContact O-N 3.15Å; L786-N788 PolarHBondContact O-N 3.09Å; L786-A789 WeakPolarHBondContact O-CB 3.25Å; L786-A789 PolarHBondContact O-N 3.49Å; L786-A789 VanDerWaalsContact O-N 3.08Å; L786-V792 HydrophobicContact CD2-CG2 4.41Å; L786-V792 HydrophobicContact CG-CG2 4.03Å; L786-L808 HydrophobicContact CD1-CD1 4.36Å; L786-N810 WeakPolarHBondContact CD2-ND2 3.36Å; L786-L849 HydrophobicContact CD2-CB 4.02Å; L786-T850 PolarHBondContact N-O 3.22Å; L786-Y852 HydrophobicContact CD1-CD1 3.39Å; L786-Y852 HydrophobicContact CD1-CE1 3.85Å; L786-Y852 HydrophobicContact CD1-CG 4.39Å
787	G	79.6	Confident	77.4	Confident	10 Å²	10	57.3 Å²	57.3	10%	0.103	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	-136.6	-173.8	0	0	0	0	0	112.3	D784 A789 R848	D784-G787 WeakPolarHBondContact O-CA 3.32Å; D784-G787 PolarHBondContact O-N 2.88Å; D784-G787 WeakPolarHBondContact OD1-CA 3.35Å; D784-G787 PolarHBondContact OD1-N 2.89Å; D784-G787 VanDerWaalsContact OD1-N 3.14Å; G787-A789 PolarHBondContact O-N 3.5Å; G787-R848 PolarHBondContact O-NH2 2.76Å
788	N	70.4	Confident	78	Confident	166 Å²	166	52.4 Å²	52.4	89%	0.888	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	13.6	178.8	-67.1	0.2	0	0	0	113.5	L786 S790	L786-N788 PolarHBondContact O-N 3.09Å; N788-S790 PolarHBondContact O-N 2.78Å
789	A	77.2	Confident	77.9	Confident	31 Å²	31	54 Å²	54	26%	0.256	31%	0.306	S	S	.	.			trans	-69.1	115.8	178.8	0	0	0	0	0	111.3	L786 G787 K791 V792	L786-A789 WeakPolarHBondContact O-CB 3.25Å; L786-A789 PolarHBondContact O-N 3.49Å; L786-A789 VanDerWaalsContact O-N 3.08Å; G787-A789 PolarHBondContact O-N 3.5Å; A789-K791 VanDerWaalsContact C-N 3.31Å; A789-V792 HydrophobicContact CB-CG2 3.83Å
790	S	79.3	Confident	77.9	Confident	53 Å²	53	55.2 Å²	55.2	37%	0.371	31%	0.313	S	S	.	.	S	Bend	trans	-73.7	-23.7	172.6	57.3	0	0	0	0	112.8	N788 I809 N810 S812	N788-S790 PolarHBondContact O-N 2.78Å; S790-I809 CarbonylContact O-C 3.58Å; S790-I809 WeakPolarHBondContact O-CA 3.38Å; S790-N810 CarbonylContact C-O 3.55Å; S790-N810 VanDerWaalsContact CA-O 3.22Å; S790-N810 WeakPolarHBondContact CA-O 3.4Å; S790-N810 WeakPolarHBondContact CB-O 3.24Å; S790-N810 PolarHBondContact O-N 3.49Å; S790-N810 VanDerWaalsContact O-O 3.05Å; S790-S812 WeakPolarHBondContact CB-OG 3.15Å
791	K	85.6	Confident	78	Confident	104 Å²	104	56.8 Å²	56.8	45%	0.452	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	133.4	175.1	-174.1	169.2	-174.9	173.8	0	111.3	A789 Q807 L808 I809	A789-K791 VanDerWaalsContact C-N 3.31Å; K791-Q807 VanDerWaalsContact CE-CD 3.41Å; K791-L808 WeakPolarHBondContact CA-O 3.33Å; K791-I809 HydrophobicContact CD-CG1 4.45Å; K791-I809 HydrophobicContact CG-CG1 4.22Å
792	V	86.8	Confident	78.2	Confident	16 Å²	16	53.4 Å²	53.4	10%	0.097	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.2	169.4	176.3	0	0	0	0	108.2	L786 A789 Q807 L808 Y852	L786-V792 HydrophobicContact CD2-CG2 4.41Å; L786-V792 HydrophobicContact CG-CG2 4.03Å; A789-V792 HydrophobicContact CB-CG2 3.83Å; V792-Q807 CarbonylContact O-C 3.57Å; V792-Q807 WeakPolarHBondContact O-CA 3.33Å; V792-L808 HydrophobicContact CB-CB 4.39Å; V792-L808 PolarHBondContact N-O 2.98Å; V792-L808 PolarHBondContact O-N 3.45Å; V792-Y852 HydrophobicContact CG1-CE1 4.05Å; V792-Y852 HydrophobicContact CG1-CE2 4.26Å
793	Q	88	Confident	78.5	Confident	123 Å²	123	56.3 Å²	56.3	58%	0.575	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	143	175.8	64.3	-175.9	-3.8	0	0	111.8	I805 V806 Q807	Q793-I805 HydrophobicContact CB-CG2 4.42Å; Q793-V806 CarbonylContact C-O 3.53Å; Q793-V806 VanDerWaalsContact CA-O 3.27Å; Q793-V806 WeakPolarHBondContact CA-O 3.32Å; Q793-Q807 HydrophobicContact CB-CG 4Å
794	F	86.3	Confident	79.1	Confident	13 Å²	13	52.1 Å²	52.1	6%	0.057	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	164.5	176.8	57.6	-89.2	0	0	0	110.7	C796 V806 L808 Y852 Y854 I859	F794-C796 HydrophobicContact CE2-CB 4.42Å; F794-V806 HydrophobicContact CD2-CB 4.09Å; F794-V806 HydrophobicContact CE1-CB 4.11Å; F794-V806 HydrophobicContact CE1-CG1 3.97Å; F794-V806 HydrophobicContact CE2-CB 3.64Å; F794-V806 HydrophobicContact CE2-CG1 4Å; F794-V806 HydrophobicContact CE2-CG2 4Å; F794-V806 HydrophobicContact CZ-CB 3.65Å; F794-V806 HydrophobicContact CZ-CG1 3.51Å; F794-V806 HydrophobicContact CZ-CG2 4.38Å; F794-V806 PolarHBondContact N-O 3.35Å; F794-V806 PolarHBondContact O-N 2.85Å; F794-L808 HydrophobicContact CE1-CD1 4.07Å; F794-L808 HydrophobicContact CE1-CD2 4.37Å; F794-L808 HydrophobicContact CE1-CG 4.02Å; F794-Y852 AromaticContact CD1-CD2 3.86Å; F794-Y852 HydrophobicContact CD1-CD2 3.86Å; F794-Y852 AromaticContact CD1-CE2 3.69Å; F794-Y852 HydrophobicContact CD1-CE2 3.69Å; F794-Y852 AromaticContact CE1-CD2 3.68Å; F794-Y852 HydrophobicContact CE1-CD2 3.68Å; F794-Y852 HydrophobicContact CE1-CE2 4.03Å; F794-Y852 HydrophobicContact CG-CE2 4.36Å; F794-Y852 HydrophobicContact CZ-CD2 4.37Å; F794-Y854 HydrophobicContact CB-CD1 4.43Å; F794-Y854 HydrophobicContact CB-CE1 3.87Å; F794-Y854 HydrophobicContact CB-CE2 4.48Å; F794-Y854 HydrophobicContact CD1-CD1 4.47Å; F794-Y854 AromaticContact CD2-CD1 3.54Å; F794-Y854 HydrophobicContact CD2-CD1 3.54Å; F794-Y854 AromaticContact CD2-CD2 3.67Å; F794-Y854 HydrophobicContact CD2-CD2 3.67Å; F794-Y854 AromaticContact CD2-CE1 3.81Å; F794-Y854 HydrophobicContact CD2-CE1 3.81Å; F794-Y854 AromaticContact CD2-CE2 3.9Å; F794-Y854 HydrophobicContact CD2-CE2 3.9Å; F794-Y854 AromaticContact CD2-CG 3.5Å; F794-Y854 HydrophobicContact CD2-CG 3.5Å; F794-Y854 VanDerWaalsContact CD2-CG 3.5Å; F794-Y854 AromaticContact CD2-CZ 3.98Å; F794-Y854 AromaticContact CE2-CD1 3.79Å; F794-Y854 HydrophobicContact CE2-CD1 3.79Å; F794-Y854 HydrophobicContact CE2-CD2 4.01Å; F794-Y854 HydrophobicContact CE2-CE1 4.49Å; F794-Y854 AromaticContact CE2-CG 3.53Å; F794-Y854 HydrophobicContact CE2-CG 3.53Å; F794-Y854 AromaticContact CG-CD1 3.92Å; F794-Y854 HydrophobicContact CG-CD1 3.92Å; F794-Y854 AromaticContact CG-CE1 3.86Å; F794-Y854 HydrophobicContact CG-CE1 3.86Å; F794-Y854 HydrophobicContact CG-CG 4.33Å; F794-Y854 HydrophobicContact CZ-CD1 4.35Å; F794-Y854 HydrophobicContact CZ-CG 4.38Å; F794-I859 HydrophobicContact CE2-CG1 4.45Å; F794-I859 HydrophobicContact CE2-CG2 4.44Å; F794-I859 HydrophobicContact CZ-CG2 3.93Å
795	V	84.3	Confident	79.5	Confident	83 Å²	83	53.6 Å²	53.6	50%	0.503	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128	177.8	-178.1	0	0	0	0	109.3	P803 I804 Y854	V795-P803 HydrophobicContact CG1-CB 3.86Å; V795-I804 WeakPolarHBondContact CA-O 3.37Å; V795-Y854 VanDerWaalsContact O-CE2 3.31Å; V795-Y854 WeakPolarHBondContact O-CE2 3.49Å
796	C	78.5	Confident	79.8	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.014	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141	177.8	176.8	0	0	0	0	108.4	F794 N798 I804 V806 S855 D856 S873	F794-C796 HydrophobicContact CE2-CB 4.42Å; C796-N798 PolarHBondContact O-N 2.85Å; C796-I804 HydrophobicContact CB-CG1 4.13Å; C796-I804 PolarHBondContact N-O 2.89Å; C796-I804 WeakPolarHBondContact O-CG1 3.07Å; C796-I804 PolarHBondContact O-N 3.26Å; C796-V806 HydrophobicContact CB-CG2 4.08Å; C796-S855 PolarHBondContact SG-O 3.24Å; C796-D856 PolarHBondContact SG-O 2.84Å; C796-D856 VanDerWaalsContact SG-O 3.36Å; C796-S873 WeakPolarHBondContact SG-CB 3.5Å
797	S	71.1	Confident	80	Confident	51 Å²	51	52.9 Å²	52.9	36%	0.357	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	79.2	-174.4	57.2	0	0	0	0	111.9	L799 G802 D856	S797-L799 PolarHBondContact O-N 3.16Å; S797-G802 CarbonylContact C-O 3.59Å; S797-D856 CarbonylContact C-O 3.53Å; S797-D856 VanDerWaalsContact OG-CA 3.3Å; S797-D856 WeakPolarHBondContact OG-CA 3.4Å; S797-D856 WeakPolarHBondContact OG-CB 3.12Å
798	N	69.7	Low	80.6	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	130.3	173.7	173.5	-23.2	0	0	0	110.5	C796 I800 D801 G802 I804 S873	C796-N798 PolarHBondContact O-N 2.85Å; N798-I800 PolarHBondContact O-N 2.98Å; N798-I800 WeakPolarHBondContact OD1-CA 3.47Å; N798-I800 WeakPolarHBondContact OD1-CB 3.44Å; N798-I800 PolarHBondContact OD1-N 3.03Å; N798-D801 HydrophobicContact CB-CB 4.26Å; N798-D801 PolarHBondContact ND2-OD2 2.84Å; N798-D801 PolarHBondContact OD1-N 2.8Å; N798-D801 VanDerWaalsContact OD1-N 3.08Å; N798-G802 WeakPolarHBondContact CB-O 3.25Å; N798-G802 PolarHBondContact N-O 2.85Å; N798-G802 CarbonylContact O-C 3.58Å; N798-G802 WeakPolarHBondContact O-CA 3.49Å; N798-G802 PolarHBondContact O-N 3.41Å; N798-I804 HydrophobicContact CB-CD1 3.98Å; N798-I804 HydrophobicContact CB-CG1 3.96Å; N798-I804 HydrophobicContact CB-CG2 3.88Å; N798-S873 WeakPolarHBondContact CA-OG 3.29Å; N798-S873 PolarHBondContact ND2-O 2.64Å
799	L	65.5	Low	81.5	Confident	94 Å²	94	46.6 Å²	46.6	49%	0.492	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.6	-176.4	-71	168.2	0	0	0	113.9	S797 E857 F991	S797-L799 PolarHBondContact O-N 3.16Å; L799-E857 HydrophobicContact CD1-CG 3.85Å; L799-E857 HydrophobicContact CG-CG 4.26Å; L799-F991 HydrophobicContact CD1-CE2 4.08Å; L799-F991 HydrophobicContact CD1-CZ 3.75Å
800	I	72.5	Confident	81.9	Confident	116 Å²	116	45.6 Å²	45.6	60%	0.595	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-51.4	179.9	-49.8	177.2	0	0	0	110.1	N798 T874 F991	N798-I800 PolarHBondContact O-N 2.98Å; N798-I800 WeakPolarHBondContact OD1-CA 3.47Å; N798-I800 WeakPolarHBondContact OD1-CB 3.44Å; N798-I800 PolarHBondContact OD1-N 3.03Å; I800-T874 HydrophobicContact CD1-CG2 3.85Å; I800-T874 HydrophobicContact CG1-CG2 4.43Å; I800-F991 HydrophobicContact CD1-CD1 4.16Å
801	D	73.9	Confident	81.3	Confident	40 Å²	40	45.5 Å²	45.5	21%	0.214	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-1.1	-174.4	-68.1	-70.5	0	0	0	114.1	N798 I804 R835 L840	N798-D801 HydrophobicContact CB-CB 4.26Å; N798-D801 PolarHBondContact ND2-OD2 2.84Å; N798-D801 PolarHBondContact OD1-N 2.8Å; N798-D801 VanDerWaalsContact OD1-N 3.08Å; D801-I804 HydrophobicContact CB-CG2 3.74Å; D801-R835 WeakPolarHBondContact O-CD 3.27Å; D801-R835 PolarHBondContact O-NE 2.79Å; D801-R835 PolarHBondContact O-NH1 3Å; D801-L840 HydrophobicContact CB-CD1 3.92Å
802	G	76.4	Confident	79.7	Confident	25 Å²	25	44.2 Å²	44.2	26%	0.258	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	66.2	-147.3	-172.4	0	0	0	0	0	112.1	S797 N798 I804	S797-G802 CarbonylContact C-O 3.59Å; N798-G802 WeakPolarHBondContact CB-O 3.25Å; N798-G802 PolarHBondContact N-O 2.85Å; N798-G802 CarbonylContact O-C 3.58Å; N798-G802 WeakPolarHBondContact O-CA 3.49Å; N798-G802 PolarHBondContact O-N 3.41Å; G802-I804 PolarHBondContact O-N 3.35Å; G802-I804 VanDerWaalsContact O-N 3.16Å
803	P	82.1	Confident	77.4	Confident	86 Å²	86	50 Å²	50	56%	0.558	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	115.9	179.9	27.4	-33.3	0	0	0	111.4	V795	V795-P803 HydrophobicContact CG1-CB 3.86Å
804	I	85.5	Confident	74.8	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	144.5	174.7	60.5	161.7	0	0	0	110.1	V795 C796 N798 D801 G802 V806 A833 R835 L840 S873	V795-I804 WeakPolarHBondContact CA-O 3.37Å; C796-I804 HydrophobicContact CB-CG1 4.13Å; C796-I804 PolarHBondContact N-O 2.89Å; C796-I804 WeakPolarHBondContact O-CG1 3.07Å; C796-I804 PolarHBondContact O-N 3.26Å; N798-I804 HydrophobicContact CB-CD1 3.98Å; N798-I804 HydrophobicContact CB-CG1 3.96Å; N798-I804 HydrophobicContact CB-CG2 3.88Å; D801-I804 HydrophobicContact CB-CG2 3.74Å; G802-I804 PolarHBondContact O-N 3.35Å; G802-I804 VanDerWaalsContact O-N 3.16Å; I804-V806 HydrophobicContact CD1-CG2 3.98Å; I804-V806 HydrophobicContact CG1-CG2 4.29Å; I804-A833 HydrophobicContact CD1-CB 4.06Å; I804-R835 HydrophobicContact CG2-CB 4.49Å; I804-L840 HydrophobicContact CB-CD1 4.25Å; I804-L840 HydrophobicContact CG2-CD1 3.38Å; I804-S873 VanDerWaalsContact CD1-O 3.24Å; I804-S873 WeakPolarHBondContact CD1-O 3.33Å
805	I	88.4	Confident	72.1	Confident	61 Å²	61	53.9 Å²	53.9	31%	0.313	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	120.8	172	-56.6	175.2	0	0	0	107.3	Q793 Q807 A833 S834	Q793-I805 HydrophobicContact CB-CG2 4.42Å; I805-Q807 HydrophobicContact CG2-CG 4.05Å; I805-A833 WeakPolarHBondContact O-CA 3.35Å; I805-S834 PolarHBondContact N-O 2.89Å; I805-S834 PolarHBondContact O-N 2.82Å
806	V	89.6	Confident	69.7	Low	0 Å²	0	55.7 Å²	55.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.1	174	-175.8	0	0	0	0	108.4	Q793 F794 C796 I804 I831 I832 I859	Q793-V806 CarbonylContact C-O 3.53Å; Q793-V806 VanDerWaalsContact CA-O 3.27Å; Q793-V806 WeakPolarHBondContact CA-O 3.32Å; F794-V806 HydrophobicContact CD2-CB 4.09Å; F794-V806 HydrophobicContact CE1-CB 4.11Å; F794-V806 HydrophobicContact CE1-CG1 3.97Å; F794-V806 HydrophobicContact CE2-CB 3.64Å; F794-V806 HydrophobicContact CE2-CG1 4Å; F794-V806 HydrophobicContact CE2-CG2 4Å; F794-V806 HydrophobicContact CZ-CB 3.65Å; F794-V806 HydrophobicContact CZ-CG1 3.51Å; F794-V806 HydrophobicContact CZ-CG2 4.38Å; F794-V806 PolarHBondContact N-O 3.35Å; F794-V806 PolarHBondContact O-N 2.85Å; C796-V806 HydrophobicContact CB-CG2 4.08Å; I804-V806 HydrophobicContact CD1-CG2 3.98Å; I804-V806 HydrophobicContact CG1-CG2 4.29Å; V806-I831 HydrophobicContact CG1-CG2 3.98Å; V806-I832 CarbonylContact C-O 3.59Å; V806-I832 VanDerWaalsContact CA-O 3.32Å; V806-I832 WeakPolarHBondContact CA-O 3.22Å; V806-I859 HydrophobicContact CG1-CD1 4.33Å; V806-I859 HydrophobicContact CG2-CD1 3.86Å
807	Q	89.9	Confident	67.2	Low	33 Å²	33	67.6 Å²	67.6	15%	0.154	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.3	-179.3	-56.3	-173.7	-10.9	0	0	109.8	K791 V792 Q793 I805 I831 I832	K791-Q807 VanDerWaalsContact CE-CD 3.41Å; V792-Q807 CarbonylContact O-C 3.57Å; V792-Q807 WeakPolarHBondContact O-CA 3.33Å; Q793-Q807 HydrophobicContact CB-CG 4Å; I805-Q807 HydrophobicContact CG2-CG 4.05Å; Q807-I831 WeakPolarHBondContact O-CA 3.34Å; Q807-I832 HydrophobicContact CB-CB 4.44Å; Q807-I832 PolarHBondContact N-O 3.04Å; Q807-I832 PolarHBondContact O-N 2.77Å
808	L	91.8	Very high	65.3	Low	0 Å²	0	70.9 Å²	70.9	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.6	169.8	-52.3	177.6	0	0	0	107.7	L786 K791 V792 F794 I831 L849 Y852 V861	L786-L808 HydrophobicContact CD1-CD1 4.36Å; K791-L808 WeakPolarHBondContact CA-O 3.33Å; V792-L808 HydrophobicContact CB-CB 4.39Å; V792-L808 PolarHBondContact N-O 2.98Å; V792-L808 PolarHBondContact O-N 3.45Å; F794-L808 HydrophobicContact CE1-CD1 4.07Å; F794-L808 HydrophobicContact CE1-CD2 4.37Å; F794-L808 HydrophobicContact CE1-CG 4.02Å; L808-I831 HydrophobicContact CD2-CB 4.34Å; L808-I831 HydrophobicContact CD2-CG1 3.85Å; L808-I831 HydrophobicContact CD2-CG2 3.94Å; L808-L849 HydrophobicContact CB-CD1 4.08Å; L808-L849 HydrophobicContact CD2-CD1 4.2Å; L808-Y852 HydrophobicContact CD1-CD1 4.07Å; L808-Y852 HydrophobicContact CD1-CD2 4.07Å; L808-Y852 HydrophobicContact CD1-CG 3.67Å; L808-V861 HydrophobicContact CD2-CG1 4.4Å; L808-V861 HydrophobicContact CD2-CG2 4.06Å
809	I	89.7	Confident	63.4	Low	44 Å²	44	79.6 Å²	79.6	23%	0.226	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.5	-178.9	-57.7	-177.2	0	0	0	109.7	S790 K791 P829 R830 I832	S790-I809 CarbonylContact O-C 3.58Å; S790-I809 WeakPolarHBondContact O-CA 3.38Å; K791-I809 HydrophobicContact CD-CG1 4.45Å; K791-I809 HydrophobicContact CG-CG1 4.22Å; I809-P829 CarbonylContact O-C 3.59Å; I809-P829 WeakPolarHBondContact O-CA 3.32Å; I809-P829 WeakPolarHBondContact O-CB 3.48Å; I809-R830 PolarHBondContact N-O 2.84Å; I809-R830 PolarHBondContact O-N 3.13Å; I809-I832 HydrophobicContact CD1-CD1 3.67Å
810	N	84.6	Confident	61.7	Low	11 Å²	11	83.7 Å²	83.7	6%	0.059	47%	0.465	C	S	.	.			trans	-103.8	117.2	168.2	-84.9	-28.3	0	0	0	108.7	L786 S790 S812 L849	L786-N810 WeakPolarHBondContact CD2-ND2 3.36Å; S790-N810 CarbonylContact C-O 3.55Å; S790-N810 VanDerWaalsContact CA-O 3.22Å; S790-N810 WeakPolarHBondContact CA-O 3.4Å; S790-N810 WeakPolarHBondContact CB-O 3.24Å; S790-N810 PolarHBondContact O-N 3.49Å; S790-N810 VanDerWaalsContact O-O 3.05Å; N810-S812 PolarHBondContact O-N 2.97Å; N810-L849 PolarHBondContact ND2-O 3.42Å; N810-L849 PolarHBondContact OD1-N 2.8Å
811	S	66.7	Low	59.7	Low	50 Å²	50	84.7 Å²	84.7	35%	0.35	47%	0.47	S	S	.	.			trans	-65	118.1	-176.6	-36.1	0	0	0	0	112	S827	S811-S827 WeakPolarHBondContact CB-O 3.11Å; S811-S827 PolarHBondContact OG-O 2.96Å
812	S	52.9	Low	57.6	Low	78 Å²	78	88.6 Å²	88.6	55%	0.545	50%	0.498	S	S	.	.			trans	-100.2	111.1	178.4	53.1	0	0	0	0	111.6	S790 N810 S814	S790-S812 WeakPolarHBondContact CB-OG 3.15Å; N810-S812 PolarHBondContact O-N 2.97Å; S812-S814 PolarHBondContact O-N 2.99Å
813	N	37.2	Very low	55.4	Low	138 Å²	138	96.8 Å²	96.8	74%	0.738	53%	0.526	S	S	*	.			trans	-75.1	87.7	170	-76.5	-2.4	0	0	0	110.4	S815	N813-S815 PolarHBondContact O-N 2.81Å
814	S	34.6	Very low	52.8	Low	100 Å²	100	100.1 Å²	100.1	70%	0.699	54%	0.539	S	S	*	.			trans	-80.3	90.9	166.3	54.4	0	0	0	0	109.7	S812 T816	S812-S814 PolarHBondContact O-N 2.99Å; S814-T816 PolarHBondContact O-N 2.86Å; S814-T816 VanDerWaalsContact O-N 3.15Å
815	S	28.4	Very low	50.4	Low	117 Å²	117	104.8 Å²	104.8	82%	0.818	57%	0.571	S	S	*	*			trans	-77.9	94.2	-177.9	55.1	0	0	0	0	112.2	N813	N813-S815 PolarHBondContact O-N 2.81Å
816	T	34	Very low	48.2	Very low	121 Å²	121	108.2 Å²	108.2	74%	0.742	59%	0.59	S	S	*	*			trans	-126.8	84.6	173.4	53.6	0	0	0	0	112.7	S814	S814-T816 PolarHBondContact O-N 2.86Å; S814-T816 VanDerWaalsContact O-N 3.15Å
817	R	27.6	Very low	46.9	Very low	252 Å²	252	111.5 Å²	111.5	95%	0.951	61%	0.613	S	S	*	*			trans	49.2	81.2	137.2	-164.5	-169.4	-170.5	177.7	4.8	118.4
818	S	30.4	Very low	46.4	Very low	119 Å²	119	112.3 Å²	112.3	83%	0.832	62%	0.62	S	S	*	*			trans	-159.1	160.8	139.3	60.7	0	0	0	0	109.9
819	E	29.5	Very low	46.3	Very low	187 Å²	187	113 Å²	113	87%	0.874	63%	0.625	S	S	*	*			trans	-88.7	-177.7	-174.8	-67	170.3	117.7	0	0	112.9
820	E	29.3	Very low	46.3	Very low	180 Å²	180	115.2 Å²	115.2	84%	0.841	63%	0.63	S	S	*	*			trans	82.3	123.3	171.4	-53.9	-156.8	141.7	0	0	120
821	I	30.9	Very low	46.6	Very low	136 Å²	136	114.7 Å²	114.7	70%	0.697	63%	0.627	S	S	*	*			trans	62.8	96.7	161.1	-50.5	170.1	0	0	0	117.5	K823	I821-K823 PolarHBondContact O-N 2.91Å
822	P	29.7	Very low	47.8	Very low	123 Å²	123	113.2 Å²	113.2	80%	0.799	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-77.6	118.3	169.3	31.4	-32.5	0	0	0	112
823	K	30.1	Very low	49.6	Very low	196 Å²	196	109.5 Å²	109.5	85%	0.852	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-96.2	132.6	162.2	-75.1	-174.2	177.7	177.1	0	110.4	I821	I821-K823 PolarHBondContact O-N 2.91Å
824	L	28.6	Very low	52	Low	157 Å²	157	103.8 Å²	103.8	82%	0.822	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-67.4	138.6	-171.8	-98.5	66.5	0	0	0	113.8
825	S	34.1	Very low	54.4	Low	97 Å²	97	104.7 Å²	104.7	68%	0.678	55%	0.548	S	S	*	.			trans	61.9	140.2	147.1	69.2	0	0	0	0	119.9
826	N	41.8	Very low	56.7	Low	134 Å²	134	103.7 Å²	103.7	72%	0.717	54%	0.541	S	S	*	.			cis	-151.3	145.4	-16.8	-104.2	-21.3	0	0	0	107.8	V828	N826-V828 HydrophobicContact CB-CG2 3.91Å; N826-V828 PolarHBondContact O-N 3.02Å
827	S	62.8	Low	58.7	Low	69 Å²	69	105.9 Å²	105.9	48%	0.483	55%	0.548	S	S	.	.			trans	-79.8	61.9	-174.7	62.6	0	0	0	0	112.4	S811	S811-S827 WeakPolarHBondContact CB-O 3.11Å; S811-S827 PolarHBondContact OG-O 2.96Å
828	V	80.6	Confident	61.4	Low	49 Å²	49	102.7 Å²	102.7	30%	0.297	54%	0.537	S	S	.	.			trans	-84.5	128.6	-171.9	-168.2	0	0	0	0	112.5	N826 I844 C845	N826-V828 HydrophobicContact CB-CG2 3.91Å; N826-V828 PolarHBondContact O-N 3.02Å; V828-I844 HydrophobicContact CB-CG2 4.2Å; V828-I844 HydrophobicContact CG1-CG2 3.44Å; V828-I844 VanDerWaalsContact CG1-CG2 3.44Å; V828-C845 WeakPolarHBondContact CG1-O 3.48Å
829	P	88	Confident	64	Low	15 Å²	15	102.6 Å²	102.6	10%	0.097	52%	0.518	C	S	.	.			trans	-58.1	149.5	174.3	-28	37.8	0	0	0	114.6	I809 C845 L849	I809-P829 CarbonylContact O-C 3.59Å; I809-P829 WeakPolarHBondContact O-CA 3.32Å; I809-P829 WeakPolarHBondContact O-CB 3.48Å; P829-C845 HydrophobicContact CB-CB 4.34Å; P829-C845 PolarHBondContact O-N 3.4Å; P829-L849 HydrophobicContact CB-CG 4.37Å
830	R	90.2	Very high	66.7	Low	90 Å²	90	95.8 Å²	95.8	34%	0.34	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	147.3	-170.2	-70.4	155.8	-172.9	-100.8	5.2	112.5	I809 I832 E842 L843	I809-R830 PolarHBondContact N-O 2.84Å; I809-R830 PolarHBondContact O-N 3.13Å; R830-I832 HydrophobicContact CB-CG1 4.31Å; R830-E842 WeakPolarHBondContact CD-OE1 3.31Å; R830-E842 WeakPolarHBondContact CG-OE1 3.22Å; R830-E842 IonicContact CZ-OE1 3.82Å; R830-E842 IonicContact NE-OE1 2.97Å; R830-E842 VanDerWaalsContact NH1-CD 3.3Å; R830-E842 IonicContact NH1-OE1 2.73Å; R830-E842 PolarHBondContact NH1-OE1 3.25Å; R830-E842 IonicContact NH1-OE2 3.26Å; R830-E842 PolarHBondContact NH1-OE2 3.49Å; R830-L843 WeakPolarHBondContact CA-O 3.48Å
831	I	91.8	Very high	69.5	Low	0 Å²	0	88.8 Å²	88.8	0%	0	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.2	165.3	-53	168	0	0	0	106.8	V806 Q807 L808 W841 E842 L843 L849 V861 I871	V806-I831 HydrophobicContact CG1-CG2 3.98Å; Q807-I831 WeakPolarHBondContact O-CA 3.34Å; L808-I831 HydrophobicContact CD2-CB 4.34Å; L808-I831 HydrophobicContact CD2-CG1 3.85Å; L808-I831 HydrophobicContact CD2-CG2 3.94Å; I831-W841 HydrophobicContact CB-CZ3 4.31Å; I831-W841 HydrophobicContact CG2-CH2 3.89Å; I831-W841 HydrophobicContact CG2-CZ3 3.61Å; I831-E842 CarbonylContact O-C 3.6Å; I831-E842 WeakPolarHBondContact O-CA 3.26Å; I831-L843 HydrophobicContact CB-CB 4.31Å; I831-L843 PolarHBondContact N-O 3.45Å; I831-L843 PolarHBondContact O-N 3.08Å; I831-L849 HydrophobicContact CG1-CD1 4.15Å; I831-V861 HydrophobicContact CD1-CB 4.14Å; I831-V861 HydrophobicContact CD1-CG1 4.26Å; I831-V861 HydrophobicContact CD1-CG2 3.83Å; I831-I871 HydrophobicContact CD1-CD1 3.85Å
832	I	91.1	Very high	72.3	Confident	20 Å²	20	84.9 Å²	84.9	10%	0.103	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.1	-175.1	-50.4	173.6	0	0	0	109.4	V806 Q807 I809 R830 R839	V806-I832 CarbonylContact C-O 3.59Å; V806-I832 VanDerWaalsContact CA-O 3.32Å; V806-I832 WeakPolarHBondContact CA-O 3.22Å; Q807-I832 HydrophobicContact CB-CB 4.44Å; Q807-I832 PolarHBondContact N-O 3.04Å; Q807-I832 PolarHBondContact O-N 2.77Å; I809-I832 HydrophobicContact CD1-CD1 3.67Å; R830-I832 HydrophobicContact CB-CG1 4.31Å; I832-R839 VanDerWaalsContact CD1-NH2 3.28Å; I832-R839 HydrophobicContact CG2-CG 3.94Å
833	A	90.2	Very high	75.1	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	136.7	165.8	0	0	0	0	0	111.1	I804 I805 L840 W841	I804-A833 HydrophobicContact CD1-CB 4.06Å; I805-A833 WeakPolarHBondContact O-CA 3.35Å; A833-L840 HydrophobicContact CB-CB 4.34Å; A833-L840 PolarHBondContact O-N 3.24Å; A833-W841 HydrophobicContact CB-CD2 3.57Å; A833-W841 HydrophobicContact CB-CE3 4.2Å; A833-W841 HydrophobicContact CB-CG 3.94Å; A833-W841 HydrophobicContact CB-CH2 4.29Å; A833-W841 HydrophobicContact CB-CZ2 3.67Å; A833-W841 PolarHBondContact N-O 3.46Å
834	S	88	Confident	77.8	Confident	17 Å²	17	76.4 Å²	76.4	12%	0.119	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	156	171.7	66	0	0	0	0	112.4	I805 R838	I805-S834 PolarHBondContact N-O 2.89Å; I805-S834 PolarHBondContact O-N 2.82Å; S834-R838 CarbonylContact C-O 3.58Å; S834-R838 WeakPolarHBondContact CA-O 3.19Å; S834-R838 WeakPolarHBondContact CB-O 3.24Å
835	R	85.3	Confident	80.5	Confident	119 Å²	119	69 Å²	69	45%	0.449	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	114.7	168.7	-174.6	-176.5	-177.7	179.8	3.4	107.9	D801 I804 D837 R838 L840	D801-R835 WeakPolarHBondContact O-CD 3.27Å; D801-R835 PolarHBondContact O-NE 2.79Å; D801-R835 PolarHBondContact O-NH1 3Å; I804-R835 HydrophobicContact CG2-CB 4.49Å; R835-D837 PolarHBondContact O-N 2.83Å; R835-R838 PolarHBondContact N-O 3.22Å; R835-R838 PolarHBondContact O-N 2.62Å; R835-L840 HydrophobicContact CB-CD1 4.21Å
836	S	77.3	Confident	82.8	Confident	97 Å²	97	68.3 Å²	68.3	68%	0.678	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	-131	-160.2	-51.6	0	0	0	0	109.1	R838	S836-R838 VanDerWaalsContact C-N 3.35Å
837	D	76	Confident	84.9	Confident	166 Å²	166	63.3 Å²	63.3	89%	0.888	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-11.9	179	-45.4	-67.4	0	0	0	113.7	R835 R839	R835-D837 PolarHBondContact O-N 2.83Å; D837-R839 PolarHBondContact O-N 2.8Å
838	R	84.2	Confident	86.1	Confident	186 Å²	186	63.6 Å²	63.6	70%	0.702	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	109.7	180	-176	177.4	178.1	-173.5	-1.2	110.4	S834 R835 S836 L840	S834-R838 CarbonylContact C-O 3.58Å; S834-R838 WeakPolarHBondContact CA-O 3.19Å; S834-R838 WeakPolarHBondContact CB-O 3.24Å; R835-R838 PolarHBondContact N-O 3.22Å; R835-R838 PolarHBondContact O-N 2.62Å; S836-R838 VanDerWaalsContact C-N 3.35Å; R838-L840 HydrophobicContact CG-CD2 4.42Å; R838-L840 PolarHBondContact O-N 2.72Å
839	R	85.3	Confident	86.5	Confident	116 Å²	116	61.4 Å²	61.4	44%	0.438	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	130	164	-158.4	-179	-143	-152.8	-0.8	109.9	I832 D837 E842	I832-R839 VanDerWaalsContact CD1-NH2 3.28Å; I832-R839 HydrophobicContact CG2-CG 3.94Å; D837-R839 PolarHBondContact O-N 2.8Å; R839-E842 VanDerWaalsContact CZ-CD 3.48Å; R839-E842 IonicContact CZ-OE1 3.61Å; R839-E842 IonicContact CZ-OE2 3.36Å; R839-E842 VanDerWaalsContact NH1-CD 3.28Å; R839-E842 IonicContact NH1-OE1 3.69Å; R839-E842 IonicContact NH1-OE2 2.7Å; R839-E842 PolarHBondContact NH1-OE2 3.06Å; R839-E842 IonicContact NH2-OE1 2.72Å; R839-E842 PolarHBondContact NH2-OE1 2.88Å; R839-E842 IonicContact NH2-OE2 3.26Å; R839-E842 PolarHBondContact NH2-OE2 3.3Å
840	L	85.7	Confident	86.6	Confident	44 Å²	44	60.7 Å²	60.7	23%	0.23	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-50.7	179.1	-61.2	176.7	0	0	0	110.8	D801 I804 A833 R835 R838	D801-L840 HydrophobicContact CB-CD1 3.92Å; I804-L840 HydrophobicContact CB-CD1 4.25Å; I804-L840 HydrophobicContact CG2-CD1 3.38Å; A833-L840 HydrophobicContact CB-CB 4.34Å; A833-L840 PolarHBondContact O-N 3.24Å; R835-L840 HydrophobicContact CB-CD1 4.21Å; R838-L840 HydrophobicContact CG-CD2 4.42Å; R838-L840 PolarHBondContact O-N 2.72Å
841	W	88.9	Confident	86.6	Confident	33 Å²	33	56.4 Å²	56.4	13%	0.125	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	160.2	177.8	52.6	-101.1	0	0	0	111.8	I831 A833 L843 I859 I871 S873 T874	I831-W841 HydrophobicContact CB-CZ3 4.31Å; I831-W841 HydrophobicContact CG2-CH2 3.89Å; I831-W841 HydrophobicContact CG2-CZ3 3.61Å; A833-W841 HydrophobicContact CB-CD2 3.57Å; A833-W841 HydrophobicContact CB-CE3 4.2Å; A833-W841 HydrophobicContact CB-CG 3.94Å; A833-W841 HydrophobicContact CB-CH2 4.29Å; A833-W841 HydrophobicContact CB-CZ2 3.67Å; A833-W841 PolarHBondContact N-O 3.46Å; W841-L843 HydrophobicContact CE3-CD1 4.32Å; W841-L843 HydrophobicContact CE3-CG 4.06Å; W841-L843 HydrophobicContact CZ3-CD1 3.87Å; W841-L843 HydrophobicContact CZ3-CG 4.01Å; W841-I859 HydrophobicContact CH2-CD1 4Å; W841-I859 HydrophobicContact CZ2-CD1 3.91Å; W841-I871 HydrophobicContact CH2-CG2 4.45Å; W841-S873 PolarHBondContact NE1-O 3.37Å; W841-S873 VanDerWaalsContact NE1-O 3.07Å; W841-T874 VanDerWaalsContact CD1-O 3.31Å; W841-T874 VanDerWaalsContact NE1-C 3.32Å
842	E	89.3	Confident	86.7	Confident	55 Å²	55	57 Å²	57	26%	0.257	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	138.7	171.1	168.2	168.7	-122	0	0	109.3	R830 I831 R839 I844	R830-E842 WeakPolarHBondContact CD-OE1 3.31Å; R830-E842 WeakPolarHBondContact CG-OE1 3.22Å; R830-E842 IonicContact CZ-OE1 3.82Å; R830-E842 IonicContact NE-OE1 2.97Å; R830-E842 VanDerWaalsContact NH1-CD 3.3Å; R830-E842 IonicContact NH1-OE1 2.73Å; R830-E842 PolarHBondContact NH1-OE1 3.25Å; R830-E842 IonicContact NH1-OE2 3.26Å; R830-E842 PolarHBondContact NH1-OE2 3.49Å; I831-E842 CarbonylContact O-C 3.6Å; I831-E842 WeakPolarHBondContact O-CA 3.26Å; R839-E842 VanDerWaalsContact CZ-CD 3.48Å; R839-E842 IonicContact CZ-OE1 3.61Å; R839-E842 IonicContact CZ-OE2 3.36Å; R839-E842 VanDerWaalsContact NH1-CD 3.28Å; R839-E842 IonicContact NH1-OE1 3.69Å; R839-E842 IonicContact NH1-OE2 2.7Å; R839-E842 PolarHBondContact NH1-OE2 3.06Å; R839-E842 IonicContact NH2-OE1 2.72Å; R839-E842 PolarHBondContact NH2-OE1 2.88Å; R839-E842 IonicContact NH2-OE2 3.26Å; R839-E842 PolarHBondContact NH2-OE2 3.3Å; E842-I844 HydrophobicContact CG-CG1 4.21Å
843	L	88.2	Confident	86.7	Confident	34 Å²	34	56.5 Å²	56.5	18%	0.178	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.9	165.4	-60.7	171.1	0	0	0	108.7	R830 I831 W841 I871	R830-L843 WeakPolarHBondContact CA-O 3.48Å; I831-L843 HydrophobicContact CB-CB 4.31Å; I831-L843 PolarHBondContact N-O 3.45Å; I831-L843 PolarHBondContact O-N 3.08Å; W841-L843 HydrophobicContact CE3-CD1 4.32Å; W841-L843 HydrophobicContact CE3-CG 4.06Å; W841-L843 HydrophobicContact CZ3-CD1 3.87Å; W841-L843 HydrophobicContact CZ3-CG 4.01Å; L843-I871 HydrophobicContact CD1-CD1 3.67Å; L843-I871 HydrophobicContact CD1-CG1 4.11Å; L843-I871 HydrophobicContact CD1-CG2 3.87Å
844	I	87.1	Confident	86.6	Confident	107 Å²	107	59.4 Å²	59.4	55%	0.549	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.5	-179.8	-59.4	178.1	0	0	0	108.2	V828 E842	V828-I844 HydrophobicContact CB-CG2 4.2Å; V828-I844 HydrophobicContact CG1-CG2 3.44Å; V828-I844 VanDerWaalsContact CG1-CG2 3.44Å; E842-I844 HydrophobicContact CG-CG1 4.21Å
845	C	85.1	Confident	86.4	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.007	29%	0.287	C	S	.	.			trans	-106.2	128.7	-173	-59.7	0	0	0	0	110.5	V828 P829 D847 L849	V828-C845 WeakPolarHBondContact CG1-O 3.48Å; P829-C845 HydrophobicContact CB-CB 4.34Å; P829-C845 PolarHBondContact O-N 3.4Å; C845-D847 VanDerWaalsContact C-N 3.26Å; C845-D847 PolarHBondContact O-N 2.89Å; C845-L849 HydrophobicContact CB-CD2 3.74Å
846	S	80.9	Confident	85.9	Confident	82 Å²	82	57.1 Å²	57.1	57%	0.573	28%	0.283	S	S	*	.	S	Bend	trans	-82.4	9.2	-172.6	47.3	0	0	0	0	115.4	R867	S846-R867 PolarHBondContact OG-NH1 3.06Å; S846-R867 PolarHBondContact OG-NH2 3.23Å
847	D	86	Confident	85.9	Confident	30 Å²	30	53 Å²	53	16%	0.16	25%	0.253	C	S	.	.	S	Bend	trans	-155	169.1	172.6	-143.4	-63.4	0	0	0	110.9	C845 L849 D863 K865	C845-D847 VanDerWaalsContact C-N 3.26Å; C845-D847 PolarHBondContact O-N 2.89Å; D847-L849 PolarHBondContact O-N 3.46Å; D847-D863 HydrophobicContact CB-CB 4.43Å; D847-K865 HydrophobicContact CB-CG 4.5Å; D847-K865 WeakPolarHBondContact OD2-CD 3.38Å; D847-K865 WeakPolarHBondContact OD2-CE 3.32Å; D847-K865 WeakPolarHBondContact OD2-CG 3.38Å; D847-K865 IonicContact OD2-NZ 3.75Å; D847-K865 PolarHBondContact OD2-NZ 3.31Å
848	R	88.2	Confident	86.4	Confident	74 Å²	74	45.1 Å²	45.1	28%	0.279	21%	0.211	S	C	.	.			trans	-62.4	128.5	179	178.9	180	160	-79.6	-1.4	110.3	D784 G787 D863 N864	D784-R848 VanDerWaalsContact CG-NH2 3.3Å; D784-R848 IonicContact OD1-CZ 3.35Å; D784-R848 IonicContact OD1-NH1 3.99Å; D784-R848 IonicContact OD1-NH2 3.53Å; D784-R848 PolarHBondContact OD1-NH2 3.02Å; D784-R848 IonicContact OD2-CZ 3.73Å; D784-R848 VanDerWaalsContact OD2-CZ 3.28Å; D784-R848 IonicContact OD2-NH1 3.37Å; D784-R848 PolarHBondContact OD2-NH1 3.19Å; D784-R848 IonicContact OD2-NH2 3.1Å; D784-R848 PolarHBondContact OD2-NH2 2.75Å; G787-R848 PolarHBondContact O-NH2 2.76Å; R848-D863 WeakPolarHBondContact O-CA 3.3Å; R848-D863 WeakPolarHBondContact O-CB 3.16Å; R848-N864 HydrophobicContact CB-CB 4.43Å; R848-N864 PolarHBondContact O-N 3.23Å
849	L	90.7	Very high	86.7	Confident	3 Å²	3	36.2 Å²	36.2	2%	0.016	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	131.5	174	-52.2	-177.7	0	0	0	109.3	L786 L808 N810 P829 I831 C845 D847 V861 D863	L786-L849 HydrophobicContact CD2-CB 4.02Å; L808-L849 HydrophobicContact CB-CD1 4.08Å; L808-L849 HydrophobicContact CD2-CD1 4.2Å; N810-L849 PolarHBondContact ND2-O 3.42Å; N810-L849 PolarHBondContact OD1-N 2.8Å; P829-L849 HydrophobicContact CB-CG 4.37Å; I831-L849 HydrophobicContact CG1-CD1 4.15Å; C845-L849 HydrophobicContact CB-CD2 3.74Å; D847-L849 PolarHBondContact O-N 3.46Å; L849-V861 HydrophobicContact CB-CG1 4.36Å; L849-V861 HydrophobicContact CD1-CG1 4.11Å; L849-V861 HydrophobicContact CD2-CG1 3.83Å; L849-V861 HydrophobicContact CG-CG1 4.31Å; L849-D863 HydrophobicContact CD2-CB 4.5Å
850	T	89.2	Confident	87.1	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-30.1	-175.8	60.6	0	0	0	0	112.9	D784 Q785 L786 G862 N864 V887	D784-T850 VanDerWaalsContact OD2-CA 3.25Å; D784-T850 WeakPolarHBondContact OD2-CA 3.33Å; D784-T850 WeakPolarHBondContact OD2-CB 3.33Å; D784-T850 VanDerWaalsContact OD2-CG2 3.28Å; D784-T850 WeakPolarHBondContact OD2-CG2 3.23Å; Q785-T850 PolarHBondContact N-O 2.96Å; L786-T850 PolarHBondContact N-O 3.22Å; T850-G862 PolarHBondContact N-O 2.99Å; T850-G862 PolarHBondContact OG1-O 3.29Å; T850-N864 HydrophobicContact CG2-CB 3.86Å; T850-V887 WeakPolarHBondContact CB-O 3.03Å; T850-V887 PolarHBondContact OG1-O 3.25Å
851	S	90.8	Very high	87.4	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	154.9	-163.3	47.8	0	0	0	0	111.7	G862 V887	S851-G862 PolarHBondContact N-O 2.87Å; S851-G862 PolarHBondContact O-N 2.99Å; S851-G862 WeakPolarHBondContact OG-CA 3.3Å; S851-V887 WeakPolarHBondContact OG-CB 3.34Å; S851-V887 VanDerWaalsContact OG-CG1 3.24Å; S851-V887 WeakPolarHBondContact OG-CG1 3.33Å
852	Y	92.8	Very high	87.5	Confident	13 Å²	13	27.2 Å²	27.2	5%	0.051	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	150.3	-179.8	72	-68.3	0	0	0	111.7	Q785 L786 V792 F794 L808 Y854 A860 H928	Q785-Y852 HydrophobicContact CG-CD1 4.35Å; Q785-Y852 HydrophobicContact CG-CE1 4.37Å; Q785-Y852 PolarHBondContact NE2-O 2.97Å; Q785-Y852 PolarHBondContact OE1-O 3.42Å; L786-Y852 HydrophobicContact CD1-CD1 3.39Å; L786-Y852 HydrophobicContact CD1-CE1 3.85Å; L786-Y852 HydrophobicContact CD1-CG 4.39Å; V792-Y852 HydrophobicContact CG1-CE1 4.05Å; V792-Y852 HydrophobicContact CG1-CE2 4.26Å; F794-Y852 AromaticContact CD1-CD2 3.86Å; F794-Y852 HydrophobicContact CD1-CD2 3.86Å; F794-Y852 AromaticContact CD1-CE2 3.69Å; F794-Y852 HydrophobicContact CD1-CE2 3.69Å; F794-Y852 AromaticContact CE1-CD2 3.68Å; F794-Y852 HydrophobicContact CE1-CD2 3.68Å; F794-Y852 HydrophobicContact CE1-CE2 4.03Å; F794-Y852 HydrophobicContact CG-CE2 4.36Å; F794-Y852 HydrophobicContact CZ-CD2 4.37Å; L808-Y852 HydrophobicContact CD1-CD1 4.07Å; L808-Y852 HydrophobicContact CD1-CD2 4.07Å; L808-Y852 HydrophobicContact CD1-CG 3.67Å; Y852-Y854 HydrophobicContact CD2-CD1 4.25Å; Y852-Y854 HydrophobicContact CE2-CD1 4.28Å; Y852-Y854 HydrophobicContact CE2-CE1 4.26Å; Y852-A860 CarbonylContact C-O 3.59Å; Y852-A860 VanDerWaalsContact CA-O 3.23Å; Y852-A860 WeakPolarHBondContact CA-O 3.48Å; Y852-H928 AromaticContact CE1-CE1 3.41Å; Y852-H928 VanDerWaalsContact CE1-CE1 3.41Å; Y852-H928 WeakPolarHBondContact CE1-CE1 3.18Å; Y852-H928 AromaticContact CE1-NE2 3.89Å; Y852-H928 AromaticContact CZ-CE1 3.55Å; Y852-H928 AromaticContact CZ-NE2 3.82Å; Y852-H928 PolarHBondContact OH-CE1 2.84Å
853	A	90.8	Very high	87.6	Confident	9 Å²	9	24.7 Å²	24.7	7%	0.074	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	152.6	165.6	0	0	0	0	0	108.8	A860 L890 L892	A853-A860 HydrophobicContact CB-CB 4.45Å; A853-A860 PolarHBondContact N-O 3.06Å; A853-A860 PolarHBondContact O-N 3.27Å; A853-A860 VanDerWaalsContact O-O 3.11Å; A853-L890 HydrophobicContact CB-CB 3.92Å; A853-L892 HydrophobicContact CB-CB 3.61Å
854	Y	89.4	Confident	87.5	Confident	61 Å²	61	26.7 Å²	26.7	24%	0.239	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	163.5	-178.8	68.8	-80.5	0	0	0	111.7	F794 V795 Y852 V858	F794-Y854 HydrophobicContact CB-CD1 4.43Å; F794-Y854 HydrophobicContact CB-CE1 3.87Å; F794-Y854 HydrophobicContact CB-CE2 4.48Å; F794-Y854 HydrophobicContact CD1-CD1 4.47Å; F794-Y854 AromaticContact CD2-CD1 3.54Å; F794-Y854 HydrophobicContact CD2-CD1 3.54Å; F794-Y854 AromaticContact CD2-CD2 3.67Å; F794-Y854 HydrophobicContact CD2-CD2 3.67Å; F794-Y854 AromaticContact CD2-CE1 3.81Å; F794-Y854 HydrophobicContact CD2-CE1 3.81Å; F794-Y854 AromaticContact CD2-CE2 3.9Å; F794-Y854 HydrophobicContact CD2-CE2 3.9Å; F794-Y854 AromaticContact CD2-CG 3.5Å; F794-Y854 HydrophobicContact CD2-CG 3.5Å; F794-Y854 VanDerWaalsContact CD2-CG 3.5Å; F794-Y854 AromaticContact CD2-CZ 3.98Å; F794-Y854 AromaticContact CE2-CD1 3.79Å; F794-Y854 HydrophobicContact CE2-CD1 3.79Å; F794-Y854 HydrophobicContact CE2-CD2 4.01Å; F794-Y854 HydrophobicContact CE2-CE1 4.49Å; F794-Y854 AromaticContact CE2-CG 3.53Å; F794-Y854 HydrophobicContact CE2-CG 3.53Å; F794-Y854 AromaticContact CG-CD1 3.92Å; F794-Y854 HydrophobicContact CG-CD1 3.92Å; F794-Y854 AromaticContact CG-CE1 3.86Å; F794-Y854 HydrophobicContact CG-CE1 3.86Å; F794-Y854 HydrophobicContact CG-CG 4.33Å; F794-Y854 HydrophobicContact CZ-CD1 4.35Å; F794-Y854 HydrophobicContact CZ-CG 4.38Å; V795-Y854 VanDerWaalsContact O-CE2 3.31Å; V795-Y854 WeakPolarHBondContact O-CE2 3.49Å; Y852-Y854 HydrophobicContact CD2-CD1 4.25Å; Y852-Y854 HydrophobicContact CE2-CD1 4.28Å; Y852-Y854 HydrophobicContact CE2-CE1 4.26Å; Y854-V858 CarbonylContact C-O 3.52Å; Y854-V858 VanDerWaalsContact CA-O 3.3Å; Y854-V858 WeakPolarHBondContact CA-O 3.49Å
855	S	82.8	Confident	87.4	Confident	19 Å²	19	27.6 Å²	27.6	13%	0.133	14%	0.14	C	C	.	.			trans	-139.5	-171	173.9	60.5	0	0	0	0	108	C796 E857 V858 Y968	C796-S855 PolarHBondContact SG-O 3.24Å; S855-E857 VanDerWaalsContact C-N 3.3Å; S855-E857 PolarHBondContact O-N 2.87Å; S855-V858 PolarHBondContact N-O 2.86Å; S855-V858 WeakPolarHBondContact OG-CB 3.38Å; S855-V858 PolarHBondContact OG-N 2.89Å; S855-V858 PolarHBondContact OG-O 3.35Å; S855-V858 VanDerWaalsContact OG-O 3.09Å; S855-Y968 WeakPolarHBondContact OG-CE1 3.45Å
856	D	74.4	Confident	87.5	Confident	68 Å²	68	27.6 Å²	27.6	36%	0.364	14%	0.14	S	C	.	.	S	Bend	trans	-58.2	-41.2	175.3	-55.3	-4.7	0	0	0	112.4	C796 S797 S873	C796-D856 PolarHBondContact SG-O 2.84Å; C796-D856 VanDerWaalsContact SG-O 3.36Å; S797-D856 CarbonylContact C-O 3.53Å; S797-D856 VanDerWaalsContact OG-CA 3.3Å; S797-D856 WeakPolarHBondContact OG-CA 3.4Å; S797-D856 WeakPolarHBondContact OG-CB 3.12Å; D856-S873 PolarHBondContact O-OG 2.81Å
857	E	77.7	Confident	88	Confident	11 Å²	11	25.9 Å²	25.9	5%	0.051	12%	0.121	C	C	.	.	S	Bend	trans	-110.9	-23	-170.1	-71.9	167.2	-149.8	0	0	114	L799 S855 Y872 S873 R966 Y968	L799-E857 HydrophobicContact CD1-CG 3.85Å; L799-E857 HydrophobicContact CG-CG 4.26Å; S855-E857 VanDerWaalsContact C-N 3.3Å; S855-E857 PolarHBondContact O-N 2.87Å; E857-Y872 CarbonylContact O-C 3.57Å; E857-Y872 WeakPolarHBondContact O-CA 3.43Å; E857-S873 PolarHBondContact O-N 3.39Å; E857-R966 WeakPolarHBondContact OE1-CD 3.49Å; E857-R966 IonicContact OE1-CZ 3.46Å; E857-R966 VanDerWaalsContact OE1-CZ 3.26Å; E857-R966 IonicContact OE1-NE 2.86Å; E857-R966 PolarHBondContact OE1-NE 3.11Å; E857-R966 IonicContact OE1-NH1 2.7Å; E857-R966 PolarHBondContact OE1-NH1 2.77Å; E857-Y968 PolarHBondContact OE2-OH 3.31Å
858	V	86.9	Confident	88.3	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.6	-168.7	-177.3	0	0	0	0	111.5	Y854 S855 L870 I878 L892 Y968 F984 L986	Y854-V858 CarbonylContact C-O 3.52Å; Y854-V858 VanDerWaalsContact CA-O 3.3Å; Y854-V858 WeakPolarHBondContact CA-O 3.49Å; S855-V858 PolarHBondContact N-O 2.86Å; S855-V858 WeakPolarHBondContact OG-CB 3.38Å; S855-V858 PolarHBondContact OG-N 2.89Å; S855-V858 PolarHBondContact OG-O 3.35Å; S855-V858 VanDerWaalsContact OG-O 3.09Å; V858-L870 HydrophobicContact CG1-CD2 4.38Å; V858-I878 HydrophobicContact CB-CD1 4.23Å; V858-I878 HydrophobicContact CG1-CD1 3.54Å; V858-I878 HydrophobicContact CG2-CD1 3.84Å; V858-L892 HydrophobicContact CB-CD2 4.09Å; V858-L892 HydrophobicContact CG1-CD2 4.16Å; V858-Y968 HydrophobicContact CB-CE1 4.45Å; V858-Y968 HydrophobicContact CG2-CD1 4.29Å; V858-Y968 HydrophobicContact CG2-CE1 4.01Å; V858-Y968 HydrophobicContact CG2-CE2 4.32Å; V858-F984 HydrophobicContact CG1-CE2 4.29Å; V858-F984 HydrophobicContact CG1-CZ 4.05Å; V858-F984 HydrophobicContact CG2-CE2 4.23Å; V858-L986 HydrophobicContact CG2-CD1 3.34Å
859	I	91	Very high	88.4	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.3	174.1	-54.6	163.7	0	0	0	107.7	F794 V806 W841 V861 I871	F794-I859 HydrophobicContact CE2-CG1 4.45Å; F794-I859 HydrophobicContact CE2-CG2 4.44Å; F794-I859 HydrophobicContact CZ-CG2 3.93Å; V806-I859 HydrophobicContact CG1-CD1 4.33Å; V806-I859 HydrophobicContact CG2-CD1 3.86Å; W841-I859 HydrophobicContact CH2-CD1 4Å; W841-I859 HydrophobicContact CZ2-CD1 3.91Å; I859-V861 HydrophobicContact CG2-CG2 3.91Å; I859-I871 PolarHBondContact N-O 3.07Å; I859-I871 PolarHBondContact O-N 3.13Å
860	A	92.6	Very high	88.4	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	129.2	173.3	0	0	0	0	0	109.2	Y852 A853 Q869 L870 L890 L970	Y852-A860 CarbonylContact C-O 3.59Å; Y852-A860 VanDerWaalsContact CA-O 3.23Å; Y852-A860 WeakPolarHBondContact CA-O 3.48Å; A853-A860 HydrophobicContact CB-CB 4.45Å; A853-A860 PolarHBondContact N-O 3.06Å; A853-A860 PolarHBondContact O-N 3.27Å; A853-A860 VanDerWaalsContact O-O 3.11Å; A860-Q869 WeakPolarHBondContact CA-O 3.34Å; A860-L870 HydrophobicContact CB-CD2 3.51Å; A860-L890 HydrophobicContact CB-CD1 4.31Å; A860-L970 HydrophobicContact CB-CD1 3.62Å
861	V	92.9	Very high	88.5	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.012	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	127.5	177.9	-170.7	0	0	0	0	110	L808 I831 L849 I859 I868 Q869 I871	L808-V861 HydrophobicContact CD2-CG1 4.4Å; L808-V861 HydrophobicContact CD2-CG2 4.06Å; I831-V861 HydrophobicContact CD1-CB 4.14Å; I831-V861 HydrophobicContact CD1-CG1 4.26Å; I831-V861 HydrophobicContact CD1-CG2 3.83Å; L849-V861 HydrophobicContact CB-CG1 4.36Å; L849-V861 HydrophobicContact CD1-CG1 4.11Å; L849-V861 HydrophobicContact CD2-CG1 3.83Å; L849-V861 HydrophobicContact CG-CG1 4.31Å; I859-V861 HydrophobicContact CG2-CG2 3.91Å; V861-I868 CarbonylContact O-C 3.52Å; V861-I868 WeakPolarHBondContact O-CA 3.47Å; V861-Q869 PolarHBondContact N-O 3.22Å; V861-Q869 PolarHBondContact O-N 2.73Å; V861-I871 HydrophobicContact CG2-CD1 4.46Å
862	G	91.6	Very high	88.3	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	147	178	0	0	0	0	0	112	T850 S851 R867	T850-G862 PolarHBondContact N-O 2.99Å; T850-G862 PolarHBondContact OG1-O 3.29Å; S851-G862 PolarHBondContact N-O 2.87Å; S851-G862 PolarHBondContact O-N 2.99Å; S851-G862 WeakPolarHBondContact OG-CA 3.3Å; G862-R867 CarbonylContact C-O 3.58Å; G862-R867 VanDerWaalsContact CA-O 3.32Å; G862-R867 WeakPolarHBondContact CA-O 3.46Å
863	D	89.8	Confident	87.8	Confident	3 Å²	3	24.3 Å²	24.3	2%	0.016	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	170.8	176.6	80.3	18.8	0	0	0	114.6	D847 R848 L849 K865 G866 R867	D847-D863 HydrophobicContact CB-CB 4.43Å; R848-D863 WeakPolarHBondContact O-CA 3.3Å; R848-D863 WeakPolarHBondContact O-CB 3.16Å; L849-D863 HydrophobicContact CD2-CB 4.5Å; D863-K865 PolarHBondContact O-N 2.88Å; D863-K865 WeakPolarHBondContact OD1-CA 3.35Å; D863-K865 WeakPolarHBondContact OD1-CB 3.44Å; D863-K865 PolarHBondContact OD1-N 3.25Å; D863-G866 PolarHBondContact O-N 3.39Å; D863-G866 PolarHBondContact OD1-N 2.99Å; D863-R867 PolarHBondContact N-O 3.28Å; D863-R867 WeakPolarHBondContact OD1-CB 3.46Å; D863-R867 PolarHBondContact OD1-N 2.93Å; D863-R867 IonicContact OD1-NE 2.62Å; D863-R867 IonicContact OD2-CZ 3.61Å; D863-R867 IonicContact OD2-NE 3.8Å; D863-R867 PolarHBondContact OD2-NE 3.1Å; D863-R867 IonicContact OD2-NH2 3.65Å; D863-R867 PolarHBondContact OD2-NH2 3.19Å
864	N	86.4	Confident	87.3	Confident	75 Å²	75	26.3 Å²	26.3	40%	0.401	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-19.5	-174.8	-171.7	53.9	0	0	0	113.6	R848 T850 G866	R848-N864 HydrophobicContact CB-CB 4.43Å; R848-N864 PolarHBondContact O-N 3.23Å; T850-N864 HydrophobicContact CG2-CB 3.86Å; N864-G866 PolarHBondContact O-N 3.15Å
865	K	85.8	Confident	87	Confident	127 Å²	127	24 Å²	24	55%	0.552	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	10	170.2	-81	-175.8	172.1	96.5	0	112.8	D847 D863 R867	D847-K865 HydrophobicContact CB-CG 4.5Å; D847-K865 WeakPolarHBondContact OD2-CD 3.38Å; D847-K865 WeakPolarHBondContact OD2-CE 3.32Å; D847-K865 WeakPolarHBondContact OD2-CG 3.38Å; D847-K865 IonicContact OD2-NZ 3.75Å; D847-K865 PolarHBondContact OD2-NZ 3.31Å; D863-K865 PolarHBondContact O-N 2.88Å; D863-K865 WeakPolarHBondContact OD1-CA 3.35Å; D863-K865 WeakPolarHBondContact OD1-CB 3.44Å; D863-K865 PolarHBondContact OD1-N 3.25Å; K865-R867 VanDerWaalsContact C-N 3.3Å; K865-R867 PolarHBondContact O-N 3.27Å
866	G	86.6	Confident	86.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	77.6	11.8	177.2	0	0	0	0	0	114.2	D863 N864 L884	D863-G866 PolarHBondContact O-N 3.39Å; D863-G866 PolarHBondContact OD1-N 2.99Å; N864-G866 PolarHBondContact O-N 3.15Å; G866-L884 WeakPolarHBondContact CA-O 3.22Å; G866-L884 WeakPolarHBondContact O-CB 3.13Å; G866-L884 PolarHBondContact O-N 2.85Å
867	R	90.7	Very high	87.3	Confident	47 Å²	47	25.8 Å²	25.8	18%	0.177	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.7	178.9	-60.6	174.9	-61.8	-173.5	6.6	109.9	S846 G862 D863 K865 N881 L882 L883	S846-R867 PolarHBondContact OG-NH1 3.06Å; S846-R867 PolarHBondContact OG-NH2 3.23Å; G862-R867 CarbonylContact C-O 3.58Å; G862-R867 VanDerWaalsContact CA-O 3.32Å; G862-R867 WeakPolarHBondContact CA-O 3.46Å; D863-R867 PolarHBondContact N-O 3.28Å; D863-R867 WeakPolarHBondContact OD1-CB 3.46Å; D863-R867 PolarHBondContact OD1-N 2.93Å; D863-R867 IonicContact OD1-NE 2.62Å; D863-R867 IonicContact OD2-CZ 3.61Å; D863-R867 IonicContact OD2-NE 3.8Å; D863-R867 PolarHBondContact OD2-NE 3.1Å; D863-R867 IonicContact OD2-NH2 3.65Å; D863-R867 PolarHBondContact OD2-NH2 3.19Å; K865-R867 VanDerWaalsContact C-N 3.3Å; K865-R867 PolarHBondContact O-N 3.27Å; R867-N881 HydrophobicContact CB-CB 4.43Å; R867-L882 CarbonylContact C-O 3.52Å; R867-L882 VanDerWaalsContact CA-O 3.27Å; R867-L882 WeakPolarHBondContact CA-O 3.33Å; R867-L883 HydrophobicContact CG-CD2 3.69Å
868	I	92.7	Very high	87.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124.3	166.6	-54.7	168.4	0	0	0	108.8	V861 N881 L882 L884 V887 L890 L970 A972 W982	V861-I868 CarbonylContact O-C 3.52Å; V861-I868 WeakPolarHBondContact O-CA 3.47Å; I868-N881 CarbonylContact O-C 3.59Å; I868-N881 VanDerWaalsContact O-CA 3.29Å; I868-N881 WeakPolarHBondContact O-CA 3.37Å; I868-L882 HydrophobicContact CB-CB 4.19Å; I868-L882 PolarHBondContact N-O 2.97Å; I868-L882 PolarHBondContact O-N 2.87Å; I868-L884 HydrophobicContact CD1-CD1 3.54Å; I868-L884 HydrophobicContact CG1-CD1 4.27Å; I868-V887 HydrophobicContact CD1-CG2 4.43Å; I868-V887 HydrophobicContact CG1-CG1 4.46Å; I868-V887 HydrophobicContact CG1-CG2 3.81Å; I868-L890 HydrophobicContact CD1-CD2 3.78Å; I868-L890 HydrophobicContact CG1-CD2 4.26Å; I868-L890 HydrophobicContact CG2-CD1 4.31Å; I868-L970 HydrophobicContact CG2-CD2 4.42Å; I868-A972 HydrophobicContact CD1-CB 3.68Å; I868-W982 HydrophobicContact CD1-CH2 4.24Å; I868-W982 HydrophobicContact CD1-CZ3 4.45Å
869	Q	91.2	Very high	87.5	Confident	19 Å²	19	26 Å²	26	9%	0.089	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.2	170.1	-47.7	-163.8	-8	0	0	108.9	A860 V861 I871 N881	A860-Q869 WeakPolarHBondContact CA-O 3.34Å; V861-Q869 PolarHBondContact N-O 3.22Å; V861-Q869 PolarHBondContact O-N 2.73Å; Q869-I871 HydrophobicContact CB-CD1 4.22Å; Q869-I871 HydrophobicContact CB-CG1 4.22Å; Q869-N881 WeakPolarHBondContact CG-OD1 3.08Å
870	L	91	Very high	87.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.2	170	-73.3	-178.9	0	0	0	109.4	V858 A860 H877 I878 L970 F984 P1004	V858-L870 HydrophobicContact CG1-CD2 4.38Å; A860-L870 HydrophobicContact CB-CD2 3.51Å; L870-H877 WeakPolarHBondContact O-CA 3.42Å; L870-I878 HydrophobicContact CB-CB 4.11Å; L870-I878 HydrophobicContact CB-CD1 4.28Å; L870-I878 PolarHBondContact O-N 3.36Å; L870-L970 HydrophobicContact CD1-CD2 4.49Å; L870-L970 HydrophobicContact CD2-CD1 4.47Å; L870-L970 HydrophobicContact CD2-CD2 4.2Å; L870-F984 HydrophobicContact CD1-CE1 4.26Å; L870-F984 HydrophobicContact CD1-CZ 4.37Å; L870-P1004 HydrophobicContact CD1-CG 3.48Å; L870-P1004 VanDerWaalsContact CD1-CG 3.48Å
871	I	89.9	Confident	87	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.3	-165.8	-43.9	156.4	0	0	0	108.2	I831 W841 L843 I859 V861 Q869 G876	I831-I871 HydrophobicContact CD1-CD1 3.85Å; W841-I871 HydrophobicContact CH2-CG2 4.45Å; L843-I871 HydrophobicContact CD1-CD1 3.67Å; L843-I871 HydrophobicContact CD1-CG1 4.11Å; L843-I871 HydrophobicContact CD1-CG2 3.87Å; I859-I871 PolarHBondContact N-O 3.07Å; I859-I871 PolarHBondContact O-N 3.13Å; V861-I871 HydrophobicContact CG2-CD1 4.46Å; Q869-I871 HydrophobicContact CB-CD1 4.22Å; Q869-I871 HydrophobicContact CB-CG1 4.22Å; I871-G876 CarbonylContact C-O 3.56Å; I871-G876 WeakPolarHBondContact CA-O 3.35Å; I871-G876 WeakPolarHBondContact CG2-O 3.33Å
872	Y	86.5	Confident	86.7	Confident	63 Å²	63	33 Å²	33	25%	0.247	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	156.7	167.5	-67.3	-78.9	0	0	0	110.6	E857 T874 G875 G876 I878 L986	E857-Y872 CarbonylContact O-C 3.57Å; E857-Y872 WeakPolarHBondContact O-CA 3.43Å; Y872-T874 WeakPolarHBondContact CB-OG1 3.39Å; Y872-T874 PolarHBondContact O-N 3.14Å; Y872-T874 VanDerWaalsContact O-N 3.07Å; Y872-G875 PolarHBondContact O-N 2.83Å; Y872-G876 WeakPolarHBondContact CD2-O 3.44Å; Y872-G876 PolarHBondContact N-O 3.4Å; Y872-I878 HydrophobicContact CD1-CD1 4.3Å; Y872-I878 HydrophobicContact CD1-CG1 4.09Å; Y872-I878 HydrophobicContact CD2-CG1 3.64Å; Y872-I878 HydrophobicContact CE1-CD1 4.42Å; Y872-I878 HydrophobicContact CE1-CG1 4.04Å; Y872-I878 HydrophobicContact CE2-CB 4.3Å; Y872-I878 HydrophobicContact CE2-CG1 3.58Å; Y872-I878 HydrophobicContact CG-CD1 4.4Å; Y872-I878 HydrophobicContact CG-CG1 3.9Å; Y872-L986 HydrophobicContact CD1-CD1 4.35Å; Y872-L986 HydrophobicContact CE1-CD1 3.84Å; Y872-L986 HydrophobicContact CE1-CD2 4.05Å; Y872-L986 HydrophobicContact CE1-CG 4.5Å
873	S	82.7	Confident	86.6	Confident	5 Å²	5	39.3 Å²	39.3	4%	0.035	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.7	173.8	55.5	0	0	0	0	113.9	C796 N798 I804 W841 D856 E857	C796-S873 WeakPolarHBondContact SG-CB 3.5Å; N798-S873 WeakPolarHBondContact CA-OG 3.29Å; N798-S873 PolarHBondContact ND2-O 2.64Å; I804-S873 VanDerWaalsContact CD1-O 3.24Å; I804-S873 WeakPolarHBondContact CD1-O 3.33Å; W841-S873 PolarHBondContact NE1-O 3.37Å; W841-S873 VanDerWaalsContact NE1-O 3.07Å; D856-S873 PolarHBondContact O-OG 2.81Å; E857-S873 PolarHBondContact O-N 3.39Å
874	T	80.3	Confident	86.5	Confident	51 Å²	51	40.5 Å²	40.5	31%	0.313	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-5.3	169	55.7	0	0	0	0	114.7	I800 W841 Y872 F991	I800-T874 HydrophobicContact CD1-CG2 3.85Å; I800-T874 HydrophobicContact CG1-CG2 4.43Å; W841-T874 VanDerWaalsContact CD1-O 3.31Å; W841-T874 VanDerWaalsContact NE1-C 3.32Å; Y872-T874 WeakPolarHBondContact CB-OG1 3.39Å; Y872-T874 PolarHBondContact O-N 3.14Å; Y872-T874 VanDerWaalsContact O-N 3.07Å; T874-F991 HydrophobicContact CG2-CE1 4.22Å
875	G	82.6	Confident	86	Confident	12 Å²	12	40.6 Å²	40.6	12%	0.124	22%	0.216	C	C	.	.	S	Bend	trans	95.1	-7.5	175	0	0	0	0	0	116	Y872	Y872-G875 PolarHBondContact O-N 2.83Å
876	G	80.3	Confident	85.8	Confident	35 Å²	35	35.5 Å²	35.5	36%	0.361	20%	0.196	S	C	.	.			trans	-75.8	143.5	174.9	0	0	0	0	0	112.6	I871 Y872	I871-G876 CarbonylContact C-O 3.56Å; I871-G876 WeakPolarHBondContact CA-O 3.35Å; I871-G876 WeakPolarHBondContact CG2-O 3.33Å; Y872-G876 WeakPolarHBondContact CD2-O 3.44Å; Y872-G876 PolarHBondContact N-O 3.4Å
877	H	84.7	Confident	85.8	Confident	91 Å²	91	35.5 Å²	35.5	42%	0.421	20%	0.196	S	C	.	.	B	Isolated β-bridge	trans	-72.6	139.3	173.2	-72.9	-86.1	0	0	0	111.8	L870	L870-H877 WeakPolarHBondContact O-CA 3.42Å
878	I	85	Confident	85.6	Confident	8 Å²	8	33.5 Å²	33.5	4%	0.041	19%	0.189	C	C	.	.	S	Bend	trans	-82.3	-39.5	178.3	-62.7	170.3	0	0	0	110.9	V858 L870 Y872 F984 L986	V858-I878 HydrophobicContact CB-CD1 4.23Å; V858-I878 HydrophobicContact CG1-CD1 3.54Å; V858-I878 HydrophobicContact CG2-CD1 3.84Å; L870-I878 HydrophobicContact CB-CB 4.11Å; L870-I878 HydrophobicContact CB-CD1 4.28Å; L870-I878 PolarHBondContact O-N 3.36Å; Y872-I878 HydrophobicContact CD1-CD1 4.3Å; Y872-I878 HydrophobicContact CD1-CG1 4.09Å; Y872-I878 HydrophobicContact CD2-CG1 3.64Å; Y872-I878 HydrophobicContact CE1-CD1 4.42Å; Y872-I878 HydrophobicContact CE1-CG1 4.04Å; Y872-I878 HydrophobicContact CE2-CB 4.3Å; Y872-I878 HydrophobicContact CE2-CG1 3.58Å; Y872-I878 HydrophobicContact CG-CD1 4.4Å; Y872-I878 HydrophobicContact CG-CG1 3.9Å; I878-F984 HydrophobicContact CD1-CE2 4.49Å; I878-L986 HydrophobicContact CD1-CD1 4.49Å; I878-L986 HydrophobicContact CG2-CD2 3.95Å
879	C	83.2	Confident	85.5	Confident	6 Å²	6	34 Å²	34	4%	0.041	19%	0.192	C	C	.	.	S	Bend	trans	-150.1	166.6	179.2	68.5	0	0	0	0	110.5
880	P	84.6	Confident	85.6	Confident	66 Å²	66	33.2 Å²	33.2	43%	0.429	19%	0.188	S	C	.	.	S	Bend	trans	-55.9	154.2	164.6	-24.5	36.1	0	0	0	112.2	L882 F1003	P880-L882 PolarHBondContact O-N 3.42Å; P880-F1003 HydrophobicContact CB-CZ 4.09Å; P880-F1003 HydrophobicContact CG-CE2 3.98Å; P880-F1003 HydrophobicContact CG-CZ 3.69Å
881	N	87.7	Confident	85.6	Confident	64 Å²	64	33.5 Å²	33.5	34%	0.342	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-60.5	129.7	-175.5	-61.9	-24.8	0	0	0	111.9	R867 I868 Q869	R867-N881 HydrophobicContact CB-CB 4.43Å; I868-N881 CarbonylContact O-C 3.59Å; I868-N881 VanDerWaalsContact O-CA 3.29Å; I868-N881 WeakPolarHBondContact O-CA 3.37Å; Q869-N881 WeakPolarHBondContact CG-OD1 3.08Å
882	L	88.2	Confident	85.6	Confident	19 Å²	19	33.7 Å²	33.7	10%	0.099	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	140.2	171.6	-48.8	175.9	0	0	0	108.9	R867 I868 P880 L970 W982 P1004	R867-L882 CarbonylContact C-O 3.52Å; R867-L882 VanDerWaalsContact CA-O 3.27Å; R867-L882 WeakPolarHBondContact CA-O 3.33Å; I868-L882 HydrophobicContact CB-CB 4.19Å; I868-L882 PolarHBondContact N-O 2.97Å; I868-L882 PolarHBondContact O-N 2.87Å; P880-L882 PolarHBondContact O-N 3.42Å; L882-L970 HydrophobicContact CD1-CD2 4.29Å; L882-W982 HydrophobicContact CD1-CD2 4.2Å; L882-W982 HydrophobicContact CD1-CZ2 4.14Å; L882-P1004 HydrophobicContact CD1-CG 4.33Å; L882-P1004 HydrophobicContact CD2-CG 4.31Å
883	L	89.3	Confident	85.7	Confident	134 Å²	134	31.6 Å²	31.6	70%	0.702	19%	0.185	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.4	-175.3	-80.8	161.9	0	0	0	111.7	R867	R867-L883 HydrophobicContact CG-CD2 3.69Å
884	L	87.7	Confident	85.6	Confident	28 Å²	28	33.4 Å²	33.4	15%	0.147	20%	0.196	C	C	.	.			trans	-133.8	-180	-177.3	-60.1	177.4	0	0	0	111.2	G866 I868 V887 A972 I980 W982	G866-L884 WeakPolarHBondContact CA-O 3.22Å; G866-L884 WeakPolarHBondContact O-CB 3.13Å; G866-L884 PolarHBondContact O-N 2.85Å; I868-L884 HydrophobicContact CD1-CD1 3.54Å; I868-L884 HydrophobicContact CG1-CD1 4.27Å; L884-V887 HydrophobicContact CD1-CG2 4.33Å; L884-A972 HydrophobicContact CD1-CB 3.92Å; L884-I980 HydrophobicContact CD2-CD1 3.51Å; L884-W982 HydrophobicContact CD1-CH2 3.85Å; L884-W982 HydrophobicContact CD1-CZ2 4.49Å; L884-W982 HydrophobicContact CD2-CH2 4.21Å; L884-W982 HydrophobicContact CD2-CZ2 4.22Å
885	D	74.8	Confident	85	Confident	77 Å²	77	32.9 Å²	32.9	41%	0.412	19%	0.19	S	C	.	.	S	Bend	trans	-85.5	-25.9	-174	42.6	-27.6	0	0	0	115.1	C974 S976 R978	D885-C974 WeakPolarHBondContact OD1-CB 3.28Å; D885-C974 PolarHBondContact OD1-SG 3.26Å; D885-S976 WeakPolarHBondContact OD2-CB 3.44Å; D885-S976 PolarHBondContact OD2-OG 2.63Å; D885-R978 IonicContact OD1-NH1 2.75Å; D885-R978 PolarHBondContact OD1-NH1 3.39Å; D885-R978 WeakPolarHBondContact OD2-CD 3.26Å; D885-R978 IonicContact OD2-NH1 3.3Å
886	C	82.8	Confident	83.6	Confident	20 Å²	20	38 Å²	38	14%	0.135	22%	0.219	C	C	.	.			trans	173.6	120.9	157.7	178.9	0	0	0	0	107.7	H888 C974 R975	C886-H888 PolarHBondContact O-N 2.9Å; C886-C974 CarbonylContact O-C 3.56Å; C886-C974 WeakPolarHBondContact O-CA 3.4Å; C886-R975 HydrophobicContact CB-CB 4.11Å; C886-R975 PolarHBondContact O-N 3.17Å
887	V	85.7	Confident	81.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	123.3	-174.5	-157.7	0	0	0	0	110.4	T850 S851 I868 L884 L890 A972	T850-V887 WeakPolarHBondContact CB-O 3.03Å; T850-V887 PolarHBondContact OG1-O 3.25Å; S851-V887 WeakPolarHBondContact OG-CB 3.34Å; S851-V887 VanDerWaalsContact OG-CG1 3.24Å; S851-V887 WeakPolarHBondContact OG-CG1 3.33Å; I868-V887 HydrophobicContact CD1-CG2 4.43Å; I868-V887 HydrophobicContact CG1-CG1 4.46Å; I868-V887 HydrophobicContact CG1-CG2 3.81Å; L884-V887 HydrophobicContact CD1-CG2 4.33Å; V887-L890 HydrophobicContact CG1-CD2 3.88Å; V887-L890 HydrophobicContact CG1-CG 3.92Å; V887-A972 HydrophobicContact CG1-CB 4.27Å
888	H	86.6	Confident	79	Confident	5 Å²	5	45.1 Å²	45.1	2%	0.023	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-37.5	-178.7	-178.2	78.3	0	0	0	112.5	I780 T782 S783 Q785 C886 L973 F1024	I780-H888 WeakPolarHBondContact CG2-NE2 3.49Å; T782-H888 PolarHBondContact O-CE1 3.24Å; T782-H888 PolarHBondContact OG1-CE1 2.99Å; T782-H888 PolarHBondContact OG1-NE2 3Å; S783-H888 PolarHBondContact O-CE1 3.32Å; S783-H888 PolarHBondContact O-NE2 3.14Å; Q785-H888 PolarHBondContact N-O 3.14Å; C886-H888 PolarHBondContact O-N 2.9Å; H888-L973 WeakPolarHBondContact CA-O 3.43Å; H888-L973 WeakPolarHBondContact CB-O 3.35Å; H888-L973 PolarHBondContact N-O 2.79Å; H888-F1024 AromaticContact CD2-CD1 3.86Å; H888-F1024 AromaticContact CD2-CE1 3.77Å; H888-F1024 AromaticContact NE2-CD1 3.6Å; H888-F1024 AromaticContact NE2-CE1 3.83Å
889	T	90.8	Very high	76.1	Confident	11 Å²	11	49.8 Å²	49.8	7%	0.067	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	141.5	178.1	-56.7	0	0	0	0	110.4	Q785 L973 F1024 L1027	Q785-T889 HydrophobicContact CB-CG2 4.37Å; Q785-T889 HydrophobicContact CG-CG2 4.4Å; T889-L973 PolarHBondContact N-O 3.43Å; T889-L973 PolarHBondContact O-N 3.48Å; T889-F1024 HydrophobicContact CG2-CZ 4.41Å; T889-F1024 WeakPolarHBondContact OG1-CE1 3.48Å; T889-L1027 HydrophobicContact CG2-CB 4.04Å
890	L	92.8	Very high	73.2	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.016	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	144	172.3	-70.7	172.2	0	0	0	110.8	Q785 A853 A860 I868 V887 L970 A971 A972	Q785-L890 PolarHBondContact NE2-O 3.17Å; A853-L890 HydrophobicContact CB-CB 3.92Å; A860-L890 HydrophobicContact CB-CD1 4.31Å; I868-L890 HydrophobicContact CD1-CD2 3.78Å; I868-L890 HydrophobicContact CG1-CD2 4.26Å; I868-L890 HydrophobicContact CG2-CD1 4.31Å; V887-L890 HydrophobicContact CG1-CD2 3.88Å; V887-L890 HydrophobicContact CG1-CG 3.92Å; L890-L970 HydrophobicContact CD2-CD1 4.34Å; L890-A971 WeakPolarHBondContact CA-O 3.35Å; L890-A972 HydrophobicContact CD2-CB 3.55Å
891	A	91.9	Very high	70.3	Confident	5 Å²	5	61 Å²	61	4%	0.041	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	147.6	166.7	0	0	0	0	0	109.8	L970 A971 L1027 F1029	A891-L970 CarbonylContact O-C 3.58Å; A891-L970 WeakPolarHBondContact O-CA 3.48Å; A891-A971 PolarHBondContact N-O 3.2Å; A891-A971 PolarHBondContact O-N 3.37Å; A891-L1027 HydrophobicContact CB-CD2 4.19Å; A891-L1027 HydrophobicContact CB-CG 4.16Å; A891-F1029 HydrophobicContact CB-CD2 4.1Å; A891-F1029 HydrophobicContact CB-CE2 4.03Å
892	L	89.7	Confident	67.3	Low	5 Å²	5	62.9 Å²	62.9	3%	0.026	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	142	178.6	-171.9	76.2	0	0	0	109.3	A853 V858 R969 L970 F984	A853-L892 HydrophobicContact CB-CB 3.61Å; V858-L892 HydrophobicContact CB-CD2 4.09Å; V858-L892 HydrophobicContact CG1-CD2 4.16Å; L892-R969 CarbonylContact C-O 3.55Å; L892-R969 WeakPolarHBondContact CA-O 3.17Å; L892-R969 WeakPolarHBondContact CD1-O 3.03Å; L892-L970 HydrophobicContact CB-CD1 4.49Å; L892-L970 HydrophobicContact CD1-CB 4.02Å; L892-L970 HydrophobicContact CD1-CD1 3.85Å; L892-F984 HydrophobicContact CD1-CE1 4.21Å; L892-F984 HydrophobicContact CD1-CZ 4.1Å
893	T	87.9	Confident	64.2	Low	19 Å²	19	67 Å²	67	12%	0.117	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	163	171.2	-166.3	0	0	0	0	111.3	Y968 R969 F1029	T893-Y968 WeakPolarHBondContact O-CA 3.33Å; T893-R969 HydrophobicContact CG2-CB 3.74Å; T893-R969 PolarHBondContact N-O 3.12Å; T893-R969 PolarHBondContact O-N 3.38Å; T893-F1029 HydrophobicContact CG2-CB 3.76Å; T893-F1029 HydrophobicContact CG2-CD1 4.07Å; T893-F1029 HydrophobicContact CG2-CD2 3.43Å; T893-F1029 VanDerWaalsContact CG2-CD2 3.43Å; T893-F1029 HydrophobicContact CG2-CE2 3.95Å; T893-F1029 HydrophobicContact CG2-CG 3.48Å; T893-F1029 VanDerWaalsContact CG2-CG 3.48Å; T893-F1029 HydrophobicContact CG2-CZ 4.46Å
894	T	80.5	Confident	61.2	Low	43 Å²	43	67.9 Å²	67.9	26%	0.264	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.2	168.6	46.1	0	0	0	0	110.6	T896 K967 Y968	T894-T896 PolarHBondContact O-N 3.2Å; T894-K967 CarbonylContact C-O 3.55Å; T894-K967 VanDerWaalsContact CA-O 3.31Å; T894-K967 WeakPolarHBondContact CA-O 3.14Å; T894-Y968 HydrophobicContact CG2-CD1 3.81Å; T894-Y968 HydrophobicContact CG2-CE1 3.36Å
895	E	68.2	Low	58.1	Low	39 Å²	39	72 Å²	72	18%	0.182	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	109.8	165.5	-64.8	-177.8	172.6	0	0	109.3	T897 K967 R969 N983	E895-T897 PolarHBondContact O-N 3.28Å; E895-K967 HydrophobicContact CB-CB 3.86Å; E895-K967 HydrophobicContact CG-CB 4.29Å; E895-K967 PolarHBondContact N-O 3.03Å; E895-K967 WeakPolarHBondContact OE2-CD 3.48Å; E895-K967 IonicContact OE2-NZ 3.05Å; E895-R969 HydrophobicContact CG-CG 4.42Å; E895-R969 IonicContact OE1-CZ 2.69Å; E895-R969 IonicContact OE1-NE 3.5Å; E895-R969 PolarHBondContact OE1-NE 3.18Å; E895-R969 IonicContact OE1-NH2 3.44Å; E895-R969 PolarHBondContact OE1-NH2 3.49Å; E895-N983 PolarHBondContact OE1-ND2 2.93Å
896	T	54.2	Low	55.7	Low	120 Å²	120	74.1 Å²	74.1	74%	0.736	44%	0.436	S	S	*	.			trans	-78.8	104.4	166.2	48.1	0	0	0	0	109.5	T894 E898	T894-T896 PolarHBondContact O-N 3.2Å; T896-E898 PolarHBondContact O-N 2.72Å
897	T	36.6	Very low	52.9	Low	88 Å²	88	77.5 Å²	77.5	54%	0.54	46%	0.46	S	S	.	.			trans	-74.6	106.9	174.4	50.3	0	0	0	0	110.7	E895 S899	E895-T897 PolarHBondContact O-N 3.28Å; T897-S899 PolarHBondContact O-N 2.85Å
898	E	30.2	Very low	50	Low	188 Å²	188	83.6 Å²	83.6	88%	0.879	49%	0.492	S	S	*	.			trans	-73	69.3	168.9	-67.6	-167	153	0	0	111	T896 S900	T896-E898 PolarHBondContact O-N 2.72Å; E898-S900 PolarHBondContact O-N 2.92Å
899	S	24.4	Very low	47	Very low	105 Å²	105	93.7 Å²	93.7	73%	0.734	53%	0.53	S	S	*	.			trans	-90.5	71.9	-176.4	60.7	0	0	0	0	112.3	T897	T897-S899 PolarHBondContact O-N 2.85Å
900	S	23.5	Very low	43.8	Very low	105 Å²	105	103.4 Å²	103.4	73%	0.734	57%	0.572	S	S	*	*			trans	-155.2	55.6	172.7	63	0	0	0	0	115	E898	E898-S900 PolarHBondContact O-N 2.92Å
901	Q	23	Very low	40.3	Very low	202 Å²	202	112.8 Å²	112.8	94%	0.944	61%	0.613	S	S	*	*			trans	-130.8	84.4	158.4	-73.7	-159.5	4.2	0	0	111.3
902	S	25.5	Very low	37.1	Very low	104 Å²	104	118 Å²	118	73%	0.727	65%	0.649	S	S	*	*			trans	-147.6	100.6	166.3	59.8	0	0	0	0	110.3
903	S	23	Very low	33.8	Very low	105 Å²	105	123.8 Å²	123.8	73%	0.734	69%	0.685	S	S	*	*			trans	22.2	143.3	146	61.5	0	0	0	0	121.7
904	L	25	Very low	30.7	Very low	153 Å²	153	129.1 Å²	129.1	80%	0.801	72%	0.721	S	S	*	*			trans	95.5	100.2	160.8	-58.9	153.8	0	0	0	117.1
905	T	22.8	Very low	27.8	Very low	116 Å²	116	133.7 Å²	133.7	71%	0.712	75%	0.749	S	S	*	*				26.6	129.2	125.7	57.8	0	0	0	0	117.7
906	T	24.2	Very low	25.6	Very low	120 Å²	120	139.9 Å²	139.9	74%	0.736	78%	0.778	S	S	*	*			cis	-167.4	151.1	47.1	-38	0	0	0	0	112.7
907	S	23.7	Very low	23.9	Very low	91 Å²	91	140.2 Å²	140.2	64%	0.636	79%	0.786	S	S	*	*			trans	60.1	135.1	149.1	57.9	0	0	0	0	123.2
908	N	24.8	Very low	23.2	Very low	128 Å²	128	141.3 Å²	141.3	68%	0.684	79%	0.792	S	S	*	*			trans	72.1	102.2	147.5	-64.2	-25.6	0	0	0	118.5
909	R	23.8	Very low	22.8	Very low	217 Å²	217	138 Å²	138	82%	0.819	79%	0.785	S	S	*	*				77.4	98.6	78.4	-77.4	179.9	-169.8	-170.4	4.8	112.8
910	F	23.6	Very low	22.7	Very low	216 Å²	216	140.7 Å²	140.7	95%	0.947	79%	0.791	S	S	*	*				-155.5	129.4	121.8	-100.7	-70.2	0	0	0	109.2
911	F	20.4	Very low	22.7	Very low	200 Å²	200	141.8 Å²	141.8	88%	0.877	79%	0.789	S	S	*	*			trans	-91.6	143.4	171.5	-86.2	-105.5	0	0	0	109.3
912	S	24.2	Very low	22.8	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	77%	0.774	S	S	*	*				-173.2	134.7	119.7	32.4	0	0	0	0	113.4
913	T	21.3	Very low	22.8	Very low	128 Å²	128	137.6 Å²	137.6	79%	0.785	77%	0.772	S	S	*	*			trans	-8.3	119.8	155.6	50.6	0	0	0	0	119.3
914	C	20.9	Very low	23.1	Very low	130 Å²	130	136.4 Å²	136.4	88%	0.878	76%	0.757	S	S	*	*			trans	-138.4	122.7	134.2	-88.5	0	0	0	0	108.4
915	T	20.2	Very low	23.4	Very low	140 Å²	140	130.8 Å²	130.8	86%	0.859	73%	0.73	S	S	*	*			trans	-103.9	92.3	179.1	48.1	0	0	0	0	109.8
916	E	21.4	Very low	23.6	Very low	169 Å²	169	135.7 Å²	135.7	79%	0.79	74%	0.736	S	S	*	*			trans	-122.2	128	171.6	-70.1	-163.6	149.1	0	0	111.4	T918	E916-T918 PolarHBondContact O-N 2.84Å
917	S	19.2	Very low	24	Very low	127 Å²	127	133.6 Å²	133.6	89%	0.888	72%	0.72	S	S	*	*			trans	-82.5	93.9	179.2	53.7	0	0	0	0	110.8
918	T	22.2	Very low	24.4	Very low	111 Å²	111	132.6 Å²	132.6	68%	0.681	71%	0.705	S	S	*	*			trans	-119.4	126.4	169.3	43.9	0	0	0	0	111.5	E916 N920	E916-T918 PolarHBondContact O-N 2.84Å; T918-N920 PolarHBondContact O-N 2.94Å
919	T	20.9	Very low	24.3	Very low	118 Å²	118	131 Å²	131	72%	0.724	71%	0.71	S	S	*	*			trans	-79	96.7	179.5	50.9	0	0	0	0	110.2	N921	T919-N921 PolarHBondContact O-N 3.14Å
920	N	23.7	Very low	24.5	Very low	161 Å²	161	124.9 Å²	124.9	86%	0.861	70%	0.696	S	S	*	*			trans	-69	84.7	167.3	-82.1	-22.1	0	0	0	109.8	T918 S922	T918-N920 PolarHBondContact O-N 2.94Å; N920-S922 PolarHBondContact O-N 3.1Å
921	N	23.5	Very low	24.5	Very low	128 Å²	128	120.7 Å²	120.7	68%	0.684	69%	0.688	S	S	*	*			trans	-58	121.8	169.9	-71.8	-57.6	0	0	0	108.9	T919 N923	T919-N921 PolarHBondContact O-N 3.14Å; N921-N923 PolarHBondContact O-N 2.99Å
922	S	25.2	Very low	24.7	Very low	91 Å²	91	116.2 Å²	116.2	64%	0.636	68%	0.682	S	S	*	*			trans	-56	129.9	165.4	52.8	0	0	0	0	109.2	N920 L924	N920-S922 PolarHBondContact O-N 3.1Å; S922-L924 PolarHBondContact O-N 3.02Å
923	N	25.8	Very low	24.7	Very low	128 Å²	128	114 Å²	114	68%	0.684	68%	0.676	S	S	*	*			trans	-72.3	58.4	-179.3	-77.2	-16.3	0	0	0	112.7	N921 S925	N921-N923 PolarHBondContact O-N 2.99Å; N923-S925 PolarHBondContact O-N 2.81Å
924	L	27.9	Very low	24.8	Very low	79 Å²	79	115 Å²	115	41%	0.414	68%	0.677	S	S	.	*			trans	-60.5	130.5	159.4	-73.1	165.7	0	0	0	107.9	S922 R926 A1083	S922-L924 PolarHBondContact O-N 3.02Å; L924-R926 PolarHBondContact O-N 2.74Å; L924-A1083 HydrophobicContact CD1-CB 4.16Å
925	S	31.8	Very low	24.9	Very low	36 Å²	36	117.2 Å²	117.2	25%	0.252	67%	0.674	S	S	.	*			trans	-54	129.6	-173.9	47.1	0	0	0	0	111.8	N923 L927	N923-S925 PolarHBondContact O-N 2.81Å; S925-L927 VanDerWaalsContact C-N 3.25Å; S925-L927 PolarHBondContact O-N 3.36Å
926	R	27.3	Very low	25	Very low	218 Å²	218	119.3 Å²	119.3	82%	0.823	68%	0.675	S	S	*	*			trans	-67.8	80	179.8	-93.2	-177.4	162.1	-177.7	-4.2	111.3	L924 H928	L924-R926 PolarHBondContact O-N 2.74Å; R926-H928 PolarHBondContact O-N 3.34Å; R926-H928 VanDerWaalsContact O-N 3.13Å
927	L	32.3	Very low	25.2	Very low	77 Å²	77	120.8 Å²	120.8	40%	0.403	68%	0.682	S	S	.	*			trans	-77.8	101.2	-176.5	-125.7	149.7	0	0	0	111.2	S925 T1028	S925-L927 VanDerWaalsContact C-N 3.25Å; S925-L927 PolarHBondContact O-N 3.36Å; L927-T1028 VanDerWaalsContact CD1-OG1 3.24Å; L927-T1028 WeakPolarHBondContact CD1-OG1 3.47Å
928	H	31.6	Very low	25.3	Very low	69 Å²	69	123.3 Å²	123.3	32%	0.319	68%	0.679	S	S	.	*			trans	54.4	81.3	153.5	-71.1	-116	0	0	0	117.5	Q785 Y852 R926 V930	Q785-H928 PolarHBondContact NE2-CE1 2.8Å; Q785-H928 PolarHBondContact NE2-NE2 2.98Å; Y852-H928 AromaticContact CE1-CE1 3.41Å; Y852-H928 VanDerWaalsContact CE1-CE1 3.41Å; Y852-H928 WeakPolarHBondContact CE1-CE1 3.18Å; Y852-H928 AromaticContact CE1-NE2 3.89Å; Y852-H928 AromaticContact CZ-CE1 3.55Å; Y852-H928 AromaticContact CZ-NE2 3.82Å; Y852-H928 PolarHBondContact OH-CE1 2.84Å; R926-H928 PolarHBondContact O-N 3.34Å; R926-H928 VanDerWaalsContact O-N 3.13Å; H928-V930 HydrophobicContact CB-CG2 4.33Å
929	A	23.4	Very low	25.4	Very low	96 Å²	96	127.3 Å²	127.3	79%	0.793	69%	0.69	S	S	*	*			trans	-89.7	89.1	143.1	0	0	0	0	0	108.5	V931	A929-V931 PolarHBondContact O-N 2.84Å; A929-V931 VanDerWaalsContact O-N 3.11Å
930	V	27.8	Very low	25.4	Very low	88 Å²	88	129.7 Å²	129.7	53%	0.533	69%	0.693	S	S	.	*			trans	-76.3	97.2	173.9	179.4	0	0	0	0	108.4	H928 S932	H928-V930 HydrophobicContact CB-CG2 4.33Å; V930-S932 VanDerWaalsContact C-N 3.28Å; V930-S932 PolarHBondContact O-N 3.38Å
931	V	23.5	Very low	25.4	Very low	128 Å²	128	129 Å²	129	78%	0.776	70%	0.695	S	S	*	*			trans	-77.2	83.6	171.9	-175.4	0	0	0	0	108.6	A929 G933	A929-V931 PolarHBondContact O-N 2.84Å; A929-V931 VanDerWaalsContact O-N 3.11Å; V931-G933 PolarHBondContact O-N 2.79Å
932	S	25.4	Very low	25.3	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	69%	0.691	S	S	*	*			trans	-73	71.2	168.6	56.7	0	0	0	0	109.8	V930 N934	V930-S932 VanDerWaalsContact C-N 3.28Å; V930-S932 PolarHBondContact O-N 3.38Å; S932-N934 VanDerWaalsContact C-N 3.32Å; S932-N934 PolarHBondContact O-N 2.96Å
933	G	24.1	Very low	25.4	Very low	66 Å²	66	131.8 Å²	131.8	68%	0.68	71%	0.706	S	S	*	*			trans	-75.8	75.6	-175.3	0	0	0	0	0	113.2	V931	V931-G933 PolarHBondContact O-N 2.79Å
934	N	23	Very low	25.4	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	71%	0.709	S	S	*	*			trans	-73.3	139.4	152.7	-84	12.5	0	0	0	109	S932	S932-N934 VanDerWaalsContact C-N 3.32Å; S932-N934 PolarHBondContact O-N 2.96Å
935	E	23.7	Very low	25.2	Very low	177 Å²	177	137.4 Å²	137.4	83%	0.827	73%	0.731	S	S	*	*	S	Bend	trans	61.4	98	160.4	-61.7	-178.1	168.5	0	0	118.6
936	Q	22.1	Very low	25	Very low	185 Å²	185	139 Å²	139	86%	0.864	75%	0.753	S	S	*	*			trans	21.4	102.5	137.3	-56.1	-178.4	13.9	0	0	118.9
937	Q	23.9	Very low	25	Very low	200 Å²	200	136.2 Å²	136.2	94%	0.935	75%	0.754	S	S	*	*				-157.4	141.7	128.1	-115.8	154.8	80	0	0	112.3
938	Q	21.8	Very low	24.7	Very low	179 Å²	179	140.3 Å²	140.3	84%	0.836	78%	0.777	S	S	*	*			trans	-94	135.4	178.2	-64.7	173.1	-11.7	0	0	110
939	Q	24.1	Very low	24.6	Very low	195 Å²	195	145.3 Å²	145.3	91%	0.911	81%	0.806	S	S	*	*			trans	-133.9	124.3	149.4	-73	-166.9	-3.6	0	0	109.2
940	Q	21.1	Very low	24.9	Very low	168 Å²	168	149.5 Å²	149.5	79%	0.785	81%	0.808	S	S	*	*			trans	-89.4	137	173.9	-66.8	173.7	-26.9	0	0	109.4
941	T	24.2	Very low	24.7	Very low	146 Å²	146	153.6 Å²	153.6	90%	0.896	82%	0.819	S	S	*	*			trans	-130.5	95.9	155.4	51.1	0	0	0	0	108.8
942	T	22.5	Very low	24.8	Very low	100 Å²	100	153.8 Å²	153.8	61%	0.613	82%	0.821	S	S	*	*			trans	-80.5	133.4	-177.6	-39.2	0	0	0	0	110.8	Q944	T942-Q944 HydrophobicContact CG2-CG 4.29Å
943	L	25.4	Very low	24.8	Very low	179 Å²	179	155.1 Å²	155.1	94%	0.937	82%	0.819	S	S	*	*			trans	-128.1	141.3	155.5	-78.1	176	0	0	0	108.8
944	Q	25.8	Very low	24.9	Very low	163 Å²	163	157.1 Å²	157.1	76%	0.762	82%	0.82	S	S	*	*			trans	-107.1	156.7	-158.8	-65.1	177.6	-18.5	0	0	113.6	T942	T942-Q944 HydrophobicContact CG2-CG 4.29Å
945	N	24.6	Very low	25	Very low	162 Å²	162	156.6 Å²	156.6	87%	0.866	82%	0.818	S	S	*	*			trans	18.9	130.2	143	-55.6	-11.4	0	0	0	119.3
946	G	27	Very low	25.2	Very low	70 Å²	70	155.7 Å²	155.7	72%	0.722	82%	0.818	S	S	*	*			trans	-163.6	37.1	177.4	0	0	0	0	0	118.7
947	N	28.3	Very low	25.5	Very low	159 Å²	159	151.6 Å²	151.6	85%	0.85	81%	0.81	S	S	*	*			trans	102.6	131.7	159.7	-56.6	-29.7	0	0	0	120
948	N	26.1	Very low	25.8	Very low	162 Å²	162	147.2 Å²	147.2	87%	0.866	79%	0.792	S	S	*	*			trans	-74.6	143	162.6	-57.5	-44.6	0	0	0	109.8
949	N	29.3	Very low	26	Very low	174 Å²	174	146.3 Å²	146.3	93%	0.93	79%	0.79	S	S	*	*			trans	-141.8	147.4	152.8	-104.6	-40	0	0	0	109.7
950	H	28.6	Very low	26.2	Very low	184 Å²	184	144.6 Å²	144.6	85%	0.852	79%	0.787	S	S	*	*			trans	-84.9	157.7	-156	-138.1	-91.1	0	0	0	114.3
951	F	23.8	Very low	26.6	Very low	174 Å²	174	145.4 Å²	145.4	76%	0.763	79%	0.788	S	S	*	*			trans	-55	131	175.6	-100.8	-113.7	0	0	0	114	L953	F951-L953 HydrophobicContact CD1-CD1 3.72Å; F951-L953 HydrophobicContact CE1-CD1 3.98Å
952	T	26.1	Very low	27.2	Very low	132 Å²	132	144.6 Å²	144.6	81%	0.81	77%	0.772	S	S	*	*			trans	-142.9	135.7	138	49	0	0	0	0	109.3
953	L	24.4	Very low	27.7	Very low	134 Å²	134	146.5 Å²	146.5	70%	0.702	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-84.4	131.5	177	-86.2	74.5	0	0	0	110.8	F951	F951-L953 HydrophobicContact CD1-CD1 3.72Å; F951-L953 HydrophobicContact CE1-CD1 3.98Å
954	P	26.9	Very low	28.9	Very low	109 Å²	109	142.3 Å²	142.3	71%	0.708	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-80.1	130.6	160.9	31.4	-30.7	0	0	0	110.7
955	N	25.8	Very low	30.6	Very low	137 Å²	137	138.7 Å²	138.7	73%	0.733	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-65.8	135	-170.8	-66.4	-55.2	0	0	0	114.9	S957	N955-S957 VanDerWaalsContact C-N 3.26Å; N955-S957 PolarHBondContact O-N 2.81Å
956	N	27.4	Very low	32.9	Very low	157 Å²	157	135.8 Å²	135.8	84%	0.84	72%	0.723	S	S	*	*	S	Bend	trans	48.3	-5.5	144.6	-67.1	-5.1	0	0	0	122.5
957	S	27.7	Very low	35.5	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	71%	0.706	S	S	*	*			trans	-82.4	-13	-175.6	63.6	0	0	0	0	114.9	N955	N955-S957 VanDerWaalsContact C-N 3.26Å; N955-S957 PolarHBondContact O-N 2.81Å
958	I	31.6	Very low	38.3	Very low	109 Å²	109	128.8 Å²	128.8	56%	0.559	67%	0.665	S	S	*	*	S	Bend	trans	-87	-26.9	-167.9	-69.2	174.1	0	0	0	113.6	N960 K961 F962	I958-N960 VanDerWaalsContact C-N 3.28Å; I958-N960 PolarHBondContact O-N 3.01Å; I958-K961 PolarHBondContact O-N 2.86Å; I958-F962 HydrophobicContact CG2-CE2 3.84Å
959	M	26.4	Very low	41.3	Very low	160 Å²	160	122.4 Å²	122.4	79%	0.788	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-59.3	-33.9	-174.9	-78.5	-171.4	171	0	0	113.9	K961 F962	M959-K961 PolarHBondContact O-N 3.39Å; M959-F962 PolarHBondContact O-N 2.85Å
960	N	27.7	Very low	44.3	Very low	158 Å²	158	114.1 Å²	114.1	85%	0.845	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-68.5	-5	-176.8	-77.3	-1.9	0	0	0	114.9	I958	I958-N960 VanDerWaalsContact C-N 3.28Å; I958-N960 PolarHBondContact O-N 3.01Å
961	K	30	Very low	47.4	Very low	186 Å²	186	105.4 Å²	105.4	81%	0.809	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-90	-8.8	173.7	-94.1	-173.7	173.3	-178.3	0	115.2	I958 M959	I958-K961 PolarHBondContact O-N 2.86Å; M959-K961 PolarHBondContact O-N 3.39Å
962	F	36.2	Very low	50.7	Low	128 Å²	128	97.1 Å²	97.1	56%	0.561	51%	0.508	S	S	*	.			trans	-96.8	4.9	-171.9	-74.3	-87.4	0	0	0	115.2	I958 M959 V964 N988	I958-F962 HydrophobicContact CG2-CE2 3.84Å; M959-F962 PolarHBondContact O-N 2.85Å; F962-V964 PolarHBondContact O-N 3.25Å; F962-N988 PolarHBondContact O-ND2 2.9Å
963	N	32.1	Very low	53.9	Low	141 Å²	141	90.9 Å²	90.9	75%	0.754	47%	0.469	S	S	*	.			trans	-86.5	51.4	-175.5	-151.5	12	0	0	0	112.8
964	V	50.3	Low	57.1	Low	91 Å²	91	84.5 Å²	84.5	55%	0.552	44%	0.436	S	S	*	.			trans	-115.7	107.4	-177.4	-176.4	0	0	0	0	109.4	F962 R966	F962-V964 PolarHBondContact O-N 3.25Å; V964-R966 PolarHBondContact O-N 2.77Å; V964-R966 VanDerWaalsContact O-N 3.15Å
965	N	62.9	Low	59.9	Low	87 Å²	87	84.5 Å²	84.5	47%	0.465	42%	0.422	S	S	.	.			trans	-66.9	112.1	176.3	-67.5	-15.7	0	0	0	109.8	L986 N987	N965-L986 WeakPolarHBondContact CA-O 3.48Å; N965-N987 PolarHBondContact ND2-OD1 2.8Å; N965-N987 PolarHBondContact OD1-OD1 3.34Å
966	R	71.8	Confident	62.8	Low	100 Å²	100	79 Å²	79	38%	0.377	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	125.3	-177.5	-75	179.1	165.7	-151.8	-10.1	110.1	E857 V964 Y968 C985 L986	E857-R966 WeakPolarHBondContact OE1-CD 3.49Å; E857-R966 IonicContact OE1-CZ 3.46Å; E857-R966 VanDerWaalsContact OE1-CZ 3.26Å; E857-R966 IonicContact OE1-NE 2.86Å; E857-R966 PolarHBondContact OE1-NE 3.11Å; E857-R966 IonicContact OE1-NH1 2.7Å; E857-R966 PolarHBondContact OE1-NH1 2.77Å; V964-R966 PolarHBondContact O-N 2.77Å; V964-R966 VanDerWaalsContact O-N 3.15Å; R966-Y968 HydrophobicContact CB-CD2 4.44Å; R966-Y968 HydrophobicContact CB-CE2 3.58Å; R966-Y968 WeakPolarHBondContact O-CD2 3.38Å; R966-C985 CarbonylContact O-C 3.53Å; R966-C985 WeakPolarHBondContact O-CA 3.41Å; R966-L986 PolarHBondContact N-O 2.83Å; R966-L986 VanDerWaalsContact N-O 3.08Å; R966-L986 PolarHBondContact O-N 3.01Å
967	K	82.1	Confident	65.6	Low	83 Å²	83	71.6 Å²	71.6	36%	0.361	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.9	175.4	-74.1	-171.2	-176.2	178.6	0	110.6	T894 E895 F984	T894-K967 CarbonylContact C-O 3.55Å; T894-K967 VanDerWaalsContact CA-O 3.31Å; T894-K967 WeakPolarHBondContact CA-O 3.14Å; E895-K967 HydrophobicContact CB-CB 3.86Å; E895-K967 HydrophobicContact CG-CB 4.29Å; E895-K967 PolarHBondContact N-O 3.03Å; E895-K967 WeakPolarHBondContact OE2-CD 3.48Å; E895-K967 IonicContact OE2-NZ 3.05Å; K967-F984 WeakPolarHBondContact CA-O 3.35Å
968	Y	87.6	Confident	68.6	Low	0 Å²	0	70.2 Å²	70.2	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.7	-179.8	-70.1	-91.1	0	0	0	110.8	S855 E857 V858 T893 T894 R966 N983 F984 L986	S855-Y968 WeakPolarHBondContact OG-CE1 3.45Å; E857-Y968 PolarHBondContact OE2-OH 3.31Å; V858-Y968 HydrophobicContact CB-CE1 4.45Å; V858-Y968 HydrophobicContact CG2-CD1 4.29Å; V858-Y968 HydrophobicContact CG2-CE1 4.01Å; V858-Y968 HydrophobicContact CG2-CE2 4.32Å; T893-Y968 WeakPolarHBondContact O-CA 3.33Å; T894-Y968 HydrophobicContact CG2-CD1 3.81Å; T894-Y968 HydrophobicContact CG2-CE1 3.36Å; R966-Y968 HydrophobicContact CB-CD2 4.44Å; R966-Y968 HydrophobicContact CB-CE2 3.58Å; R966-Y968 WeakPolarHBondContact O-CD2 3.38Å; Y968-N983 CarbonylContact O-C 3.56Å; Y968-N983 WeakPolarHBondContact O-CA 3.29Å; Y968-F984 HydrophobicContact CD2-CD2 4.32Å; Y968-F984 AromaticContact CD2-CE2 3.97Å; Y968-F984 HydrophobicContact CD2-CE2 3.97Å; Y968-F984 HydrophobicContact CG-CD2 4.41Å; Y968-F984 AromaticContact CG-CE2 3.82Å; Y968-F984 HydrophobicContact CG-CE2 3.82Å; Y968-F984 AromaticContact CG-CZ 3.91Å; Y968-F984 HydrophobicContact CG-CZ 3.91Å; Y968-F984 PolarHBondContact N-O 2.93Å; Y968-F984 PolarHBondContact O-N 2.74Å; Y968-L986 HydrophobicContact CD2-CD1 4.09Å; Y968-L986 HydrophobicContact CD2-CG 4.01Å; Y968-L986 HydrophobicContact CE2-CB 4.21Å; Y968-L986 HydrophobicContact CE2-CD1 3.7Å; Y968-L986 HydrophobicContact CE2-CG 3.94Å
969	R	89.4	Confident	71.6	Confident	28 Å²	28	65 Å²	65	11%	0.106	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121.7	168.1	-94.3	-178.9	-156.4	-176.9	12.8	109.6	L892 T893 E895 W982 N983 F1029 N1032 G1033	L892-R969 CarbonylContact C-O 3.55Å; L892-R969 WeakPolarHBondContact CA-O 3.17Å; L892-R969 WeakPolarHBondContact CD1-O 3.03Å; T893-R969 HydrophobicContact CG2-CB 3.74Å; T893-R969 PolarHBondContact N-O 3.12Å; T893-R969 PolarHBondContact O-N 3.38Å; E895-R969 HydrophobicContact CG-CG 4.42Å; E895-R969 IonicContact OE1-CZ 2.69Å; E895-R969 IonicContact OE1-NE 3.5Å; E895-R969 PolarHBondContact OE1-NE 3.18Å; E895-R969 IonicContact OE1-NH2 3.44Å; E895-R969 PolarHBondContact OE1-NH2 3.49Å; R969-W982 WeakPolarHBondContact CA-O 3.38Å; R969-N983 WeakPolarHBondContact CG-OD1 3.48Å; R969-F1029 HydrophobicContact CB-CE1 4.13Å; R969-F1029 HydrophobicContact CB-CE2 4.26Å; R969-F1029 HydrophobicContact CB-CZ 3.81Å; R969-F1029 VanDerWaalsContact O-CE2 3.27Å; R969-F1029 WeakPolarHBondContact O-CE2 3.04Å; R969-N1032 PolarHBondContact NH1-O 2.71Å; R969-G1033 WeakPolarHBondContact CD-O 3.37Å; R969-G1033 PolarHBondContact NH1-O 2.78Å
970	L	92.2	Very high	74.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	136.2	170	-178.8	77.9	0	0	0	108.5	A860 I868 L870 L882 L890 A891 L892 I981 W982 F984	A860-L970 HydrophobicContact CB-CD1 3.62Å; I868-L970 HydrophobicContact CG2-CD2 4.42Å; L870-L970 HydrophobicContact CD1-CD2 4.49Å; L870-L970 HydrophobicContact CD2-CD1 4.47Å; L870-L970 HydrophobicContact CD2-CD2 4.2Å; L882-L970 HydrophobicContact CD1-CD2 4.29Å; L890-L970 HydrophobicContact CD2-CD1 4.34Å; A891-L970 CarbonylContact O-C 3.58Å; A891-L970 WeakPolarHBondContact O-CA 3.48Å; L892-L970 HydrophobicContact CB-CD1 4.49Å; L892-L970 HydrophobicContact CD1-CB 4.02Å; L892-L970 HydrophobicContact CD1-CD1 3.85Å; L970-I981 CarbonylContact O-C 3.55Å; L970-I981 VanDerWaalsContact O-CA 3.27Å; L970-I981 WeakPolarHBondContact O-CA 3.24Å; L970-I981 WeakPolarHBondContact O-CG2 3.36Å; L970-W982 HydrophobicContact CB-CE3 4.41Å; L970-W982 HydrophobicContact CD2-CD2 4.46Å; L970-W982 HydrophobicContact CD2-CE3 3.89Å; L970-W982 HydrophobicContact CD2-CZ3 4.34Å; L970-W982 HydrophobicContact CG-CE3 4.23Å; L970-W982 PolarHBondContact N-O 2.95Å; L970-W982 PolarHBondContact O-N 3.11Å; L970-F984 HydrophobicContact CB-CE1 4.2Å
971	A	93.1	Very high	77.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.6	166.4	0	0	0	0	0	110	L890 A891 L979 I980 I981 L1027 F1029	L890-A971 WeakPolarHBondContact CA-O 3.35Å; A891-A971 PolarHBondContact N-O 3.2Å; A891-A971 PolarHBondContact O-N 3.37Å; A971-L979 HydrophobicContact CB-CD1 4.25Å; A971-I980 CarbonylContact C-O 3.55Å; A971-I980 WeakPolarHBondContact CA-O 3.24Å; A971-I981 HydrophobicContact CB-CG1 4.33Å; A971-L1027 HydrophobicContact CB-CD2 4.03Å; A971-F1029 HydrophobicContact CB-CE1 4.15Å; A971-F1029 HydrophobicContact CB-CE2 4.1Å; A971-F1029 HydrophobicContact CB-CZ 3.51Å
972	A	93.3	Very high	80.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124	173.9	0	0	0	0	0	109.8	I868 L884 V887 L890 L979 I980 W982	I868-A972 HydrophobicContact CD1-CB 3.68Å; L884-A972 HydrophobicContact CD1-CB 3.92Å; V887-A972 HydrophobicContact CG1-CB 4.27Å; L890-A972 HydrophobicContact CD2-CB 3.55Å; A972-L979 WeakPolarHBondContact O-CA 3.36Å; A972-I980 PolarHBondContact N-O 3.36Å; A972-I980 PolarHBondContact O-N 2.96Å; A972-W982 HydrophobicContact CB-CH2 3.86Å; A972-W982 HydrophobicContact CB-CZ3 3.53Å
973	L	92.8	Very high	83.2	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.7	168.2	179.9	62.9	0	0	0	108.6	I780 H888 T889 L979 I1012 F1024 L1027	I780-L973 HydrophobicContact CD1-CD1 3.99Å; I780-L973 HydrophobicContact CD1-CD2 3.71Å; I780-L973 HydrophobicContact CD1-CG 3.71Å; H888-L973 WeakPolarHBondContact CA-O 3.43Å; H888-L973 WeakPolarHBondContact CB-O 3.35Å; H888-L973 PolarHBondContact N-O 2.79Å; T889-L973 PolarHBondContact N-O 3.43Å; T889-L973 PolarHBondContact O-N 3.48Å; L973-L979 HydrophobicContact CB-CD1 4.27Å; L973-L979 HydrophobicContact CD1-CB 4.13Å; L973-I1012 HydrophobicContact CD1-CD1 3.9Å; L973-I1012 HydrophobicContact CD1-CG1 4.06Å; L973-I1012 HydrophobicContact CD1-CG2 3.84Å; L973-I1012 HydrophobicContact CD2-CD1 3.97Å; L973-F1024 HydrophobicContact CD2-CD1 3.94Å; L973-F1024 HydrophobicContact CD2-CD2 3.63Å; L973-F1024 HydrophobicContact CD2-CE1 3.66Å; L973-F1024 HydrophobicContact CD2-CE2 3.33Å; L973-F1024 HydrophobicContact CD2-CG 3.92Å; L973-F1024 HydrophobicContact CD2-CZ 3.34Å; L973-L1027 HydrophobicContact CB-CD2 4.27Å
974	C	91.1	Very high	85.8	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	155.4	174.3	-63.6	0	0	0	0	111.6	I780 D885 C886 S976 G977 R978	I780-C974 WeakPolarHBondContact CD1-O 3.36Å; D885-C974 WeakPolarHBondContact OD1-CB 3.28Å; D885-C974 PolarHBondContact OD1-SG 3.26Å; C886-C974 CarbonylContact O-C 3.56Å; C886-C974 WeakPolarHBondContact O-CA 3.4Å; C974-S976 PolarHBondContact O-N 3.09Å; C974-S976 VanDerWaalsContact O-N 3.08Å; C974-G977 PolarHBondContact O-N 2.82Å; C974-R978 HydrophobicContact CB-CB 4.21Å; C974-R978 PolarHBondContact N-O 3.23Å
975	R	86.9	Confident	87.3	Confident	109 Å²	109	29 Å²	29	41%	0.411	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.5	177.4	-159.1	174.5	-171.1	171.6	2.2	113.7	L779 I780 C886 G977	L779-R975 CarbonylContact C-O 3.57Å; L779-R975 VanDerWaalsContact CA-O 3.27Å; L779-R975 WeakPolarHBondContact CA-O 3Å; L779-R975 HydrophobicContact CD2-CG 4.37Å; I780-R975 HydrophobicContact CB-CG 4.45Å; I780-R975 PolarHBondContact N-O 2.84Å; I780-R975 PolarHBondContact O-NE 3.41Å; C886-R975 HydrophobicContact CB-CB 4.11Å; C886-R975 PolarHBondContact O-N 3.17Å; R975-G977 PolarHBondContact O-N 2.84Å
976	S	86	Confident	87.8	Confident	23 Å²	23	25.2 Å²	25.2	16%	0.161	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	0.1	172.1	57.6	0	0	0	0	115.2	D885 C974 R978	D885-S976 WeakPolarHBondContact OD2-CB 3.44Å; D885-S976 PolarHBondContact OD2-OG 2.63Å; C974-S976 PolarHBondContact O-N 3.09Å; C974-S976 VanDerWaalsContact O-N 3.08Å; S976-R978 VanDerWaalsContact C-N 3.29Å; S976-R978 PolarHBondContact O-N 2.77Å; S976-R978 WeakPolarHBondContact OG-CD 3.39Å; S976-R978 WeakPolarHBondContact OG-CG 3.17Å
977	G	87.5	Confident	87.4	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	83.2	-4.7	-173.6	0	0	0	0	0	114.6	C974 R975 L979 N1011 I1012	C974-G977 PolarHBondContact O-N 2.82Å; R975-G977 PolarHBondContact O-N 2.84Å; G977-L979 PolarHBondContact O-N 2.63Å; G977-N1011 CarbonylContact O-C 3.22Å; G977-N1011 WeakPolarHBondContact O-CA 3.3Å; G977-N1011 VanDerWaalsContact O-CG 3.32Å; G977-N1011 PolarHBondContact O-OD1 3.36Å; G977-I1012 PolarHBondContact O-N 3.22Å
978	R	90.7	Very high	86	Confident	70 Å²	70	22.2 Å²	22.2	26%	0.264	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	124.2	175.2	-63.6	168.8	70.5	-147.4	2.8	109.7	D885 C974 S976 E1009 T1010	D885-R978 IonicContact OD1-NH1 2.75Å; D885-R978 PolarHBondContact OD1-NH1 3.39Å; D885-R978 WeakPolarHBondContact OD2-CD 3.26Å; D885-R978 IonicContact OD2-NH1 3.3Å; C974-R978 HydrophobicContact CB-CB 4.21Å; C974-R978 PolarHBondContact N-O 3.23Å; S976-R978 VanDerWaalsContact C-N 3.29Å; S976-R978 PolarHBondContact O-N 2.77Å; S976-R978 WeakPolarHBondContact OG-CD 3.39Å; S976-R978 WeakPolarHBondContact OG-CG 3.17Å; R978-E1009 IonicContact CZ-OE1 2.9Å; R978-E1009 VanDerWaalsContact CZ-OE1 3.28Å; R978-E1009 IonicContact CZ-OE2 3.67Å; R978-E1009 IonicContact NE-OE1 3.82Å; R978-E1009 PolarHBondContact NE-OE1 2.93Å; R978-E1009 IonicContact NE-OE2 3.99Å; R978-E1009 IonicContact NH2-OE1 2.68Å; R978-E1009 PolarHBondContact NH2-OE1 3.34Å; R978-E1009 IonicContact NH2-OE2 3.12Å; R978-E1009 PolarHBondContact NH2-OE2 2.57Å; R978-T1010 WeakPolarHBondContact CA-O 3.16Å
979	L	92.6	Very high	83.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.3	172.9	174	63.4	0	0	0	107.9	A971 A972 L973 G977 E1009 T1010 I1012 L1027 P1035 W1054	A971-L979 HydrophobicContact CB-CD1 4.25Å; A972-L979 WeakPolarHBondContact O-CA 3.36Å; L973-L979 HydrophobicContact CB-CD1 4.27Å; L973-L979 HydrophobicContact CD1-CB 4.13Å; G977-L979 PolarHBondContact O-N 2.63Å; L979-E1009 WeakPolarHBondContact O-CA 3.47Å; L979-T1010 HydrophobicContact CB-CG2 3.86Å; L979-T1010 HydrophobicContact CD2-CG2 4Å; L979-T1010 HydrophobicContact CG-CG2 4.14Å; L979-T1010 PolarHBondContact N-O 3.13Å; L979-T1010 PolarHBondContact O-N 2.87Å; L979-I1012 HydrophobicContact CB-CG2 4.27Å; L979-I1012 HydrophobicContact CD2-CG2 4.47Å; L979-L1027 HydrophobicContact CD1-CD1 4.1Å; L979-L1027 HydrophobicContact CD1-CD2 3.78Å; L979-L1027 HydrophobicContact CD2-CD1 4.34Å; L979-P1035 HydrophobicContact CD2-CG 4.35Å; L979-W1054 HydrophobicContact CD2-CH2 3.73Å; L979-W1054 HydrophobicContact CD2-CZ2 4.18Å
980	I	92.7	Very high	81.1	Confident	6 Å²	6	27.9 Å²	27.9	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	138.7	-177.8	-56.2	163.8	0	0	0	108.2	L884 A971 A972 W982 V1006 E1009	L884-I980 HydrophobicContact CD2-CD1 3.51Å; A971-I980 CarbonylContact C-O 3.55Å; A971-I980 WeakPolarHBondContact CA-O 3.24Å; A972-I980 PolarHBondContact N-O 3.36Å; A972-I980 PolarHBondContact O-N 2.96Å; I980-W982 HydrophobicContact CB-CH2 3.55Å; I980-W982 HydrophobicContact CB-CZ2 4.13Å; I980-W982 HydrophobicContact CB-CZ3 3.86Å; I980-W982 HydrophobicContact CD1-CH2 4.47Å; I980-W982 HydrophobicContact CG2-CD2 4.24Å; I980-W982 HydrophobicContact CG2-CE3 4.2Å; I980-W982 HydrophobicContact CG2-CH2 3.39Å; I980-W982 HydrophobicContact CG2-CZ2 3.46Å; I980-W982 VanDerWaalsContact CG2-CZ2 3.46Å; I980-W982 HydrophobicContact CG2-CZ3 3.79Å; I980-W982 VanDerWaalsContact O-CZ3 3.26Å; I980-W982 WeakPolarHBondContact O-CZ3 3.35Å; I980-V1006 HydrophobicContact CG2-CG1 3.77Å; I980-V1006 HydrophobicContact CG2-CG2 4.46Å; I980-E1009 HydrophobicContact CG1-CB 4.07Å; I980-E1009 HydrophobicContact CG1-CG 3.76Å
981	I	92.1	Very high	78.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.4	-178.2	-44.4	-179.7	0	0	0	108.9	L970 A971 V1006 L1007 I1008 F1029 P1035 I1049	L970-I981 CarbonylContact O-C 3.55Å; L970-I981 VanDerWaalsContact O-CA 3.27Å; L970-I981 WeakPolarHBondContact O-CA 3.24Å; L970-I981 WeakPolarHBondContact O-CG2 3.36Å; A971-I981 HydrophobicContact CB-CG1 4.33Å; I981-V1006 CarbonylContact O-C 3.52Å; I981-V1006 WeakPolarHBondContact O-CA 3.27Å; I981-V1006 WeakPolarHBondContact O-CG1 3.35Å; I981-L1007 PolarHBondContact O-N 2.84Å; I981-I1008 HydrophobicContact CB-CG2 4.05Å; I981-I1008 HydrophobicContact CD1-CG2 3.5Å; I981-I1008 VanDerWaalsContact CD1-CG2 3.5Å; I981-I1008 HydrophobicContact CG1-CG2 3.82Å; I981-I1008 PolarHBondContact N-O 2.89Å; I981-I1008 PolarHBondContact O-N 2.8Å; I981-F1029 HydrophobicContact CG2-CE1 4.4Å; I981-F1029 HydrophobicContact CG2-CZ 4.4Å; I981-P1035 HydrophobicContact CD1-CG 3.61Å; I981-I1049 HydrophobicContact CD1-CD1 3.63Å; I981-I1049 HydrophobicContact CD1-CG1 3.88Å; I981-I1049 HydrophobicContact CG2-CD1 4.49Å
982	W	91.5	Very high	75.4	Confident	13 Å²	13	35.9 Å²	35.9	5%	0.049	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144	173.2	-59	-104.2	0	0	0	111.6	I868 L882 L884 R969 L970 A972 I980 P1004 Q1005 V1006	I868-W982 HydrophobicContact CD1-CH2 4.24Å; I868-W982 HydrophobicContact CD1-CZ3 4.45Å; L882-W982 HydrophobicContact CD1-CD2 4.2Å; L882-W982 HydrophobicContact CD1-CZ2 4.14Å; L884-W982 HydrophobicContact CD1-CH2 3.85Å; L884-W982 HydrophobicContact CD1-CZ2 4.49Å; L884-W982 HydrophobicContact CD2-CH2 4.21Å; L884-W982 HydrophobicContact CD2-CZ2 4.22Å; R969-W982 WeakPolarHBondContact CA-O 3.38Å; L970-W982 HydrophobicContact CB-CE3 4.41Å; L970-W982 HydrophobicContact CD2-CD2 4.46Å; L970-W982 HydrophobicContact CD2-CE3 3.89Å; L970-W982 HydrophobicContact CD2-CZ3 4.34Å; L970-W982 HydrophobicContact CG-CE3 4.23Å; L970-W982 PolarHBondContact N-O 2.95Å; L970-W982 PolarHBondContact O-N 3.11Å; A972-W982 HydrophobicContact CB-CH2 3.86Å; A972-W982 HydrophobicContact CB-CZ3 3.53Å; I980-W982 HydrophobicContact CB-CH2 3.55Å; I980-W982 HydrophobicContact CB-CZ2 4.13Å; I980-W982 HydrophobicContact CB-CZ3 3.86Å; I980-W982 HydrophobicContact CD1-CH2 4.47Å; I980-W982 HydrophobicContact CG2-CD2 4.24Å; I980-W982 HydrophobicContact CG2-CE3 4.2Å; I980-W982 HydrophobicContact CG2-CH2 3.39Å; I980-W982 HydrophobicContact CG2-CZ2 3.46Å; I980-W982 VanDerWaalsContact CG2-CZ2 3.46Å; I980-W982 HydrophobicContact CG2-CZ3 3.79Å; I980-W982 VanDerWaalsContact O-CZ3 3.26Å; I980-W982 WeakPolarHBondContact O-CZ3 3.35Å; W982-P1004 HydrophobicContact CB-CB 3.7Å; W982-P1004 HydrophobicContact CG-CB 3.86Å; W982-Q1005 CarbonylContact C-O 3.54Å; W982-Q1005 WeakPolarHBondContact CA-O 3.38Å; W982-V1006 HydrophobicContact CG-CG2 4.46Å
983	N	88.8	Confident	72.4	Confident	30 Å²	30	40.2 Å²	40.2	16%	0.16	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	142.4	162.1	-86.2	35.1	0	0	0	110.3	E895 Y968 R969 Q1005 L1007	E895-N983 PolarHBondContact OE1-ND2 2.93Å; Y968-N983 CarbonylContact O-C 3.56Å; Y968-N983 WeakPolarHBondContact O-CA 3.29Å; R969-N983 WeakPolarHBondContact CG-OD1 3.48Å; N983-Q1005 PolarHBondContact N-O 3.01Å; N983-Q1005 WeakPolarHBondContact O-CB 3.46Å; N983-Q1005 PolarHBondContact O-N 3.26Å; N983-L1007 WeakPolarHBondContact OD1-CD2 3.23Å
984	F	86.7	Confident	69.4	Low	7 Å²	7	48.9 Å²	48.9	3%	0.031	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	151.9	165.1	56.9	-78.6	0	0	0	110.9	V858 L870 I878 L892 K967 Y968 L970 L986 I1002 P1004	V858-F984 HydrophobicContact CG1-CE2 4.29Å; V858-F984 HydrophobicContact CG1-CZ 4.05Å; V858-F984 HydrophobicContact CG2-CE2 4.23Å; L870-F984 HydrophobicContact CD1-CE1 4.26Å; L870-F984 HydrophobicContact CD1-CZ 4.37Å; I878-F984 HydrophobicContact CD1-CE2 4.49Å; L892-F984 HydrophobicContact CD1-CE1 4.21Å; L892-F984 HydrophobicContact CD1-CZ 4.1Å; K967-F984 WeakPolarHBondContact CA-O 3.35Å; Y968-F984 HydrophobicContact CD2-CD2 4.32Å; Y968-F984 AromaticContact CD2-CE2 3.97Å; Y968-F984 HydrophobicContact CD2-CE2 3.97Å; Y968-F984 HydrophobicContact CG-CD2 4.41Å; Y968-F984 AromaticContact CG-CE2 3.82Å; Y968-F984 HydrophobicContact CG-CE2 3.82Å; Y968-F984 AromaticContact CG-CZ 3.91Å; Y968-F984 HydrophobicContact CG-CZ 3.91Å; Y968-F984 PolarHBondContact N-O 2.93Å; Y968-F984 PolarHBondContact O-N 2.74Å; L970-F984 HydrophobicContact CB-CE1 4.2Å; F984-L986 HydrophobicContact CD2-CD2 4.05Å; F984-L986 HydrophobicContact CD2-CG 4.19Å; F984-L986 HydrophobicContact CE2-CD1 4.43Å; F984-L986 HydrophobicContact CE2-CD2 4.32Å; F984-L986 HydrophobicContact CE2-CG 4.27Å; F984-I1002 HydrophobicContact CB-CG2 4.35Å; F984-P1004 HydrophobicContact CB-CB 4.39Å; F984-P1004 HydrophobicContact CD1-CB 4.28Å; F984-P1004 HydrophobicContact CD1-CG 4.45Å
985	C	81.3	Confident	66.4	Low	53 Å²	53	53.5 Å²	53.5	36%	0.358	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129	176.4	-54.5	0	0	0	0	108.4	R966 I1002	R966-C985 CarbonylContact O-C 3.53Å; R966-C985 WeakPolarHBondContact O-CA 3.41Å; C985-I1002 WeakPolarHBondContact O-CD1 3.42Å; C985-I1002 WeakPolarHBondContact O-CG2 3.32Å
986	L	74.5	Confident	63.7	Low	6 Å²	6	53.2 Å²	53.2	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.5	168.5	-62.6	-175.8	0	0	0	109.5	V858 Y872 I878 N965 R966 Y968 F984 I1002	V858-L986 HydrophobicContact CG2-CD1 3.34Å; Y872-L986 HydrophobicContact CD1-CD1 4.35Å; Y872-L986 HydrophobicContact CE1-CD1 3.84Å; Y872-L986 HydrophobicContact CE1-CD2 4.05Å; Y872-L986 HydrophobicContact CE1-CG 4.5Å; I878-L986 HydrophobicContact CD1-CD1 4.49Å; I878-L986 HydrophobicContact CG2-CD2 3.95Å; N965-L986 WeakPolarHBondContact CA-O 3.48Å; R966-L986 PolarHBondContact N-O 2.83Å; R966-L986 VanDerWaalsContact N-O 3.08Å; R966-L986 PolarHBondContact O-N 3.01Å; Y968-L986 HydrophobicContact CD2-CD1 4.09Å; Y968-L986 HydrophobicContact CD2-CG 4.01Å; Y968-L986 HydrophobicContact CE2-CB 4.21Å; Y968-L986 HydrophobicContact CE2-CD1 3.7Å; Y968-L986 HydrophobicContact CE2-CG 3.94Å; F984-L986 HydrophobicContact CD2-CD2 4.05Å; F984-L986 HydrophobicContact CD2-CG 4.19Å; F984-L986 HydrophobicContact CE2-CD1 4.43Å; F984-L986 HydrophobicContact CE2-CD2 4.32Å; F984-L986 HydrophobicContact CE2-CG 4.27Å; L986-I1002 HydrophobicContact CD2-CD1 4.15Å
987	N	62.2	Low	61	Low	72 Å²	72	57.9 Å²	57.9	39%	0.385	35%	0.352	S	S	.	.			trans	-98.7	134.8	174.3	-59.4	-5.8	0	0	0	108.1	N965 C989	N965-N987 PolarHBondContact ND2-OD1 2.8Å; N965-N987 PolarHBondContact OD1-OD1 3.34Å; N987-C989 PolarHBondContact O-N 2.88Å
988	N	53	Low	58.1	Low	49 Å²	49	67.1 Å²	67.1	26%	0.262	39%	0.392	S	S	.	.	S	Bend	trans	-70.5	0.6	-174.2	-94.3	-23.3	0	0	0	115.4	F962 G990	F962-N988 PolarHBondContact O-ND2 2.9Å; N988-G990 VanDerWaalsContact C-N 3.3Å; N988-G990 PolarHBondContact O-N 2.92Å
989	C	38.2	Very low	55.4	Low	105 Å²	105	69 Å²	69	71%	0.709	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	72.3	175	44.3	0	0	0	0	112.3	N987	N987-C989 PolarHBondContact O-N 2.88Å
990	G	36.4	Very low	53	Low	42 Å²	42	76.4 Å²	76.4	43%	0.433	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.5	-10.9	176.1	0	0	0	0	0	116.8	N988 G992	N988-G990 VanDerWaalsContact C-N 3.3Å; N988-G990 PolarHBondContact O-N 2.92Å; G990-G992 PolarHBondContact O-N 2.85Å
991	F	35.8	Very low	50.9	Low	113 Å²	113	80 Å²	80	50%	0.496	47%	0.472	S	S	.	.			trans	-79.3	64.1	-178.6	-67.2	-75	0	0	0	112.9	L799 I800 T874	L799-F991 HydrophobicContact CD1-CE2 4.08Å; L799-F991 HydrophobicContact CD1-CZ 3.75Å; I800-F991 HydrophobicContact CD1-CD1 4.16Å; T874-F991 HydrophobicContact CG2-CE1 4.22Å
992	G	28.9	Very low	49.6	Very low	54 Å²	54	82.1 Å²	82.1	56%	0.557	48%	0.483	S	S	*	.	S	Bend	trans	-158.8	116.7	179.1	0	0	0	0	0	113	G990	G990-G992 PolarHBondContact O-N 2.85Å
993	S	29.8	Very low	48.5	Very low	91 Å²	91	87.7 Å²	87.7	64%	0.636	51%	0.508	S	S	*	.			trans	67.6	136.4	-179.5	-158.4	0	0	0	0	117.1	S995	S993-S995 VanDerWaalsContact C-N 3.33Å; S993-S995 PolarHBondContact OG-OG 2.85Å
994	I	30	Very low	48	Very low	183 Å²	183	86.8 Å²	86.8	94%	0.938	50%	0.503	S	S	*	.	S	Bend	trans	-88	-1	-179.6	-75.6	171.2	0	0	0	111.8
995	S	28.9	Very low	47.8	Very low	97 Å²	97	91.9 Å²	91.9	68%	0.678	53%	0.527	S	S	*	.	S	Bend	trans	-129.9	26.9	-160.9	69.2	0	0	0	0	116	S993	S993-S995 VanDerWaalsContact C-N 3.33Å; S993-S995 PolarHBondContact OG-OG 2.85Å
996	T	30.1	Very low	48	Very low	103 Å²	103	90.9 Å²	90.9	63%	0.632	52%	0.519	S	S	*	.			trans	-129.7	115.9	177	28.9	0	0	0	0	112.8
997	V	29	Very low	48.3	Very low	121 Å²	121	93.5 Å²	93.5	73%	0.733	53%	0.533	S	S	*	.			trans	-64	156.6	164.2	-173.5	0	0	0	0	109.1
998	F	26.6	Very low	49.5	Very low	195 Å²	195	90.6 Å²	90.6	86%	0.855	52%	0.518	S	S	*	.			trans	73.9	59.7	-179.6	-49.9	-76.5	0	0	0	116.4
999	N	34.1	Very low	51.2	Low	108 Å²	108	93 Å²	93	58%	0.578	53%	0.527	S	S	*	.			trans	-88.3	143.9	139.7	-89.5	-36.4	0	0	0	109	C1001	N999-C1001 PolarHBondContact O-N 2.93Å; N999-C1001 VanDerWaalsContact O-N 3.1Å
1000	N	42	Very low	53.6	Low	157 Å²	157	89.1 Å²	89.1	84%	0.84	50%	0.5	S	S	*	.			trans	-57.9	115.1	-175.6	-74.1	-34.5	0	0	0	111	I1002	N1000-I1002 WeakPolarHBondContact O-CG1 3.4Å; N1000-I1002 PolarHBondContact O-N 3.4Å
1001	C	49.3	Very low	56	Low	81 Å²	81	88.7 Å²	88.7	55%	0.547	49%	0.488	S	S	.	.			trans	-61.8	108.3	-179.5	-70.1	0	0	0	0	110.5	N999 F1003	N999-C1001 PolarHBondContact O-N 2.93Å; N999-C1001 VanDerWaalsContact O-N 3.1Å; C1001-F1003 VanDerWaalsContact C-N 3.33Å; C1001-F1003 HydrophobicContact CB-CD2 4.37Å; C1001-F1003 HydrophobicContact CB-CE2 4.48Å; C1001-F1003 PolarHBondContact O-N 2.71Å
1002	I	63.5	Low	58.5	Low	44 Å²	44	83.3 Å²	83.3	23%	0.226	46%	0.464	C	S	.	.			trans	-79.1	86.8	-179	-53.2	-172.7	0	0	0	107.9	F984 C985 L986 N1000 P1004	F984-I1002 HydrophobicContact CB-CG2 4.35Å; C985-I1002 WeakPolarHBondContact O-CD1 3.42Å; C985-I1002 WeakPolarHBondContact O-CG2 3.32Å; L986-I1002 HydrophobicContact CD2-CD1 4.15Å; N1000-I1002 WeakPolarHBondContact O-CG1 3.4Å; N1000-I1002 PolarHBondContact O-N 3.4Å; I1002-P1004 WeakPolarHBondContact O-CD 3.45Å
1003	F	70.4	Confident	61.2	Low	131 Å²	131	83.9 Å²	83.9	58%	0.575	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-65.7	123.8	176.9	-100.6	-83.3	0	0	0	110.7	P880 C1001 Q1005	P880-F1003 HydrophobicContact CB-CZ 4.09Å; P880-F1003 HydrophobicContact CG-CE2 3.98Å; P880-F1003 HydrophobicContact CG-CZ 3.69Å; C1001-F1003 VanDerWaalsContact C-N 3.33Å; C1001-F1003 HydrophobicContact CB-CD2 4.37Å; C1001-F1003 HydrophobicContact CB-CE2 4.48Å; C1001-F1003 PolarHBondContact O-N 2.71Å; F1003-Q1005 PolarHBondContact O-N 2.98Å
1004	P	78.1	Confident	63.4	Low	10 Å²	10	84.7 Å²	84.7	7%	0.065	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-61.6	129.8	175.5	-23.1	33.9	0	0	0	111.8	L870 L882 W982 F984 I1002	L870-P1004 HydrophobicContact CD1-CG 3.48Å; L870-P1004 VanDerWaalsContact CD1-CG 3.48Å; L882-P1004 HydrophobicContact CD1-CG 4.33Å; L882-P1004 HydrophobicContact CD2-CG 4.31Å; W982-P1004 HydrophobicContact CB-CB 3.7Å; W982-P1004 HydrophobicContact CG-CB 3.86Å; F984-P1004 HydrophobicContact CB-CB 4.39Å; F984-P1004 HydrophobicContact CD1-CB 4.28Å; F984-P1004 HydrophobicContact CD1-CG 4.45Å; I1002-P1004 WeakPolarHBondContact O-CD 3.45Å
1005	Q	81.6	Confident	65.9	Low	114 Å²	114	76.5 Å²	76.5	53%	0.533	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	116	-179.2	-170.9	-176.3	-17.9	0	0	109	F118 W982 N983 F1003 L1007	F118-Q1005 HydrophobicContact CD1-CG 4.27Å; F118-Q1005 HydrophobicContact CE1-CB 4.4Å; F118-Q1005 HydrophobicContact CE1-CG 3.26Å; F118-Q1005 HydrophobicContact CZ-CB 4.35Å; F118-Q1005 HydrophobicContact CZ-CG 3.6Å; W982-Q1005 CarbonylContact C-O 3.54Å; W982-Q1005 WeakPolarHBondContact CA-O 3.38Å; N983-Q1005 PolarHBondContact N-O 3.01Å; N983-Q1005 WeakPolarHBondContact O-CB 3.46Å; N983-Q1005 PolarHBondContact O-N 3.26Å; F1003-Q1005 PolarHBondContact O-N 2.98Å; Q1005-L1007 PolarHBondContact O-N 2.71Å; Q1005-L1007 VanDerWaalsContact O-N 3.1Å
1006	V	84.8	Confident	68.3	Low	33 Å²	33	72.9 Å²	72.9	20%	0.2	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	118	176.1	-176.7	0	0	0	0	108.3	F118 I980 I981 W982	F118-V1006 HydrophobicContact CB-CB 4.35Å; F118-V1006 HydrophobicContact CD1-CB 4.47Å; F118-V1006 WeakPolarHBondContact CD1-O 3.27Å; F118-V1006 HydrophobicContact CD2-CB 3.5Å; F118-V1006 HydrophobicContact CD2-CG2 3.87Å; F118-V1006 HydrophobicContact CE2-CB 3.9Å; F118-V1006 HydrophobicContact CE2-CG2 4.01Å; F118-V1006 HydrophobicContact CG-CB 3.81Å; F118-V1006 VanDerWaalsContact CG-O 3.24Å; F118-V1006 WeakPolarHBondContact CG-O 3.37Å; I980-V1006 HydrophobicContact CG2-CG1 3.77Å; I980-V1006 HydrophobicContact CG2-CG2 4.46Å; I981-V1006 CarbonylContact O-C 3.52Å; I981-V1006 WeakPolarHBondContact O-CA 3.27Å; I981-V1006 WeakPolarHBondContact O-CG1 3.35Å; W982-V1006 HydrophobicContact CG-CG2 4.46Å
1007	L	81.7	Confident	69.9	Low	60 Å²	60	73.7 Å²	73.7	31%	0.314	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-40.6	176.7	-174.5	60.5	0	0	0	110.6	I981 N983 Q1005 I1049	I981-L1007 PolarHBondContact O-N 2.84Å; N983-L1007 WeakPolarHBondContact OD1-CD2 3.23Å; Q1005-L1007 PolarHBondContact O-N 2.71Å; Q1005-L1007 VanDerWaalsContact O-N 3.1Å; L1007-I1049 HydrophobicContact CD2-CD1 3.97Å; L1007-I1049 HydrophobicContact CD2-CG2 3.78Å; L1007-I1049 HydrophobicContact CG-CG2 3.8Å
1008	I	87.1	Confident	71.1	Confident	12 Å²	12	70.4 Å²	70.4	6%	0.062	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	153.3	176.4	-170.2	146.9	0	0	0	112.3	I981 F1047 I1049 R1052	I981-I1008 HydrophobicContact CB-CG2 4.05Å; I981-I1008 HydrophobicContact CD1-CG2 3.5Å; I981-I1008 VanDerWaalsContact CD1-CG2 3.5Å; I981-I1008 HydrophobicContact CG1-CG2 3.82Å; I981-I1008 PolarHBondContact N-O 2.89Å; I981-I1008 PolarHBondContact O-N 2.8Å; I1008-F1047 HydrophobicContact CD1-CE1 3.62Å; I1008-F1047 HydrophobicContact CD1-CZ 3.88Å; I1008-F1047 HydrophobicContact CG1-CE1 3.97Å; I1008-F1047 HydrophobicContact CG1-CZ 4.42Å; I1008-F1047 HydrophobicContact CG2-CE1 4.01Å; I1008-I1049 HydrophobicContact CB-CG2 4.37Å; I1008-I1049 HydrophobicContact CG2-CG1 4.33Å; I1008-I1049 HydrophobicContact CG2-CG2 3.9Å; I1008-R1052 HydrophobicContact CD1-CB 4.04Å; I1008-R1052 HydrophobicContact CD1-CG 3.52Å
1009	E	88.1	Confident	72.2	Confident	99 Å²	99	64.7 Å²	64.7	46%	0.463	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.3	161.6	175.2	170.6	156.1	0	0	109.1	R978 L979 I980	R978-E1009 IonicContact CZ-OE1 2.9Å; R978-E1009 VanDerWaalsContact CZ-OE1 3.28Å; R978-E1009 IonicContact CZ-OE2 3.67Å; R978-E1009 IonicContact NE-OE1 3.82Å; R978-E1009 PolarHBondContact NE-OE1 2.93Å; R978-E1009 IonicContact NE-OE2 3.99Å; R978-E1009 IonicContact NH2-OE1 2.68Å; R978-E1009 PolarHBondContact NH2-OE1 3.34Å; R978-E1009 IonicContact NH2-OE2 3.12Å; R978-E1009 PolarHBondContact NH2-OE2 2.57Å; L979-E1009 WeakPolarHBondContact O-CA 3.47Å; I980-E1009 HydrophobicContact CG1-CB 4.07Å; I980-E1009 HydrophobicContact CG1-CG 3.76Å
1010	T	89.2	Confident	73.1	Confident	23 Å²	23	64.3 Å²	64.3	14%	0.141	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	179.8	176.5	-171.2	0	0	0	0	109.9	R978 L979 F1047 W1054	R978-T1010 WeakPolarHBondContact CA-O 3.16Å; L979-T1010 HydrophobicContact CB-CG2 3.86Å; L979-T1010 HydrophobicContact CD2-CG2 4Å; L979-T1010 HydrophobicContact CG-CG2 4.14Å; L979-T1010 PolarHBondContact N-O 3.13Å; L979-T1010 PolarHBondContact O-N 2.87Å; T1010-F1047 HydrophobicContact CG2-CD1 4.03Å; T1010-F1047 HydrophobicContact CG2-CD2 4.38Å; T1010-F1047 HydrophobicContact CG2-CE1 3.8Å; T1010-F1047 HydrophobicContact CG2-CE2 4.19Å; T1010-F1047 HydrophobicContact CG2-CG 4.31Å; T1010-F1047 HydrophobicContact CG2-CZ 3.9Å; T1010-F1047 WeakPolarHBondContact OG1-CE2 3.45Å; T1010-W1054 HydrophobicContact CG2-CZ2 3.97Å
1011	N	88.2	Confident	73.8	Confident	33 Å²	33	65 Å²	65	18%	0.176	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.6	176.3	-156.5	-64.1	0	0	0	111.8	G977 K1013 W1054	G977-N1011 CarbonylContact O-C 3.22Å; G977-N1011 WeakPolarHBondContact O-CA 3.3Å; G977-N1011 VanDerWaalsContact O-CG 3.32Å; G977-N1011 PolarHBondContact O-OD1 3.36Å; N1011-K1013 VanDerWaalsContact C-N 3.29Å; N1011-K1013 PolarHBondContact O-N 3.06Å; N1011-K1013 WeakPolarHBondContact OD1-CB 3.38Å; N1011-K1013 WeakPolarHBondContact OD1-CG 3.41Å; N1011-K1013 PolarHBondContact OD1-N 2.81Å; N1011-W1054 PolarHBondContact O-NE1 2.84Å
1012	I	88.3	Confident	74.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.8	179.1	69.7	163.8	0	0	0	113.6	I780 L973 G977 L979 D1014 V1015 L1016 F1024 V1037 W1054	I780-I1012 HydrophobicContact CD1-CD1 3.85Å; I780-I1012 HydrophobicContact CG1-CD1 4.33Å; L973-I1012 HydrophobicContact CD1-CD1 3.9Å; L973-I1012 HydrophobicContact CD1-CG1 4.06Å; L973-I1012 HydrophobicContact CD1-CG2 3.84Å; L973-I1012 HydrophobicContact CD2-CD1 3.97Å; G977-I1012 PolarHBondContact O-N 3.22Å; L979-I1012 HydrophobicContact CB-CG2 4.27Å; L979-I1012 HydrophobicContact CD2-CG2 4.47Å; I1012-D1014 PolarHBondContact O-N 3.45Å; I1012-V1015 PolarHBondContact O-N 2.97Å; I1012-V1015 VanDerWaalsContact O-N 3.08Å; I1012-L1016 HydrophobicContact CD1-CD1 3.68Å; I1012-L1016 HydrophobicContact CG1-CD1 3.9Å; I1012-L1016 PolarHBondContact O-N 3.01Å; I1012-F1024 HydrophobicContact CD1-CB 4.05Å; I1012-F1024 HydrophobicContact CD1-CD2 4Å; I1012-F1024 HydrophobicContact CD1-CG 4.22Å; I1012-V1037 HydrophobicContact CG2-CG2 4.28Å; I1012-W1054 HydrophobicContact CG2-CH2 4.03Å; I1012-W1054 HydrophobicContact CG2-CZ2 3.96Å
1013	K	84.5	Confident	75.7	Confident	67 Å²	67	66.5 Å²	66.5	29%	0.291	36%	0.36	S	S	.	.	H	α-helix	trans	-53.3	-37.1	169.6	-76.7	179.2	-137.3	-171.3	0	112.3	F778 N1011 V1015 L1016 N1017	F778-K1013 HydrophobicContact CB-CD 3.89Å; F778-K1013 HydrophobicContact CB-CG 4.3Å; F778-K1013 HydrophobicContact CD1-CD 3.94Å; F778-K1013 VanDerWaalsContact CD1-CE 3.49Å; F778-K1013 HydrophobicContact CD1-CG 3.57Å; F778-K1013 HydrophobicContact CD2-CD 4.41Å; F778-K1013 HydrophobicContact CD2-CG 3.92Å; F778-K1013 HydrophobicContact CE1-CG 3.83Å; F778-K1013 HydrophobicContact CE2-CG 4.14Å; F778-K1013 HydrophobicContact CG-CD 3.81Å; F778-K1013 HydrophobicContact CG-CG 3.64Å; F778-K1013 HydrophobicContact CZ-CG 4.12Å; N1011-K1013 VanDerWaalsContact C-N 3.29Å; N1011-K1013 PolarHBondContact O-N 3.06Å; N1011-K1013 WeakPolarHBondContact OD1-CB 3.38Å; N1011-K1013 WeakPolarHBondContact OD1-CG 3.41Å; N1011-K1013 PolarHBondContact OD1-N 2.81Å; K1013-V1015 PolarHBondContact O-N 3.06Å; K1013-L1016 PolarHBondContact O-N 3.24Å; K1013-N1017 VanDerWaalsContact O-CB 3.24Å; K1013-N1017 WeakPolarHBondContact O-CB 3.17Å; K1013-N1017 PolarHBondContact O-N 2.87Å
1014	D	76	Confident	76.5	Confident	108 Å²	108	60.5 Å²	60.5	58%	0.578	33%	0.334	S	S	*	.	H	α-helix	trans	-66	-20.9	-178.3	-60.3	-36.1	0	0	0	112.5	I1012	I1012-D1014 PolarHBondContact O-N 3.45Å
1015	V	81.7	Confident	76.9	Confident	11 Å²	11	63.3 Å²	63.3	7%	0.067	35%	0.354	C	S	.	.	H	α-helix	trans	-91.5	-47.4	172	-177.3	0	0	0	0	110.8	I1012 K1013 N1017 G1018 L1039 Y1045 W1054	I1012-V1015 PolarHBondContact O-N 2.97Å; I1012-V1015 VanDerWaalsContact O-N 3.08Å; K1013-V1015 PolarHBondContact O-N 3.06Å; V1015-N1017 VanDerWaalsContact C-N 3.32Å; V1015-N1017 PolarHBondContact O-N 3.41Å; V1015-G1018 PolarHBondContact O-N 3.49Å; V1015-L1039 HydrophobicContact CG1-CD1 4.24Å; V1015-Y1045 HydrophobicContact CG1-CD1 4.01Å; V1015-Y1045 HydrophobicContact CG1-CD2 3.31Å; V1015-Y1045 HydrophobicContact CG1-CE1 4.24Å; V1015-Y1045 HydrophobicContact CG1-CE2 3.57Å; V1015-Y1045 HydrophobicContact CG1-CG 3.56Å; V1015-W1054 HydrophobicContact CG2-CB 4.18Å; V1015-W1054 HydrophobicContact CG2-CD2 3.35Å; V1015-W1054 HydrophobicContact CG2-CE3 3.73Å; V1015-W1054 HydrophobicContact CG2-CG 3.56Å; V1015-W1054 HydrophobicContact CG2-CH2 4.5Å; V1015-W1054 HydrophobicContact CG2-CZ2 4.19Å; V1015-W1054 HydrophobicContact CG2-CZ3 4.28Å
1016	L	79.2	Confident	77.1	Confident	20 Å²	20	59.6 Å²	59.6	11%	0.105	34%	0.34	C	S	.	.	H	α-helix	trans	-69.3	-24.4	-175.3	-71	171.9	0	0	0	114.2	F778 I1012 K1013 G1018 L1039	F778-L1016 HydrophobicContact CE2-CD1 4.17Å; F778-L1016 HydrophobicContact CZ-CD1 3.58Å; I1012-L1016 HydrophobicContact CD1-CD1 3.68Å; I1012-L1016 HydrophobicContact CG1-CD1 3.9Å; I1012-L1016 PolarHBondContact O-N 3.01Å; K1013-L1016 PolarHBondContact O-N 3.24Å; L1016-G1018 PolarHBondContact O-N 3.4Å; L1016-L1039 HydrophobicContact CD2-CD1 4.25Å; L1016-L1039 HydrophobicContact CD2-CD2 3.51Å; L1016-L1039 HydrophobicContact CG-CD2 4.45Å
1017	N	65.4	Low	77.4	Confident	120 Å²	120	58.2 Å²	58.2	64%	0.642	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	6.9	175.4	-69.4	-8.6	0	0	0	113.2	K1013 V1015 G1019	K1013-N1017 VanDerWaalsContact O-CB 3.24Å; K1013-N1017 WeakPolarHBondContact O-CB 3.17Å; K1013-N1017 PolarHBondContact O-N 2.87Å; V1015-N1017 VanDerWaalsContact C-N 3.32Å; V1015-N1017 PolarHBondContact O-N 3.41Å; N1017-G1019 PolarHBondContact O-N 2.8Å
1018	G	53.6	Low	77.8	Confident	52 Å²	52	56 Å²	56	54%	0.536	32%	0.321	S	S	.	.	S	Bend	trans	-70	36.3	-174.6	0	0	0	0	0	116.4	V1015 L1016 H1020	V1015-G1018 PolarHBondContact O-N 3.49Å; L1016-G1018 PolarHBondContact O-N 3.4Å; G1018-H1020 PolarHBondContact O-CD2 3.28Å; G1018-H1020 PolarHBondContact O-N 3.29Å; G1018-H1020 VanDerWaalsContact O-N 3.14Å
1019	G	48.8	Very low	77.9	Confident	75 Å²	75	55.5 Å²	55.5	77%	0.773	32%	0.318	S	S	*	.	S	Bend	trans	80	-19.2	176.6	0	0	0	0	0	115.8	N1017	N1017-G1019 PolarHBondContact O-N 2.8Å
1020	H	52.7	Low	77.7	Confident	100 Å²	100	51.1 Å²	51.1	46%	0.463	30%	0.3	S	S	.	.	S	Bend	trans	-104.4	133.2	177.8	-62.7	-80.2	0	0	0	110.5	G1018 S1022 S1061	G1018-H1020 PolarHBondContact O-CD2 3.28Å; G1018-H1020 PolarHBondContact O-N 3.29Å; G1018-H1020 VanDerWaalsContact O-N 3.14Å; H1020-S1022 PolarHBondContact O-N 2.88Å; H1020-S1061 PolarHBondContact CE1-OG 2.83Å; H1020-S1061 PolarHBondContact NE2-OG 3.38Å
1021	N	58.7	Low	77.2	Confident	173 Å²	173	51 Å²	51	93%	0.925	30%	0.299	S	S	*	.			trans	-78.1	38.8	-173.8	-140.3	-7.5	0	0	0	112.5
1022	S	71.4	Confident	76.7	Confident	22 Å²	22	55.1 Å²	55.1	15%	0.154	32%	0.321	C	S	.	.			trans	-79	166.1	-173.5	-160.2	0	0	0	0	111.5	H1020 D1041	H1020-S1022 PolarHBondContact O-N 2.88Å; S1022-D1041 WeakPolarHBondContact CB-OD2 3.48Å; S1022-D1041 PolarHBondContact OG-OD1 2.77Å; S1022-D1041 PolarHBondContact OG-OD2 2.96Å
1023	R	80.4	Confident	76.5	Confident	133 Å²	133	55.5 Å²	55.5	50%	0.502	33%	0.325	S	S	.	.			trans	-127.9	152.7	-177.8	-60.6	-179.9	-176.5	178.3	0.1	109.9	T782 S1025 L1039 Q1040	T782-R1023 HydrophobicContact CG2-CB 4.25Å; R1023-S1025 PolarHBondContact O-N 3.28Å; R1023-L1039 CarbonylContact O-C 3.48Å; R1023-L1039 VanDerWaalsContact O-CA 3.3Å; R1023-L1039 WeakPolarHBondContact O-CA 3.19Å; R1023-Q1040 HydrophobicContact CB-CG 4.15Å; R1023-Q1040 PolarHBondContact O-N 2.86Å
1024	F	87.1	Confident	76.7	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.022	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	137.5	170.2	174.4	-101.4	0	0	0	110.7	I780 H888 T889 L973 I1012 S1026 L1027 V1037	I780-F1024 HydrophobicContact CG2-CB 4.29Å; H888-F1024 AromaticContact CD2-CD1 3.86Å; H888-F1024 AromaticContact CD2-CE1 3.77Å; H888-F1024 AromaticContact NE2-CD1 3.6Å; H888-F1024 AromaticContact NE2-CE1 3.83Å; T889-F1024 HydrophobicContact CG2-CZ 4.41Å; T889-F1024 WeakPolarHBondContact OG1-CE1 3.48Å; L973-F1024 HydrophobicContact CD2-CD1 3.94Å; L973-F1024 HydrophobicContact CD2-CD2 3.63Å; L973-F1024 HydrophobicContact CD2-CE1 3.66Å; L973-F1024 HydrophobicContact CD2-CE2 3.33Å; L973-F1024 HydrophobicContact CD2-CG 3.92Å; L973-F1024 HydrophobicContact CD2-CZ 3.34Å; I1012-F1024 HydrophobicContact CD1-CB 4.05Å; I1012-F1024 HydrophobicContact CD1-CD2 4Å; I1012-F1024 HydrophobicContact CD1-CG 4.22Å; F1024-S1026 VanDerWaalsContact CE2-O 3.27Å; F1024-S1026 WeakPolarHBondContact CE2-O 3.45Å; F1024-S1026 VanDerWaalsContact CZ-CA 3.48Å; F1024-L1027 HydrophobicContact CE2-CB 4.14Å; F1024-L1027 HydrophobicContact CZ-CB 3.92Å; F1024-V1037 HydrophobicContact CD2-CG1 3.83Å; F1024-V1037 HydrophobicContact CE2-CG1 4.06Å
1025	S	85.6	Confident	77.5	Confident	69 Å²	69	47.3 Å²	47.3	48%	0.483	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-49	177	-174.5	0	0	0	0	112.3	R1023 Y1038	R1023-S1025 PolarHBondContact O-N 3.28Å; S1025-Y1038 WeakPolarHBondContact CA-O 3.48Å; S1025-Y1038 WeakPolarHBondContact CB-O 3.42Å; S1025-Y1038 PolarHBondContact N-O 3.47Å
1026	S	87.1	Confident	78	Confident	36 Å²	36	46.8 Å²	46.8	25%	0.252	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	162.9	178.5	62.1	0	0	0	0	112.9	F1024 Y1038	F1024-S1026 VanDerWaalsContact CE2-O 3.27Å; F1024-S1026 WeakPolarHBondContact CE2-O 3.45Å; F1024-S1026 VanDerWaalsContact CZ-CA 3.48Å; S1026-Y1038 PolarHBondContact N-O 3.49Å; S1026-Y1038 PolarHBondContact O-N 3.27Å; S1026-Y1038 VanDerWaalsContact OG-CD2 3.26Å; S1026-Y1038 WeakPolarHBondContact OG-CD2 3.47Å
1027	L	90.8	Very high	78.6	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.8	177.9	177.2	71.3	0	0	0	108.8	T889 A891 A971 L973 L979 F1024 P1035 V1037	T889-L1027 HydrophobicContact CG2-CB 4.04Å; A891-L1027 HydrophobicContact CB-CD2 4.19Å; A891-L1027 HydrophobicContact CB-CG 4.16Å; A971-L1027 HydrophobicContact CB-CD2 4.03Å; L973-L1027 HydrophobicContact CB-CD2 4.27Å; L979-L1027 HydrophobicContact CD1-CD1 4.1Å; L979-L1027 HydrophobicContact CD1-CD2 3.78Å; L979-L1027 HydrophobicContact CD2-CD1 4.34Å; F1024-L1027 HydrophobicContact CE2-CB 4.14Å; F1024-L1027 HydrophobicContact CZ-CB 3.92Å; L1027-P1035 HydrophobicContact CD1-CB 3.99Å; L1027-V1037 HydrophobicContact CD1-CG2 3.81Å
1028	T	89.8	Confident	79.7	Confident	13 Å²	13	41 Å²	41	8%	0.08	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	174.9	170.7	-168.4	0	0	0	0	110.3	L927 P1035 V1036 Y1038	L927-T1028 VanDerWaalsContact CD1-OG1 3.24Å; L927-T1028 WeakPolarHBondContact CD1-OG1 3.47Å; T1028-P1035 CarbonylContact O-C 3.33Å; T1028-P1035 VanDerWaalsContact O-CA 3.23Å; T1028-P1035 WeakPolarHBondContact O-CA 3.19Å; T1028-V1036 HydrophobicContact CG2-CB 3.76Å; T1028-V1036 PolarHBondContact N-O 3.08Å; T1028-V1036 PolarHBondContact O-N 2.93Å; T1028-Y1038 HydrophobicContact CG2-CE2 3.58Å
1029	F	88.8	Confident	81.4	Confident	3 Å²	3	38.9 Å²	38.9	1%	0.013	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	145.9	152.3	-70.6	-73.5	0	0	0	110.6	A891 T893 R969 A971 I981 G1033 F1034 P1035	A891-F1029 HydrophobicContact CB-CD2 4.1Å; A891-F1029 HydrophobicContact CB-CE2 4.03Å; T893-F1029 HydrophobicContact CG2-CB 3.76Å; T893-F1029 HydrophobicContact CG2-CD1 4.07Å; T893-F1029 HydrophobicContact CG2-CD2 3.43Å; T893-F1029 VanDerWaalsContact CG2-CD2 3.43Å; T893-F1029 HydrophobicContact CG2-CE2 3.95Å; T893-F1029 HydrophobicContact CG2-CG 3.48Å; T893-F1029 VanDerWaalsContact CG2-CG 3.48Å; T893-F1029 HydrophobicContact CG2-CZ 4.46Å; R969-F1029 HydrophobicContact CB-CE1 4.13Å; R969-F1029 HydrophobicContact CB-CE2 4.26Å; R969-F1029 HydrophobicContact CB-CZ 3.81Å; R969-F1029 VanDerWaalsContact O-CE2 3.27Å; R969-F1029 WeakPolarHBondContact O-CE2 3.04Å; A971-F1029 HydrophobicContact CB-CE1 4.15Å; A971-F1029 HydrophobicContact CB-CE2 4.1Å; A971-F1029 HydrophobicContact CB-CZ 3.51Å; I981-F1029 HydrophobicContact CG2-CE1 4.4Å; I981-F1029 HydrophobicContact CG2-CZ 4.4Å; F1029-G1033 WeakPolarHBondContact CD1-O 3.4Å; F1029-G1033 WeakPolarHBondContact CE1-O 3.49Å; F1029-F1034 WeakPolarHBondContact CA-O 3.31Å; F1029-P1035 HydrophobicContact CD1-CB 4.25Å; F1029-P1035 HydrophobicContact CE1-CB 4.21Å
1030	G	84.6	Confident	83	Confident	7 Å²	7	40.1 Å²	40.1	7%	0.072	21%	0.211	C	C	.	.			trans	-107.6	-156.1	169.4	0	0	0	0	0	111.6	G1033 F1034 C1084	G1030-G1033 PolarHBondContact O-N 3.21Å; G1030-F1034 PolarHBondContact N-O 2.96Å; G1030-C1084 WeakPolarHBondContact CA-SG 3.39Å
1031	P	77.6	Confident	84.2	Confident	19 Å²	19	37.6 Å²	37.6	12%	0.123	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-56.9	151.2	177.6	24.1	-33.5	0	0	0	112.2	G1033 F1034 P1080 C1084 F1131	P1031-G1033 PolarHBondContact O-N 3.29Å; P1031-F1034 WeakPolarHBondContact O-CD2 3.41Å; P1031-F1034 PolarHBondContact O-N 3.25Å; P1031-P1080 HydrophobicContact CB-CB 3.88Å; P1031-P1080 HydrophobicContact CG-CB 3.98Å; P1031-C1084 VanDerWaalsContact CD-SG 3.56Å; P1031-F1131 HydrophobicContact CG-CB 3.81Å; P1031-F1131 HydrophobicContact CG-CD1 4.5Å; P1031-F1131 WeakPolarHBondContact CG-O 3.2Å
1032	N	78.8	Confident	85.3	Confident	120 Å²	120	32.1 Å²	32.1	64%	0.642	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	52.6	17.7	-176.9	-57.6	-3	0	0	0	114.6	R969 F1034	R969-N1032 PolarHBondContact NH1-O 2.71Å; N1032-F1034 VanDerWaalsContact C-N 3.34Å; N1032-F1034 HydrophobicContact CB-CD2 4.07Å; N1032-F1034 HydrophobicContact CB-CE2 3.7Å; N1032-F1034 HydrophobicContact CB-CZ 4.09Å; N1032-F1034 PolarHBondContact O-N 3.13Å
1033	G	83.5	Confident	86.1	Confident	8 Å²	8	31.1 Å²	31.1	8%	0.082	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	68.9	26.3	-178.7	0	0	0	0	0	114.3	R969 F1029 G1030 P1031	R969-G1033 WeakPolarHBondContact CD-O 3.37Å; R969-G1033 PolarHBondContact NH1-O 2.78Å; F1029-G1033 WeakPolarHBondContact CD1-O 3.4Å; F1029-G1033 WeakPolarHBondContact CE1-O 3.49Å; G1030-G1033 PolarHBondContact O-N 3.21Å; P1031-G1033 PolarHBondContact O-N 3.29Å
1034	F	89.7	Confident	86.5	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.018	14%	0.141	C	C	.	.			trans	-79.1	136.4	169.2	-58.6	-48.4	0	0	0	110	F1029 G1030 P1031 N1032 L1046 H1048 I1049 F1131	F1029-F1034 WeakPolarHBondContact CA-O 3.31Å; G1030-F1034 PolarHBondContact N-O 2.96Å; P1031-F1034 WeakPolarHBondContact O-CD2 3.41Å; P1031-F1034 PolarHBondContact O-N 3.25Å; N1032-F1034 VanDerWaalsContact C-N 3.34Å; N1032-F1034 HydrophobicContact CB-CD2 4.07Å; N1032-F1034 HydrophobicContact CB-CE2 3.7Å; N1032-F1034 HydrophobicContact CB-CZ 4.09Å; N1032-F1034 PolarHBondContact O-N 3.13Å; F1034-L1046 HydrophobicContact CB-CD1 4.12Å; F1034-L1046 HydrophobicContact CB-CD2 3.92Å; F1034-L1046 HydrophobicContact CB-CG 3.97Å; F1034-L1046 HydrophobicContact CD2-CD2 4.27Å; F1034-L1046 HydrophobicContact CG-CD2 4.3Å; F1034-H1048 AromaticContact CD2-CD2 3.86Å; F1034-H1048 AromaticContact CE1-CD2 3.95Å; F1034-H1048 AromaticContact CE2-CD2 3.39Å; F1034-H1048 WeakPolarHBondContact CE2-CD2 3.4Å; F1034-H1048 AromaticContact CE2-NE2 3.44Å; F1034-H1048 WeakPolarHBondContact CE2-NE2 3.49Å; F1034-H1048 AromaticContact CZ-CD2 3.45Å; F1034-H1048 VanDerWaalsContact CZ-CD2 3.45Å; F1034-H1048 WeakPolarHBondContact CZ-CD2 3.46Å; F1034-H1048 AromaticContact CZ-NE2 3.25Å; F1034-H1048 WeakPolarHBondContact CZ-NE2 3.47Å; F1034-I1049 HydrophobicContact CD1-CB 4.05Å; F1034-I1049 HydrophobicContact CD1-CD1 3.99Å; F1034-I1049 HydrophobicContact CD1-CG1 3.87Å; F1034-I1049 HydrophobicContact CE1-CB 4.17Å; F1034-I1049 HydrophobicContact CE1-CG1 4.49Å; F1034-F1131 HydrophobicContact CD2-CD1 4.31Å; F1034-F1131 AromaticContact CD2-CE1 3.98Å; F1034-F1131 HydrophobicContact CD2-CE1 3.98Å; F1034-F1131 HydrophobicContact CE2-CD1 4.39Å; F1034-F1131 AromaticContact CE2-CE1 3.9Å; F1034-F1131 HydrophobicContact CE2-CE1 3.9Å
1035	P	91.7	Very high	86.8	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	145.6	179.7	33.8	-38.1	0	0	0	110.6	L979 I981 L1027 T1028 F1029 L1046 F1047	L979-P1035 HydrophobicContact CD2-CG 4.35Å; I981-P1035 HydrophobicContact CD1-CG 3.61Å; L1027-P1035 HydrophobicContact CD1-CB 3.99Å; T1028-P1035 CarbonylContact O-C 3.33Å; T1028-P1035 VanDerWaalsContact O-CA 3.23Å; T1028-P1035 WeakPolarHBondContact O-CA 3.19Å; F1029-P1035 HydrophobicContact CD1-CB 4.25Å; F1029-P1035 HydrophobicContact CE1-CB 4.21Å; P1035-L1046 WeakPolarHBondContact O-CA 3.47Å; P1035-F1047 HydrophobicContact CG-CB 3.94Å; P1035-F1047 PolarHBondContact O-N 2.92Å
1036	V	92.1	Very high	87.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.5	174.3	-178.8	0	0	0	0	108.5	T1028 Y1038 Y1045 L1046 L1057 C1084	T1028-V1036 HydrophobicContact CG2-CB 3.76Å; T1028-V1036 PolarHBondContact N-O 3.08Å; T1028-V1036 PolarHBondContact O-N 2.93Å; V1036-Y1038 HydrophobicContact CG1-CE1 4.35Å; V1036-Y1038 HydrophobicContact CG1-CE2 4.16Å; V1036-Y1045 CarbonylContact C-O 3.54Å; V1036-Y1045 WeakPolarHBondContact CA-O 3.47Å; V1036-L1046 HydrophobicContact CG2-CB 4.01Å; V1036-L1046 HydrophobicContact CG2-CD1 3.91Å; V1036-L1046 HydrophobicContact CG2-CG 4.05Å; V1036-L1057 HydrophobicContact CG1-CD1 3.78Å; V1036-L1057 HydrophobicContact CG2-CD1 4.15Å; V1036-C1084 HydrophobicContact CG2-CB 4.31Å
1037	V	91.5	Very high	87.3	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.3	175.5	169.9	0	0	0	0	108.9	I1012 F1024 L1027 L1039 S1044 Y1045 W1054	I1012-V1037 HydrophobicContact CG2-CG2 4.28Å; F1024-V1037 HydrophobicContact CD2-CG1 3.83Å; F1024-V1037 HydrophobicContact CE2-CG1 4.06Å; L1027-V1037 HydrophobicContact CD1-CG2 3.81Å; V1037-L1039 HydrophobicContact CG1-CD2 4.03Å; V1037-S1044 WeakPolarHBondContact O-CA 3.46Å; V1037-Y1045 PolarHBondContact N-O 3.4Å; V1037-Y1045 PolarHBondContact O-N 2.69Å; V1037-W1054 HydrophobicContact CB-CH2 4.42Å; V1037-W1054 HydrophobicContact CB-CZ3 4.16Å; V1037-W1054 HydrophobicContact CG2-CH2 3.7Å; V1037-W1054 HydrophobicContact CG2-CZ3 3.86Å
1038	Y	89.9	Confident	87.3	Confident	17 Å²	17	22.9 Å²	22.9	7%	0.067	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	143.5	170.6	-56.4	-89.5	0	0	0	110.3	S1025 S1026 T1028 V1036 C1084 Q1086	S1025-Y1038 WeakPolarHBondContact CA-O 3.48Å; S1025-Y1038 WeakPolarHBondContact CB-O 3.42Å; S1025-Y1038 PolarHBondContact N-O 3.47Å; S1026-Y1038 PolarHBondContact N-O 3.49Å; S1026-Y1038 PolarHBondContact O-N 3.27Å; S1026-Y1038 VanDerWaalsContact OG-CD2 3.26Å; S1026-Y1038 WeakPolarHBondContact OG-CD2 3.47Å; T1028-Y1038 HydrophobicContact CG2-CE2 3.58Å; V1036-Y1038 HydrophobicContact CG1-CE1 4.35Å; V1036-Y1038 HydrophobicContact CG1-CE2 4.16Å; Y1038-C1084 WeakPolarHBondContact CE1-O 3.49Å; Y1038-C1084 WeakPolarHBondContact OH-CA 2.97Å; Y1038-C1084 PolarHBondContact OH-O 2.9Å; Y1038-Q1086 HydrophobicContact CE1-CG 3.88Å; Y1038-Q1086 PolarHBondContact OH-NE2 3.2Å
1039	L	88	Confident	87.2	Confident	7 Å²	7	22.8 Å²	22.8	4%	0.037	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	164.2	176.7	-58	-168.6	0	0	0	111.6	V1015 L1016 R1023 V1037 D1041 N1042 S1043 Y1045	V1015-L1039 HydrophobicContact CG1-CD1 4.24Å; L1016-L1039 HydrophobicContact CD2-CD1 4.25Å; L1016-L1039 HydrophobicContact CD2-CD2 3.51Å; L1016-L1039 HydrophobicContact CG-CD2 4.45Å; R1023-L1039 CarbonylContact O-C 3.48Å; R1023-L1039 VanDerWaalsContact O-CA 3.3Å; R1023-L1039 WeakPolarHBondContact O-CA 3.19Å; V1037-L1039 HydrophobicContact CG1-CD2 4.03Å; L1039-D1041 VanDerWaalsContact C-N 3.3Å; L1039-D1041 WeakPolarHBondContact CB-OD1 3.03Å; L1039-D1041 PolarHBondContact O-N 2.88Å; L1039-N1042 WeakPolarHBondContact O-CA 3.28Å; L1039-N1042 PolarHBondContact O-N 3.27Å; L1039-S1043 PolarHBondContact N-O 3.24Å; L1039-Y1045 HydrophobicContact CD1-CD2 4.35Å; L1039-Y1045 HydrophobicContact CD1-CE2 3.79Å; L1039-Y1045 HydrophobicContact CG-CD2 4.43Å; L1039-Y1045 HydrophobicContact CG-CE2 4.27Å
1040	Q	83.1	Confident	86.9	Confident	102 Å²	102	29.8 Å²	29.8	48%	0.477	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-17.9	-174.2	-74.4	-168.7	-20.5	0	0	114.8	R1023	R1023-Q1040 HydrophobicContact CB-CG 4.15Å; R1023-Q1040 PolarHBondContact O-N 2.86Å
1041	D	78.9	Confident	87	Confident	46 Å²	46	32.7 Å²	32.7	25%	0.246	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-6.7	166.2	48	21.7	0	0	0	113.3	S1022 L1039 S1043 A1060	S1022-D1041 WeakPolarHBondContact CB-OD2 3.48Å; S1022-D1041 PolarHBondContact OG-OD1 2.77Å; S1022-D1041 PolarHBondContact OG-OD2 2.96Å; L1039-D1041 VanDerWaalsContact C-N 3.3Å; L1039-D1041 WeakPolarHBondContact CB-OD1 3.03Å; L1039-D1041 PolarHBondContact O-N 2.88Å; D1041-S1043 VanDerWaalsContact OD1-CB 3.3Å; D1041-S1043 WeakPolarHBondContact OD1-CB 3.49Å; D1041-S1043 PolarHBondContact OD1-N 3.48Å; D1041-S1043 PolarHBondContact OD1-OG 3.29Å; D1041-A1060 VanDerWaalsContact O-CB 3.31Å; D1041-A1060 WeakPolarHBondContact O-CB 3.35Å
1042	N	81.5	Confident	87.5	Confident	59 Å²	59	39.5 Å²	39.5	32%	0.316	19%	0.193	S	C	.	.	S	Bend	trans	77.6	12.3	-170.9	-43.5	-96.1	0	0	0	115.2	L1039 M1090	L1039-N1042 WeakPolarHBondContact O-CA 3.28Å; L1039-N1042 PolarHBondContact O-N 3.27Å; N1042-M1090 HydrophobicContact CB-CE 3.82Å; N1042-M1090 HydrophobicContact CB-CG 4.25Å; N1042-M1090 HydrophobicContact CB-SD 4.25Å; N1042-M1090 WeakPolarHBondContact O-CE 3.45Å
1043	S	87.3	Confident	88	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.			trans	-67.3	146.4	168.8	-59.6	0	0	0	0	111	L1039 D1041 F1058 D1059 A1060	L1039-S1043 PolarHBondContact N-O 3.24Å; D1041-S1043 VanDerWaalsContact OD1-CB 3.3Å; D1041-S1043 WeakPolarHBondContact OD1-CB 3.49Å; D1041-S1043 PolarHBondContact OD1-N 3.48Å; D1041-S1043 PolarHBondContact OD1-OG 3.29Å; S1043-F1058 CarbonylContact C-O 3.6Å; S1043-F1058 WeakPolarHBondContact CA-O 3.35Å; S1043-D1059 PolarHBondContact OG-OD1 3.11Å; S1043-A1060 PolarHBondContact OG-N 3Å
1044	S	89.9	Confident	88.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	131.9	-169.3	56.8	0	0	0	0	112.4	V1037 L1057 F1058	V1037-S1044 WeakPolarHBondContact O-CA 3.46Å; S1044-L1057 PolarHBondContact O-N 3.44Å; S1044-F1058 PolarHBondContact N-O 2.86Å; S1044-F1058 PolarHBondContact O-N 3.26Å; S1044-F1058 PolarHBondContact OG-N 2.65Å; S1044-F1058 PolarHBondContact OG-O 3.02Å
1045	Y	91.7	Very high	88.4	Confident	40 Å²	40	41.5 Å²	41.5	16%	0.157	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	129.6	-172.7	-60	-93	0	0	0	111.6	V1015 V1036 V1037 L1039 I1055 E1056	V1015-Y1045 HydrophobicContact CG1-CD1 4.01Å; V1015-Y1045 HydrophobicContact CG1-CD2 3.31Å; V1015-Y1045 HydrophobicContact CG1-CE1 4.24Å; V1015-Y1045 HydrophobicContact CG1-CE2 3.57Å; V1015-Y1045 HydrophobicContact CG1-CG 3.56Å; V1036-Y1045 CarbonylContact C-O 3.54Å; V1036-Y1045 WeakPolarHBondContact CA-O 3.47Å; V1037-Y1045 PolarHBondContact N-O 3.4Å; V1037-Y1045 PolarHBondContact O-N 2.69Å; L1039-Y1045 HydrophobicContact CD1-CD2 4.35Å; L1039-Y1045 HydrophobicContact CD1-CE2 3.79Å; L1039-Y1045 HydrophobicContact CG-CD2 4.43Å; L1039-Y1045 HydrophobicContact CG-CE2 4.27Å; Y1045-I1055 CarbonylContact C-O 3.57Å; Y1045-I1055 VanDerWaalsContact CA-O 3.3Å; Y1045-I1055 WeakPolarHBondContact CA-O 3.15Å; Y1045-E1056 HydrophobicContact CD1-CB 4.2Å; Y1045-E1056 HydrophobicContact CE1-CB 4.01Å; Y1045-E1056 HydrophobicContact CE1-CG 4.04Å
1046	L	92.5	Very high	88.4	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	135.2	176.4	-178.8	148.6	0	0	0	109.8	F1034 P1035 V1036 H1048 W1054 I1055 L1057 F1131	F1034-L1046 HydrophobicContact CB-CD1 4.12Å; F1034-L1046 HydrophobicContact CB-CD2 3.92Å; F1034-L1046 HydrophobicContact CB-CG 3.97Å; F1034-L1046 HydrophobicContact CD2-CD2 4.27Å; F1034-L1046 HydrophobicContact CG-CD2 4.3Å; P1035-L1046 WeakPolarHBondContact O-CA 3.47Å; V1036-L1046 HydrophobicContact CG2-CB 4.01Å; V1036-L1046 HydrophobicContact CG2-CD1 3.91Å; V1036-L1046 HydrophobicContact CG2-CG 4.05Å; L1046-H1048 HydrophobicContact CD2-CB 4.25Å; L1046-W1054 CarbonylContact O-C 3.5Å; L1046-I1055 HydrophobicContact CD2-CD1 4.44Å; L1046-I1055 PolarHBondContact N-O 2.83Å; L1046-I1055 PolarHBondContact O-N 2.89Å; L1046-L1057 HydrophobicContact CB-CD1 4.04Å; L1046-L1057 HydrophobicContact CB-CD2 3.76Å; L1046-L1057 HydrophobicContact CB-CG 3.86Å; L1046-L1057 HydrophobicContact CD1-CD2 4.33Å; L1046-F1131 HydrophobicContact CD1-CD1 4.39Å; L1046-F1131 HydrophobicContact CD1-CD2 4.47Å; L1046-F1131 HydrophobicContact CD1-CG 4.34Å; L1046-F1131 HydrophobicContact CD2-CE1 4.19Å; L1046-F1131 HydrophobicContact CD2-CE2 4.24Å; L1046-F1131 HydrophobicContact CD2-CZ 3.91Å
1047	F	92.1	Very high	88.2	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	109.3	172.2	-170.6	-114.5	0	0	0	110.2	I1008 T1010 P1035 I1049 R1052 I1053 W1054	I1008-F1047 HydrophobicContact CD1-CE1 3.62Å; I1008-F1047 HydrophobicContact CD1-CZ 3.88Å; I1008-F1047 HydrophobicContact CG1-CE1 3.97Å; I1008-F1047 HydrophobicContact CG1-CZ 4.42Å; I1008-F1047 HydrophobicContact CG2-CE1 4.01Å; T1010-F1047 HydrophobicContact CG2-CD1 4.03Å; T1010-F1047 HydrophobicContact CG2-CD2 4.38Å; T1010-F1047 HydrophobicContact CG2-CE1 3.8Å; T1010-F1047 HydrophobicContact CG2-CE2 4.19Å; T1010-F1047 HydrophobicContact CG2-CG 4.31Å; T1010-F1047 HydrophobicContact CG2-CZ 3.9Å; T1010-F1047 WeakPolarHBondContact OG1-CE2 3.45Å; P1035-F1047 HydrophobicContact CG-CB 3.94Å; P1035-F1047 PolarHBondContact O-N 2.92Å; F1047-I1049 HydrophobicContact CD1-CG1 4.32Å; F1047-I1049 PolarHBondContact O-N 3.19Å; F1047-I1049 VanDerWaalsContact O-N 3.11Å; F1047-R1052 WeakPolarHBondContact CE2-O 3.47Å; F1047-R1052 HydrophobicContact CZ-CB 4.34Å; F1047-I1053 CarbonylContact C-O 3.49Å; F1047-I1053 WeakPolarHBondContact CA-O 3.41Å; F1047-I1053 WeakPolarHBondContact CD2-O 3.5Å; F1047-W1054 HydrophobicContact CB-CD2 4.15Å; F1047-W1054 HydrophobicContact CB-CE3 3.77Å; F1047-W1054 HydrophobicContact CB-CH2 4.04Å; F1047-W1054 HydrophobicContact CB-CZ2 4.39Å; F1047-W1054 HydrophobicContact CB-CZ3 3.73Å; F1047-W1054 AromaticContact CD2-CD2 3.68Å; F1047-W1054 HydrophobicContact CD2-CD2 3.68Å; F1047-W1054 AromaticContact CD2-CE2 3.7Å; F1047-W1054 HydrophobicContact CD2-CE3 4.2Å; F1047-W1054 AromaticContact CD2-CG 3.89Å; F1047-W1054 HydrophobicContact CD2-CG 3.89Å; F1047-W1054 HydrophobicContact CD2-CZ2 4.22Å; F1047-W1054 AromaticContact CD2-NE1 3.89Å; F1047-W1054 HydrophobicContact CG-CD2 4.33Å; F1047-W1054 HydrophobicContact CG-CE3 4.44Å; F1047-W1054 HydrophobicContact CG-CZ2 4.46Å
1048	H	89.5	Confident	88	Confident	29 Å²	29	44.7 Å²	44.7	13%	0.134	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	99.5	179.2	-164.4	-112.3	0	0	0	109.4	F1034 L1046 E1050 S1051 R1052 I1053 I1055 F1131	F1034-H1048 AromaticContact CD2-CD2 3.86Å; F1034-H1048 AromaticContact CE1-CD2 3.95Å; F1034-H1048 AromaticContact CE2-CD2 3.39Å; F1034-H1048 WeakPolarHBondContact CE2-CD2 3.4Å; F1034-H1048 AromaticContact CE2-NE2 3.44Å; F1034-H1048 WeakPolarHBondContact CE2-NE2 3.49Å; F1034-H1048 AromaticContact CZ-CD2 3.45Å; F1034-H1048 VanDerWaalsContact CZ-CD2 3.45Å; F1034-H1048 WeakPolarHBondContact CZ-CD2 3.46Å; F1034-H1048 AromaticContact CZ-NE2 3.25Å; F1034-H1048 WeakPolarHBondContact CZ-NE2 3.47Å; L1046-H1048 HydrophobicContact CD2-CB 4.25Å; H1048-E1050 VanDerWaalsContact C-N 3.3Å; H1048-E1050 IonicContact CE1-OE2 3.36Å; H1048-E1050 PolarHBondContact O-N 3.09Å; H1048-S1051 PolarHBondContact ND1-OG 2.81Å; H1048-S1051 CarbonylContact O-C 3.49Å; H1048-S1051 PolarHBondContact O-N 2.69Å; H1048-R1052 WeakPolarHBondContact O-CA 3.17Å; H1048-R1052 PolarHBondContact O-N 2.9Å; H1048-I1053 HydrophobicContact CB-CG1 4.14Å; H1048-I1053 PolarHBondContact N-O 3.17Å; H1048-I1053 PolarHBondContact O-N 2.98Å; H1048-I1055 HydrophobicContact CB-CD1 3.82Å; H1048-I1055 HydrophobicContact CB-CG1 4.5Å; H1048-F1131 AromaticContact CD2-CE1 3.65Å; H1048-F1131 AromaticContact CD2-CZ 3.75Å
1049	I	87.5	Confident	87.8	Confident	12 Å²	12	44.9 Å²	44.9	6%	0.062	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-39.8	-167.3	-63.5	171.9	0	0	0	112.3	I981 L1007 I1008 F1034 F1047 R1052	I981-I1049 HydrophobicContact CD1-CD1 3.63Å; I981-I1049 HydrophobicContact CD1-CG1 3.88Å; I981-I1049 HydrophobicContact CG2-CD1 4.49Å; L1007-I1049 HydrophobicContact CD2-CD1 3.97Å; L1007-I1049 HydrophobicContact CD2-CG2 3.78Å; L1007-I1049 HydrophobicContact CG-CG2 3.8Å; I1008-I1049 HydrophobicContact CB-CG2 4.37Å; I1008-I1049 HydrophobicContact CG2-CG1 4.33Å; I1008-I1049 HydrophobicContact CG2-CG2 3.9Å; F1034-I1049 HydrophobicContact CD1-CB 4.05Å; F1034-I1049 HydrophobicContact CD1-CD1 3.99Å; F1034-I1049 HydrophobicContact CD1-CG1 3.87Å; F1034-I1049 HydrophobicContact CE1-CB 4.17Å; F1034-I1049 HydrophobicContact CE1-CG1 4.49Å; F1047-I1049 HydrophobicContact CD1-CG1 4.32Å; F1047-I1049 PolarHBondContact O-N 3.19Å; F1047-I1049 VanDerWaalsContact O-N 3.11Å; I1049-R1052 WeakPolarHBondContact O-CG 3.23Å; I1049-R1052 PolarHBondContact O-N 3.31Å
1050	E	84.3	Confident	87.5	Confident	150 Å²	150	45.4 Å²	45.4	70%	0.701	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-42	-178	-64.1	171.3	-172	0	0	111.8	H1048	H1048-E1050 VanDerWaalsContact C-N 3.3Å; H1048-E1050 IonicContact CE1-OE2 3.36Å; H1048-E1050 PolarHBondContact O-N 3.09Å
1051	S	85	Confident	87.2	Confident	68 Å²	68	42.3 Å²	42.3	48%	0.476	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-10.4	179.3	-49	0	0	0	0	113.6	H1048 I1053	H1048-S1051 PolarHBondContact ND1-OG 2.81Å; H1048-S1051 CarbonylContact O-C 3.49Å; H1048-S1051 PolarHBondContact O-N 2.69Å; S1051-I1053 VanDerWaalsContact C-N 3.3Å; S1051-I1053 PolarHBondContact O-N 3.04Å
1052	R	88.8	Confident	87	Confident	162 Å²	162	42.3 Å²	42.3	61%	0.611	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	32.8	-177.8	-48.1	-167.4	171.5	-169.5	-3.3	114.9	I1008 F1047 H1048 I1049	I1008-R1052 HydrophobicContact CD1-CB 4.04Å; I1008-R1052 HydrophobicContact CD1-CG 3.52Å; F1047-R1052 WeakPolarHBondContact CE2-O 3.47Å; F1047-R1052 HydrophobicContact CZ-CB 4.34Å; H1048-R1052 WeakPolarHBondContact O-CA 3.17Å; H1048-R1052 PolarHBondContact O-N 2.9Å; I1049-R1052 WeakPolarHBondContact O-CG 3.23Å; I1049-R1052 PolarHBondContact O-N 3.31Å
1053	I	90.2	Very high	86.6	Confident	86 Å²	86	44 Å²	44	44%	0.441	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.7	-179	61.3	-180	0	0	0	112.4	F1047 H1048 S1051 I1055	F1047-I1053 CarbonylContact C-O 3.49Å; F1047-I1053 WeakPolarHBondContact CA-O 3.41Å; F1047-I1053 WeakPolarHBondContact CD2-O 3.5Å; H1048-I1053 HydrophobicContact CB-CG1 4.14Å; H1048-I1053 PolarHBondContact N-O 3.17Å; H1048-I1053 PolarHBondContact O-N 2.98Å; S1051-I1053 VanDerWaalsContact C-N 3.3Å; S1051-I1053 PolarHBondContact O-N 3.04Å; I1053-I1055 HydrophobicContact CD1-CD1 4.32Å; I1053-I1055 HydrophobicContact CD1-CG1 4.15Å; I1053-I1055 HydrophobicContact CG1-CD1 4.41Å; I1053-I1055 HydrophobicContact CG1-CG1 4.07Å
1054	W	90.4	Very high	86.1	Confident	50 Å²	50	45.5 Å²	45.5	19%	0.189	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	137	162	-68.9	105.3	0	0	0	110	L979 T1010 N1011 I1012 V1015 V1037 L1046 F1047	L979-W1054 HydrophobicContact CD2-CH2 3.73Å; L979-W1054 HydrophobicContact CD2-CZ2 4.18Å; T1010-W1054 HydrophobicContact CG2-CZ2 3.97Å; N1011-W1054 PolarHBondContact O-NE1 2.84Å; I1012-W1054 HydrophobicContact CG2-CH2 4.03Å; I1012-W1054 HydrophobicContact CG2-CZ2 3.96Å; V1015-W1054 HydrophobicContact CG2-CB 4.18Å; V1015-W1054 HydrophobicContact CG2-CD2 3.35Å; V1015-W1054 HydrophobicContact CG2-CE3 3.73Å; V1015-W1054 HydrophobicContact CG2-CG 3.56Å; V1015-W1054 HydrophobicContact CG2-CH2 4.5Å; V1015-W1054 HydrophobicContact CG2-CZ2 4.19Å; V1015-W1054 HydrophobicContact CG2-CZ3 4.28Å; V1037-W1054 HydrophobicContact CB-CH2 4.42Å; V1037-W1054 HydrophobicContact CB-CZ3 4.16Å; V1037-W1054 HydrophobicContact CG2-CH2 3.7Å; V1037-W1054 HydrophobicContact CG2-CZ3 3.86Å; L1046-W1054 CarbonylContact O-C 3.5Å; F1047-W1054 HydrophobicContact CB-CD2 4.15Å; F1047-W1054 HydrophobicContact CB-CE3 3.77Å; F1047-W1054 HydrophobicContact CB-CH2 4.04Å; F1047-W1054 HydrophobicContact CB-CZ2 4.39Å; F1047-W1054 HydrophobicContact CB-CZ3 3.73Å; F1047-W1054 AromaticContact CD2-CD2 3.68Å; F1047-W1054 HydrophobicContact CD2-CD2 3.68Å; F1047-W1054 AromaticContact CD2-CE2 3.7Å; F1047-W1054 HydrophobicContact CD2-CE3 4.2Å; F1047-W1054 AromaticContact CD2-CG 3.89Å; F1047-W1054 HydrophobicContact CD2-CG 3.89Å; F1047-W1054 HydrophobicContact CD2-CZ2 4.22Å; F1047-W1054 AromaticContact CD2-NE1 3.89Å; F1047-W1054 HydrophobicContact CG-CD2 4.33Å; F1047-W1054 HydrophobicContact CG-CE3 4.44Å; F1047-W1054 HydrophobicContact CG-CZ2 4.46Å
1055	I	90.6	Very high	85.6	Confident	38 Å²	38	47.9 Å²	47.9	20%	0.195	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.8	178.3	-59.2	179.7	0	0	0	107.5	Y1045 L1046 H1048 I1053 L1057 L1127 F1131	Y1045-I1055 CarbonylContact C-O 3.57Å; Y1045-I1055 VanDerWaalsContact CA-O 3.3Å; Y1045-I1055 WeakPolarHBondContact CA-O 3.15Å; L1046-I1055 HydrophobicContact CD2-CD1 4.44Å; L1046-I1055 PolarHBondContact N-O 2.83Å; L1046-I1055 PolarHBondContact O-N 2.89Å; H1048-I1055 HydrophobicContact CB-CD1 3.82Å; H1048-I1055 HydrophobicContact CB-CG1 4.5Å; I1053-I1055 HydrophobicContact CD1-CD1 4.32Å; I1053-I1055 HydrophobicContact CD1-CG1 4.15Å; I1053-I1055 HydrophobicContact CG1-CD1 4.41Å; I1053-I1055 HydrophobicContact CG1-CG1 4.07Å; I1055-L1057 PolarHBondContact O-N 2.94Å; I1055-L1127 HydrophobicContact CG2-CD2 3.71Å; I1055-F1131 HydrophobicContact CD1-CE2 3.78Å; I1055-F1131 HydrophobicContact CD1-CZ 3.73Å
1056	E	90.8	Very high	85	Confident	65 Å²	65	46.5 Å²	46.5	30%	0.304	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	115.6	167.8	-172.1	-156.9	138.4	0	0	108.6	Y1045 D1059 R1065	Y1045-E1056 HydrophobicContact CD1-CB 4.2Å; Y1045-E1056 HydrophobicContact CE1-CB 4.01Å; Y1045-E1056 HydrophobicContact CE1-CG 4.04Å; E1056-D1059 HydrophobicContact CG-CB 4.08Å; E1056-D1059 WeakPolarHBondContact OE1-CB 3.2Å; E1056-D1059 PolarHBondContact OE1-N 2.9Å; E1056-R1065 VanDerWaalsContact CD-NH1 3.34Å; E1056-R1065 IonicContact OE1-CZ 3.14Å; E1056-R1065 IonicContact OE1-NH1 2.96Å; E1056-R1065 PolarHBondContact OE1-NH1 2.83Å; E1056-R1065 IonicContact OE2-NH1 3.62Å; E1056-R1065 PolarHBondContact OE2-NH1 2.78Å
1057	L	89.4	Confident	84.3	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-38.7	168	-63.1	-173.6	0	0	0	110.4	V1036 S1044 L1046 I1055 L1081 C1084 Q1085 L1127	V1036-L1057 HydrophobicContact CG1-CD1 3.78Å; V1036-L1057 HydrophobicContact CG2-CD1 4.15Å; S1044-L1057 PolarHBondContact O-N 3.44Å; L1046-L1057 HydrophobicContact CB-CD1 4.04Å; L1046-L1057 HydrophobicContact CB-CD2 3.76Å; L1046-L1057 HydrophobicContact CB-CG 3.86Å; L1046-L1057 HydrophobicContact CD1-CD2 4.33Å; I1055-L1057 PolarHBondContact O-N 2.94Å; L1057-L1081 HydrophobicContact CD2-CD1 4.32Å; L1057-C1084 HydrophobicContact CD1-CB 3.59Å; L1057-Q1085 HydrophobicContact CB-CG 3.93Å; L1057-Q1085 PolarHBondContact O-NE2 3.33Å; L1057-L1127 HydrophobicContact CD2-CD2 3.87Å; L1057-L1127 WeakPolarHBondContact O-CD1 3.41Å
1058	F	87.6	Confident	83.9	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	123.4	172	170.5	-102.9	0	0	0	109.8	S1043 S1044 A1060 R1065 C1066 A1069 Q1085 L1087 M1090 F1120	S1043-F1058 CarbonylContact C-O 3.6Å; S1043-F1058 WeakPolarHBondContact CA-O 3.35Å; S1044-F1058 PolarHBondContact N-O 2.86Å; S1044-F1058 PolarHBondContact O-N 3.26Å; S1044-F1058 PolarHBondContact OG-N 2.65Å; S1044-F1058 PolarHBondContact OG-O 3.02Å; F1058-A1060 HydrophobicContact CD1-CB 4.33Å; F1058-A1060 HydrophobicContact CE1-CB 3.65Å; F1058-A1060 HydrophobicContact CZ-CB 4.37Å; F1058-R1065 HydrophobicContact CE2-CG 4.32Å; F1058-C1066 HydrophobicContact CZ-CB 3.96Å; F1058-A1069 HydrophobicContact CD2-CB 4.28Å; F1058-A1069 HydrophobicContact CE2-CB 3.58Å; F1058-A1069 HydrophobicContact CZ-CB 4.27Å; F1058-Q1085 HydrophobicContact CB-CG 4.4Å; F1058-L1087 HydrophobicContact CB-CD2 4.49Å; F1058-L1087 HydrophobicContact CD1-CD2 3.76Å; F1058-L1087 HydrophobicContact CD2-CD2 3.89Å; F1058-L1087 HydrophobicContact CE1-CD2 3.8Å; F1058-L1087 HydrophobicContact CE2-CD2 3.94Å; F1058-L1087 HydrophobicContact CG-CD2 3.78Å; F1058-L1087 HydrophobicContact CZ-CD2 3.89Å; F1058-M1090 HydrophobicContact CD1-CE 3.68Å; F1058-M1090 HydrophobicContact CD1-SD 4.26Å; F1058-M1090 HydrophobicContact CE1-CE 3.61Å; F1058-M1090 HydrophobicContact CE1-SD 3.56Å; F1058-M1090 VanDerWaalsContact CE1-SD 3.56Å; F1058-M1090 HydrophobicContact CZ-SD 4.29Å; F1058-F1120 HydrophobicContact CD2-CE2 4.05Å; F1058-F1120 HydrophobicContact CE2-CE2 4.37Å
1059	D	84	Confident	83.6	Confident	22 Å²	22	50.4 Å²	50.4	12%	0.118	25%	0.249	C	C	.	.			trans	-88.9	124.8	162.5	-178.5	28.1	0	0	0	111.6	S1043 E1056 S1061	S1043-D1059 PolarHBondContact OG-OD1 3.11Å; E1056-D1059 HydrophobicContact CG-CB 4.08Å; E1056-D1059 WeakPolarHBondContact OE1-CB 3.2Å; E1056-D1059 PolarHBondContact OE1-N 2.9Å; D1059-S1061 WeakPolarHBondContact OD1-CB 3.31Å; D1059-S1061 PolarHBondContact OD1-N 3.49Å; D1059-S1061 PolarHBondContact OD1-OG 2.92Å; D1059-S1061 WeakPolarHBondContact OD2-CB 3.4Å; D1059-S1061 PolarHBondContact OD2-OG 3.36Å
1060	A	83.1	Confident	83.3	Confident	17 Å²	17	51.8 Å²	51.8	14%	0.14	26%	0.255	C	S	.	.	S	Bend	trans	-84.4	-10.5	176.4	0	0	0	0	0	113.6	D1041 S1043 F1058	D1041-A1060 VanDerWaalsContact O-CB 3.31Å; D1041-A1060 WeakPolarHBondContact O-CB 3.35Å; S1043-A1060 PolarHBondContact OG-N 3Å; F1058-A1060 HydrophobicContact CD1-CB 4.33Å; F1058-A1060 HydrophobicContact CE1-CB 3.65Å; F1058-A1060 HydrophobicContact CZ-CB 4.37Å
1061	S	75.9	Confident	83.1	Confident	37 Å²	37	48.7 Å²	48.7	26%	0.259	24%	0.244	S	C	.	.	S	Bend	trans	-67.8	-38.2	-175.6	89.2	0	0	0	0	113.2	H1020 D1059 I1063	H1020-S1061 PolarHBondContact CE1-OG 2.83Å; H1020-S1061 PolarHBondContact NE2-OG 3.38Å; D1059-S1061 WeakPolarHBondContact OD1-CB 3.31Å; D1059-S1061 PolarHBondContact OD1-N 3.49Å; D1059-S1061 PolarHBondContact OD1-OG 2.92Å; D1059-S1061 WeakPolarHBondContact OD2-CB 3.4Å; D1059-S1061 PolarHBondContact OD2-OG 3.36Å; S1061-I1063 PolarHBondContact O-N 2.86Å; S1061-I1063 VanDerWaalsContact O-N 3.08Å
1062	D	75.4	Confident	83	Confident	47 Å²	47	45.5 Å²	45.5	25%	0.251	22%	0.221	S	C	.	.			trans	-73	100.1	172.1	176.7	-3.9	0	0	0	109.4	V1064 R1065 C1066 S1116	D1062-V1064 PolarHBondContact O-N 2.75Å; D1062-V1064 WeakPolarHBondContact OD1-CA 3.46Å; D1062-V1064 VanDerWaalsContact OD1-CB 3.31Å; D1062-V1064 WeakPolarHBondContact OD1-CB 3.49Å; D1062-V1064 PolarHBondContact OD1-N 2.75Å; D1062-R1065 HydrophobicContact CB-CB 3.79Å; D1062-R1065 VanDerWaalsContact CG-CB 3.44Å; D1062-R1065 PolarHBondContact O-N 2.85Å; D1062-R1065 PolarHBondContact OD1-N 3.02Å; D1062-R1065 VanDerWaalsContact OD2-CB 3.27Å; D1062-R1065 WeakPolarHBondContact OD2-CB 3.48Å; D1062-C1066 VanDerWaalsContact O-CB 3.24Å; D1062-C1066 WeakPolarHBondContact O-CB 3.3Å; D1062-C1066 PolarHBondContact O-N 2.87Å; D1062-S1116 PolarHBondContact OD2-OG 2.98Å
1063	I	73.9	Confident	82.7	Confident	93 Å²	93	38.2 Å²	38.2	48%	0.477	20%	0.196	S	C	.	.	H	α-helix	trans	-56.8	-32.6	178.8	-60.1	173.3	0	0	0	111.8	S1061 Q1067	S1061-I1063 PolarHBondContact O-N 2.86Å; S1061-I1063 VanDerWaalsContact O-N 3.08Å; I1063-Q1067 WeakPolarHBondContact O-CB 3.5Å; I1063-Q1067 VanDerWaalsContact O-CG 3.29Å; I1063-Q1067 WeakPolarHBondContact O-CG 3.19Å; I1063-Q1067 PolarHBondContact O-N 2.84Å
1064	V	75	Confident	82.2	Confident	32 Å²	32	42.5 Å²	42.5	19%	0.194	21%	0.206	C	C	.	.	H	α-helix	trans	-73.4	-50.1	179.4	-175.8	0	0	0	0	110.1	D1062 C1066 Q1067 F1068 I1108 R1113	D1062-V1064 PolarHBondContact O-N 2.75Å; D1062-V1064 WeakPolarHBondContact OD1-CA 3.46Å; D1062-V1064 VanDerWaalsContact OD1-CB 3.31Å; D1062-V1064 WeakPolarHBondContact OD1-CB 3.49Å; D1062-V1064 PolarHBondContact OD1-N 2.75Å; V1064-C1066 VanDerWaalsContact C-N 3.27Å; V1064-C1066 PolarHBondContact O-N 2.84Å; V1064-Q1067 PolarHBondContact O-N 2.91Å; V1064-F1068 WeakPolarHBondContact O-CB 3.3Å; V1064-F1068 PolarHBondContact O-N 2.87Å; V1064-I1108 HydrophobicContact CG2-CD1 3.56Å; V1064-R1113 HydrophobicContact CG1-CG 4.42Å
1065	R	79.8	Confident	81.7	Confident	50 Å²	50	43.1 Å²	43.1	19%	0.189	23%	0.228	C	C	.	.	H	α-helix	trans	-56.1	-43	172.8	179.7	-177.6	-66	-169.2	3.6	110.9	E1056 F1058 D1062 F1068 A1069 F1120	E1056-R1065 VanDerWaalsContact CD-NH1 3.34Å; E1056-R1065 IonicContact OE1-CZ 3.14Å; E1056-R1065 IonicContact OE1-NH1 2.96Å; E1056-R1065 PolarHBondContact OE1-NH1 2.83Å; E1056-R1065 IonicContact OE2-NH1 3.62Å; E1056-R1065 PolarHBondContact OE2-NH1 2.78Å; F1058-R1065 HydrophobicContact CE2-CG 4.32Å; D1062-R1065 HydrophobicContact CB-CB 3.79Å; D1062-R1065 VanDerWaalsContact CG-CB 3.44Å; D1062-R1065 PolarHBondContact O-N 2.85Å; D1062-R1065 PolarHBondContact OD1-N 3.02Å; D1062-R1065 VanDerWaalsContact OD2-CB 3.27Å; D1062-R1065 WeakPolarHBondContact OD2-CB 3.48Å; R1065-F1068 PolarHBondContact O-N 2.89Å; R1065-A1069 WeakPolarHBondContact O-CB 3.11Å; R1065-A1069 PolarHBondContact O-N 3.4Å; R1065-F1120 HydrophobicContact CG-CB 4.39Å; R1065-F1120 HydrophobicContact CG-CD2 3.69Å; R1065-F1120 HydrophobicContact CG-CE2 4.4Å; R1065-F1120 HydrophobicContact CG-CG 4.29Å
1066	C	80.4	Confident	81.4	Confident	11 Å²	11	42.4 Å²	42.4	7%	0.074	23%	0.226	C	C	.	.	H	α-helix	trans	-64	-47.4	179.4	-177.5	0	0	0	0	112.7	F1058 D1062 V1064 F1068 A1069 M1070	F1058-C1066 HydrophobicContact CZ-CB 3.96Å; D1062-C1066 VanDerWaalsContact O-CB 3.24Å; D1062-C1066 WeakPolarHBondContact O-CB 3.3Å; D1062-C1066 PolarHBondContact O-N 2.87Å; V1064-C1066 VanDerWaalsContact C-N 3.27Å; V1064-C1066 PolarHBondContact O-N 2.84Å; C1066-F1068 VanDerWaalsContact C-N 3.32Å; C1066-F1068 PolarHBondContact O-N 3.1Å; C1066-A1069 PolarHBondContact O-N 2.83Å; C1066-M1070 WeakPolarHBondContact O-CB 3.27Å; C1066-M1070 VanDerWaalsContact O-CG 3.3Å; C1066-M1070 WeakPolarHBondContact O-CG 3.35Å; C1066-M1070 PolarHBondContact O-N 2.8Å
1067	Q	77.2	Confident	81.2	Confident	81 Å²	81	41 Å²	41	38%	0.379	22%	0.222	S	C	.	.	H	α-helix	trans	-61.9	-38.4	174.6	-75.4	179.3	2.9	0	0	112.4	I1063 V1064 N1071	I1063-Q1067 WeakPolarHBondContact O-CB 3.5Å; I1063-Q1067 VanDerWaalsContact O-CG 3.29Å; I1063-Q1067 WeakPolarHBondContact O-CG 3.19Å; I1063-Q1067 PolarHBondContact O-N 2.84Å; V1064-Q1067 PolarHBondContact O-N 2.91Å; Q1067-N1071 PolarHBondContact O-N 2.92Å; Q1067-N1071 PolarHBondContact O-ND2 3.45Å
1068	F	84	Confident	80.9	Confident	35 Å²	35	47 Å²	47	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-71.2	-41.2	177.1	-173.1	-98.2	0	0	0	112.4	V1064 R1065 C1066 N1071 S1072 N1117 F1120 L1121	V1064-F1068 WeakPolarHBondContact O-CB 3.3Å; V1064-F1068 PolarHBondContact O-N 2.87Å; R1065-F1068 PolarHBondContact O-N 2.89Å; C1066-F1068 VanDerWaalsContact C-N 3.32Å; C1066-F1068 PolarHBondContact O-N 3.1Å; F1068-N1071 PolarHBondContact O-N 2.88Å; F1068-S1072 WeakPolarHBondContact CE1-OG 2.98Å; F1068-S1072 VanDerWaalsContact O-CB 3.25Å; F1068-S1072 WeakPolarHBondContact O-CB 3.45Å; F1068-S1072 PolarHBondContact O-N 3.42Å; F1068-S1072 PolarHBondContact O-OG 2.65Å; F1068-S1072 VanDerWaalsContact O-OG 3.09Å; F1068-N1117 HydrophobicContact CD1-CB 4.18Å; F1068-N1117 HydrophobicContact CD2-CB 4.15Å; F1068-N1117 VanDerWaalsContact CD2-CG 3.41Å; F1068-N1117 WeakPolarHBondContact CD2-ND2 3.32Å; F1068-N1117 WeakPolarHBondContact CD2-OD1 3.38Å; F1068-N1117 HydrophobicContact CE1-CB 4.01Å; F1068-N1117 HydrophobicContact CE2-CB 3.97Å; F1068-N1117 HydrophobicContact CG-CB 4.24Å; F1068-N1117 VanDerWaalsContact CG-OD1 3.28Å; F1068-N1117 WeakPolarHBondContact CG-OD1 3.5Å; F1068-N1117 HydrophobicContact CZ-CB 3.89Å; F1068-F1120 AromaticContact CD1-CD1 3.67Å; F1068-F1120 HydrophobicContact CD1-CD1 3.67Å; F1068-F1120 HydrophobicContact CD1-CE1 4.23Å; F1068-F1120 HydrophobicContact CD1-CG 4.4Å; F1068-F1120 AromaticContact CE1-CD1 3.9Å; F1068-F1120 HydrophobicContact CE1-CD1 3.9Å; F1068-F1120 HydrophobicContact CE1-CE1 4.49Å; F1068-L1121 HydrophobicContact CE1-CD1 4.09Å; F1068-L1121 HydrophobicContact CE1-CD2 3.94Å; F1068-L1121 HydrophobicContact CE1-CG 3.82Å; F1068-L1121 HydrophobicContact CZ-CD1 4.05Å; F1068-L1121 HydrophobicContact CZ-CG 4.31Å
1069	A	83.6	Confident	80.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-47.5	175.7	0	0	0	0	0	111.8	F1058 R1065 C1066 N1071 S1072 S1073 L1087 F1120	F1058-A1069 HydrophobicContact CD2-CB 4.28Å; F1058-A1069 HydrophobicContact CE2-CB 3.58Å; F1058-A1069 HydrophobicContact CZ-CB 4.27Å; R1065-A1069 WeakPolarHBondContact O-CB 3.11Å; R1065-A1069 PolarHBondContact O-N 3.4Å; C1066-A1069 PolarHBondContact O-N 2.83Å; A1069-N1071 PolarHBondContact O-N 2.62Å; A1069-S1072 CarbonylContact O-C 3.55Å; A1069-S1072 PolarHBondContact O-N 3.43Å; A1069-S1073 PolarHBondContact O-N 3.49Å; A1069-S1073 PolarHBondContact O-OG 3.25Å; A1069-L1087 HydrophobicContact CB-CD2 4.33Å; A1069-F1120 HydrophobicContact CB-CE1 4Å; A1069-F1120 HydrophobicContact CB-CE2 3.65Å; A1069-F1120 HydrophobicContact CB-CZ 3.34Å
1070	M	79.5	Confident	80.8	Confident	41 Å²	41	48.5 Å²	48.5	20%	0.202	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-21.7	177.5	-78.6	-105.3	-81.3	0	0	114.7	C1066 R1074 M1090 V1094	C1066-M1070 WeakPolarHBondContact O-CB 3.27Å; C1066-M1070 VanDerWaalsContact O-CG 3.3Å; C1066-M1070 WeakPolarHBondContact O-CG 3.35Å; C1066-M1070 PolarHBondContact O-N 2.8Å; M1070-R1074 WeakPolarHBondContact O-CG 3.29Å; M1070-R1074 PolarHBondContact O-NE 3.21Å; M1070-R1074 VanDerWaalsContact O-NE 3.13Å; M1070-M1090 VanDerWaalsContact CE-O 3.24Å; M1070-M1090 WeakPolarHBondContact CE-O 3.26Å; M1070-M1090 HydrophobicContact SD-CB 3.9Å; M1070-V1094 HydrophobicContact CE-CG2 4.22Å
1071	N	81.6	Confident	81	Confident	85 Å²	85	47.7 Å²	47.7	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-94.7	-22.3	171.8	-71.8	-43.6	0	0	0	112.4	Q1067 F1068 A1069 R1074 R1143	Q1067-N1071 PolarHBondContact O-N 2.92Å; Q1067-N1071 PolarHBondContact O-ND2 3.45Å; F1068-N1071 PolarHBondContact O-N 2.88Å; A1069-N1071 PolarHBondContact O-N 2.62Å; N1071-R1074 PolarHBondContact OD1-NH2 3.05Å; N1071-R1143 PolarHBondContact O-NH2 3.15Å
1072	S	83	Confident	81.5	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-93.9	-19.7	-178.5	-67.2	0	0	0	0	115.4	F1068 A1069 R1074 Y1139 R1143	F1068-S1072 WeakPolarHBondContact CE1-OG 2.98Å; F1068-S1072 VanDerWaalsContact O-CB 3.25Å; F1068-S1072 WeakPolarHBondContact O-CB 3.45Å; F1068-S1072 PolarHBondContact O-N 3.42Å; F1068-S1072 PolarHBondContact O-OG 2.65Å; F1068-S1072 VanDerWaalsContact O-OG 3.09Å; A1069-S1072 CarbonylContact O-C 3.55Å; A1069-S1072 PolarHBondContact O-N 3.43Å; S1072-R1074 VanDerWaalsContact C-N 3.28Å; S1072-Y1139 PolarHBondContact O-OH 3.03Å; S1072-R1143 VanDerWaalsContact CA-CZ 3.44Å; S1072-R1143 PolarHBondContact O-NH1 3.36Å; S1072-R1143 PolarHBondContact OG-NE 2.94Å; S1072-R1143 PolarHBondContact OG-NH2 3.09Å
1073	S	82.1	Confident	81.9	Confident	10 Å²	10	47.2 Å²	47.2	7%	0.07	27%	0.272	C	S	.	.	S	Bend	trans	-73.1	-18.5	168.6	62.4	0	0	0	0	113.1	A1069 G1075 C1076	A1069-S1073 PolarHBondContact O-N 3.49Å; A1069-S1073 PolarHBondContact O-OG 3.25Å; S1073-G1075 PolarHBondContact O-N 2.73Å; S1073-C1076 VanDerWaalsContact O-CB 3.24Å; S1073-C1076 WeakPolarHBondContact O-CB 3.31Å; S1073-C1076 PolarHBondContact O-N 3.18Å
1074	R	78.2	Confident	82.4	Confident	176 Å²	176	43 Å²	43	66%	0.664	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	100.9	179.6	-60.8	-176.2	-171.4	-158.4	3	110.7	M1070 N1071 S1072 Y1139	M1070-R1074 WeakPolarHBondContact O-CG 3.29Å; M1070-R1074 PolarHBondContact O-NE 3.21Å; M1070-R1074 VanDerWaalsContact O-NE 3.13Å; N1071-R1074 PolarHBondContact OD1-NH2 3.05Å; S1072-R1074 VanDerWaalsContact C-N 3.28Å; R1074-Y1139 PolarHBondContact O-OH 3.19Å
1075	G	81	Confident	82.8	Confident	62 Å²	62	41.6 Å²	41.6	64%	0.639	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	107.3	-1.8	-175	0	0	0	0	0	114.6	S1073 Y1139	S1073-G1075 PolarHBondContact O-N 2.73Å; G1075-Y1139 VanDerWaalsContact C-CE2 3.44Å; G1075-Y1139 VanDerWaalsContact O-CE2 3.27Å; G1075-Y1139 WeakPolarHBondContact O-CE2 3.32Å
1076	C	84.3	Confident	82.8	Confident	24 Å²	24	41.9 Å²	41.9	16%	0.162	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-63.9	129.2	171	-169.1	0	0	0	0	109.6	S1073 Y1139	S1073-C1076 VanDerWaalsContact O-CB 3.24Å; S1073-C1076 WeakPolarHBondContact O-CB 3.31Å; S1073-C1076 PolarHBondContact O-N 3.18Å; C1076-Y1139 HydrophobicContact CB-CD1 3.86Å; C1076-Y1139 HydrophobicContact CB-CE1 3.59Å
1077	P	85.7	Confident	82.5	Confident	35 Å²	35	41.7 Å²	41.7	23%	0.227	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-66.5	146.5	176.7	27.3	-33.3	0	0	0	110.8	N1135 E1136	P1077-N1135 HydrophobicContact CB-CB 4.17Å; P1077-N1135 HydrophobicContact CG-CB 3.79Å; P1077-E1136 HydrophobicContact CG-CG 4.23Å; P1077-E1136 WeakPolarHBondContact O-CG 3.19Å
1078	P	84.1	Confident	82	Confident	127 Å²	127	43.6 Å²	43.6	83%	0.825	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-66.3	136.5	178.6	28.6	-34.7	0	0	0	110.9
1079	G	84.7	Confident	81.1	Confident	18 Å²	18	48.5 Å²	48.5	19%	0.186	28%	0.278	C	S	.	.	S	Bend	trans	-175	-173.9	178.3	0	0	0	0	0	112.6	L1081 S1082 A1083 E1136	G1079-L1081 VanDerWaalsContact C-N 3.33Å; G1079-L1081 PolarHBondContact O-N 3.29Å; G1079-S1082 PolarHBondContact N-OG 3.15Å; G1079-S1082 PolarHBondContact O-OG 3.08Å; G1079-S1082 VanDerWaalsContact O-OG 3.06Å; G1079-A1083 VanDerWaalsContact O-CB 3.27Å; G1079-A1083 WeakPolarHBondContact O-CB 3.46Å; G1079-A1083 PolarHBondContact O-N 3.11Å; G1079-E1136 WeakPolarHBondContact CA-OE1 3.3Å; G1079-E1136 WeakPolarHBondContact CA-OE2 3.48Å
1080	P	84.6	Confident	80.1	Confident	36 Å²	36	49.1 Å²	49.1	23%	0.234	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-31.8	-172.6	21.4	-32.7	0	0	0	114.4	P1031 C1084 F1131 E1136	P1031-P1080 HydrophobicContact CB-CB 3.88Å; P1031-P1080 HydrophobicContact CG-CB 3.98Å; P1080-C1084 WeakPolarHBondContact O-CB 3.24Å; P1080-C1084 PolarHBondContact O-N 3.39Å; P1080-C1084 VanDerWaalsContact O-N 3.17Å; P1080-C1084 PolarHBondContact O-SG 3Å; P1080-F1131 VanDerWaalsContact CG-O 3.26Å; P1080-F1131 WeakPolarHBondContact CG-O 3.47Å; P1080-E1136 VanDerWaalsContact CD-OE2 3.32Å; P1080-E1136 WeakPolarHBondContact CD-OE2 3.45Å
1081	L	87.1	Confident	78.8	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-73.4	-51.5	179.8	177.6	63.1	0	0	0	111.1	L1057 G1079 A1083 C1084 Q1085 L1127 A1128 E1136	L1057-L1081 HydrophobicContact CD2-CD1 4.32Å; G1079-L1081 VanDerWaalsContact C-N 3.33Å; G1079-L1081 PolarHBondContact O-N 3.29Å; L1081-A1083 PolarHBondContact O-N 3.25Å; L1081-C1084 PolarHBondContact O-N 2.98Å; L1081-Q1085 HydrophobicContact CD1-CG 4.08Å; L1081-Q1085 HydrophobicContact CG-CG 4.46Å; L1081-Q1085 WeakPolarHBondContact O-CG 3.35Å; L1081-Q1085 PolarHBondContact O-N 3.5Å; L1081-L1127 HydrophobicContact CD1-CB 3.91Å; L1081-L1127 HydrophobicContact CD2-CB 3.85Å; L1081-A1128 HydrophobicContact CD2-CB 3.89Å; L1081-E1136 PolarHBondContact N-OE1 3.23Å
1082	S	85.7	Confident	77.1	Confident	32 Å²	32	51.9 Å²	51.9	22%	0.224	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-33.9	177.7	50.6	0	0	0	0	112.5	G1079 Q1086 E1136	G1079-S1082 PolarHBondContact N-OG 3.15Å; G1079-S1082 PolarHBondContact O-OG 3.08Å; G1079-S1082 VanDerWaalsContact O-OG 3.06Å; S1082-Q1086 PolarHBondContact O-N 2.8Å; S1082-Q1086 VanDerWaalsContact O-N 3.14Å; S1082-E1136 VanDerWaalsContact CB-OE1 3.28Å; S1082-E1136 WeakPolarHBondContact CB-OE1 3.33Å; S1082-E1136 PolarHBondContact N-OE1 2.8Å; S1082-E1136 PolarHBondContact OG-OE1 3.26Å
1083	A	83.7	Confident	75.2	Confident	42 Å²	42	56.1 Å²	56.1	35%	0.347	33%	0.326	S	S	.	.	H	α-helix	trans	-65.8	-36	170.7	0	0	0	0	0	113.3	L924 G1079 L1081 Q1086	L924-A1083 HydrophobicContact CD1-CB 4.16Å; G1079-A1083 VanDerWaalsContact O-CB 3.27Å; G1079-A1083 WeakPolarHBondContact O-CB 3.46Å; G1079-A1083 PolarHBondContact O-N 3.11Å; L1081-A1083 PolarHBondContact O-N 3.25Å; A1083-Q1086 WeakPolarHBondContact O-CG 3.2Å
1084	C	85.4	Confident	73.5	Confident	4 Å²	4	57.3 Å²	57.3	3%	0.027	33%	0.332	C	S	.	.	H	α-helix	trans	-84.5	-18.8	-179.5	-66.2	0	0	0	0	114.7	G1030 P1031 V1036 Y1038 L1057 P1080 L1081	G1030-C1084 WeakPolarHBondContact CA-SG 3.39Å; P1031-C1084 VanDerWaalsContact CD-SG 3.56Å; V1036-C1084 HydrophobicContact CG2-CB 4.31Å; Y1038-C1084 WeakPolarHBondContact CE1-O 3.49Å; Y1038-C1084 WeakPolarHBondContact OH-CA 2.97Å; Y1038-C1084 PolarHBondContact OH-O 2.9Å; L1057-C1084 HydrophobicContact CD1-CB 3.59Å; P1080-C1084 WeakPolarHBondContact O-CB 3.24Å; P1080-C1084 PolarHBondContact O-N 3.39Å; P1080-C1084 VanDerWaalsContact O-N 3.17Å; P1080-C1084 PolarHBondContact O-SG 3Å; L1081-C1084 PolarHBondContact O-N 2.98Å
1085	Q	84.3	Confident	71.5	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.009	33%	0.333	C	S	.	.	H	α-helix	trans	-92.6	-26.6	174.9	-67.9	168.4	-32.8	0	0	113	L1057 F1058 L1081 L1087 M1090	L1057-Q1085 HydrophobicContact CB-CG 3.93Å; L1057-Q1085 PolarHBondContact O-NE2 3.33Å; F1058-Q1085 HydrophobicContact CB-CG 4.4Å; L1081-Q1085 HydrophobicContact CD1-CG 4.08Å; L1081-Q1085 HydrophobicContact CG-CG 4.46Å; L1081-Q1085 WeakPolarHBondContact O-CG 3.35Å; L1081-Q1085 PolarHBondContact O-N 3.5Å; Q1085-L1087 HydrophobicContact CB-CD1 4.49Å; Q1085-L1087 HydrophobicContact CB-CG 4.02Å; Q1085-L1087 PolarHBondContact O-N 2.99Å; Q1085-M1090 WeakPolarHBondContact O-CE 3.42Å
1086	Q	77.9	Confident	69.4	Low	56 Å²	56	62.8 Å²	62.8	26%	0.262	34%	0.34	S	S	.	.			trans	54.4	23.3	178.7	-53.6	-169.5	28.8	0	0	115.6	Y1038 S1082 A1083 N1088 K1089	Y1038-Q1086 HydrophobicContact CE1-CG 3.88Å; Y1038-Q1086 PolarHBondContact OH-NE2 3.2Å; S1082-Q1086 PolarHBondContact O-N 2.8Å; S1082-Q1086 VanDerWaalsContact O-N 3.14Å; A1083-Q1086 WeakPolarHBondContact O-CG 3.2Å; Q1086-N1088 PolarHBondContact O-N 3.38Å; Q1086-K1089 HydrophobicContact CB-CD 4.27Å; Q1086-K1089 HydrophobicContact CB-CG 4.39Å; Q1086-K1089 WeakPolarHBondContact O-CB 3.34Å; Q1086-K1089 PolarHBondContact O-N 2.9Å; Q1086-K1089 VanDerWaalsContact OE1-CD 3.31Å; Q1086-K1089 VanDerWaalsContact OE1-CE 3.23Å
1087	L	74.9	Confident	67.3	Low	7 Å²	7	63.9 Å²	63.9	4%	0.037	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-46.7	-38.5	-179.4	-64.4	172.2	0	0	0	113.3	F1058 A1069 Q1085 K1089 M1090	F1058-L1087 HydrophobicContact CB-CD2 4.49Å; F1058-L1087 HydrophobicContact CD1-CD2 3.76Å; F1058-L1087 HydrophobicContact CD2-CD2 3.89Å; F1058-L1087 HydrophobicContact CE1-CD2 3.8Å; F1058-L1087 HydrophobicContact CE2-CD2 3.94Å; F1058-L1087 HydrophobicContact CG-CD2 3.78Å; F1058-L1087 HydrophobicContact CZ-CD2 3.89Å; A1069-L1087 HydrophobicContact CB-CD2 4.33Å; Q1085-L1087 HydrophobicContact CB-CD1 4.49Å; Q1085-L1087 HydrophobicContact CB-CG 4.02Å; Q1085-L1087 PolarHBondContact O-N 2.99Å; L1087-K1089 PolarHBondContact O-N 2.9Å; L1087-K1089 VanDerWaalsContact O-N 3.17Å; L1087-M1090 HydrophobicContact CD2-CE 3.96Å; L1087-M1090 HydrophobicContact CD2-SD 4.03Å; L1087-M1090 WeakPolarHBondContact O-CB 3.46Å; L1087-M1090 PolarHBondContact O-N 3.17Å; L1087-M1090 VanDerWaalsContact O-N 3.09Å
1088	N	66.7	Low	64.9	Low	121 Å²	121	66 Å²	66	65%	0.647	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-67.7	-11.9	-179.7	-64.1	-10.7	0	0	0	114.3	Q1086	Q1086-N1088 PolarHBondContact O-N 3.38Å
1089	K	65.9	Low	62.5	Low	138 Å²	138	68.2 Å²	68.2	60%	0.6	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-90	-10.1	173	-60.2	-170.1	-171.2	172.8	0	113.5	Q1086 L1087 T1091	Q1086-K1089 HydrophobicContact CB-CD 4.27Å; Q1086-K1089 HydrophobicContact CB-CG 4.39Å; Q1086-K1089 WeakPolarHBondContact O-CB 3.34Å; Q1086-K1089 PolarHBondContact O-N 2.9Å; Q1086-K1089 VanDerWaalsContact OE1-CD 3.31Å; Q1086-K1089 VanDerWaalsContact OE1-CE 3.23Å; L1087-K1089 PolarHBondContact O-N 2.9Å; L1087-K1089 VanDerWaalsContact O-N 3.17Å; K1089-T1091 PolarHBondContact O-N 2.85Å
1090	M	62.9	Low	60	Low	13 Å²	13	76 Å²	76	6%	0.064	39%	0.385	C	S	.	.			trans	-79	36.9	-174.3	-57.4	-177	-173.3	0	0	113.3	N1042 F1058 M1070 Q1085 L1087	N1042-M1090 HydrophobicContact CB-CE 3.82Å; N1042-M1090 HydrophobicContact CB-CG 4.25Å; N1042-M1090 HydrophobicContact CB-SD 4.25Å; N1042-M1090 WeakPolarHBondContact O-CE 3.45Å; F1058-M1090 HydrophobicContact CD1-CE 3.68Å; F1058-M1090 HydrophobicContact CD1-SD 4.26Å; F1058-M1090 HydrophobicContact CE1-CE 3.61Å; F1058-M1090 HydrophobicContact CE1-SD 3.56Å; F1058-M1090 VanDerWaalsContact CE1-SD 3.56Å; F1058-M1090 HydrophobicContact CZ-SD 4.29Å; M1070-M1090 VanDerWaalsContact CE-O 3.24Å; M1070-M1090 WeakPolarHBondContact CE-O 3.26Å; M1070-M1090 HydrophobicContact SD-CB 3.9Å; Q1085-M1090 WeakPolarHBondContact O-CE 3.42Å; L1087-M1090 HydrophobicContact CD2-CE 3.96Å; L1087-M1090 HydrophobicContact CD2-SD 4.03Å; L1087-M1090 WeakPolarHBondContact O-CB 3.46Å; L1087-M1090 PolarHBondContact O-N 3.17Å; L1087-M1090 VanDerWaalsContact O-N 3.09Å
1091	T	50.6	Low	57.7	Low	92 Å²	92	76.1 Å²	76.1	56%	0.564	39%	0.385	S	S	*	.			trans	-85.4	-13	-168.9	48.7	0	0	0	0	114.7	K1089	K1089-T1091 PolarHBondContact O-N 2.85Å
1092	T	45.8	Very low	55.3	Low	92 Å²	92	80.2 Å²	80.2	56%	0.564	41%	0.414	S	S	*	.	S	Bend	trans	-105.1	-40.4	-167.3	51.7	0	0	0	0	115.3
1093	N	42.8	Very low	52.9	Low	91 Å²	91	82.3 Å²	82.3	49%	0.487	43%	0.429	S	S	.	.	S	Bend	trans	-79.6	-37.7	-169.2	-77.3	-7.9	0	0	0	114.1	Q1095 R1096 S1097	N1093-Q1095 VanDerWaalsContact C-N 3.27Å; N1093-Q1095 PolarHBondContact O-N 2.86Å; N1093-R1096 PolarHBondContact O-N 2.68Å; N1093-R1096 VanDerWaalsContact O-N 3.09Å; N1093-S1097 PolarHBondContact O-N 3.12Å
1094	V	46.4	Very low	50.7	Low	34 Å²	34	85.8 Å²	85.8	21%	0.206	44%	0.442	C	S	.	.	H	α-helix	trans	-64.8	-32	-179.5	-174.7	0	0	0	0	111.8	M1070 R1096 S1097 N1098	M1070-V1094 HydrophobicContact CE-CG2 4.22Å; V1094-R1096 PolarHBondContact O-N 2.92Å; V1094-S1097 PolarHBondContact O-N 2.86Å; V1094-S1097 PolarHBondContact O-OG 2.83Å; V1094-N1098 PolarHBondContact O-N 3.48Å; V1094-N1098 VanDerWaalsContact O-N 3.15Å; V1094-N1098 PolarHBondContact O-OD1 3.15Å
1095	Q	37.5	Very low	48.7	Very low	144 Å²	144	88.2 Å²	88.2	67%	0.673	46%	0.458	S	S	*	.	H	α-helix	trans	-64.9	-24.4	175.9	-70.8	-167.7	-18.7	0	0	113.5	N1093	N1093-Q1095 VanDerWaalsContact C-N 3.27Å; N1093-Q1095 PolarHBondContact O-N 2.86Å
1096	R	37.3	Very low	46.7	Very low	210 Å²	210	93.9 Å²	93.9	79%	0.792	49%	0.489	S	S	*	.	H	α-helix	trans	-82.9	-31.2	177	-71.3	-176.6	171.2	179.5	-2.8	113.2	N1093 V1094	N1093-R1096 PolarHBondContact O-N 2.68Å; N1093-R1096 VanDerWaalsContact O-N 3.09Å; V1094-R1096 PolarHBondContact O-N 2.92Å
1097	S	39.2	Very low	45.4	Very low	46 Å²	46	97 Å²	97	32%	0.322	51%	0.512	S	S	.	.	H	α-helix	trans	-78.8	-24.5	175.1	57.2	0	0	0	0	113.3	N1093 V1094 H1099 F1100 T1101	N1093-S1097 PolarHBondContact O-N 3.12Å; V1094-S1097 PolarHBondContact O-N 2.86Å; V1094-S1097 PolarHBondContact O-OG 2.83Å; S1097-H1099 PolarHBondContact O-N 2.61Å; S1097-F1100 PolarHBondContact O-N 2.75Å; S1097-T1101 PolarHBondContact O-N 3.33Å; S1097-T1101 PolarHBondContact O-OG1 2.74Å; S1097-T1101 VanDerWaalsContact O-OG1 3.07Å
1098	N	35.8	Very low	44.7	Very low	80 Å²	80	99.6 Å²	99.6	43%	0.428	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-21	179.1	-78.6	-11.9	0	0	0	115.5	V1094	V1094-N1098 PolarHBondContact O-N 3.48Å; V1094-N1098 VanDerWaalsContact O-N 3.15Å; V1094-N1098 PolarHBondContact O-OD1 3.15Å
1099	H	33.9	Very low	44.6	Very low	173 Å²	173	97.3 Å²	97.3	80%	0.801	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-5.6	174.7	-82.2	-67.7	0	0	0	114.8	S1097	S1097-H1099 PolarHBondContact O-N 2.61Å
1100	F	31.2	Very low	44.8	Very low	182 Å²	182	94.7 Å²	94.7	80%	0.798	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-5.7	-179.2	-96.5	-85.5	0	0	0	114.7	S1097	S1097-F1100 PolarHBondContact O-N 2.75Å
1101	T	37.1	Very low	45.4	Very low	38 Å²	38	98 Å²	98	23%	0.233	55%	0.547	C	S	.	.			trans	-114.3	-2.2	-170.5	55.4	0	0	0	0	115.8	S1097 S1103 N1104 S1105	S1097-T1101 PolarHBondContact O-N 3.33Å; S1097-T1101 PolarHBondContact O-OG1 2.74Å; S1097-T1101 VanDerWaalsContact O-OG1 3.07Å; T1101-S1103 PolarHBondContact O-N 2.65Å; T1101-S1103 VanDerWaalsContact O-N 3.16Å; T1101-N1104 PolarHBondContact O-N 3.07Å; T1101-N1104 VanDerWaalsContact O-N 3.15Å; T1101-S1105 PolarHBondContact O-N 3Å
1102	S	36	Very low	46.4	Very low	87 Å²	87	96.9 Å²	96.9	61%	0.608	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.3	-177.4	56.5	0	0	0	0	114.7
1103	S	35.3	Very low	47.9	Very low	77 Å²	77	96.7 Å²	96.7	54%	0.538	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-39.4	174.4	45.4	0	0	0	0	113.3	T1101	T1101-S1103 PolarHBondContact O-N 2.65Å; T1101-S1103 VanDerWaalsContact O-N 3.16Å
1104	N	38.5	Very low	49.8	Very low	115 Å²	115	95.2 Å²	95.2	62%	0.615	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-87.6	-22.9	-168.5	-73.9	-1.9	0	0	0	114	T1101 N1106 V1107	T1101-N1104 PolarHBondContact O-N 3.07Å; T1101-N1104 VanDerWaalsContact O-N 3.15Å; N1104-N1106 PolarHBondContact O-N 3.43Å; N1104-N1106 VanDerWaalsContact O-N 3.1Å; N1104-V1107 PolarHBondContact O-N 3.16Å
1105	S	42.6	Very low	51.5	Low	54 Å²	54	97 Å²	97	38%	0.378	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-64.7	-13.8	179.3	57.6	0	0	0	0	114.3	T1101 R1113	T1101-S1105 PolarHBondContact O-N 3Å; S1105-R1113 PolarHBondContact O-NH2 3.17Å
1106	N	42.4	Very low	53.7	Low	121 Å²	121	91 Å²	91	65%	0.647	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-87.3	-13.5	-179	-69.6	-19.9	0	0	0	113.9	N1104	N1104-N1106 PolarHBondContact O-N 3.43Å; N1104-N1106 VanDerWaalsContact O-N 3.1Å
1107	V	51.3	Low	56	Low	122 Å²	122	82.4 Å²	82.4	74%	0.739	48%	0.475	S	S	*	.	S	Bend	trans	-74.9	-26.7	-177.4	-173.8	0	0	0	0	112.5	N1104 S1109	N1104-V1107 PolarHBondContact O-N 3.16Å; V1107-S1109 PolarHBondContact O-N 2.85Å
1108	I	59.4	Low	58.3	Low	62 Å²	62	80.6 Å²	80.6	32%	0.318	46%	0.461	S	S	.	.	S	Bend	trans	-80.1	119.4	-176.4	-58.5	175.1	0	0	0	110.1	V1064 C1112 R1113	V1064-I1108 HydrophobicContact CG2-CD1 3.56Å; I1108-C1112 HydrophobicContact CG2-CB 3.82Å; I1108-R1113 HydrophobicContact CG2-CG 3.86Å; I1108-R1113 VanDerWaalsContact O-CZ 3.27Å; I1108-R1113 PolarHBondContact O-NE 2.84Å; I1108-R1113 PolarHBondContact O-NH2 2.72Å
1109	S	64	Low	60.8	Low	73 Å²	73	80.3 Å²	80.3	51%	0.51	46%	0.46	S	S	.	.			trans	-61.7	151.7	-177.5	74.9	0	0	0	0	112.9	V1107 S1111 C1112 R1113	V1107-S1109 PolarHBondContact O-N 2.85Å; S1109-S1111 PolarHBondContact O-N 3.03Å; S1109-C1112 WeakPolarHBondContact O-CB 3.07Å; S1109-C1112 PolarHBondContact O-N 2.74Å; S1109-C1112 VanDerWaalsContact O-N 3.09Å; S1109-C1112 WeakPolarHBondContact OG-CB 3.18Å; S1109-C1112 PolarHBondContact OG-N 3.39Å; S1109-R1113 PolarHBondContact O-N 3.03Å; S1109-R1113 VanDerWaalsContact O-N 3.11Å
1110	A	71.8	Confident	63.5	Low	83 Å²	83	72.3 Å²	72.3	69%	0.686	42%	0.422	S	S	*	.	H	α-helix	trans	-57.4	-37.8	179.6	0	0	0	0	0	112.6	R1113 K1114	A1110-R1113 PolarHBondContact O-N 2.81Å; A1110-K1114 PolarHBondContact O-N 2.89Å
1111	S	74	Confident	66.4	Low	82 Å²	82	63.7 Å²	63.7	57%	0.573	39%	0.385	S	S	*	.	H	α-helix	trans	-62.4	-43	175.3	-174.6	0	0	0	0	112.4	S1109 R1113 K1114 V1115	S1109-S1111 PolarHBondContact O-N 3.03Å; S1111-R1113 VanDerWaalsContact C-N 3.34Å; S1111-R1113 PolarHBondContact O-N 2.78Å; S1111-K1114 WeakPolarHBondContact O-CB 3.48Å; S1111-K1114 PolarHBondContact O-N 3.28Å; S1111-V1115 WeakPolarHBondContact O-CG2 3.38Å; S1111-V1115 PolarHBondContact O-N 3.41Å
1112	C	71.5	Confident	69	Low	69 Å²	69	64.6 Å²	64.6	47%	0.466	39%	0.387	S	S	.	.	H	α-helix	trans	-63.1	-39.5	176	-177.5	0	0	0	0	112.1	I1108 S1109 V1115 S1116	I1108-C1112 HydrophobicContact CG2-CB 3.82Å; S1109-C1112 WeakPolarHBondContact O-CB 3.07Å; S1109-C1112 PolarHBondContact O-N 2.74Å; S1109-C1112 VanDerWaalsContact O-N 3.09Å; S1109-C1112 WeakPolarHBondContact OG-CB 3.18Å; S1109-C1112 PolarHBondContact OG-N 3.39Å; C1112-V1115 PolarHBondContact O-N 3.06Å; C1112-S1116 PolarHBondContact O-N 2.91Å
1113	R	77.7	Confident	71.6	Confident	87 Å²	87	62.5 Å²	62.5	33%	0.328	37%	0.372	S	S	.	.	H	α-helix	trans	-65.1	-43.9	174.2	-57.9	-178.4	-149.2	-156.6	1.2	112	V1064 S1105 I1108 S1109 A1110 S1111 V1115 S1116 N1117	V1064-R1113 HydrophobicContact CG1-CG 4.42Å; S1105-R1113 PolarHBondContact O-NH2 3.17Å; I1108-R1113 HydrophobicContact CG2-CG 3.86Å; I1108-R1113 VanDerWaalsContact O-CZ 3.27Å; I1108-R1113 PolarHBondContact O-NE 2.84Å; I1108-R1113 PolarHBondContact O-NH2 2.72Å; S1109-R1113 PolarHBondContact O-N 3.03Å; S1109-R1113 VanDerWaalsContact O-N 3.11Å; A1110-R1113 PolarHBondContact O-N 2.81Å; S1111-R1113 VanDerWaalsContact C-N 3.34Å; S1111-R1113 PolarHBondContact O-N 2.78Å; R1113-V1115 VanDerWaalsContact C-N 3.35Å; R1113-V1115 PolarHBondContact O-N 2.82Å; R1113-S1116 PolarHBondContact O-N 2.71Å; R1113-N1117 WeakPolarHBondContact O-CB 3.38Å; R1113-N1117 PolarHBondContact O-N 2.82Å; R1113-N1117 PolarHBondContact O-ND2 3.39Å; R1113-N1117 PolarHBondContact O-OD1 2.82Å
1114	K	82	Confident	74.3	Confident	61 Å²	61	58.9 Å²	58.9	27%	0.265	35%	0.346	S	S	.	.	H	α-helix	trans	-53.8	-50.9	174.1	172.2	176.6	169.2	167.4	0	110.8	A1110 S1111 N1117 Q1118 D1151 E1153	A1110-K1114 PolarHBondContact O-N 2.89Å; S1111-K1114 WeakPolarHBondContact O-CB 3.48Å; S1111-K1114 PolarHBondContact O-N 3.28Å; K1114-N1117 PolarHBondContact O-N 3.1Å; K1114-Q1118 WeakPolarHBondContact O-CG 3.21Å; K1114-Q1118 PolarHBondContact O-N 3.27Å; K1114-D1151 WeakPolarHBondContact CD-OD1 3.43Å; K1114-D1151 WeakPolarHBondContact CE-OD1 3.35Å; K1114-D1151 PolarHBondContact NZ-O 3.27Å; K1114-D1151 VanDerWaalsContact NZ-O 3.07Å; K1114-D1151 IonicContact NZ-OD1 2.76Å; K1114-D1151 PolarHBondContact NZ-OD1 3.46Å; K1114-E1153 WeakPolarHBondContact CE-OE1 3.13Å; K1114-E1153 IonicContact NZ-OE1 2.71Å; K1114-E1153 PolarHBondContact NZ-OE1 3.4Å
1115	V	83.9	Confident	76.9	Confident	72 Å²	72	53.5 Å²	53.5	44%	0.436	32%	0.318	S	S	.	.	H	α-helix	trans	-63.7	-45.3	179.9	175	0	0	0	0	112.1	S1111 C1112 R1113 N1117 Q1118 N1119	S1111-V1115 WeakPolarHBondContact O-CG2 3.38Å; S1111-V1115 PolarHBondContact O-N 3.41Å; C1112-V1115 PolarHBondContact O-N 3.06Å; R1113-V1115 VanDerWaalsContact C-N 3.35Å; R1113-V1115 PolarHBondContact O-N 2.82Å; V1115-N1117 PolarHBondContact O-N 3.47Å; V1115-Q1118 PolarHBondContact O-N 2.96Å; V1115-N1119 WeakPolarHBondContact O-CB 3.47Å; V1115-N1119 PolarHBondContact O-N 2.97Å; V1115-N1119 PolarHBondContact O-OD1 2.82Å
1116	S	82.3	Confident	79.2	Confident	18 Å²	18	55.5 Å²	55.5	13%	0.126	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-41	177.9	-166.9	0	0	0	0	112.2	D1062 C1112 R1113 N1119 F1120	D1062-S1116 PolarHBondContact OD2-OG 2.98Å; C1112-S1116 PolarHBondContact O-N 2.91Å; R1113-S1116 PolarHBondContact O-N 2.71Å; S1116-N1119 PolarHBondContact O-N 3.22Å; S1116-F1120 WeakPolarHBondContact O-CB 3.38Å; S1116-F1120 PolarHBondContact O-N 3.15Å
1117	N	86.2	Confident	81.6	Confident	28 Å²	28	50.2 Å²	50.2	15%	0.15	29%	0.293	C	S	.	.	H	α-helix	trans	-64.4	-44.1	177.1	-67.3	-7.8	0	0	0	112.3	F1068 R1113 K1114 V1115 F1120 L1121	F1068-N1117 HydrophobicContact CD1-CB 4.18Å; F1068-N1117 HydrophobicContact CD2-CB 4.15Å; F1068-N1117 VanDerWaalsContact CD2-CG 3.41Å; F1068-N1117 WeakPolarHBondContact CD2-ND2 3.32Å; F1068-N1117 WeakPolarHBondContact CD2-OD1 3.38Å; F1068-N1117 HydrophobicContact CE1-CB 4.01Å; F1068-N1117 HydrophobicContact CE2-CB 3.97Å; F1068-N1117 HydrophobicContact CG-CB 4.24Å; F1068-N1117 VanDerWaalsContact CG-OD1 3.28Å; F1068-N1117 WeakPolarHBondContact CG-OD1 3.5Å; F1068-N1117 HydrophobicContact CZ-CB 3.89Å; R1113-N1117 WeakPolarHBondContact O-CB 3.38Å; R1113-N1117 PolarHBondContact O-N 2.82Å; R1113-N1117 PolarHBondContact O-ND2 3.39Å; R1113-N1117 PolarHBondContact O-OD1 2.82Å; K1114-N1117 PolarHBondContact O-N 3.1Å; V1115-N1117 PolarHBondContact O-N 3.47Å; N1117-F1120 PolarHBondContact O-N 2.75Å; N1117-L1121 WeakPolarHBondContact O-CG 3.43Å; N1117-L1121 PolarHBondContact O-N 3.46Å; N1117-L1121 VanDerWaalsContact O-N 3.07Å
1118	Q	88	Confident	83.5	Confident	8 Å²	8	44.4 Å²	44.4	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-48	175.5	-75.6	-170.1	11	0	0	111.4	K1114 V1115 F1120 L1121 E1122 Q1147 D1151 E1153	K1114-Q1118 WeakPolarHBondContact O-CG 3.21Å; K1114-Q1118 PolarHBondContact O-N 3.27Å; V1115-Q1118 PolarHBondContact O-N 2.96Å; Q1118-F1120 VanDerWaalsContact C-N 3.26Å; Q1118-F1120 PolarHBondContact O-N 2.84Å; Q1118-L1121 PolarHBondContact O-N 3.28Å; Q1118-L1121 VanDerWaalsContact O-N 3.15Å; Q1118-E1122 WeakPolarHBondContact O-CB 3.27Å; Q1118-E1122 PolarHBondContact O-N 2.87Å; Q1118-Q1147 HydrophobicContact CG-CG 4.31Å; Q1118-D1151 VanDerWaalsContact NE2-CG 3.32Å; Q1118-D1151 PolarHBondContact NE2-OD2 3.16Å; Q1118-E1153 PolarHBondContact NE2-OE1 2.65Å
1119	N	87.7	Confident	84.9	Confident	74 Å²	74	44.4 Å²	44.4	40%	0.396	26%	0.258	S	S	.	.	H	α-helix	trans	-61.5	-35.5	179.5	-68.2	-3.2	0	0	0	111.8	V1115 S1116 S1123	V1115-N1119 WeakPolarHBondContact O-CB 3.47Å; V1115-N1119 PolarHBondContact O-N 2.97Å; V1115-N1119 PolarHBondContact O-OD1 2.82Å; S1116-N1119 PolarHBondContact O-N 3.22Å; N1119-S1123 VanDerWaalsContact O-CB 3.28Å; N1119-S1123 WeakPolarHBondContact O-CB 3.35Å; N1119-S1123 PolarHBondContact O-N 3.34Å
1120	F	89.9	Confident	86	Confident	5 Å²	5	44.3 Å²	44.3	2%	0.022	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-50.7	172	174	-98	0	0	0	111.7	F1058 R1065 F1068 A1069 S1116 N1117 Q1118 E1122 S1123 Q1124 W1140	F1058-F1120 HydrophobicContact CD2-CE2 4.05Å; F1058-F1120 HydrophobicContact CE2-CE2 4.37Å; R1065-F1120 HydrophobicContact CG-CB 4.39Å; R1065-F1120 HydrophobicContact CG-CD2 3.69Å; R1065-F1120 HydrophobicContact CG-CE2 4.4Å; R1065-F1120 HydrophobicContact CG-CG 4.29Å; F1068-F1120 AromaticContact CD1-CD1 3.67Å; F1068-F1120 HydrophobicContact CD1-CD1 3.67Å; F1068-F1120 HydrophobicContact CD1-CE1 4.23Å; F1068-F1120 HydrophobicContact CD1-CG 4.4Å; F1068-F1120 AromaticContact CE1-CD1 3.9Å; F1068-F1120 HydrophobicContact CE1-CD1 3.9Å; F1068-F1120 HydrophobicContact CE1-CE1 4.49Å; A1069-F1120 HydrophobicContact CB-CE1 4Å; A1069-F1120 HydrophobicContact CB-CE2 3.65Å; A1069-F1120 HydrophobicContact CB-CZ 3.34Å; S1116-F1120 WeakPolarHBondContact O-CB 3.38Å; S1116-F1120 PolarHBondContact O-N 3.15Å; N1117-F1120 PolarHBondContact O-N 2.75Å; Q1118-F1120 VanDerWaalsContact C-N 3.26Å; Q1118-F1120 PolarHBondContact O-N 2.84Å; F1120-E1122 VanDerWaalsContact C-N 3.34Å; F1120-E1122 PolarHBondContact O-N 3.01Å; F1120-S1123 WeakPolarHBondContact O-CB 3.27Å; F1120-S1123 PolarHBondContact O-N 3.32Å; F1120-Q1124 HydrophobicContact CD1-CG 4.05Å; F1120-Q1124 HydrophobicContact CD2-CG 4.14Å; F1120-Q1124 HydrophobicContact CE1-CG 3.56Å; F1120-Q1124 HydrophobicContact CE2-CG 3.66Å; F1120-Q1124 HydrophobicContact CG-CG 4.33Å; F1120-Q1124 HydrophobicContact CZ-CG 3.34Å; F1120-Q1124 VanDerWaalsContact O-CG 3.31Å; F1120-Q1124 WeakPolarHBondContact O-CG 3.17Å; F1120-Q1124 PolarHBondContact O-N 3.46Å; F1120-W1140 HydrophobicContact CE1-CH2 4.12Å; F1120-W1140 AromaticContact CE1-CZ3 3.99Å; F1120-W1140 HydrophobicContact CE1-CZ3 3.99Å; F1120-W1140 HydrophobicContact CZ-CH2 4.29Å
1121	L	92.2	Very high	86.6	Confident	1 Å²	1	41 Å²	41	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-35.9	-179.2	-67.8	176.1	0	0	0	113	F1068 N1117 Q1118 T1125 W1140 R1143 W1144 Q1147	F1068-L1121 HydrophobicContact CE1-CD1 4.09Å; F1068-L1121 HydrophobicContact CE1-CD2 3.94Å; F1068-L1121 HydrophobicContact CE1-CG 3.82Å; F1068-L1121 HydrophobicContact CZ-CD1 4.05Å; F1068-L1121 HydrophobicContact CZ-CG 4.31Å; N1117-L1121 WeakPolarHBondContact O-CG 3.43Å; N1117-L1121 PolarHBondContact O-N 3.46Å; N1117-L1121 VanDerWaalsContact O-N 3.07Å; Q1118-L1121 PolarHBondContact O-N 3.28Å; Q1118-L1121 VanDerWaalsContact O-N 3.15Å; L1121-T1125 WeakPolarHBondContact O-CB 3.49Å; L1121-T1125 PolarHBondContact O-N 2.81Å; L1121-T1125 PolarHBondContact O-OG1 2.82Å; L1121-W1140 HydrophobicContact CD2-CE3 3.94Å; L1121-W1140 HydrophobicContact CD2-CZ3 3.87Å; L1121-R1143 HydrophobicContact CD2-CG 4.18Å; L1121-W1144 HydrophobicContact CB-CB 3.86Å; L1121-W1144 HydrophobicContact CB-CG 3.89Å; L1121-Q1147 HydrophobicContact CD1-CB 3.63Å; L1121-Q1147 HydrophobicContact CD1-CG 3.88Å
1122	E	92.8	Very high	87.1	Confident	58 Å²	58	37.4 Å²	37.4	27%	0.271	20%	0.203	S	C	.	.	H	α-helix	trans	-60.6	-52	171.8	-176.6	163.3	-177.1	0	0	110.3	Q1118 F1120 Q1124 T1125 Q1126 W1144 R1156	Q1118-E1122 WeakPolarHBondContact O-CB 3.27Å; Q1118-E1122 PolarHBondContact O-N 2.87Å; F1120-E1122 VanDerWaalsContact C-N 3.34Å; F1120-E1122 PolarHBondContact O-N 3.01Å; E1122-Q1124 PolarHBondContact O-N 2.78Å; E1122-T1125 PolarHBondContact O-N 3.27Å; E1122-Q1126 WeakPolarHBondContact O-CG 3.41Å; E1122-Q1126 PolarHBondContact O-N 2.99Å; E1122-W1144 HydrophobicContact CB-CD2 4.4Å; E1122-W1144 HydrophobicContact CB-CH2 4.23Å; E1122-W1144 HydrophobicContact CB-CZ2 3.57Å; E1122-W1144 HydrophobicContact CG-CH2 3.75Å; E1122-W1144 HydrophobicContact CG-CZ2 3.45Å; E1122-W1144 VanDerWaalsContact CG-CZ2 3.45Å; E1122-R1156 IonicContact OE1-NH2 3.22Å; E1122-R1156 IonicContact OE2-CZ 2.62Å; E1122-R1156 IonicContact OE2-NH1 3.45Å; E1122-R1156 IonicContact OE2-NH2 2.79Å; E1122-R1156 PolarHBondContact OE2-NH2 2.88Å
1123	S	91.2	Very high	87.8	Confident	42 Å²	42	35.5 Å²	35.5	29%	0.294	19%	0.19	S	C	.	.	H	α-helix	trans	-56.9	-48.6	175.1	178.8	0	0	0	0	112.5	N1119 F1120 T1125 Q1126 L1127	N1119-S1123 VanDerWaalsContact O-CB 3.28Å; N1119-S1123 WeakPolarHBondContact O-CB 3.35Å; N1119-S1123 PolarHBondContact O-N 3.34Å; F1120-S1123 WeakPolarHBondContact O-CB 3.27Å; F1120-S1123 PolarHBondContact O-N 3.32Å; S1123-T1125 VanDerWaalsContact C-N 3.3Å; S1123-T1125 PolarHBondContact O-N 2.95Å; S1123-Q1126 PolarHBondContact O-N 3.38Å; S1123-L1127 WeakPolarHBondContact O-CB 3.34Å; S1123-L1127 VanDerWaalsContact O-CG 3.3Å; S1123-L1127 WeakPolarHBondContact O-CG 3.45Å; S1123-L1127 PolarHBondContact O-N 3.08Å
1124	Q	91.4	Very high	88.4	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.009	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-38.9	176.9	-68.4	-52.3	-60.5	0	0	112.7	F1120 E1122 A1128 W1140	F1120-Q1124 HydrophobicContact CD1-CG 4.05Å; F1120-Q1124 HydrophobicContact CD2-CG 4.14Å; F1120-Q1124 HydrophobicContact CE1-CG 3.56Å; F1120-Q1124 HydrophobicContact CE2-CG 3.66Å; F1120-Q1124 HydrophobicContact CG-CG 4.33Å; F1120-Q1124 HydrophobicContact CZ-CG 3.34Å; F1120-Q1124 VanDerWaalsContact O-CG 3.31Å; F1120-Q1124 WeakPolarHBondContact O-CG 3.17Å; F1120-Q1124 PolarHBondContact O-N 3.46Å; E1122-Q1124 PolarHBondContact O-N 2.78Å; Q1124-A1128 VanDerWaalsContact O-CB 3.23Å; Q1124-A1128 WeakPolarHBondContact O-CB 3.23Å; Q1124-A1128 PolarHBondContact O-N 2.85Å; Q1124-W1140 HydrophobicContact CB-CB 4.37Å; Q1124-W1140 HydrophobicContact CB-CD2 3.6Å; Q1124-W1140 HydrophobicContact CB-CE3 3.74Å; Q1124-W1140 HydrophobicContact CB-CG 3.89Å; Q1124-W1140 HydrophobicContact CB-CZ2 4.46Å; Q1124-W1140 HydrophobicContact CB-CZ3 4.24Å; Q1124-W1140 HydrophobicContact CG-CD2 4.21Å; Q1124-W1140 HydrophobicContact CG-CE3 4.1Å; Q1124-W1140 HydrophobicContact CG-CH2 4.14Å; Q1124-W1140 HydrophobicContact CG-CZ2 4.23Å; Q1124-W1140 HydrophobicContact CG-CZ3 4.08Å
1125	T	92.6	Very high	88.8	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.012	20%	0.197	C	C	.	.	H	α-helix	trans	-66.1	-42.2	177.5	-56.4	0	0	0	0	111.3	L1121 E1122 S1123 A1128 L1129 Y1137 W1140 L1141 W1144	L1121-T1125 WeakPolarHBondContact O-CB 3.49Å; L1121-T1125 PolarHBondContact O-N 2.81Å; L1121-T1125 PolarHBondContact O-OG1 2.82Å; E1122-T1125 PolarHBondContact O-N 3.27Å; S1123-T1125 VanDerWaalsContact C-N 3.3Å; S1123-T1125 PolarHBondContact O-N 2.95Å; T1125-A1128 PolarHBondContact O-N 2.93Å; T1125-L1129 WeakPolarHBondContact O-CB 3.42Å; T1125-L1129 PolarHBondContact O-N 2.9Å; T1125-Y1137 HydrophobicContact CG2-CD2 4.2Å; T1125-Y1137 HydrophobicContact CG2-CE2 3.85Å; T1125-W1140 PolarHBondContact OG1-O 2.91Å; T1125-L1141 HydrophobicContact CG2-CB 3.89Å; T1125-L1141 HydrophobicContact CG2-CD1 3.95Å; T1125-W1144 HydrophobicContact CG2-CE3 4.04Å; T1125-W1144 HydrophobicContact CG2-CZ3 4.43Å
1126	Q	91.3	Very high	89.1	Confident	96 Å²	96	31.1 Å²	31.1	45%	0.449	18%	0.177	S	C	.	.	H	α-helix	trans	-70.1	-40.7	176.7	-62.7	-63	-9.3	0	0	112.5	E1122 S1123 A1128 L1129 S1130	E1122-Q1126 WeakPolarHBondContact O-CG 3.41Å; E1122-Q1126 PolarHBondContact O-N 2.99Å; S1123-Q1126 PolarHBondContact O-N 3.38Å; Q1126-A1128 VanDerWaalsContact C-N 3.28Å; Q1126-A1128 PolarHBondContact O-N 3.15Å; Q1126-L1129 WeakPolarHBondContact O-CB 3.42Å; Q1126-L1129 PolarHBondContact O-N 3.5Å; Q1126-S1130 PolarHBondContact O-N 2.79Å; Q1126-S1130 PolarHBondContact O-OG 3.38Å
1127	L	91.5	Very high	89.6	Confident	10 Å²	10	30.9 Å²	30.9	5%	0.052	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-37.1	172.7	-72.2	172.8	0	0	0	111.7	I1055 L1057 L1081 S1123 F1131 G1132	I1055-L1127 HydrophobicContact CG2-CD2 3.71Å; L1057-L1127 HydrophobicContact CD2-CD2 3.87Å; L1057-L1127 WeakPolarHBondContact O-CD1 3.41Å; L1081-L1127 HydrophobicContact CD1-CB 3.91Å; L1081-L1127 HydrophobicContact CD2-CB 3.85Å; S1123-L1127 WeakPolarHBondContact O-CB 3.34Å; S1123-L1127 VanDerWaalsContact O-CG 3.3Å; S1123-L1127 WeakPolarHBondContact O-CG 3.45Å; S1123-L1127 PolarHBondContact O-N 3.08Å; L1127-F1131 HydrophobicContact CD2-CD2 4.12Å; L1127-F1131 HydrophobicContact CD2-CE2 4.3Å; L1127-F1131 WeakPolarHBondContact O-CA 3.15Å; L1127-F1131 WeakPolarHBondContact O-CB 3.34Å; L1127-F1131 PolarHBondContact O-N 3.28Å; L1127-G1132 PolarHBondContact O-N 3.14Å
1128	A	91.2	Very high	90	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-73	-33.9	176.3	0	0	0	0	0	112.2	L1081 Q1124 T1125 Q1126 G1132 E1136 K1183	L1081-A1128 HydrophobicContact CD2-CB 3.89Å; Q1124-A1128 VanDerWaalsContact O-CB 3.23Å; Q1124-A1128 WeakPolarHBondContact O-CB 3.23Å; Q1124-A1128 PolarHBondContact O-N 2.85Å; T1125-A1128 PolarHBondContact O-N 2.93Å; Q1126-A1128 VanDerWaalsContact C-N 3.28Å; Q1126-A1128 PolarHBondContact O-N 3.15Å; A1128-G1132 WeakPolarHBondContact O-CA 3.38Å; A1128-G1132 PolarHBondContact O-N 3.21Å; A1128-G1132 VanDerWaalsContact O-N 3.09Å; A1128-E1136 HydrophobicContact CB-CB 4.36Å; A1128-K1183 PolarHBondContact O-NZ 3.02Å
1129	L	90	Very high	90.2	Very high	61 Å²	61	35.7 Å²	35.7	32%	0.319	19%	0.189	S	C	.	.	H	α-helix	trans	-62	-47.1	171.7	-178.2	56	0	0	0	111.6	T1125 Q1126 Y1137 V1182 K1183	T1125-L1129 WeakPolarHBondContact O-CB 3.42Å; T1125-L1129 PolarHBondContact O-N 2.9Å; Q1126-L1129 WeakPolarHBondContact O-CB 3.42Å; Q1126-L1129 PolarHBondContact O-N 3.5Å; L1129-Y1137 HydrophobicContact CB-CD2 3.76Å; L1129-Y1137 HydrophobicContact CB-CE2 3.77Å; L1129-Y1137 HydrophobicContact CD1-CD2 4.25Å; L1129-Y1137 HydrophobicContact CD1-CE2 3.95Å; L1129-Y1137 HydrophobicContact CD2-CE2 4.4Å; L1129-Y1137 HydrophobicContact CG-CE2 4.25Å; L1129-V1182 HydrophobicContact CD1-CG1 3.37Å; L1129-K1183 HydrophobicContact CD1-CG 4.47Å; L1129-K1183 WeakPolarHBondContact O-CD 3.29Å; L1129-K1183 WeakPolarHBondContact O-CE 3.2Å; L1129-K1183 PolarHBondContact O-NZ 3.02Å
1130	S	86.3	Confident	90.5	Very high	71 Å²	71	32.3 Å²	32.3	50%	0.497	17%	0.171	S	C	.	.	H	α-helix	trans	-75	-51.3	179	-59.8	0	0	0	0	113	Q1126	Q1126-S1130 PolarHBondContact O-N 2.79Å; Q1126-S1130 PolarHBondContact O-OG 3.38Å
1131	F	85.1	Confident	90.7	Very high	15 Å²	15	32.3 Å²	32.3	7%	0.066	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-21.1	-163.2	-54.2	-55.8	0	0	0	114.8	P1031 F1034 L1046 H1048 I1055 P1080 L1127	P1031-F1131 HydrophobicContact CG-CB 3.81Å; P1031-F1131 HydrophobicContact CG-CD1 4.5Å; P1031-F1131 WeakPolarHBondContact CG-O 3.2Å; F1034-F1131 HydrophobicContact CD2-CD1 4.31Å; F1034-F1131 AromaticContact CD2-CE1 3.98Å; F1034-F1131 HydrophobicContact CD2-CE1 3.98Å; F1034-F1131 HydrophobicContact CE2-CD1 4.39Å; F1034-F1131 AromaticContact CE2-CE1 3.9Å; F1034-F1131 HydrophobicContact CE2-CE1 3.9Å; L1046-F1131 HydrophobicContact CD1-CD1 4.39Å; L1046-F1131 HydrophobicContact CD1-CD2 4.47Å; L1046-F1131 HydrophobicContact CD1-CG 4.34Å; L1046-F1131 HydrophobicContact CD2-CE1 4.19Å; L1046-F1131 HydrophobicContact CD2-CE2 4.24Å; L1046-F1131 HydrophobicContact CD2-CZ 3.91Å; H1048-F1131 AromaticContact CD2-CE1 3.65Å; H1048-F1131 AromaticContact CD2-CZ 3.75Å; I1055-F1131 HydrophobicContact CD1-CE2 3.78Å; I1055-F1131 HydrophobicContact CD1-CZ 3.73Å; P1080-F1131 VanDerWaalsContact CG-O 3.26Å; P1080-F1131 WeakPolarHBondContact CG-O 3.47Å; L1127-F1131 HydrophobicContact CD2-CD2 4.12Å; L1127-F1131 HydrophobicContact CD2-CE2 4.3Å; L1127-F1131 WeakPolarHBondContact O-CA 3.15Å; L1127-F1131 WeakPolarHBondContact O-CB 3.34Å; L1127-F1131 PolarHBondContact O-N 3.28Å
1132	G	83.5	Confident	90.7	Very high	6 Å²	6	34.4 Å²	34.4	6%	0.062	18%	0.184	C	C	.	.	S	Bend	trans	-72.6	177.6	179.3	0	0	0	0	0	114.5	L1127 A1128 E1136 K1183	L1127-G1132 PolarHBondContact O-N 3.14Å; A1128-G1132 WeakPolarHBondContact O-CA 3.38Å; A1128-G1132 PolarHBondContact O-N 3.21Å; A1128-G1132 VanDerWaalsContact O-N 3.09Å; G1132-E1136 WeakPolarHBondContact CA-OE2 3.48Å; G1132-K1183 WeakPolarHBondContact O-CE 3.39Å; G1132-K1183 PolarHBondContact O-NZ 3.28Å
1133	S	87.5	Confident	90.7	Very high	28 Å²	28	35.4 Å²	35.4	20%	0.196	19%	0.185	C	C	.	.			trans	-75.4	165.5	162.3	60.5	0	0	0	0	111.7	N1135 E1136 Y1137	S1133-N1135 PolarHBondContact O-N 3.23Å; S1133-E1136 PolarHBondContact N-OE2 3.44Å; S1133-E1136 PolarHBondContact O-N 2.96Å; S1133-E1136 WeakPolarHBondContact OG-CB 3.14Å; S1133-E1136 VanDerWaalsContact OG-CG 3.31Å; S1133-E1136 WeakPolarHBondContact OG-CG 3.45Å; S1133-E1136 PolarHBondContact OG-N 3.24Å; S1133-E1136 VanDerWaalsContact OG-N 3.09Å; S1133-E1136 PolarHBondContact OG-OE2 2.94Å; S1133-Y1137 PolarHBondContact O-N 3.08Å
1134	S	89	Confident	90.8	Very high	38 Å²	38	34.3 Å²	34.3	27%	0.266	18%	0.175	S	C	.	.	H	α-helix	trans	-58.5	-36.9	171.6	58.2	0	0	0	0	112.5	Y1137 R1138 K1183 I1185	S1134-Y1137 PolarHBondContact O-N 2.87Å; S1134-R1138 WeakPolarHBondContact O-CB 3.06Å; S1134-R1138 PolarHBondContact O-N 3.49Å; S1134-K1183 VanDerWaalsContact CB-O 3.22Å; S1134-K1183 WeakPolarHBondContact CB-O 3.24Å; S1134-I1185 WeakPolarHBondContact O-CD1 3.38Å
1135	N	90.5	Very high	90.9	Very high	90 Å²	90	34.2 Å²	34.2	48%	0.481	17%	0.174	S	C	.	.	H	α-helix	trans	-69	-40.8	175.7	-68.9	-39.5	0	0	0	112.7	P1077 S1133 Y1139	P1077-N1135 HydrophobicContact CB-CB 4.17Å; P1077-N1135 HydrophobicContact CG-CB 3.79Å; S1133-N1135 PolarHBondContact O-N 3.23Å; N1135-Y1139 WeakPolarHBondContact O-CB 3.47Å; N1135-Y1139 PolarHBondContact O-N 3.17Å
1136	E	90.8	Very high	90.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.5	-42.4	173.6	-75.9	165.9	127	0	0	111.3	P1077 G1079 P1080 L1081 S1082 A1128 G1132 S1133 Y1139 W1140	P1077-E1136 HydrophobicContact CG-CG 4.23Å; P1077-E1136 WeakPolarHBondContact O-CG 3.19Å; G1079-E1136 WeakPolarHBondContact CA-OE1 3.3Å; G1079-E1136 WeakPolarHBondContact CA-OE2 3.48Å; P1080-E1136 VanDerWaalsContact CD-OE2 3.32Å; P1080-E1136 WeakPolarHBondContact CD-OE2 3.45Å; L1081-E1136 PolarHBondContact N-OE1 3.23Å; S1082-E1136 VanDerWaalsContact CB-OE1 3.28Å; S1082-E1136 WeakPolarHBondContact CB-OE1 3.33Å; S1082-E1136 PolarHBondContact N-OE1 2.8Å; S1082-E1136 PolarHBondContact OG-OE1 3.26Å; A1128-E1136 HydrophobicContact CB-CB 4.36Å; G1132-E1136 WeakPolarHBondContact CA-OE2 3.48Å; S1133-E1136 PolarHBondContact N-OE2 3.44Å; S1133-E1136 PolarHBondContact O-N 2.96Å; S1133-E1136 WeakPolarHBondContact OG-CB 3.14Å; S1133-E1136 VanDerWaalsContact OG-CG 3.31Å; S1133-E1136 WeakPolarHBondContact OG-CG 3.45Å; S1133-E1136 PolarHBondContact OG-N 3.24Å; S1133-E1136 VanDerWaalsContact OG-N 3.09Å; S1133-E1136 PolarHBondContact OG-OE2 2.94Å; E1136-Y1139 PolarHBondContact O-N 2.56Å; E1136-W1140 PolarHBondContact O-N 2.85Å
1137	Y	93.2	Very high	90.8	Very high	14 Å²	14	35.9 Å²	35.9	6%	0.055	18%	0.178	C	C	.	.	H	α-helix	trans	-60.8	-49.3	176.2	173.3	-111.2	0	0	0	111.7	T1125 L1129 S1133 S1134 Y1139 W1140 L1141 V1182 L1190	T1125-Y1137 HydrophobicContact CG2-CD2 4.2Å; T1125-Y1137 HydrophobicContact CG2-CE2 3.85Å; L1129-Y1137 HydrophobicContact CB-CD2 3.76Å; L1129-Y1137 HydrophobicContact CB-CE2 3.77Å; L1129-Y1137 HydrophobicContact CD1-CD2 4.25Å; L1129-Y1137 HydrophobicContact CD1-CE2 3.95Å; L1129-Y1137 HydrophobicContact CD2-CE2 4.4Å; L1129-Y1137 HydrophobicContact CG-CE2 4.25Å; S1133-Y1137 PolarHBondContact O-N 3.08Å; S1134-Y1137 PolarHBondContact O-N 2.87Å; Y1137-Y1139 VanDerWaalsContact C-N 3.32Å; Y1137-Y1139 PolarHBondContact O-N 3.48Å; Y1137-W1140 PolarHBondContact O-N 2.89Å; Y1137-L1141 HydrophobicContact CE1-CD2 4.05Å; Y1137-L1141 WeakPolarHBondContact O-CB 3.33Å; Y1137-L1141 PolarHBondContact O-N 2.8Å; Y1137-V1182 HydrophobicContact CD1-CG1 3.99Å; Y1137-V1182 HydrophobicContact CE1-CB 4.33Å; Y1137-V1182 HydrophobicContact CE1-CG1 3.46Å; Y1137-V1182 VanDerWaalsContact CE1-CG1 3.46Å; Y1137-L1190 HydrophobicContact CE1-CD1 3.91Å
1138	R	93.4	Very high	90.8	Very high	91 Å²	91	35.4 Å²	35.4	34%	0.343	18%	0.176	S	C	.	.	H	α-helix	trans	-58.7	-42	175.7	-176.8	173.7	175.8	-154.5	3.8	111.9	S1134 T1142 I1185 L1190 E1193	S1134-R1138 WeakPolarHBondContact O-CB 3.06Å; S1134-R1138 PolarHBondContact O-N 3.49Å; R1138-T1142 VanDerWaalsContact O-CB 3.22Å; R1138-T1142 WeakPolarHBondContact O-CB 3.47Å; R1138-T1142 PolarHBondContact O-N 2.72Å; R1138-T1142 PolarHBondContact O-OG1 3.31Å; R1138-I1185 HydrophobicContact CB-CD1 4.1Å; R1138-L1190 HydrophobicContact CB-CD2 4.24Å; R1138-L1190 HydrophobicContact CG-CD2 3.79Å; R1138-E1193 IonicContact CZ-OE1 3.25Å; R1138-E1193 IonicContact CZ-OE2 3.52Å; R1138-E1193 IonicContact NE-OE1 3.5Å; R1138-E1193 IonicContact NE-OE2 3.52Å; R1138-E1193 PolarHBondContact NE-OE2 2.72Å; R1138-E1193 IonicContact NH2-OE1 3.24Å; R1138-E1193 PolarHBondContact NH2-OE1 2.9Å; R1138-E1193 IonicContact NH2-OE2 2.71Å; R1138-E1193 PolarHBondContact NH2-OE2 3.06Å
1139	Y	93.7	Very high	90.8	Very high	45 Å²	45	35.4 Å²	35.4	18%	0.176	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-53.6	176.9	174.9	-95.3	0	0	0	112.3	S1072 R1074 G1075 C1076 N1135 E1136 Y1137 T1142 R1143	S1072-Y1139 PolarHBondContact O-OH 3.03Å; R1074-Y1139 PolarHBondContact O-OH 3.19Å; G1075-Y1139 VanDerWaalsContact C-CE2 3.44Å; G1075-Y1139 VanDerWaalsContact O-CE2 3.27Å; G1075-Y1139 WeakPolarHBondContact O-CE2 3.32Å; C1076-Y1139 HydrophobicContact CB-CD1 3.86Å; C1076-Y1139 HydrophobicContact CB-CE1 3.59Å; N1135-Y1139 WeakPolarHBondContact O-CB 3.47Å; N1135-Y1139 PolarHBondContact O-N 3.17Å; E1136-Y1139 PolarHBondContact O-N 2.56Å; Y1137-Y1139 VanDerWaalsContact C-N 3.32Å; Y1137-Y1139 PolarHBondContact O-N 3.48Å; Y1139-T1142 PolarHBondContact O-N 2.81Å; Y1139-R1143 WeakPolarHBondContact O-CB 3.37Å; Y1139-R1143 PolarHBondContact O-N 3.06Å; Y1139-R1143 PolarHBondContact OH-NH1 3.37Å
1140	W	93.9	Very high	90.7	Very high	3 Å²	3	37.6 Å²	37.6	1%	0.011	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-42.2	-177.7	-71.9	117.8	0	0	0	112.2	F1120 L1121 Q1124 T1125 E1136 Y1137 T1142 R1143 W1144	F1120-W1140 HydrophobicContact CE1-CH2 4.12Å; F1120-W1140 AromaticContact CE1-CZ3 3.99Å; F1120-W1140 HydrophobicContact CE1-CZ3 3.99Å; F1120-W1140 HydrophobicContact CZ-CH2 4.29Å; L1121-W1140 HydrophobicContact CD2-CE3 3.94Å; L1121-W1140 HydrophobicContact CD2-CZ3 3.87Å; Q1124-W1140 HydrophobicContact CB-CB 4.37Å; Q1124-W1140 HydrophobicContact CB-CD2 3.6Å; Q1124-W1140 HydrophobicContact CB-CE3 3.74Å; Q1124-W1140 HydrophobicContact CB-CG 3.89Å; Q1124-W1140 HydrophobicContact CB-CZ2 4.46Å; Q1124-W1140 HydrophobicContact CB-CZ3 4.24Å; Q1124-W1140 HydrophobicContact CG-CD2 4.21Å; Q1124-W1140 HydrophobicContact CG-CE3 4.1Å; Q1124-W1140 HydrophobicContact CG-CH2 4.14Å; Q1124-W1140 HydrophobicContact CG-CZ2 4.23Å; Q1124-W1140 HydrophobicContact CG-CZ3 4.08Å; T1125-W1140 PolarHBondContact OG1-O 2.91Å; E1136-W1140 PolarHBondContact O-N 2.85Å; Y1137-W1140 PolarHBondContact O-N 2.89Å; W1140-T1142 PolarHBondContact O-N 3.15Å; W1140-R1143 PolarHBondContact O-N 3.16Å; W1140-W1144 WeakPolarHBondContact O-CB 3.3Å; W1140-W1144 PolarHBondContact O-N 2.78Å
1141	L	93.8	Very high	90.7	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.026	17%	0.169	C	C	.	.	H	α-helix	trans	-58.8	-46.6	174.5	-179.3	65.1	0	0	0	111.8	T1125 Y1137 R1143 W1144 F1145 I1160 L1164 L1190 L1194	T1125-L1141 HydrophobicContact CG2-CB 3.89Å; T1125-L1141 HydrophobicContact CG2-CD1 3.95Å; Y1137-L1141 HydrophobicContact CE1-CD2 4.05Å; Y1137-L1141 WeakPolarHBondContact O-CB 3.33Å; Y1137-L1141 PolarHBondContact O-N 2.8Å; L1141-R1143 VanDerWaalsContact C-N 3.29Å; L1141-R1143 PolarHBondContact O-N 2.82Å; L1141-W1144 HydrophobicContact CD1-CE3 4.33Å; L1141-W1144 PolarHBondContact O-N 2.8Å; L1141-F1145 VanDerWaalsContact O-CB 3.25Å; L1141-F1145 WeakPolarHBondContact O-CB 3.29Å; L1141-F1145 PolarHBondContact O-N 2.76Å; L1141-I1160 HydrophobicContact CD1-CG2 4.16Å; L1141-L1164 HydrophobicContact CD2-CD1 4.39Å; L1141-L1190 HydrophobicContact CD2-CD1 4.39Å; L1141-L1194 HydrophobicContact CD1-CD1 4.39Å; L1141-L1194 HydrophobicContact CD2-CD1 4.05Å; L1141-L1194 HydrophobicContact CG-CD1 4Å; L1141-L1194 HydrophobicContact CG-CD2 4.46Å
1142	T	93.1	Very high	90.8	Very high	46 Å²	46	38 Å²	38	28%	0.282	18%	0.181	S	C	.	.	H	α-helix	trans	-61.5	-38.3	177.1	-59.9	0	0	0	0	111.7	R1138 Y1139 W1140 R1146 L1197	R1138-T1142 VanDerWaalsContact O-CB 3.22Å; R1138-T1142 WeakPolarHBondContact O-CB 3.47Å; R1138-T1142 PolarHBondContact O-N 2.72Å; R1138-T1142 PolarHBondContact O-OG1 3.31Å; Y1139-T1142 PolarHBondContact O-N 2.81Å; W1140-T1142 PolarHBondContact O-N 3.15Å; T1142-R1146 WeakPolarHBondContact O-CB 3.5Å; T1142-R1146 PolarHBondContact O-N 3.46Å; T1142-R1146 VanDerWaalsContact O-N 3.13Å; T1142-L1197 HydrophobicContact CG2-CD1 4.01Å
1143	R	92	Very high	90.9	Very high	79 Å²	79	40.4 Å²	40.4	30%	0.298	19%	0.191	S	C	.	.	H	α-helix	trans	-73.5	-39.1	178.9	-166	170.1	-172.8	118.3	8.4	112.6	N1071 S1072 L1121 Y1139 W1140 L1141 Q1147	N1071-R1143 PolarHBondContact O-NH2 3.15Å; S1072-R1143 VanDerWaalsContact CA-CZ 3.44Å; S1072-R1143 PolarHBondContact O-NH1 3.36Å; S1072-R1143 PolarHBondContact OG-NE 2.94Å; S1072-R1143 PolarHBondContact OG-NH2 3.09Å; L1121-R1143 HydrophobicContact CD2-CG 4.18Å; Y1139-R1143 WeakPolarHBondContact O-CB 3.37Å; Y1139-R1143 PolarHBondContact O-N 3.06Å; Y1139-R1143 PolarHBondContact OH-NH1 3.37Å; W1140-R1143 PolarHBondContact O-N 3.16Å; L1141-R1143 VanDerWaalsContact C-N 3.29Å; L1141-R1143 PolarHBondContact O-N 2.82Å; R1143-Q1147 PolarHBondContact O-N 3.26Å; R1143-Q1147 VanDerWaalsContact O-N 3.13Å
1144	W	93.6	Very high	91	Very high	18 Å²	18	43 Å²	43	7%	0.068	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-47.5	175	-174.2	34.5	0	0	0	111.8	L1121 E1122 T1125 W1140 L1141 R1146 Q1147 L1148 I1160	L1121-W1144 HydrophobicContact CB-CB 3.86Å; L1121-W1144 HydrophobicContact CB-CG 3.89Å; E1122-W1144 HydrophobicContact CB-CD2 4.4Å; E1122-W1144 HydrophobicContact CB-CH2 4.23Å; E1122-W1144 HydrophobicContact CB-CZ2 3.57Å; E1122-W1144 HydrophobicContact CG-CH2 3.75Å; E1122-W1144 HydrophobicContact CG-CZ2 3.45Å; E1122-W1144 VanDerWaalsContact CG-CZ2 3.45Å; T1125-W1144 HydrophobicContact CG2-CE3 4.04Å; T1125-W1144 HydrophobicContact CG2-CZ3 4.43Å; W1140-W1144 WeakPolarHBondContact O-CB 3.3Å; W1140-W1144 PolarHBondContact O-N 2.78Å; L1141-W1144 HydrophobicContact CD1-CE3 4.33Å; L1141-W1144 PolarHBondContact O-N 2.8Å; W1144-R1146 VanDerWaalsContact C-N 3.32Å; W1144-R1146 PolarHBondContact O-N 2.91Å; W1144-Q1147 WeakPolarHBondContact O-CB 3.47Å; W1144-Q1147 PolarHBondContact O-N 2.82Å; W1144-L1148 HydrophobicContact CD2-CD1 4.23Å; W1144-L1148 HydrophobicContact CG-CD1 4.43Å; W1144-L1148 HydrophobicContact CZ2-CD1 4.27Å; W1144-L1148 WeakPolarHBondContact O-CG 3.32Å; W1144-L1148 PolarHBondContact O-N 3.04Å; W1144-I1160 HydrophobicContact CD2-CD1 4.47Å; W1144-I1160 HydrophobicContact CE3-CD1 4.01Å; W1144-I1160 HydrophobicContact CH2-CD1 3.9Å; W1144-I1160 HydrophobicContact CH2-CG1 4.48Å; W1144-I1160 HydrophobicContact CZ2-CD1 4.36Å; W1144-I1160 HydrophobicContact CZ3-CD1 3.7Å; W1144-I1160 HydrophobicContact CZ3-CG1 4.29Å
1145	F	93.3	Very high	90.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-38.3	179.1	-162.6	-98.9	0	0	0	112.4	L1141 L1148 I1149 V1157 I1160 I1161 L1194 L1197 F1198	L1141-F1145 VanDerWaalsContact O-CB 3.25Å; L1141-F1145 WeakPolarHBondContact O-CB 3.29Å; L1141-F1145 PolarHBondContact O-N 2.76Å; F1145-L1148 PolarHBondContact O-N 2.99Å; F1145-I1149 HydrophobicContact CD1-CD1 3.65Å; F1145-I1149 HydrophobicContact CD1-CG1 4.39Å; F1145-I1149 HydrophobicContact CE1-CD1 3.5Å; F1145-I1149 HydrophobicContact CE1-CG1 4.32Å; F1145-I1149 HydrophobicContact CZ-CD1 4.47Å; F1145-I1149 WeakPolarHBondContact O-CG1 3.4Å; F1145-I1149 PolarHBondContact O-N 3.06Å; F1145-V1157 HydrophobicContact CE1-CG1 4.47Å; F1145-V1157 HydrophobicContact CE2-CB 4.39Å; F1145-V1157 HydrophobicContact CE2-CG1 3.94Å; F1145-V1157 HydrophobicContact CZ-CG1 3.67Å; F1145-I1160 HydrophobicContact CD2-CB 4.26Å; F1145-I1160 HydrophobicContact CD2-CD1 4.17Å; F1145-I1160 HydrophobicContact CD2-CG2 3.85Å; F1145-I1160 HydrophobicContact CE2-CB 4.13Å; F1145-I1160 HydrophobicContact CE2-CG2 3.96Å; F1145-I1161 HydrophobicContact CE1-CD1 4.42Å; F1145-I1161 HydrophobicContact CE2-CD1 3.86Å; F1145-I1161 HydrophobicContact CE2-CG1 3.74Å; F1145-I1161 HydrophobicContact CZ-CD1 3.59Å; F1145-I1161 HydrophobicContact CZ-CG1 3.52Å; F1145-L1194 HydrophobicContact CB-CD1 4.4Å; F1145-L1194 HydrophobicContact CB-CD2 3.83Å; F1145-L1194 HydrophobicContact CD1-CB 3.77Å; F1145-L1194 HydrophobicContact CD1-CD1 4.44Å; F1145-L1194 HydrophobicContact CD1-CD2 4.05Å; F1145-L1194 HydrophobicContact CD1-CG 4.29Å; F1145-L1194 HydrophobicContact CD2-CD1 3.99Å; F1145-L1194 HydrophobicContact CE1-CB 3.7Å; F1145-L1194 WeakPolarHBondContact CE1-O 3.45Å; F1145-L1194 HydrophobicContact CE2-CD1 4.32Å; F1145-L1194 HydrophobicContact CG-CB 4.21Å; F1145-L1194 HydrophobicContact CG-CD1 4.04Å; F1145-L1194 HydrophobicContact CG-CD2 3.98Å; F1145-L1194 HydrophobicContact CG-CG 4.3Å; F1145-L1194 HydrophobicContact CZ-CB 4.11Å; F1145-L1197 HydrophobicContact CD1-CD1 4.04Å; F1145-F1198 HydrophobicContact CE1-CD2 4.25Å; F1145-F1198 AromaticContact CE1-CE2 3.72Å; F1145-F1198 HydrophobicContact CE1-CE2 3.72Å; F1145-F1198 AromaticContact CZ-CE2 3.77Å; F1145-F1198 HydrophobicContact CZ-CE2 3.77Å; F1145-F1198 HydrophobicContact CZ-CZ 4.35Å
1146	R	92.1	Very high	90.9	Very high	95 Å²	95	46.6 Å²	46.6	36%	0.358	21%	0.206	S	C	.	.	H	α-helix	trans	-57.8	-49.3	169.1	172.6	-179.3	-72	-90	-0.8	111.8	T1142 W1144 L1148 I1149 E1150 L1197 L1200	T1142-R1146 WeakPolarHBondContact O-CB 3.5Å; T1142-R1146 PolarHBondContact O-N 3.46Å; T1142-R1146 VanDerWaalsContact O-N 3.13Å; W1144-R1146 VanDerWaalsContact C-N 3.32Å; W1144-R1146 PolarHBondContact O-N 2.91Å; R1146-L1148 VanDerWaalsContact C-N 3.32Å; R1146-L1148 PolarHBondContact O-N 2.9Å; R1146-I1149 PolarHBondContact O-N 2.8Å; R1146-E1150 WeakPolarHBondContact CD-OE1 3.35Å; R1146-E1150 HydrophobicContact CG-CG 4.41Å; R1146-E1150 WeakPolarHBondContact CG-OE1 3.38Å; R1146-E1150 IonicContact NH1-OE1 2.87Å; R1146-E1150 PolarHBondContact NH1-OE1 3.08Å; R1146-E1150 WeakPolarHBondContact O-CG 3.46Å; R1146-E1150 PolarHBondContact O-N 3.15Å; R1146-L1197 HydrophobicContact CB-CD1 4.34Å; R1146-L1200 HydrophobicContact CG-CD1 4.1Å
1147	Q	89.3	Confident	90.9	Very high	39 Å²	39	46.6 Å²	46.6	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-43.4	178.4	-175.5	65.3	59.7	0	0	111.2	Q1118 L1121 R1143 W1144 I1149 E1150 D1151	Q1118-Q1147 HydrophobicContact CG-CG 4.31Å; L1121-Q1147 HydrophobicContact CD1-CB 3.63Å; L1121-Q1147 HydrophobicContact CD1-CG 3.88Å; R1143-Q1147 PolarHBondContact O-N 3.26Å; R1143-Q1147 VanDerWaalsContact O-N 3.13Å; W1144-Q1147 WeakPolarHBondContact O-CB 3.47Å; W1144-Q1147 PolarHBondContact O-N 2.82Å; Q1147-I1149 PolarHBondContact O-N 2.84Å; Q1147-E1150 PolarHBondContact O-N 3.18Å; Q1147-D1151 WeakPolarHBondContact CG-OD2 3.28Å; Q1147-D1151 PolarHBondContact NE2-OD2 3.49Å; Q1147-D1151 WeakPolarHBondContact O-CB 3.17Å; Q1147-D1151 PolarHBondContact O-N 2.81Å
1148	L	91.4	Very high	90.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-34.7	176.9	-65.4	172.6	0	0	0	113.3	W1144 F1145 R1146 N1152 E1153 R1156 V1157 I1160	W1144-L1148 HydrophobicContact CD2-CD1 4.23Å; W1144-L1148 HydrophobicContact CG-CD1 4.43Å; W1144-L1148 HydrophobicContact CZ2-CD1 4.27Å; W1144-L1148 WeakPolarHBondContact O-CG 3.32Å; W1144-L1148 PolarHBondContact O-N 3.04Å; F1145-L1148 PolarHBondContact O-N 2.99Å; R1146-L1148 VanDerWaalsContact C-N 3.32Å; R1146-L1148 PolarHBondContact O-N 2.9Å; L1148-N1152 PolarHBondContact O-N 3.48Å; L1148-E1153 HydrophobicContact CB-CB 4.29Å; L1148-E1153 HydrophobicContact CD2-CB 3.86Å; L1148-E1153 HydrophobicContact CD2-CG 3.82Å; L1148-E1153 PolarHBondContact O-N 3.06Å; L1148-R1156 HydrophobicContact CD1-CB 4.09Å; L1148-R1156 HydrophobicContact CD2-CB 4.17Å; L1148-V1157 HydrophobicContact CB-CG2 3.74Å; L1148-I1160 HydrophobicContact CD1-CD1 3.53Å
1149	I	90.7	Very high	90.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.7	-42.8	173.2	-78.3	174.3	0	0	0	111.6	F1145 R1146 Q1147 D1151 N1152 V1157 L1197 F1198 L1200 N1201 L1204	F1145-I1149 HydrophobicContact CD1-CD1 3.65Å; F1145-I1149 HydrophobicContact CD1-CG1 4.39Å; F1145-I1149 HydrophobicContact CE1-CD1 3.5Å; F1145-I1149 HydrophobicContact CE1-CG1 4.32Å; F1145-I1149 HydrophobicContact CZ-CD1 4.47Å; F1145-I1149 WeakPolarHBondContact O-CG1 3.4Å; F1145-I1149 PolarHBondContact O-N 3.06Å; R1146-I1149 PolarHBondContact O-N 2.8Å; Q1147-I1149 PolarHBondContact O-N 2.84Å; I1149-D1151 VanDerWaalsContact C-N 3.31Å; I1149-N1152 PolarHBondContact O-N 2.99Å; I1149-V1157 HydrophobicContact CG1-CG2 4.24Å; I1149-L1197 HydrophobicContact CD1-CB 3.86Å; I1149-F1198 HydrophobicContact CD1-CD2 3.86Å; I1149-F1198 HydrophobicContact CD1-CE2 4.12Å; I1149-F1198 HydrophobicContact CD1-CG 4.21Å; I1149-L1200 HydrophobicContact CG2-CB 4.17Å; I1149-N1201 HydrophobicContact CG2-CB 3.77Å; I1149-N1201 PolarHBondContact O-ND2 3.28Å; I1149-L1204 HydrophobicContact CB-CD1 4.22Å; I1149-L1204 HydrophobicContact CG1-CD1 3.98Å; I1149-L1204 HydrophobicContact CG2-CD1 4.19Å
1150	E	88	Confident	90.5	Very high	106 Å²	106	48.1 Å²	48.1	50%	0.495	22%	0.218	S	C	.	.	H	α-helix	trans	-69.5	-29.5	177.2	-70.1	171.2	-165.1	0	0	111.4	R1146 Q1147	R1146-E1150 WeakPolarHBondContact CD-OE1 3.35Å; R1146-E1150 HydrophobicContact CG-CG 4.41Å; R1146-E1150 WeakPolarHBondContact CG-OE1 3.38Å; R1146-E1150 IonicContact NH1-OE1 2.87Å; R1146-E1150 PolarHBondContact NH1-OE1 3.08Å; R1146-E1150 WeakPolarHBondContact O-CG 3.46Å; R1146-E1150 PolarHBondContact O-N 3.15Å; Q1147-E1150 PolarHBondContact O-N 3.18Å
1151	D	86.9	Confident	90.4	Very high	35 Å²	35	48 Å²	48	19%	0.187	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-6.1	175.6	-83.2	-43.9	0	0	0	115.2	K1114 Q1118 Q1147 I1149 E1153	K1114-D1151 WeakPolarHBondContact CD-OD1 3.43Å; K1114-D1151 WeakPolarHBondContact CE-OD1 3.35Å; K1114-D1151 PolarHBondContact NZ-O 3.27Å; K1114-D1151 VanDerWaalsContact NZ-O 3.07Å; K1114-D1151 IonicContact NZ-OD1 2.76Å; K1114-D1151 PolarHBondContact NZ-OD1 3.46Å; Q1118-D1151 VanDerWaalsContact NE2-CG 3.32Å; Q1118-D1151 PolarHBondContact NE2-OD2 3.16Å; Q1147-D1151 WeakPolarHBondContact CG-OD2 3.28Å; Q1147-D1151 PolarHBondContact NE2-OD2 3.49Å; Q1147-D1151 WeakPolarHBondContact O-CB 3.17Å; Q1147-D1151 PolarHBondContact O-N 2.81Å; I1149-D1151 VanDerWaalsContact C-N 3.31Å; D1151-E1153 HydrophobicContact CB-CG 3.91Å
1152	N	87.4	Confident	90.1	Very high	59 Å²	59	50.7 Å²	50.7	32%	0.316	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	37.9	-176.9	-148.4	99.2	0	0	0	115.6	L1148 I1149 E1154 N1201	L1148-N1152 PolarHBondContact O-N 3.48Å; I1149-N1152 PolarHBondContact O-N 2.99Å; N1152-E1154 VanDerWaalsContact C-N 3.35Å; N1152-E1154 PolarHBondContact ND2-OE1 3.38Å; N1152-E1154 PolarHBondContact O-N 3.28Å; N1152-N1201 PolarHBondContact OD1-ND2 2.97Å
1153	E	86	Confident	89.8	Confident	58 Å²	58	52.4 Å²	52.4	27%	0.271	24%	0.237	S	C	.	.			trans	-82.5	67.7	-179.2	-59.2	-65.1	159.4	0	0	112.4	K1114 Q1118 L1148 D1151 E1155 R1156 V1157	K1114-E1153 WeakPolarHBondContact CE-OE1 3.13Å; K1114-E1153 IonicContact NZ-OE1 2.71Å; K1114-E1153 PolarHBondContact NZ-OE1 3.4Å; Q1118-E1153 PolarHBondContact NE2-OE1 2.65Å; L1148-E1153 HydrophobicContact CB-CB 4.29Å; L1148-E1153 HydrophobicContact CD2-CB 3.86Å; L1148-E1153 HydrophobicContact CD2-CG 3.82Å; L1148-E1153 PolarHBondContact O-N 3.06Å; D1151-E1153 HydrophobicContact CB-CG 3.91Å; E1153-E1155 VanDerWaalsContact C-N 3.31Å; E1153-E1155 PolarHBondContact O-N 2.95Å; E1153-E1155 VanDerWaalsContact O-N 3.14Å; E1153-R1156 HydrophobicContact CB-CB 4.17Å; E1153-R1156 PolarHBondContact O-N 3.37Å; E1153-R1156 VanDerWaalsContact O-N 3.17Å; E1153-V1157 WeakPolarHBondContact O-CG2 3.46Å; E1153-V1157 PolarHBondContact O-N 3.37Å
1154	E	88.2	Confident	89.7	Confident	81 Å²	81	48.7 Å²	48.7	38%	0.379	22%	0.223	S	C	.	.	H	α-helix	trans	-50	-44.8	-168.4	-52.3	-154.6	166.8	0	0	114.3	N1152 V1157 R1158 L1204 L1207	N1152-E1154 VanDerWaalsContact C-N 3.35Å; N1152-E1154 PolarHBondContact ND2-OE1 3.38Å; N1152-E1154 PolarHBondContact O-N 3.28Å; E1154-V1157 WeakPolarHBondContact O-CB 3.35Å; E1154-V1157 PolarHBondContact O-N 2.89Å; E1154-R1158 WeakPolarHBondContact O-CB 3.5Å; E1154-R1158 PolarHBondContact O-N 3.04Å; E1154-L1204 HydrophobicContact CG-CD2 3.64Å; E1154-L1207 HydrophobicContact CB-CD2 4.16Å
1155	E	88.4	Confident	89.3	Confident	119 Å²	119	48.2 Å²	48.2	56%	0.556	22%	0.222	S	C	*	.	H	α-helix	trans	-75.4	-34.1	-174	-164.2	62.3	-172.7	0	0	112.8	E1153 V1157 R1158 Q1159	E1153-E1155 VanDerWaalsContact C-N 3.31Å; E1153-E1155 PolarHBondContact O-N 2.95Å; E1153-E1155 VanDerWaalsContact O-N 3.14Å; E1155-V1157 VanDerWaalsContact C-N 3.33Å; E1155-R1158 PolarHBondContact O-N 2.85Å; E1155-R1158 IonicContact OE2-CZ 2.78Å; E1155-R1158 IonicContact OE2-NH1 3.94Å; E1155-R1158 PolarHBondContact OE2-NH1 2.98Å; E1155-Q1159 VanDerWaalsContact O-CB 3.3Å; E1155-Q1159 WeakPolarHBondContact O-CB 3.25Å; E1155-Q1159 PolarHBondContact O-N 3.27Å
1156	R	89.9	Confident	88.5	Confident	85 Å²	85	48.8 Å²	48.8	32%	0.321	23%	0.228	S	C	.	.	H	α-helix	trans	-65.9	-39.8	171.5	-73.1	178.8	146.1	-153.5	-24.9	110.5	E1122 L1148 E1153 I1160	E1122-R1156 IonicContact OE1-NH2 3.22Å; E1122-R1156 IonicContact OE2-CZ 2.62Å; E1122-R1156 IonicContact OE2-NH1 3.45Å; E1122-R1156 IonicContact OE2-NH2 2.79Å; E1122-R1156 PolarHBondContact OE2-NH2 2.88Å; L1148-R1156 HydrophobicContact CD1-CB 4.09Å; L1148-R1156 HydrophobicContact CD2-CB 4.17Å; E1153-R1156 HydrophobicContact CB-CB 4.17Å; E1153-R1156 PolarHBondContact O-N 3.37Å; E1153-R1156 VanDerWaalsContact O-N 3.17Å; R1156-I1160 WeakPolarHBondContact O-CD1 3.32Å; R1156-I1160 VanDerWaalsContact O-CG1 3.3Å; R1156-I1160 WeakPolarHBondContact O-CG1 3.43Å; R1156-I1160 PolarHBondContact O-N 3.05Å; R1156-I1160 VanDerWaalsContact O-N 3.13Å
1157	V	91.2	Very high	87.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.1	-46.1	175.2	169.8	0	0	0	0	111.4	F1145 L1148 I1149 E1153 E1154 E1155 I1161 F1198 L1207	F1145-V1157 HydrophobicContact CE1-CG1 4.47Å; F1145-V1157 HydrophobicContact CE2-CB 4.39Å; F1145-V1157 HydrophobicContact CE2-CG1 3.94Å; F1145-V1157 HydrophobicContact CZ-CG1 3.67Å; L1148-V1157 HydrophobicContact CB-CG2 3.74Å; I1149-V1157 HydrophobicContact CG1-CG2 4.24Å; E1153-V1157 WeakPolarHBondContact O-CG2 3.46Å; E1153-V1157 PolarHBondContact O-N 3.37Å; E1154-V1157 WeakPolarHBondContact O-CB 3.35Å; E1154-V1157 PolarHBondContact O-N 2.89Å; E1155-V1157 VanDerWaalsContact C-N 3.33Å; V1157-I1161 PolarHBondContact O-N 3.06Å; V1157-F1198 HydrophobicContact CG1-CE1 4.09Å; V1157-F1198 HydrophobicContact CG1-CE2 4.07Å; V1157-F1198 HydrophobicContact CG1-CZ 3.36Å; V1157-L1207 HydrophobicContact CB-CD2 4.18Å; V1157-L1207 HydrophobicContact CG1-CD2 3.77Å
1158	R	91.5	Very high	86.1	Confident	46 Å²	46	49 Å²	49	17%	0.174	24%	0.244	C	C	.	.	H	α-helix	trans	-57.3	-52.1	174	178.3	177.7	-76.6	113.1	-1.3	111.2	E1154 E1155 I1160 I1161 Q1162 L1207 E1210 L1211	E1154-R1158 WeakPolarHBondContact O-CB 3.5Å; E1154-R1158 PolarHBondContact O-N 3.04Å; E1155-R1158 PolarHBondContact O-N 2.85Å; E1155-R1158 IonicContact OE2-CZ 2.78Å; E1155-R1158 IonicContact OE2-NH1 3.94Å; E1155-R1158 PolarHBondContact OE2-NH1 2.98Å; R1158-I1160 PolarHBondContact O-N 3.05Å; R1158-I1161 PolarHBondContact O-N 3.46Å; R1158-Q1162 HydrophobicContact CG-CG 4.34Å; R1158-Q1162 WeakPolarHBondContact O-CB 3.24Å; R1158-Q1162 WeakPolarHBondContact O-CG 3.19Å; R1158-Q1162 PolarHBondContact O-N 3.28Å; R1158-L1207 HydrophobicContact CB-CD1 4.18Å; R1158-E1210 IonicContact CZ-OE1 3.22Å; R1158-E1210 VanDerWaalsContact CZ-OE1 3.26Å; R1158-E1210 IonicContact CZ-OE2 2.77Å; R1158-E1210 IonicContact NE-OE1 2.93Å; R1158-E1210 PolarHBondContact NE-OE1 3.33Å; R1158-E1210 VanDerWaalsContact NH2-CD 3.29Å; R1158-E1210 IonicContact NH2-OE1 2.79Å; R1158-E1210 PolarHBondContact NH2-OE1 3.02Å; R1158-E1210 IonicContact NH2-OE2 3.26Å; R1158-E1210 PolarHBondContact NH2-OE2 2.93Å; R1158-L1211 HydrophobicContact CG-CD2 4.33Å
1159	Q	90	Very high	84.3	Confident	115 Å²	115	56.3 Å²	56.3	54%	0.537	28%	0.278	S	S	.	.	H	α-helix	trans	-61	-40	-176.3	-177.8	61.1	94.1	0	0	113.1	E1155 Q1162 D1163	E1155-Q1159 VanDerWaalsContact O-CB 3.3Å; E1155-Q1159 WeakPolarHBondContact O-CB 3.25Å; E1155-Q1159 PolarHBondContact O-N 3.27Å; Q1159-Q1162 PolarHBondContact O-N 2.74Å; Q1159-D1163 PolarHBondContact O-N 3.33Å
1160	I	90.7	Very high	82.2	Confident	22 Å²	22	61.3 Å²	61.3	11%	0.113	32%	0.32	C	S	.	.	H	α-helix	trans	-65.5	-44.5	177.5	-70.1	165.8	0	0	0	111.2	L1141 W1144 F1145 L1148 R1156 R1158 D1163 L1164 L1194	L1141-I1160 HydrophobicContact CD1-CG2 4.16Å; W1144-I1160 HydrophobicContact CD2-CD1 4.47Å; W1144-I1160 HydrophobicContact CE3-CD1 4.01Å; W1144-I1160 HydrophobicContact CH2-CD1 3.9Å; W1144-I1160 HydrophobicContact CH2-CG1 4.48Å; W1144-I1160 HydrophobicContact CZ2-CD1 4.36Å; W1144-I1160 HydrophobicContact CZ3-CD1 3.7Å; W1144-I1160 HydrophobicContact CZ3-CG1 4.29Å; F1145-I1160 HydrophobicContact CD2-CB 4.26Å; F1145-I1160 HydrophobicContact CD2-CD1 4.17Å; F1145-I1160 HydrophobicContact CD2-CG2 3.85Å; F1145-I1160 HydrophobicContact CE2-CB 4.13Å; F1145-I1160 HydrophobicContact CE2-CG2 3.96Å; L1148-I1160 HydrophobicContact CD1-CD1 3.53Å; R1156-I1160 WeakPolarHBondContact O-CD1 3.32Å; R1156-I1160 VanDerWaalsContact O-CG1 3.3Å; R1156-I1160 WeakPolarHBondContact O-CG1 3.43Å; R1156-I1160 PolarHBondContact O-N 3.05Å; R1156-I1160 VanDerWaalsContact O-N 3.13Å; R1158-I1160 PolarHBondContact O-N 3.05Å; I1160-D1163 PolarHBondContact O-N 3.08Å; I1160-L1164 HydrophobicContact CG2-CD1 4.15Å; I1160-L1164 WeakPolarHBondContact O-CG 3.42Å; I1160-L1164 PolarHBondContact O-N 3.22Å; I1160-L1164 VanDerWaalsContact O-N 3.12Å; I1160-L1194 HydrophobicContact CG2-CD1 4.18Å
1161	I	90.3	Very high	80	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-70.3	-35.8	179.2	-63.5	-62.1	0	0	0	111.3	F1145 V1157 R1158 L1164 I1165 L1194 L1195 L1211	F1145-I1161 HydrophobicContact CE1-CD1 4.42Å; F1145-I1161 HydrophobicContact CE2-CD1 3.86Å; F1145-I1161 HydrophobicContact CE2-CG1 3.74Å; F1145-I1161 HydrophobicContact CZ-CD1 3.59Å; F1145-I1161 HydrophobicContact CZ-CG1 3.52Å; V1157-I1161 PolarHBondContact O-N 3.06Å; R1158-I1161 PolarHBondContact O-N 3.46Å; I1161-L1164 HydrophobicContact CD1-CD1 4.47Å; I1161-L1164 CarbonylContact O-C 3.52Å; I1161-L1164 PolarHBondContact O-N 2.82Å; I1161-L1164 VanDerWaalsContact O-N 3.14Å; I1161-I1165 HydrophobicContact CG2-CD1 3.64Å; I1161-I1165 HydrophobicContact CG2-CG1 4.22Å; I1161-I1165 WeakPolarHBondContact O-CG1 3.39Å; I1161-I1165 PolarHBondContact O-N 3.41Å; I1161-L1194 HydrophobicContact CD1-CB 3.82Å; I1161-L1194 HydrophobicContact CD1-CD1 4.13Å; I1161-L1195 HydrophobicContact CD1-CG 4.45Å; I1161-L1211 HydrophobicContact CB-CD1 4.02Å; I1161-L1211 HydrophobicContact CB-CD2 4.16Å; I1161-L1211 HydrophobicContact CG1-CD1 4.07Å; I1161-L1211 HydrophobicContact CG2-CB 4.07Å; I1161-L1211 HydrophobicContact CG2-CD1 4.25Å; I1161-L1211 HydrophobicContact CG2-CD2 4.03Å; I1161-L1211 HydrophobicContact CG2-CG 4.35Å
1162	Q	88	Confident	77.8	Confident	62 Å²	62	65 Å²	65	29%	0.29	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-40.1	175	-73.5	178.9	-10.7	0	0	112.6	R1158 Q1159 L1164 I1165 G1166 L1211 M1214	R1158-Q1162 HydrophobicContact CG-CG 4.34Å; R1158-Q1162 WeakPolarHBondContact O-CB 3.24Å; R1158-Q1162 WeakPolarHBondContact O-CG 3.19Å; R1158-Q1162 PolarHBondContact O-N 3.28Å; Q1159-Q1162 PolarHBondContact O-N 2.74Å; Q1162-L1164 VanDerWaalsContact C-N 3.29Å; Q1162-L1164 PolarHBondContact O-N 2.96Å; Q1162-I1165 PolarHBondContact O-N 3.26Å; Q1162-G1166 PolarHBondContact O-N 2.82Å; Q1162-L1211 HydrophobicContact CG-CD2 4.48Å; Q1162-M1214 HydrophobicContact CG-CE 4.03Å; Q1162-M1214 HydrophobicContact CG-SD 4.45Å
1163	D	87.6	Confident	75.7	Confident	81 Å²	81	72.3 Å²	72.3	43%	0.433	38%	0.379	S	S	.	.	H	α-helix	trans	-66.8	-29.2	171.8	-178	53.6	0	0	0	112.4	Q1159 I1160 W1178 R1187	Q1159-D1163 PolarHBondContact O-N 3.33Å; I1160-D1163 PolarHBondContact O-N 3.08Å; D1163-W1178 PolarHBondContact O-NE1 2.7Å; D1163-R1187 PolarHBondContact O-NH1 2.91Å; D1163-R1187 IonicContact OD1-NH1 2.69Å; D1163-R1187 PolarHBondContact OD1-NH1 2.83Å; D1163-R1187 IonicContact OD2-CZ 3.74Å; D1163-R1187 IonicContact OD2-NH1 2.69Å; D1163-R1187 PolarHBondContact OD2-NH1 3.03Å
1164	L	88.4	Confident	73.6	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-79.7	-18.3	174	-68.2	171.8	0	0	0	114.3	L1141 I1160 I1161 Q1162 R1187 L1190 A1191 L1194	L1141-L1164 HydrophobicContact CD2-CD1 4.39Å; I1160-L1164 HydrophobicContact CG2-CD1 4.15Å; I1160-L1164 WeakPolarHBondContact O-CG 3.42Å; I1160-L1164 PolarHBondContact O-N 3.22Å; I1160-L1164 VanDerWaalsContact O-N 3.12Å; I1161-L1164 HydrophobicContact CD1-CD1 4.47Å; I1161-L1164 CarbonylContact O-C 3.52Å; I1161-L1164 PolarHBondContact O-N 2.82Å; I1161-L1164 VanDerWaalsContact O-N 3.14Å; Q1162-L1164 VanDerWaalsContact C-N 3.29Å; Q1162-L1164 PolarHBondContact O-N 2.96Å; L1164-R1187 HydrophobicContact CB-CB 4.35Å; L1164-R1187 HydrophobicContact CD2-CB 3.89Å; L1164-R1187 HydrophobicContact CD2-CG 4.03Å; L1164-R1187 CarbonylContact O-C 3.53Å; L1164-R1187 WeakPolarHBondContact O-CB 3.41Å; L1164-L1190 HydrophobicContact CD1-CB 4.29Å; L1164-L1190 HydrophobicContact CD2-CB 4.29Å; L1164-L1190 HydrophobicContact CD2-CD1 4.34Å; L1164-A1191 HydrophobicContact CB-CB 4.02Å; L1164-L1194 HydrophobicContact CD1-CD1 3.55Å
1165	I	85.3	Confident	71.5	Confident	7 Å²	7	76 Å²	76	4%	0.036	40%	0.398	C	S	.	.	H	α-helix	trans	-88.6	-40.1	173.2	-70.7	169.3	0	0	0	111.1	I1161 Q1162 V1168 W1178 M1214 L1215	I1161-I1165 HydrophobicContact CG2-CD1 3.64Å; I1161-I1165 HydrophobicContact CG2-CG1 4.22Å; I1161-I1165 WeakPolarHBondContact O-CG1 3.39Å; I1161-I1165 PolarHBondContact O-N 3.41Å; Q1162-I1165 PolarHBondContact O-N 3.26Å; I1165-V1168 HydrophobicContact CG2-CG2 3.91Å; I1165-W1178 VanDerWaalsContact C-CZ2 3.47Å; I1165-W1178 WeakPolarHBondContact O-CH2 3.45Å; I1165-W1178 WeakPolarHBondContact O-CZ2 3.32Å; I1165-M1214 HydrophobicContact CD1-CB 4.01Å; I1165-L1215 HydrophobicContact CD1-CB 3.94Å; I1165-L1215 HydrophobicContact CG1-CB 4.4Å; I1165-L1215 HydrophobicContact CG1-CD1 4.16Å
1166	G	78.1	Confident	69.8	Low	12 Å²	12	74.1 Å²	74.1	12%	0.124	40%	0.398	C	S	.	.			trans	85.4	-174.5	-173.3	0	0	0	0	0	113.5	Q1162 V1168 W1178	Q1162-G1166 PolarHBondContact O-N 2.82Å; G1166-V1168 PolarHBondContact O-N 2.68Å; G1166-V1168 VanDerWaalsContact O-N 3.11Å; G1166-W1178 VanDerWaalsContact CA-NE1 3.31Å
1167	P	68.7	Low	68.7	Low	87 Å²	87	76.6 Å²	76.6	57%	0.565	42%	0.423	S	S	*	.			trans	-67.8	108.8	179.1	27.4	-33.3	0	0	0	110.9	Q1169	P1167-Q1169 PolarHBondContact O-N 2.85Å; P1167-Q1169 VanDerWaalsContact O-N 3.13Å
1168	V	61	Low	68.1	Low	53 Å²	53	79.9 Å²	79.9	32%	0.321	44%	0.435	S	S	.	.	S	Bend	trans	-63.3	-19.2	-176.6	-174.6	0	0	0	0	113	I1165 G1166 M1214 E1217	I1165-V1168 HydrophobicContact CG2-CG2 3.91Å; G1166-V1168 PolarHBondContact O-N 2.68Å; G1166-V1168 VanDerWaalsContact O-N 3.11Å; V1168-M1214 HydrophobicContact CG2-CE 3.81Å; V1168-E1217 HydrophobicContact CG1-CB 4.24Å
1169	Q	53.9	Low	67.3	Low	153 Å²	153	84.2 Å²	84.2	72%	0.715	46%	0.457	S	S	*	.			trans	-111.3	113.1	-177.7	-65.9	174	-4.6	0	0	110.8	P1167 T1171	P1167-Q1169 PolarHBondContact O-N 2.85Å; P1167-Q1169 VanDerWaalsContact O-N 3.13Å; Q1169-T1171 PolarHBondContact O-N 3.36Å
1170	A	46.8	Very low	66.9	Low	105 Å²	105	82 Å²	82	87%	0.868	46%	0.455	S	S	*	.			trans	-72.2	16.9	179.6	0	0	0	0	0	114.5	T1172	A1170-T1172 VanDerWaalsContact C-N 3.34Å; A1170-T1172 PolarHBondContact O-N 2.79Å; A1170-T1172 VanDerWaalsContact O-N 3.13Å
1171	T	41.9	Very low	66.7	Low	110 Å²	110	86 Å²	86	68%	0.675	47%	0.473	S	S	*	.			trans	-91.1	51.2	-166	50.2	0	0	0	0	113.7	Q1169	Q1169-T1171 PolarHBondContact O-N 3.36Å
1172	T	39.9	Very low	66.4	Low	107 Å²	107	86.5 Å²	86.5	66%	0.656	48%	0.476	S	S	*	.			trans	-173.8	137.1	150	14.6	0	0	0	0	109.8	A1170 L1174	A1170-T1172 VanDerWaalsContact C-N 3.34Å; A1170-T1172 PolarHBondContact O-N 2.79Å; A1170-T1172 VanDerWaalsContact O-N 3.13Å; T1172-L1174 HydrophobicContact CG2-CD1 3.92Å; T1172-L1174 HydrophobicContact CG2-CG 4.41Å; T1172-L1174 PolarHBondContact O-N 2.89Å; T1172-L1174 VanDerWaalsContact O-N 3.1Å
1173	K	44.1	Very low	66	Low	213 Å²	213	87 Å²	87	93%	0.926	48%	0.478	S	S	*	.			trans	-82.2	28.9	175.6	-72.1	-174.5	174.4	179.5	0	113.1
1174	L	42	Very low	65.8	Low	64 Å²	64	86.2 Å²	86.2	34%	0.335	49%	0.488	S	S	.	.	S	Bend	trans	-98.8	96.1	-176.2	-69.5	168.2	0	0	0	109.7	M663 Q665 T1172 S1176	M663-L1174 HydrophobicContact SD-CD2 3.53Å; M663-L1174 VanDerWaalsContact SD-CD2 3.53Å; Q665-L1174 HydrophobicContact CB-CD1 4.43Å; Q665-L1174 HydrophobicContact CB-CD2 4.43Å; Q665-L1174 HydrophobicContact CG-CD2 4.19Å; T1172-L1174 HydrophobicContact CG2-CD1 3.92Å; T1172-L1174 HydrophobicContact CG2-CG 4.41Å; T1172-L1174 PolarHBondContact O-N 2.89Å; T1172-L1174 VanDerWaalsContact O-N 3.1Å; L1174-S1176 PolarHBondContact O-N 2.88Å
1175	H	44.5	Very low	65.7	Low	154 Å²	154	87.4 Å²	87.4	71%	0.713	49%	0.494	S	S	*	.			trans	18.8	68.3	167.9	-73.9	-96.4	0	0	0	117.3	M663 T1177	M663-H1175 VanDerWaalsContact CE-CD2 3.48Å; M663-H1175 WeakPolarHBondContact CE-CD2 3.43Å; H1175-T1177 PolarHBondContact O-N 2.87Å; H1175-T1177 VanDerWaalsContact O-N 3.12Å
1176	S	51.6	Low	65.8	Low	78 Å²	78	88.7 Å²	88.7	55%	0.545	50%	0.504	S	S	.	.			trans	-59.1	114.7	159.3	166.1	0	0	0	0	109.2	L1174 W1178	L1174-S1176 PolarHBondContact O-N 2.88Å; S1176-W1178 PolarHBondContact O-N 2.92Å; S1176-W1178 WeakPolarHBondContact OG-CB 3.22Å; S1176-W1178 PolarHBondContact OG-N 2.84Å
1177	T	67	Low	66.4	Low	137 Å²	137	89.6 Å²	89.6	84%	0.84	50%	0.503	S	S	*	.			trans	-78.5	-4.7	173.1	50.7	0	0	0	0	113.1	H1175	H1175-T1177 PolarHBondContact O-N 2.87Å; H1175-T1177 VanDerWaalsContact O-N 3.12Å
1178	W	77.8	Confident	67.4	Low	70 Å²	70	87.2 Å²	87.2	27%	0.265	49%	0.486	S	S	.	.			trans	-67.7	132.7	-179.6	-173.1	90.5	0	0	0	112	D1163 I1165 G1166 S1176 R1187	D1163-W1178 PolarHBondContact O-NE1 2.7Å; I1165-W1178 VanDerWaalsContact C-CZ2 3.47Å; I1165-W1178 WeakPolarHBondContact O-CH2 3.45Å; I1165-W1178 WeakPolarHBondContact O-CZ2 3.32Å; G1166-W1178 VanDerWaalsContact CA-NE1 3.31Å; S1176-W1178 PolarHBondContact O-N 2.92Å; S1176-W1178 WeakPolarHBondContact OG-CB 3.22Å; S1176-W1178 PolarHBondContact OG-N 2.84Å; W1178-R1187 HydrophobicContact CZ2-CB 4.23Å; W1178-R1187 HydrophobicContact CZ2-CG 4.45Å
1179	Q	76	Confident	68.7	Low	136 Å²	136	87.7 Å²	87.7	64%	0.636	49%	0.489	S	S	*	.			trans	-111.5	131.3	179.7	-65.6	179.9	-17	0	0	109.9	E1181 R1187	Q1179-E1181 PolarHBondContact O-N 2.86Å; Q1179-R1187 WeakPolarHBondContact O-CD 3.42Å; Q1179-R1187 PolarHBondContact O-NE 2.87Å
1180	S	82	Confident	70.5	Confident	70 Å²	70	80.5 Å²	80.5	49%	0.49	46%	0.455	S	S	.	.	S	Bend	trans	-67.1	-15.4	-176.9	52.6	0	0	0	0	114.9	S1186 R1187	S1180-S1186 WeakPolarHBondContact O-CA 3.37Å; S1180-R1187 PolarHBondContact O-N 3Å
1181	E	85.5	Confident	72.6	Confident	105 Å²	105	75.5 Å²	75.5	49%	0.491	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	150.7	175.8	-53.9	-161	152.8	0	0	111.6	Q1179 I1185	Q1179-E1181 PolarHBondContact O-N 2.86Å; E1181-I1185 CarbonylContact C-O 3.5Å; E1181-I1185 WeakPolarHBondContact CA-O 3.45Å
1182	V	83.5	Confident	74.9	Confident	11 Å²	11	74 Å²	74	7%	0.067	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	117.7	174.2	169.6	0	0	0	0	107.7	L1129 Y1137 G1184 I1185 R1187	L1129-V1182 HydrophobicContact CD1-CG1 3.37Å; Y1137-V1182 HydrophobicContact CD1-CG1 3.99Å; Y1137-V1182 HydrophobicContact CE1-CB 4.33Å; Y1137-V1182 HydrophobicContact CE1-CG1 3.46Å; Y1137-V1182 VanDerWaalsContact CE1-CG1 3.46Å; V1182-G1184 PolarHBondContact O-N 2.97Å; V1182-I1185 PolarHBondContact N-O 2.99Å; V1182-I1185 PolarHBondContact O-N 3.05Å; V1182-R1187 HydrophobicContact CB-CG 4.46Å; V1182-R1187 HydrophobicContact CG2-CG 3.7Å
1183	K	81.5	Confident	77.3	Confident	73 Å²	73	71.9 Å²	71.9	32%	0.317	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	37.3	-175.6	-45.2	-167.2	79.8	136.2	0	113.5	A1128 L1129 G1132 S1134 I1185	A1128-K1183 PolarHBondContact O-NZ 3.02Å; L1129-K1183 HydrophobicContact CD1-CG 4.47Å; L1129-K1183 WeakPolarHBondContact O-CD 3.29Å; L1129-K1183 WeakPolarHBondContact O-CE 3.2Å; L1129-K1183 PolarHBondContact O-NZ 3.02Å; G1132-K1183 WeakPolarHBondContact O-CE 3.39Å; G1132-K1183 PolarHBondContact O-NZ 3.28Å; S1134-K1183 VanDerWaalsContact CB-O 3.22Å; S1134-K1183 WeakPolarHBondContact CB-O 3.24Å; K1183-I1185 VanDerWaalsContact C-N 3.33Å; K1183-I1185 PolarHBondContact O-N 2.85Å
1184	G	82.8	Confident	79.6	Confident	63 Å²	63	61.8 Å²	61.8	65%	0.649	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	15.4	-177.7	0	0	0	0	0	115.1	V1182	V1182-G1184 PolarHBondContact O-N 2.97Å
1185	I	86	Confident	81.9	Confident	27 Å²	27	59.1 Å²	59.1	14%	0.138	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.7	168.7	-47.1	174.9	0	0	0	108.4	S1134 R1138 E1181 V1182 K1183 R1187 L1190	S1134-I1185 WeakPolarHBondContact O-CD1 3.38Å; R1138-I1185 HydrophobicContact CB-CD1 4.1Å; E1181-I1185 CarbonylContact C-O 3.5Å; E1181-I1185 WeakPolarHBondContact CA-O 3.45Å; V1182-I1185 PolarHBondContact N-O 2.99Å; V1182-I1185 PolarHBondContact O-N 3.05Å; K1183-I1185 VanDerWaalsContact C-N 3.33Å; K1183-I1185 PolarHBondContact O-N 2.85Å; I1185-R1187 PolarHBondContact O-N 3.37Å; I1185-L1190 HydrophobicContact CB-CD1 4.31Å; I1185-L1190 HydrophobicContact CB-CG 4.44Å; I1185-L1190 HydrophobicContact CD1-CD2 4.42Å; I1185-L1190 HydrophobicContact CG2-CD1 4.16Å; I1185-L1190 HydrophobicContact CG2-CD2 3.94Å; I1185-L1190 HydrophobicContact CG2-CG 3.74Å
1186	S	87.5	Confident	84	Confident	34 Å²	34	55.7 Å²	55.7	24%	0.238	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	126.7	172.8	177.3	0	0	0	0	111.5	S1180 L1188 V1189 L1190	S1180-S1186 WeakPolarHBondContact O-CA 3.37Å; S1186-L1188 PolarHBondContact O-N 2.89Å; S1186-V1189 WeakPolarHBondContact O-CB 3.33Å; S1186-V1189 PolarHBondContact O-N 3.07Å; S1186-L1190 PolarHBondContact O-N 3.38Å
1187	R	90.5	Very high	85.6	Confident	31 Å²	31	52.8 Å²	52.8	12%	0.117	29%	0.294	C	S	.	.	H	α-helix	trans	-57.7	-37.8	178.6	-66	-174.9	178.3	-125	-1.7	111.6	D1163 L1164 W1178 Q1179 S1180 V1182 I1185 V1189 L1190 A1191	D1163-R1187 PolarHBondContact O-NH1 2.91Å; D1163-R1187 IonicContact OD1-NH1 2.69Å; D1163-R1187 PolarHBondContact OD1-NH1 2.83Å; D1163-R1187 IonicContact OD2-CZ 3.74Å; D1163-R1187 IonicContact OD2-NH1 2.69Å; D1163-R1187 PolarHBondContact OD2-NH1 3.03Å; L1164-R1187 HydrophobicContact CB-CB 4.35Å; L1164-R1187 HydrophobicContact CD2-CB 3.89Å; L1164-R1187 HydrophobicContact CD2-CG 4.03Å; L1164-R1187 CarbonylContact O-C 3.53Å; L1164-R1187 WeakPolarHBondContact O-CB 3.41Å; W1178-R1187 HydrophobicContact CZ2-CB 4.23Å; W1178-R1187 HydrophobicContact CZ2-CG 4.45Å; Q1179-R1187 WeakPolarHBondContact O-CD 3.42Å; Q1179-R1187 PolarHBondContact O-NE 2.87Å; S1180-R1187 PolarHBondContact O-N 3Å; V1182-R1187 HydrophobicContact CB-CG 4.46Å; V1182-R1187 HydrophobicContact CG2-CG 3.7Å; I1185-R1187 PolarHBondContact O-N 3.37Å; R1187-V1189 PolarHBondContact O-N 3.07Å; R1187-L1190 PolarHBondContact O-N 2.8Å; R1187-A1191 PolarHBondContact O-N 2.85Å
1188	L	89	Confident	86.5	Confident	37 Å²	37	46.7 Å²	46.7	19%	0.194	26%	0.256	C	S	.	.	H	α-helix	trans	-69	-14.9	177	-60.9	178.5	0	0	0	114	S1186 K1192 L1215	S1186-L1188 PolarHBondContact O-N 2.89Å; L1188-K1192 WeakPolarHBondContact O-CD 3.38Å; L1188-K1192 WeakPolarHBondContact O-CG 3.45Å; L1188-K1192 PolarHBondContact O-NZ 2.95Å; L1188-L1215 HydrophobicContact CD2-CD1 3.92Å
1189	V	89.9	Confident	86.3	Confident	64 Å²	64	48 Å²	48	39%	0.388	28%	0.282	S	S	.	.	H	α-helix	trans	-85.5	-45.5	169.9	175.3	0	0	0	0	109.6	S1186 R1187 A1191 K1192 E1193	S1186-V1189 WeakPolarHBondContact O-CB 3.33Å; S1186-V1189 PolarHBondContact O-N 3.07Å; R1187-V1189 PolarHBondContact O-N 3.07Å; V1189-A1191 VanDerWaalsContact C-N 3.32Å; V1189-A1191 PolarHBondContact O-N 2.88Å; V1189-K1192 WeakPolarHBondContact O-CB 3.32Å; V1189-K1192 PolarHBondContact O-N 3.16Å; V1189-K1192 VanDerWaalsContact O-N 3.12Å; V1189-E1193 PolarHBondContact O-N 3.31Å; V1189-E1193 VanDerWaalsContact O-N 3.11Å
1190	L	90.4	Very high	86.1	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-56.3	-45.4	172.6	-67.6	172.6	0	0	0	111.6	Y1137 R1138 L1141 L1164 I1185 S1186 R1187 K1192 E1193 L1194	Y1137-L1190 HydrophobicContact CE1-CD1 3.91Å; R1138-L1190 HydrophobicContact CB-CD2 4.24Å; R1138-L1190 HydrophobicContact CG-CD2 3.79Å; L1141-L1190 HydrophobicContact CD2-CD1 4.39Å; L1164-L1190 HydrophobicContact CD1-CB 4.29Å; L1164-L1190 HydrophobicContact CD2-CB 4.29Å; L1164-L1190 HydrophobicContact CD2-CD1 4.34Å; I1185-L1190 HydrophobicContact CB-CD1 4.31Å; I1185-L1190 HydrophobicContact CB-CG 4.44Å; I1185-L1190 HydrophobicContact CD1-CD2 4.42Å; I1185-L1190 HydrophobicContact CG2-CD1 4.16Å; I1185-L1190 HydrophobicContact CG2-CD2 3.94Å; I1185-L1190 HydrophobicContact CG2-CG 3.74Å; S1186-L1190 PolarHBondContact O-N 3.38Å; R1187-L1190 PolarHBondContact O-N 2.8Å; L1190-K1192 VanDerWaalsContact C-N 3.29Å; L1190-K1192 PolarHBondContact O-N 2.87Å; L1190-E1193 PolarHBondContact O-N 2.74Å; L1190-E1193 VanDerWaalsContact O-N 3.13Å; L1190-L1194 WeakPolarHBondContact O-CG 3.48Å; L1190-L1194 PolarHBondContact O-N 3.15Å
1191	A	90.7	Very high	85.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-55.4	-41.3	176.1	0	0	0	0	0	112.8	L1164 R1187 V1189 L1195 L1215	L1164-A1191 HydrophobicContact CB-CB 4.02Å; R1187-A1191 PolarHBondContact O-N 2.85Å; V1189-A1191 VanDerWaalsContact C-N 3.32Å; V1189-A1191 PolarHBondContact O-N 2.88Å; A1191-L1195 VanDerWaalsContact O-CB 3.3Å; A1191-L1195 WeakPolarHBondContact O-CB 3.39Å; A1191-L1195 WeakPolarHBondContact O-CD1 3.39Å; A1191-L1195 VanDerWaalsContact O-CG 3.28Å; A1191-L1195 WeakPolarHBondContact O-CG 3.22Å; A1191-L1195 PolarHBondContact O-N 3.21Å; A1191-L1215 HydrophobicContact CB-CD1 4.23Å
1192	K	90.5	Very high	85.5	Confident	78 Å²	78	45.1 Å²	45.1	34%	0.339	27%	0.268	S	S	.	.	H	α-helix	trans	-66.5	-39.7	177.8	-73	173.4	-174.1	95.4	0	112.3	L1188 V1189 L1190 S1196 L1215	L1188-K1192 WeakPolarHBondContact O-CD 3.38Å; L1188-K1192 WeakPolarHBondContact O-CG 3.45Å; L1188-K1192 PolarHBondContact O-NZ 2.95Å; V1189-K1192 WeakPolarHBondContact O-CB 3.32Å; V1189-K1192 PolarHBondContact O-N 3.16Å; V1189-K1192 VanDerWaalsContact O-N 3.12Å; L1190-K1192 VanDerWaalsContact C-N 3.29Å; L1190-K1192 PolarHBondContact O-N 2.87Å; K1192-S1196 PolarHBondContact O-N 3.22Å; K1192-L1215 HydrophobicContact CG-CD2 3.64Å
1193	E	91.2	Very high	85.3	Confident	62 Å²	62	52 Å²	52	29%	0.29	30%	0.299	S	S	.	.	H	α-helix	trans	-70	-44.2	178	-67.3	179.8	-175.5	0	0	111.6	R1138 V1189 L1190 S1196	R1138-E1193 IonicContact CZ-OE1 3.25Å; R1138-E1193 IonicContact CZ-OE2 3.52Å; R1138-E1193 IonicContact NE-OE1 3.5Å; R1138-E1193 IonicContact NE-OE2 3.52Å; R1138-E1193 PolarHBondContact NE-OE2 2.72Å; R1138-E1193 IonicContact NH2-OE1 3.24Å; R1138-E1193 PolarHBondContact NH2-OE1 2.9Å; R1138-E1193 IonicContact NH2-OE2 2.71Å; R1138-E1193 PolarHBondContact NH2-OE2 3.06Å; V1189-E1193 PolarHBondContact O-N 3.31Å; V1189-E1193 VanDerWaalsContact O-N 3.11Å; L1190-E1193 PolarHBondContact O-N 2.74Å; L1190-E1193 VanDerWaalsContact O-N 3.13Å; E1193-S1196 WeakPolarHBondContact O-CB 3.37Å; E1193-S1196 PolarHBondContact O-N 2.95Å; E1193-S1196 VanDerWaalsContact O-N 3.14Å; E1193-S1196 PolarHBondContact O-OG 3.02Å
1194	L	92.1	Very high	85.4	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-41.6	175	-66.4	-172.9	0	0	0	111.9	L1141 F1145 I1160 I1161 L1164 L1190 S1196 L1197	L1141-L1194 HydrophobicContact CD1-CD1 4.39Å; L1141-L1194 HydrophobicContact CD2-CD1 4.05Å; L1141-L1194 HydrophobicContact CG-CD1 4Å; L1141-L1194 HydrophobicContact CG-CD2 4.46Å; F1145-L1194 HydrophobicContact CB-CD1 4.4Å; F1145-L1194 HydrophobicContact CB-CD2 3.83Å; F1145-L1194 HydrophobicContact CD1-CB 3.77Å; F1145-L1194 HydrophobicContact CD1-CD1 4.44Å; F1145-L1194 HydrophobicContact CD1-CD2 4.05Å; F1145-L1194 HydrophobicContact CD1-CG 4.29Å; F1145-L1194 HydrophobicContact CD2-CD1 3.99Å; F1145-L1194 HydrophobicContact CE1-CB 3.7Å; F1145-L1194 WeakPolarHBondContact CE1-O 3.45Å; F1145-L1194 HydrophobicContact CE2-CD1 4.32Å; F1145-L1194 HydrophobicContact CG-CB 4.21Å; F1145-L1194 HydrophobicContact CG-CD1 4.04Å; F1145-L1194 HydrophobicContact CG-CD2 3.98Å; F1145-L1194 HydrophobicContact CG-CG 4.3Å; F1145-L1194 HydrophobicContact CZ-CB 4.11Å; I1160-L1194 HydrophobicContact CG2-CD1 4.18Å; I1161-L1194 HydrophobicContact CD1-CB 3.82Å; I1161-L1194 HydrophobicContact CD1-CD1 4.13Å; L1164-L1194 HydrophobicContact CD1-CD1 3.55Å; L1190-L1194 WeakPolarHBondContact O-CG 3.48Å; L1190-L1194 PolarHBondContact O-N 3.15Å; L1194-S1196 PolarHBondContact O-N 3.46Å; L1194-L1197 HydrophobicContact CD2-CD1 4.19Å; L1194-L1197 VanDerWaalsContact O-CB 3.28Å; L1194-L1197 WeakPolarHBondContact O-CB 3.38Å; L1194-L1197 PolarHBondContact O-N 3.1Å
1195	L	89.5	Confident	85.5	Confident	8 Å²	8	51.5 Å²	51.5	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-61.2	-23.1	174.3	-80.1	164.8	0	0	0	113.4	I1161 A1191 L1197 F1198 Y1208 L1211 L1215	I1161-L1195 HydrophobicContact CD1-CG 4.45Å; A1191-L1195 VanDerWaalsContact O-CB 3.3Å; A1191-L1195 WeakPolarHBondContact O-CB 3.39Å; A1191-L1195 WeakPolarHBondContact O-CD1 3.39Å; A1191-L1195 VanDerWaalsContact O-CG 3.28Å; A1191-L1195 WeakPolarHBondContact O-CG 3.22Å; A1191-L1195 PolarHBondContact O-N 3.21Å; L1195-L1197 PolarHBondContact O-N 2.83Å; L1195-F1198 HydrophobicContact CD2-CD2 4.04Å; L1195-F1198 HydrophobicContact CD2-CE2 3.71Å; L1195-F1198 HydrophobicContact CD2-CZ 4.34Å; L1195-F1198 PolarHBondContact O-N 2.82Å; L1195-Y1208 HydrophobicContact CB-CE2 4.35Å; L1195-Y1208 HydrophobicContact CD2-CD2 4.03Å; L1195-Y1208 HydrophobicContact CD2-CE2 4.45Å; L1195-Y1208 WeakPolarHBondContact O-CE2 3.48Å; L1195-L1211 HydrophobicContact CD2-CB 3.92Å; L1195-L1215 HydrophobicContact CD1-CB 4.4Å; L1195-L1215 HydrophobicContact CD1-CD2 3.37Å
1196	S	88.5	Confident	85.5	Confident	82 Å²	82	60.4 Å²	60.4	57%	0.573	31%	0.313	S	S	*	.	H	α-helix	trans	-68.1	-22.1	173.3	81.6	0	0	0	0	113.3	K1192 E1193 L1194 F1198	K1192-S1196 PolarHBondContact O-N 3.22Å; E1193-S1196 WeakPolarHBondContact O-CB 3.37Å; E1193-S1196 PolarHBondContact O-N 2.95Å; E1193-S1196 VanDerWaalsContact O-N 3.14Å; E1193-S1196 PolarHBondContact O-OG 3.02Å; L1194-S1196 PolarHBondContact O-N 3.46Å; S1196-F1198 VanDerWaalsContact C-N 3.32Å; S1196-F1198 PolarHBondContact O-N 2.89Å
1197	L	86.9	Confident	85.5	Confident	17 Å²	17	59 Å²	59	9%	0.089	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-75.2	-16.7	179.9	-60.2	174.9	0	0	0	113.5	T1142 F1145 R1146 I1149 L1194 L1195 A1199 L1200	T1142-L1197 HydrophobicContact CG2-CD1 4.01Å; F1145-L1197 HydrophobicContact CD1-CD1 4.04Å; R1146-L1197 HydrophobicContact CB-CD1 4.34Å; I1149-L1197 HydrophobicContact CD1-CB 3.86Å; L1194-L1197 HydrophobicContact CD2-CD1 4.19Å; L1194-L1197 VanDerWaalsContact O-CB 3.28Å; L1194-L1197 WeakPolarHBondContact O-CB 3.38Å; L1194-L1197 PolarHBondContact O-N 3.1Å; L1195-L1197 PolarHBondContact O-N 2.83Å; L1197-A1199 PolarHBondContact O-N 3Å; L1197-A1199 VanDerWaalsContact O-N 3.09Å; L1197-L1200 HydrophobicContact CB-CD1 4.28Å; L1197-L1200 HydrophobicContact CD2-CD1 4.44Å; L1197-L1200 VanDerWaalsContact O-CB 3.31Å; L1197-L1200 WeakPolarHBondContact O-CB 3.48Å; L1197-L1200 WeakPolarHBondContact O-CD1 3.2Å; L1197-L1200 WeakPolarHBondContact O-CG 3.4Å; L1197-L1200 PolarHBondContact O-N 2.86Å
1198	F	84.5	Confident	85.4	Confident	10 Å²	10	61 Å²	61	4%	0.044	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-61.1	-19.2	176.2	-81.2	-105.1	0	0	0	113.2	F1145 I1149 V1157 L1195 S1196 L1200 N1201 L1204 L1207 Y1208 L1211	F1145-F1198 HydrophobicContact CE1-CD2 4.25Å; F1145-F1198 AromaticContact CE1-CE2 3.72Å; F1145-F1198 HydrophobicContact CE1-CE2 3.72Å; F1145-F1198 AromaticContact CZ-CE2 3.77Å; F1145-F1198 HydrophobicContact CZ-CE2 3.77Å; F1145-F1198 HydrophobicContact CZ-CZ 4.35Å; I1149-F1198 HydrophobicContact CD1-CD2 3.86Å; I1149-F1198 HydrophobicContact CD1-CE2 4.12Å; I1149-F1198 HydrophobicContact CD1-CG 4.21Å; V1157-F1198 HydrophobicContact CG1-CE1 4.09Å; V1157-F1198 HydrophobicContact CG1-CE2 4.07Å; V1157-F1198 HydrophobicContact CG1-CZ 3.36Å; L1195-F1198 HydrophobicContact CD2-CD2 4.04Å; L1195-F1198 HydrophobicContact CD2-CE2 3.71Å; L1195-F1198 HydrophobicContact CD2-CZ 4.34Å; L1195-F1198 PolarHBondContact O-N 2.82Å; S1196-F1198 VanDerWaalsContact C-N 3.32Å; S1196-F1198 PolarHBondContact O-N 2.89Å; F1198-L1200 PolarHBondContact O-N 2.86Å; F1198-N1201 PolarHBondContact O-N 3.41Å; F1198-N1201 VanDerWaalsContact O-N 3.11Å; F1198-L1204 HydrophobicContact CD1-CB 3.72Å; F1198-L1204 HydrophobicContact CE1-CB 3.88Å; F1198-L1204 HydrophobicContact CE1-CD1 4.47Å; F1198-L1207 HydrophobicContact CE1-CB 4.18Å; F1198-L1207 HydrophobicContact CE1-CD2 4.07Å; F1198-L1207 HydrophobicContact CE1-CG 3.99Å; F1198-L1207 HydrophobicContact CZ-CD2 4.31Å; F1198-L1207 HydrophobicContact CZ-CG 4.27Å; F1198-Y1208 HydrophobicContact CB-CD2 3.67Å; F1198-Y1208 HydrophobicContact CB-CG 4.14Å; F1198-Y1208 HydrophobicContact CD1-CD2 4.46Å; F1198-Y1208 HydrophobicContact CD2-CD2 4.21Å; F1198-Y1208 AromaticContact CG-CD2 3.89Å; F1198-Y1208 HydrophobicContact CG-CD2 3.89Å; F1198-Y1208 HydrophobicContact CG-CG 4.35Å; F1198-L1211 HydrophobicContact CZ-CD1 3.87Å
1199	A	74.7	Confident	85.4	Confident	98 Å²	98	62.2 Å²	62.2	81%	0.81	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-59	-10.8	171.6	0	0	0	0	0	114.2	L1197	L1197-A1199 PolarHBondContact O-N 3Å; L1197-A1199 VanDerWaalsContact O-N 3.09Å
1200	L	71.9	Confident	85.3	Confident	82 Å²	82	62 Å²	62	43%	0.429	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-81.7	-27.5	175.8	-59.7	166.3	0	0	0	113.7	R1146 I1149 L1197 F1198	R1146-L1200 HydrophobicContact CG-CD1 4.1Å; I1149-L1200 HydrophobicContact CG2-CB 4.17Å; L1197-L1200 HydrophobicContact CB-CD1 4.28Å; L1197-L1200 HydrophobicContact CD2-CD1 4.44Å; L1197-L1200 VanDerWaalsContact O-CB 3.31Å; L1197-L1200 WeakPolarHBondContact O-CB 3.48Å; L1197-L1200 WeakPolarHBondContact O-CD1 3.2Å; L1197-L1200 WeakPolarHBondContact O-CG 3.4Å; L1197-L1200 PolarHBondContact O-N 2.86Å; F1198-L1200 PolarHBondContact O-N 2.86Å
1201	N	75	Confident	85.1	Confident	24 Å²	24	62 Å²	62	13%	0.128	31%	0.314	C	S	.	.			trans	-134.7	109	-174.4	-175.8	-7	0	0	0	111.6	I1149 N1152 F1198 H1203 L1204	I1149-N1201 HydrophobicContact CG2-CB 3.77Å; I1149-N1201 PolarHBondContact O-ND2 3.28Å; N1152-N1201 PolarHBondContact OD1-ND2 2.97Å; F1198-N1201 PolarHBondContact O-N 3.41Å; F1198-N1201 VanDerWaalsContact O-N 3.11Å; N1201-H1203 VanDerWaalsContact C-N 3.29Å; N1201-H1203 PolarHBondContact O-N 3.49Å; N1201-H1203 WeakPolarHBondContact OD1-CB 3.39Å; N1201-H1203 PolarHBondContact OD1-CD2 3.24Å; N1201-H1203 PolarHBondContact OD1-N 2.94Å; N1201-L1204 HydrophobicContact CB-CD1 4.38Å; N1201-L1204 HydrophobicContact CB-CG 4.41Å; N1201-L1204 PolarHBondContact O-N 2.95Å
1202	L	78.9	Confident	85	Confident	144 Å²	144	66 Å²	66	75%	0.754	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-67.1	-23.7	-179.7	-71.8	165.2	0	0	0	113.9	L1204 Q1205	L1202-L1204 VanDerWaalsContact C-N 3.3Å; L1202-L1204 PolarHBondContact O-N 2.88Å; L1202-Q1205 VanDerWaalsContact O-CB 3.27Å; L1202-Q1205 WeakPolarHBondContact O-CB 3.33Å; L1202-Q1205 PolarHBondContact O-N 2.87Å
1203	H	80.3	Confident	84.8	Confident	156 Å²	156	67.5 Å²	67.5	72%	0.722	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-66.3	-35.9	178.1	-64.5	-73	0	0	0	111.6	N1201 Q1205	N1201-H1203 VanDerWaalsContact C-N 3.29Å; N1201-H1203 PolarHBondContact O-N 3.49Å; N1201-H1203 WeakPolarHBondContact OD1-CB 3.39Å; N1201-H1203 PolarHBondContact OD1-CD2 3.24Å; N1201-H1203 PolarHBondContact OD1-N 2.94Å; H1203-Q1205 PolarHBondContact O-N 2.68Å
1204	L	82.7	Confident	84.5	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.005	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-78.9	8.5	179.2	-56.3	-178.1	0	0	0	113.7	I1149 E1154 F1198 N1201 L1202 R1206 L1207 Y1208	I1149-L1204 HydrophobicContact CB-CD1 4.22Å; I1149-L1204 HydrophobicContact CG1-CD1 3.98Å; I1149-L1204 HydrophobicContact CG2-CD1 4.19Å; E1154-L1204 HydrophobicContact CG-CD2 3.64Å; F1198-L1204 HydrophobicContact CD1-CB 3.72Å; F1198-L1204 HydrophobicContact CE1-CB 3.88Å; F1198-L1204 HydrophobicContact CE1-CD1 4.47Å; N1201-L1204 HydrophobicContact CB-CD1 4.38Å; N1201-L1204 HydrophobicContact CB-CG 4.41Å; N1201-L1204 PolarHBondContact O-N 2.95Å; L1202-L1204 VanDerWaalsContact C-N 3.3Å; L1202-L1204 PolarHBondContact O-N 2.88Å; L1204-R1206 PolarHBondContact O-N 3.45Å; L1204-L1207 HydrophobicContact CD2-CD2 4.49Å; L1204-L1207 PolarHBondContact O-N 3.49Å; L1204-L1207 VanDerWaalsContact O-N 3.14Å; L1204-Y1208 PolarHBondContact O-N 2.84Å
1205	Q	84.4	Confident	84.1	Confident	123 Å²	123	66.7 Å²	66.7	58%	0.575	34%	0.336	S	S	*	.	H	α-helix	trans	-61.1	-29.7	-177.8	-174.3	174.5	-0.5	0	0	113	L1202 H1203 V1209	L1202-Q1205 VanDerWaalsContact O-CB 3.27Å; L1202-Q1205 WeakPolarHBondContact O-CB 3.33Å; L1202-Q1205 PolarHBondContact O-N 2.87Å; H1203-Q1205 PolarHBondContact O-N 2.68Å; Q1205-V1209 WeakPolarHBondContact O-CG2 3.44Å; Q1205-V1209 PolarHBondContact O-N 2.75Å
1206	R	86.6	Confident	83.9	Confident	215 Å²	215	70.6 Å²	70.6	81%	0.811	36%	0.357	S	S	*	.	H	α-helix	trans	-68.1	-47.7	173.7	-175.7	177.5	178.7	173	-0.1	111.6	L1204 Y1208 V1209 E1210	L1204-R1206 PolarHBondContact O-N 3.45Å; R1206-Y1208 VanDerWaalsContact C-N 3.29Å; R1206-Y1208 PolarHBondContact O-N 2.99Å; R1206-V1209 PolarHBondContact O-N 3Å; R1206-V1209 VanDerWaalsContact O-N 3.13Å; R1206-E1210 PolarHBondContact O-N 3.26Å; R1206-E1210 VanDerWaalsContact O-N 3.11Å
1207	L	86.6	Confident	83.5	Confident	4 Å²	4	73.1 Å²	73.1	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-62.6	-35.5	177	-179.5	63.5	0	0	0	111.8	E1154 V1157 R1158 F1198 L1204 V1209 L1211	E1154-L1207 HydrophobicContact CB-CD2 4.16Å; V1157-L1207 HydrophobicContact CB-CD2 4.18Å; V1157-L1207 HydrophobicContact CG1-CD2 3.77Å; R1158-L1207 HydrophobicContact CB-CD1 4.18Å; F1198-L1207 HydrophobicContact CE1-CB 4.18Å; F1198-L1207 HydrophobicContact CE1-CD2 4.07Å; F1198-L1207 HydrophobicContact CE1-CG 3.99Å; F1198-L1207 HydrophobicContact CZ-CD2 4.31Å; F1198-L1207 HydrophobicContact CZ-CG 4.27Å; L1204-L1207 HydrophobicContact CD2-CD2 4.49Å; L1204-L1207 PolarHBondContact O-N 3.49Å; L1204-L1207 VanDerWaalsContact O-N 3.14Å; L1207-V1209 VanDerWaalsContact C-N 3.34Å; L1207-V1209 PolarHBondContact O-N 3.25Å; L1207-L1211 HydrophobicContact CD1-CD1 3.73Å; L1207-L1211 HydrophobicContact CD1-CD2 4.47Å; L1207-L1211 HydrophobicContact CD1-CG 3.86Å; L1207-L1211 HydrophobicContact CD2-CD1 4.4Å; L1207-L1211 HydrophobicContact CG-CD1 3.73Å; L1207-L1211 HydrophobicContact CG-CG 4.25Å; L1207-L1211 WeakPolarHBondContact O-CB 3.49Å; L1207-L1211 VanDerWaalsContact O-CG 3.3Å; L1207-L1211 WeakPolarHBondContact O-CG 3.19Å; L1207-L1211 PolarHBondContact O-N 3.26Å
1208	Y	88.7	Confident	82.7	Confident	73 Å²	73	73.8 Å²	73.8	29%	0.286	37%	0.366	S	S	.	.	H	α-helix	trans	-59.4	-41.3	172.3	171.5	-100.2	0	0	0	112.9	L1195 F1198 L1204 R1206 K1212	L1195-Y1208 HydrophobicContact CB-CE2 4.35Å; L1195-Y1208 HydrophobicContact CD2-CD2 4.03Å; L1195-Y1208 HydrophobicContact CD2-CE2 4.45Å; L1195-Y1208 WeakPolarHBondContact O-CE2 3.48Å; F1198-Y1208 HydrophobicContact CB-CD2 3.67Å; F1198-Y1208 HydrophobicContact CB-CG 4.14Å; F1198-Y1208 HydrophobicContact CD1-CD2 4.46Å; F1198-Y1208 HydrophobicContact CD2-CD2 4.21Å; F1198-Y1208 AromaticContact CG-CD2 3.89Å; F1198-Y1208 HydrophobicContact CG-CD2 3.89Å; F1198-Y1208 HydrophobicContact CG-CG 4.35Å; L1204-Y1208 PolarHBondContact O-N 2.84Å; R1206-Y1208 VanDerWaalsContact C-N 3.29Å; R1206-Y1208 PolarHBondContact O-N 2.99Å; Y1208-K1212 HydrophobicContact CE1-CD 3.83Å; Y1208-K1212 HydrophobicContact CE2-CD 4.44Å; Y1208-K1212 WeakPolarHBondContact O-CB 3.2Å; Y1208-K1212 PolarHBondContact O-N 3.02Å; Y1208-K1212 VanDerWaalsContact O-N 3.11Å; Y1208-K1212 PolarHBondContact OH-NZ 3.26Å
1209	V	88.6	Confident	81.6	Confident	62 Å²	62	84.2 Å²	84.2	38%	0.376	41%	0.405	S	S	.	.	H	α-helix	trans	-68.2	-51.9	178.6	173.3	0	0	0	0	110	Q1205 R1206 L1207 L1211 K1212 E1213	Q1205-V1209 WeakPolarHBondContact O-CG2 3.44Å; Q1205-V1209 PolarHBondContact O-N 2.75Å; R1206-V1209 PolarHBondContact O-N 3Å; R1206-V1209 VanDerWaalsContact O-N 3.13Å; L1207-V1209 VanDerWaalsContact C-N 3.34Å; L1207-V1209 PolarHBondContact O-N 3.25Å; V1209-L1211 PolarHBondContact O-N 3.03Å; V1209-K1212 PolarHBondContact O-N 3.22Å; V1209-K1212 VanDerWaalsContact O-N 3.11Å; V1209-E1213 HydrophobicContact CG1-CG 4.39Å; V1209-E1213 WeakPolarHBondContact CG1-OE1 3.49Å; V1209-E1213 WeakPolarHBondContact O-CG 3.27Å; V1209-E1213 PolarHBondContact O-N 2.68Å
1210	E	87.8	Confident	81.9	Confident	61 Å²	61	83.5 Å²	83.5	29%	0.285	39%	0.385	S	S	.	.	H	α-helix	trans	-49.5	-55.3	176.5	-179.5	-168.5	137.3	0	0	112.2	R1158 R1206 K1212 E1213 M1214	R1158-E1210 IonicContact CZ-OE1 3.22Å; R1158-E1210 VanDerWaalsContact CZ-OE1 3.26Å; R1158-E1210 IonicContact CZ-OE2 2.77Å; R1158-E1210 IonicContact NE-OE1 2.93Å; R1158-E1210 PolarHBondContact NE-OE1 3.33Å; R1158-E1210 VanDerWaalsContact NH2-CD 3.29Å; R1158-E1210 IonicContact NH2-OE1 2.79Å; R1158-E1210 PolarHBondContact NH2-OE1 3.02Å; R1158-E1210 IonicContact NH2-OE2 3.26Å; R1158-E1210 PolarHBondContact NH2-OE2 2.93Å; R1206-E1210 PolarHBondContact O-N 3.26Å; R1206-E1210 VanDerWaalsContact O-N 3.11Å; E1210-K1212 VanDerWaalsContact C-N 3.3Å; E1210-K1212 PolarHBondContact O-N 3.25Å; E1210-E1213 PolarHBondContact O-N 2.62Å; E1210-M1214 WeakPolarHBondContact O-CG 3.49Å; E1210-M1214 PolarHBondContact O-N 3.37Å
1211	L	86.6	Confident	82.5	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-70.7	-25.1	-177.8	-66.5	175.1	0	0	0	113.4	R1158 I1161 Q1162 L1195 F1198 L1207 V1209 M1214 L1215	R1158-L1211 HydrophobicContact CG-CD2 4.33Å; I1161-L1211 HydrophobicContact CB-CD1 4.02Å; I1161-L1211 HydrophobicContact CB-CD2 4.16Å; I1161-L1211 HydrophobicContact CG1-CD1 4.07Å; I1161-L1211 HydrophobicContact CG2-CB 4.07Å; I1161-L1211 HydrophobicContact CG2-CD1 4.25Å; I1161-L1211 HydrophobicContact CG2-CD2 4.03Å; I1161-L1211 HydrophobicContact CG2-CG 4.35Å; Q1162-L1211 HydrophobicContact CG-CD2 4.48Å; L1195-L1211 HydrophobicContact CD2-CB 3.92Å; F1198-L1211 HydrophobicContact CZ-CD1 3.87Å; L1207-L1211 HydrophobicContact CD1-CD1 3.73Å; L1207-L1211 HydrophobicContact CD1-CD2 4.47Å; L1207-L1211 HydrophobicContact CD1-CG 3.86Å; L1207-L1211 HydrophobicContact CD2-CD1 4.4Å; L1207-L1211 HydrophobicContact CG-CD1 3.73Å; L1207-L1211 HydrophobicContact CG-CG 4.25Å; L1207-L1211 WeakPolarHBondContact O-CB 3.49Å; L1207-L1211 VanDerWaalsContact O-CG 3.3Å; L1207-L1211 WeakPolarHBondContact O-CG 3.19Å; L1207-L1211 PolarHBondContact O-N 3.26Å; V1209-L1211 PolarHBondContact O-N 3.03Å; L1211-M1214 HydrophobicContact CD2-SD 4.29Å; L1211-L1215 VanDerWaalsContact O-CB 3.29Å; L1211-L1215 WeakPolarHBondContact O-CB 3.35Å; L1211-L1215 PolarHBondContact O-N 2.94Å; L1211-L1215 VanDerWaalsContact O-N 3.1Å
1212	K	88.6	Confident	82.9	Confident	86 Å²	86	86.9 Å²	86.9	37%	0.374	40%	0.396	S	S	.	.	H	α-helix	trans	-78.4	-33.3	175	-178.3	-178.8	-174.4	176.4	0	112	Y1208 V1209 E1210 N1216	Y1208-K1212 HydrophobicContact CE1-CD 3.83Å; Y1208-K1212 HydrophobicContact CE2-CD 4.44Å; Y1208-K1212 WeakPolarHBondContact O-CB 3.2Å; Y1208-K1212 PolarHBondContact O-N 3.02Å; Y1208-K1212 VanDerWaalsContact O-N 3.11Å; Y1208-K1212 PolarHBondContact OH-NZ 3.26Å; V1209-K1212 PolarHBondContact O-N 3.22Å; V1209-K1212 VanDerWaalsContact O-N 3.11Å; E1210-K1212 VanDerWaalsContact C-N 3.3Å; E1210-K1212 PolarHBondContact O-N 3.25Å; K1212-N1216 PolarHBondContact O-N 2.7Å; K1212-N1216 PolarHBondContact O-ND2 3.2Å; K1212-N1216 VanDerWaalsContact O-ND2 3.11Å
1213	E	87.6	Confident	83.1	Confident	109 Å²	109	83.5 Å²	83.5	51%	0.509	38%	0.375	S	S	.	.	H	α-helix	trans	-65.8	-51.1	172.1	-74	168.3	170	0	0	109.4	V1209 E1210 L1215 N1216 E1217	V1209-E1213 HydrophobicContact CG1-CG 4.39Å; V1209-E1213 WeakPolarHBondContact CG1-OE1 3.49Å; V1209-E1213 WeakPolarHBondContact O-CG 3.27Å; V1209-E1213 PolarHBondContact O-N 2.68Å; E1210-E1213 PolarHBondContact O-N 2.62Å; E1213-L1215 VanDerWaalsContact C-N 3.28Å; E1213-L1215 PolarHBondContact O-N 2.72Å; E1213-N1216 WeakPolarHBondContact O-CA 3.44Å; E1213-N1216 WeakPolarHBondContact O-CB 3.38Å; E1213-N1216 PolarHBondContact O-N 2.73Å; E1213-E1217 WeakPolarHBondContact O-CG 3.43Å; E1213-E1217 PolarHBondContact O-N 2.87Å
1214	M	84.3	Confident	83.3	Confident	40 Å²	40	79 Å²	79	20%	0.197	35%	0.354	C	S	.	.	H	α-helix	trans	-53.6	-41.3	172.3	-66.4	-177.2	74.8	0	0	113.3	Q1162 I1165 V1168 E1210 L1211 N1216 E1217 S1218	Q1162-M1214 HydrophobicContact CG-CE 4.03Å; Q1162-M1214 HydrophobicContact CG-SD 4.45Å; I1165-M1214 HydrophobicContact CD1-CB 4.01Å; V1168-M1214 HydrophobicContact CG2-CE 3.81Å; E1210-M1214 WeakPolarHBondContact O-CG 3.49Å; E1210-M1214 PolarHBondContact O-N 3.37Å; L1211-M1214 HydrophobicContact CD2-SD 4.29Å; M1214-N1216 VanDerWaalsContact C-N 3.31Å; M1214-N1216 PolarHBondContact O-N 3.01Å; M1214-E1217 PolarHBondContact O-N 3.15Å; M1214-S1218 PolarHBondContact O-N 3.35Å
1215	L	84.1	Confident	83.3	Confident	6 Å²	6	84.2 Å²	84.2	3%	0.031	38%	0.377	C	S	.	.	H	α-helix	trans	-70.7	-24.2	177.5	176.1	64.4	0	0	0	113.6	I1165 L1188 A1191 K1192 L1195 L1211 E1213 S1218 R1219	I1165-L1215 HydrophobicContact CD1-CB 3.94Å; I1165-L1215 HydrophobicContact CG1-CB 4.4Å; I1165-L1215 HydrophobicContact CG1-CD1 4.16Å; L1188-L1215 HydrophobicContact CD2-CD1 3.92Å; A1191-L1215 HydrophobicContact CB-CD1 4.23Å; K1192-L1215 HydrophobicContact CG-CD2 3.64Å; L1195-L1215 HydrophobicContact CD1-CB 4.4Å; L1195-L1215 HydrophobicContact CD1-CD2 3.37Å; L1211-L1215 VanDerWaalsContact O-CB 3.29Å; L1211-L1215 WeakPolarHBondContact O-CB 3.35Å; L1211-L1215 PolarHBondContact O-N 2.94Å; L1211-L1215 VanDerWaalsContact O-N 3.1Å; E1213-L1215 VanDerWaalsContact C-N 3.28Å; E1213-L1215 PolarHBondContact O-N 2.72Å; L1215-S1218 PolarHBondContact O-OG 2.88Å; L1215-R1219 WeakPolarHBondContact O-CG 3.19Å
1216	N	84.6	Confident	83.3	Confident	89 Å²	89	81.4 Å²	81.4	48%	0.476	36%	0.363	S	S	.	.	H	α-helix	trans	-82.2	-34.2	173.5	-71.2	-31.4	0	0	0	111.2	K1212 E1213 M1214 S1218	K1212-N1216 PolarHBondContact O-N 2.7Å; K1212-N1216 PolarHBondContact O-ND2 3.2Å; K1212-N1216 VanDerWaalsContact O-ND2 3.11Å; E1213-N1216 WeakPolarHBondContact O-CA 3.44Å; E1213-N1216 WeakPolarHBondContact O-CB 3.38Å; E1213-N1216 PolarHBondContact O-N 2.73Å; M1214-N1216 VanDerWaalsContact C-N 3.31Å; M1214-N1216 PolarHBondContact O-N 3.01Å; N1216-S1218 VanDerWaalsContact C-N 3.27Å; N1216-S1218 PolarHBondContact O-N 3.48Å
1217	E	80.9	Confident	83	Confident	135 Å²	135	71.2 Å²	71.2	63%	0.631	33%	0.328	S	S	*	.	H	α-helix	trans	-66.8	-27.1	172.6	-68.8	174	169.6	0	0	112.5	V1168 E1213 M1214 R1219	V1168-E1217 HydrophobicContact CG1-CB 4.24Å; E1213-E1217 WeakPolarHBondContact O-CG 3.43Å; E1213-E1217 PolarHBondContact O-N 2.87Å; M1214-E1217 PolarHBondContact O-N 3.15Å; E1217-R1219 PolarHBondContact O-N 3.44Å
1218	S	70	Confident	82.7	Confident	31 Å²	31	76.8 Å²	76.8	22%	0.217	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	24.1	177.3	81.8	0	0	0	0	114.6	M1214 L1215 N1216	M1214-S1218 PolarHBondContact O-N 3.35Å; L1215-S1218 PolarHBondContact O-OG 2.88Å; N1216-S1218 VanDerWaalsContact C-N 3.27Å; N1216-S1218 PolarHBondContact O-N 3.48Å
1219	R	60.6	Low	82.1	Confident	229 Å²	229	77.1 Å²	77.1	86%	0.864	36%	0.36	S	S	*	.			trans	-129.2	0	-175	-65.4	-177.3	76.4	-170.6	0.9	113.2	L1215 E1217	L1215-R1219 WeakPolarHBondContact O-CG 3.19Å; E1217-R1219 PolarHBondContact O-N 3.44Å

Retrieved 1,219 of 1,219 residues in 227.3 ms (Link to these results)

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