A0A087XYV6_POEFO Loading...

Kinesin-like protein KIF16B

Plus end-directed microtubule-dependent motor protein involved in endosome transport and receptor recycling and degradation. Regulates the plus end motility of early endosomes and the balance between recycling and degradation of receptors such as EGF receptor (EGFR) and FGF receptor (FGFR). Regulates the Golgi to endosome transport of FGFR-containing vesicles during early development, a key process for developing basement membrane and epiblast and primitive endoderm lineages during early postimplantation development.

AlphaFold DB , UniProt , Accession A0A087XYV6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,251 aa.

						>A0A087XYV6_POEFO|A0A087XYV6
MASVRVAVRVRPMNRREKELEAKCIIRMEGSKTSITNLKVPEGVVGDSMRERIRTFTYDFSYDSTDGRSRAFVSQETVFRDLGSDVLKAAFEGYNACVFAYGQTGSGKSYTMMGVPGDAGLIPRICEGLFSRIADASRRDEASFRTEVSYLEIYNERVRDLLRRKSSHTYNLRVREHPKDGPYVEDLSKHLVQNYGDVEELMEAGNINRTTASTGMNDVSSRSHAIFTINFTQAKFDAEMPSETVSKIHLVDLAGSERADATGASGVRLKEGGNINKSLVTLGNVISALADMAPDGGNANQKKKTVFVPYRDSVLTWLLKDSLGGNAKTIMIATISPADVNYGETLSTLRYANRAKNIINKPTVNEDSNVRLIRELRAEIARLKALLLQGNQIALLDSPTALSMEEKLHQNEARVLELTKEWTNKWNETQNILKEETLALRKEGIGVVLDSELPHLIGIDDDLLSTGIILYHLKEGRTYVGREDASSEQDIILHGLDLESEHCVFENQNGTVTLVPLGGARCSVNGVLVAAPVQLNQGAVILLGRTNMFRFNHPKEAAKLREKRKSGLLSSFSLSMTDLSKSCENLSTVMLYNPGLEFERQQREELEKLEMKRRLIKEMEEKQLSEKAELERLQQEVESQRKESQEVQQRILRQEESLRRRSQDIESRLRDFLAEKERFEEERRSEIQEVALQICRELQRLQRECEDQQVRLEAERRRLEEQEREQLSLVARLEEQLREAQEAAAVLLAREDSRRLEEERRVLAEIREALLRAKEAAERTDGEDAAKEARSVQKQYLAFKEAQVDELRRLQEVLTHSLRERQQRAPQDGGGQEETLLRQTQHRLHFKERQLANMAAGVLPALVEEQQRAQEVLRRGAAPAGLDNTLFQVEKELEETQDKLHLHWHGAQQLQQLQESCEFTANVARQEEKVRRKEREILAWREAQQREALEQAVARLERRHAALRPDRRRAQPDCHRSASGSGCSGRPGRSNPNSELRVEQEIQELRRRISESENQNRAQSVGTEEKMGHSSSPVGHRQSLNPLLPLSEDRINAYIEEEVQRRLRKMNLLNGGGVDLSVSCDSLREEEKLQNINPRRLKYEHLMSRPAGTRCAAKEPVRVSIPRYVLRGQGKDEHFEFEVKVSVMDDSWTVFRRYSRFREMHRSLKSKYPELAALEFPPKKLFGNRDERMVSERRSHLERYLRNLFRVMLSCSGSPLRPDEDGVFRLSKFNICEFSPFFKKGVFESSSHGTS
					

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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	70.8	Confident	92.7	Very high	175 Å²	175	35.7 Å²	35.7	86%	0.862	19%	0.188	S	C	*	.				0	153.1	0	-57.6	-165.4	-167.9	0	0	107.8	I359 N360 K361	M1-I359 HydrophobicContact CB-CG2 3.74Å; M1-I359 HydrophobicContact CG-CG2 4.37Å; M1-I359 HydrophobicContact SD-CG2 3.95Å; M1-N360 CarbonylContact C-O 3.58Å; M1-N360 WeakPolarHBondContact CA-O 3.46Å; M1-K361 HydrophobicContact CG-CG 4.34Å
2	A	85.2	Confident	92.7	Very high	33 Å²	33	37.8 Å²	37.8	27%	0.273	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	132.8	178.5	0	0	0	0	0	109.6	N360 P362	A2-N360 PolarHBondContact N-O 3.38Å; A2-N360 WeakPolarHBondContact O-CA 3.48Å; A2-N360 PolarHBondContact O-N 3.49Å; A2-P362 HydrophobicContact CB-CG 3.9Å
3	S	90.9	Very high	92.5	Very high	72 Å²	72	37.3 Å²	37.3	50%	0.503	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	151.1	171.9	49.4	0	0	0	0	111.1	R5 I358	S3-R5 PolarHBondContact O-N 2.81Å; S3-I358 CarbonylContact C-O 3.21Å; S3-I358 VanDerWaalsContact CA-O 3.31Å; S3-I358 WeakPolarHBondContact CA-O 3.2Å
4	V	94.1	Very high	92.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-66.3	123.3	169	174.2	0	0	0	0	108.5	T329 M331 I358	V4-T329 HydrophobicContact CG1-CG2 4.24Å; V4-T329 HydrophobicContact CG2-CG2 4.48Å; V4-M331 HydrophobicContact CG1-CB 4.48Å; V4-I358 HydrophobicContact CB-CB 4.32Å; V4-I358 HydrophobicContact CG2-CB 3.73Å; V4-I358 HydrophobicContact CG2-CG2 3.77Å; V4-I358 PolarHBondContact N-O 3.06Å
5	R	95.9	Very high	91.6	Very high	76 Å²	76	49.2 Å²	49.2	29%	0.287	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	139.6	176.9	-72.6	174.5	75.6	-164.5	11.2	110.2	S3 D59 F60 D85 T329 I330 M331	S3-R5 PolarHBondContact O-N 2.81Å; R5-D59 VanDerWaalsContact CA-OD2 3.31Å; R5-D59 WeakPolarHBondContact CA-OD2 3.27Å; R5-F60 VanDerWaalsContact NH2-CE2 3.27Å; R5-D85 IonicContact CZ-OD2 2.99Å; R5-D85 IonicContact NH1-OD2 2.74Å; R5-D85 PolarHBondContact NH1-OD2 2.76Å; R5-D85 IonicContact NH2-OD2 3.58Å; R5-T329 PolarHBondContact N-O 3.33Å; R5-I330 CarbonylContact O-C 3.53Å; R5-I330 WeakPolarHBondContact O-CA 3.47Å; R5-M331 PolarHBondContact O-N 3.38Å
6	V	97.3	Very high	91.2	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.4	-175.7	-176.8	0	0	0	0	110.4	Y58 D59 F60 M331 A352 A355 K356	V6-Y58 HydrophobicContact CB-CD1 4.34Å; V6-Y58 HydrophobicContact CG1-CD1 3.65Å; V6-Y58 HydrophobicContact CG1-CE1 4.25Å; V6-D59 PolarHBondContact N-OD2 3.13Å; V6-D59 WeakPolarHBondContact O-CB 3.49Å; V6-D59 PolarHBondContact O-N 2.71Å; V6-F60 PolarHBondContact O-N 2.67Å; V6-M331 WeakPolarHBondContact CA-O 3.21Å; V6-M331 HydrophobicContact CG2-CB 4.37Å; V6-A352 HydrophobicContact CG1-CB 3.76Å; V6-A355 HydrophobicContact CG2-CB 4.25Å; V6-K356 HydrophobicContact CB-CB 4.46Å; V6-K356 HydrophobicContact CG2-CB 3.79Å; V6-K356 HydrophobicContact CG2-CG 4.44Å
7	A	97.8	Very high	91.2	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	138.1	169	0	0	0	0	0	109.9	F60 Y62 L82 M331 I332 A333	A7-F60 WeakPolarHBondContact CA-O 3Å; A7-F60 HydrophobicContact CB-CB 4Å; A7-F60 HydrophobicContact CB-CD2 4.36Å; A7-Y62 HydrophobicContact CB-CD2 4.23Å; A7-Y62 HydrophobicContact CB-CE2 3.72Å; A7-L82 HydrophobicContact CB-CD1 3.94Å; A7-L82 HydrophobicContact CB-CD2 4.43Å; A7-M331 PolarHBondContact N-O 2.98Å; A7-I332 CarbonylContact O-C 3.6Å; A7-I332 WeakPolarHBondContact O-CA 3.35Å; A7-A333 PolarHBondContact O-N 3.16Å
8	V	98.2	Very high	91.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	140.8	166.9	-179.2	0	0	0	0	108.9	M28 T33 Y58 F60 S61 Y62 A333 I335 L349	V8-M28 HydrophobicContact CB-CE 4.34Å; V8-M28 HydrophobicContact CG1-CE 3.64Å; V8-T33 HydrophobicContact CG1-CG2 4.49Å; V8-Y58 HydrophobicContact CB-CD2 4.17Å; V8-Y58 HydrophobicContact CB-CE2 4.41Å; V8-Y58 HydrophobicContact CG2-CD1 3.85Å; V8-Y58 HydrophobicContact CG2-CD2 3.32Å; V8-Y58 HydrophobicContact CG2-CE1 3.9Å; V8-Y58 HydrophobicContact CG2-CE2 3.39Å; V8-Y58 HydrophobicContact CG2-CG 3.54Å; V8-F60 PolarHBondContact N-O 2.89Å; V8-S61 CarbonylContact O-C 3.6Å; V8-S61 WeakPolarHBondContact O-CA 3.47Å; V8-Y62 PolarHBondContact O-N 3.39Å; V8-A333 CarbonylContact C-O 3.56Å; V8-A333 VanDerWaalsContact CA-O 3.28Å; V8-A333 WeakPolarHBondContact CA-O 3.12Å; V8-A333 HydrophobicContact CG2-CB 4.14Å; V8-I335 HydrophobicContact CG1-CD1 3.76Å; V8-I335 HydrophobicContact CG1-CG1 4.13Å; V8-L349 HydrophobicContact CG1-CD2 3.86Å; V8-L349 HydrophobicContact CG2-CD2 4.1Å
9	R	97.6	Very high	91	Very high	6 Å²	6	62.5 Å²	62.5	2%	0.023	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	123.5	174.8	-171.6	176.8	-170.4	-172.4	13	111.3	Y62 S64 Q75 T111 A333 T334 I335	R9-Y62 WeakPolarHBondContact CA-O 3.45Å; R9-Y62 HydrophobicContact CB-CD2 4.4Å; R9-S64 PolarHBondContact NE-OG 2.96Å; R9-Q75 VanDerWaalsContact CZ-OE1 3.25Å; R9-T111 PolarHBondContact NH1-OG1 2.96Å; R9-A333 PolarHBondContact N-O 2.7Å; R9-T334 WeakPolarHBondContact O-CA 3.47Å; R9-I335 PolarHBondContact O-N 3.28Å
10	V	97	Very high	90.9	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132.3	171.6	61.1	0	0	0	0	109.8	I26 M28 Y62 D63 S64 T65 I335 P337	V10-I26 HydrophobicContact CB-CG2 4.15Å; V10-I26 HydrophobicContact CG1-CG2 4.19Å; V10-I26 HydrophobicContact CG2-CB 4.26Å; V10-I26 HydrophobicContact CG2-CG1 4.45Å; V10-I26 HydrophobicContact CG2-CG2 4.1Å; V10-M28 HydrophobicContact CB-CE 3.7Å; V10-M28 HydrophobicContact CB-SD 4.5Å; V10-M28 HydrophobicContact CG1-CE 3.52Å; V10-M28 HydrophobicContact CG1-CG 4.43Å; V10-M28 HydrophobicContact CG1-SD 3.67Å; V10-Y62 PolarHBondContact N-O 3.21Å; V10-D63 HydrophobicContact CG1-CB 4.46Å; V10-S64 WeakPolarHBondContact O-CA 3.35Å; V10-S64 VanDerWaalsContact O-CB 3.3Å; V10-S64 WeakPolarHBondContact O-CB 3.27Å; V10-S64 PolarHBondContact O-N 3.47Å; V10-T65 HydrophobicContact CB-CG2 4.49Å; V10-T65 HydrophobicContact CG1-CG2 3.87Å; V10-T65 HydrophobicContact CG2-CG2 3.86Å; V10-I335 HydrophobicContact CB-CD1 4.15Å; V10-I335 HydrophobicContact CB-CG1 3.82Å; V10-I335 HydrophobicContact CG2-CG1 4.2Å; V10-P337 HydrophobicContact CG2-CB 3.8Å; V10-P337 HydrophobicContact CG2-CG 4.34Å
11	R	94.9	Very high	90.9	Very high	30 Å²	30	69.8 Å²	69.8	11%	0.113	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-90.5	168.3	178.3	65.4	150.1	173.1	73.7	1.2	112.2	N14 E17 G105 S106 I335 P337	R11-N14 PolarHBondContact NH2-ND2 3.3Å; R11-N14 VanDerWaalsContact NH2-ND2 3.11Å; R11-E17 IonicContact CZ-OE1 2.77Å; R11-E17 IonicContact CZ-OE2 3.93Å; R11-E17 IonicContact NH1-OE1 2.74Å; R11-E17 PolarHBondContact NH1-OE1 2.64Å; R11-E17 IonicContact NH1-OE2 2.81Å; R11-E17 PolarHBondContact NH1-OE2 2.88Å; R11-E17 IonicContact NH2-OE1 3.02Å; R11-E17 PolarHBondContact NH2-OE1 3.49Å; R11-E17 IonicContact NH2-OE2 2.99Å; R11-E17 PolarHBondContact NH2-OE2 3.41Å; R11-G105 PolarHBondContact NE-O 3.24Å; R11-G105 PolarHBondContact NH2-O 3.14Å; R11-G105 VanDerWaalsContact NH2-O 3.1Å; R11-S106 WeakPolarHBondContact CG-O 3.43Å; R11-I335 PolarHBondContact N-O 3.17Å; R11-P337 WeakPolarHBondContact O-CD 3.48Å; R11-P337 WeakPolarHBondContact O-CG 3.4Å
12	P	92.8	Very high	91.9	Very high	60 Å²	60	62.2 Å²	62.2	39%	0.39	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-58.4	154.5	167.9	-18.6	29.5	0	0	0	112.4	N14 S64 T65	P12-N14 PolarHBondContact O-N 2.9Å; P12-S64 WeakPolarHBondContact CD-O 3.26Å; P12-S64 WeakPolarHBondContact CG-O 3.26Å; P12-T65 WeakPolarHBondContact CB-O 3.37Å
13	M	90.3	Very high	92.2	Very high	32 Å²	32	67.2 Å²	67.2	16%	0.158	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-56.4	124.6	163.9	-79.7	-73	-161.3	0	0	110.2	E17 K18 A22 K23 C24 P337 A338	M13-E17 HydrophobicContact SD-CB 3.7Å; M13-E17 HydrophobicContact SD-CG 4.4Å; M13-K18 HydrophobicContact CB-CG 4.09Å; M13-K18 VanDerWaalsContact O-CE 3.24Å; M13-K18 WeakPolarHBondContact O-CE 3.27Å; M13-A22 HydrophobicContact CE-CB 4.38Å; M13-A22 WeakPolarHBondContact CE-O 3.39Å; M13-K23 WeakPolarHBondContact CE-O 2.93Å; M13-C24 HydrophobicContact CE-CB 4.17Å; M13-P337 HydrophobicContact CE-CB 4.5Å; M13-P337 HydrophobicContact CE-CG 4.42Å; M13-P337 HydrophobicContact CG-CG 3.86Å; M13-P337 HydrophobicContact SD-CB 4.49Å; M13-P337 HydrophobicContact SD-CG 3.81Å; M13-A338 HydrophobicContact CE-CB 3.91Å; M13-A338 HydrophobicContact SD-CB 3.78Å
14	N	86.4	Confident	92.4	Very high	59 Å²	59	67.3 Å²	67.3	32%	0.316	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-79.2	170.7	179.3	76.2	39.8	0	0	0	111.2	R11 P12 R16 E17 K18	R11-N14 PolarHBondContact NH2-ND2 3.3Å; R11-N14 VanDerWaalsContact NH2-ND2 3.11Å; P12-N14 PolarHBondContact O-N 2.9Å; N14-R16 PolarHBondContact O-N 2.94Å; N14-R16 WeakPolarHBondContact OD1-CA 3.25Å; N14-R16 WeakPolarHBondContact OD1-CB 3.24Å; N14-R16 PolarHBondContact OD1-N 3.24Å; N14-E17 VanDerWaalsContact CG-OE2 3.27Å; N14-E17 PolarHBondContact N-OE2 2.8Å; N14-E17 VanDerWaalsContact ND2-CD 3.32Å; N14-E17 PolarHBondContact ND2-OE1 2.72Å; N14-E17 PolarHBondContact ND2-OE2 3.02Å; N14-E17 PolarHBondContact O-N 3.01Å; N14-E17 WeakPolarHBondContact OD1-CG 3.38Å; N14-E17 PolarHBondContact OD1-N 2.73Å; N14-K18 WeakPolarHBondContact O-CG 3.5Å; N14-K18 PolarHBondContact O-N 3.5Å
15	R	84.8	Confident	92.4	Very high	194 Å²	194	67.5 Å²	67.5	73%	0.732	31%	0.311	S	S	*	.	H	α-helix	trans	-57.4	-45.5	-177.5	179.9	174	170.8	163.7	2.5	112.7	E17 K18 E19	R15-E17 PolarHBondContact O-N 3.11Å; R15-K18 PolarHBondContact O-N 2.71Å; R15-E19 HydrophobicContact CG-CG 4.36Å; R15-E19 WeakPolarHBondContact CG-OE1 3.25Å; R15-E19 IonicContact CZ-OE1 3.21Å; R15-E19 IonicContact NE-OE1 2.87Å; R15-E19 PolarHBondContact NE-OE1 2.67Å; R15-E19 IonicContact NH2-OE1 3Å; R15-E19 PolarHBondContact NH2-OE1 3.21Å; R15-E19 VanDerWaalsContact NH2-OE1 3.12Å; R15-E19 WeakPolarHBondContact O-CB 3.5Å; R15-E19 WeakPolarHBondContact O-CG 3.43Å; R15-E19 PolarHBondContact O-N 3.47Å
16	R	84.9	Confident	92.4	Very high	184 Å²	184	64.6 Å²	64.6	69%	0.694	30%	0.301	S	S	*	.	H	α-helix	trans	-64.6	-38.8	179.5	-179.4	-179.4	176.1	-171.2	-0.9	112.5	N14 K18 E19 L20	N14-R16 PolarHBondContact O-N 2.94Å; N14-R16 WeakPolarHBondContact OD1-CA 3.25Å; N14-R16 WeakPolarHBondContact OD1-CB 3.24Å; N14-R16 PolarHBondContact OD1-N 3.24Å; R16-K18 VanDerWaalsContact C-N 3.35Å; R16-E19 PolarHBondContact O-N 2.81Å; R16-L20 HydrophobicContact CG-CD1 4Å; R16-L20 WeakPolarHBondContact O-CB 3.27Å; R16-L20 VanDerWaalsContact O-CG 3.23Å; R16-L20 WeakPolarHBondContact O-CG 3.38Å; R16-L20 PolarHBondContact O-N 2.88Å
17	E	90.8	Very high	92.2	Very high	7 Å²	7	72.3 Å²	72.3	3%	0.033	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-37.4	176.5	-69.7	161.1	166	0	0	111.2	R11 M13 N14 R15 L20 E21 A22 S336 A338 N341	R11-E17 IonicContact CZ-OE1 2.77Å; R11-E17 IonicContact CZ-OE2 3.93Å; R11-E17 IonicContact NH1-OE1 2.74Å; R11-E17 PolarHBondContact NH1-OE1 2.64Å; R11-E17 IonicContact NH1-OE2 2.81Å; R11-E17 PolarHBondContact NH1-OE2 2.88Å; R11-E17 IonicContact NH2-OE1 3.02Å; R11-E17 PolarHBondContact NH2-OE1 3.49Å; R11-E17 IonicContact NH2-OE2 2.99Å; R11-E17 PolarHBondContact NH2-OE2 3.41Å; M13-E17 HydrophobicContact SD-CB 3.7Å; M13-E17 HydrophobicContact SD-CG 4.4Å; N14-E17 VanDerWaalsContact CG-OE2 3.27Å; N14-E17 PolarHBondContact N-OE2 2.8Å; N14-E17 VanDerWaalsContact ND2-CD 3.32Å; N14-E17 PolarHBondContact ND2-OE1 2.72Å; N14-E17 PolarHBondContact ND2-OE2 3.02Å; N14-E17 PolarHBondContact O-N 3.01Å; N14-E17 WeakPolarHBondContact OD1-CG 3.38Å; N14-E17 PolarHBondContact OD1-N 2.73Å; R15-E17 PolarHBondContact O-N 3.11Å; E17-L20 PolarHBondContact O-N 3.46Å; E17-E21 PolarHBondContact O-N 3Å; E17-A22 HydrophobicContact CB-CB 4.16Å; E17-A22 VanDerWaalsContact O-CB 3.24Å; E17-A22 WeakPolarHBondContact O-CB 3.28Å; E17-A22 PolarHBondContact O-N 3.34Å; E17-S336 PolarHBondContact OE1-OG 3.17Å; E17-A338 HydrophobicContact CB-CB 4.24Å; E17-A338 HydrophobicContact CG-CB 3.74Å; E17-N341 PolarHBondContact OE1-ND2 3.15Å; E17-N341 VanDerWaalsContact OE1-ND2 3.13Å
18	K	89.7	Confident	92	Very high	140 Å²	140	73.3 Å²	73.3	61%	0.609	34%	0.335	S	S	*	.	H	α-helix	trans	-67.4	-42.3	172.6	-68.4	172.9	178.3	173.8	0	112.5	M13 N14 R15 R16 L20 E21	M13-K18 HydrophobicContact CB-CG 4.09Å; M13-K18 VanDerWaalsContact O-CE 3.24Å; M13-K18 WeakPolarHBondContact O-CE 3.27Å; N14-K18 WeakPolarHBondContact O-CG 3.5Å; N14-K18 PolarHBondContact O-N 3.5Å; R15-K18 PolarHBondContact O-N 2.71Å; R16-K18 VanDerWaalsContact C-N 3.35Å; K18-L20 PolarHBondContact O-N 2.85Å; K18-E21 PolarHBondContact O-N 3.17Å; K18-E21 VanDerWaalsContact O-N 3.11Å
19	E	90.1	Very high	91.6	Very high	118 Å²	118	78.3 Å²	78.3	55%	0.551	36%	0.358	S	S	*	.	H	α-helix	trans	-65.8	-24.3	175.9	-73.6	167.5	166.2	0	0	112.9	R15 R16	R15-E19 HydrophobicContact CG-CG 4.36Å; R15-E19 WeakPolarHBondContact CG-OE1 3.25Å; R15-E19 IonicContact CZ-OE1 3.21Å; R15-E19 IonicContact NE-OE1 2.87Å; R15-E19 PolarHBondContact NE-OE1 2.67Å; R15-E19 IonicContact NH2-OE1 3Å; R15-E19 PolarHBondContact NH2-OE1 3.21Å; R15-E19 VanDerWaalsContact NH2-OE1 3.12Å; R15-E19 WeakPolarHBondContact O-CB 3.5Å; R15-E19 WeakPolarHBondContact O-CG 3.43Å; R15-E19 PolarHBondContact O-N 3.47Å; R16-E19 PolarHBondContact O-N 2.81Å
20	L	88.4	Confident	91.1	Very high	104 Å²	104	81.4 Å²	81.4	55%	0.545	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	7.6	173.6	-69.7	171.6	0	0	0	113.5	R16 E17 K18 A22	R16-L20 HydrophobicContact CG-CD1 4Å; R16-L20 WeakPolarHBondContact O-CB 3.27Å; R16-L20 VanDerWaalsContact O-CG 3.23Å; R16-L20 WeakPolarHBondContact O-CG 3.38Å; R16-L20 PolarHBondContact O-N 2.88Å; E17-L20 PolarHBondContact O-N 3.46Å; K18-L20 PolarHBondContact O-N 2.85Å; L20-A22 PolarHBondContact O-N 3.47Å; L20-A22 VanDerWaalsContact O-N 3.08Å
21	E	90.9	Very high	90.9	Very high	174 Å²	174	83.8 Å²	83.8	81%	0.813	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	29.7	-175.2	-56.9	-170.3	156.2	0	0	113.9	E17 K18	E17-E21 PolarHBondContact O-N 3Å; K18-E21 PolarHBondContact O-N 3.17Å; K18-E21 VanDerWaalsContact O-N 3.11Å
22	A	91.9	Very high	90.9	Very high	17 Å²	17	87.6 Å²	87.6	14%	0.14	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-64.1	140.3	-174.8	0	0	0	0	0	111.5	M13 E17 L20 A338 D339	M13-A22 HydrophobicContact CE-CB 4.38Å; M13-A22 WeakPolarHBondContact CE-O 3.39Å; E17-A22 HydrophobicContact CB-CB 4.16Å; E17-A22 VanDerWaalsContact O-CB 3.24Å; E17-A22 WeakPolarHBondContact O-CB 3.28Å; E17-A22 PolarHBondContact O-N 3.34Å; L20-A22 PolarHBondContact O-N 3.47Å; L20-A22 VanDerWaalsContact O-N 3.08Å; A22-A338 HydrophobicContact CB-CB 4.03Å; A22-D339 WeakPolarHBondContact CA-OD1 3.37Å; A22-D339 WeakPolarHBondContact CB-OD1 3.32Å
23	K	92.6	Very high	91.1	Very high	137 Å²	137	84.7 Å²	84.7	60%	0.596	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-92.3	142.5	-174.4	-70.8	178.8	179.3	178.5	0	111.3	M13 I25 L38 D339	M13-K23 WeakPolarHBondContact CE-O 2.93Å; K23-I25 PolarHBondContact O-N 3.36Å; K23-L38 HydrophobicContact CB-CD1 3.54Å; K23-L38 HydrophobicContact CD-CD1 3.84Å; K23-L38 HydrophobicContact CG-CD1 4.3Å; K23-D339 HydrophobicContact CB-CB 4.44Å; K23-D339 PolarHBondContact N-OD1 2.85Å; K23-D339 PolarHBondContact O-N 3.48Å
24	C	93.4	Very high	91.3	Very high	74 Å²	74	84.3 Å²	84.3	50%	0.5	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-72.6	121.5	173.9	-168.3	0	0	0	0	110.1	M13 P337	M13-C24 HydrophobicContact CE-CB 4.17Å; C24-P337 CarbonylContact C-O 3.59Å; C24-P337 WeakPolarHBondContact CA-O 3.36Å
25	I	94.9	Very high	91.8	Very high	4 Å²	4	81.5 Å²	81.5	2%	0.021	39%	0.392	C	S	.	.			trans	-109	-3.9	-179.5	51.6	158.5	0	0	0	113.8	K23 I35 T36 L38 P337 D339 Y342	K23-I25 PolarHBondContact O-N 3.36Å; I25-I35 HydrophobicContact CD1-CD1 4.08Å; I25-I35 HydrophobicContact CD1-CG1 3.94Å; I25-I35 CarbonylContact O-C 3.56Å; I25-I35 WeakPolarHBondContact O-CA 3.36Å; I25-T36 WeakPolarHBondContact CB-O 3.29Å; I25-T36 WeakPolarHBondContact CG2-O 3.15Å; I25-T36 PolarHBondContact O-N 3.39Å; I25-L38 HydrophobicContact CG2-CD1 3.75Å; I25-L38 HydrophobicContact CG2-CD2 4.45Å; I25-L38 HydrophobicContact CG2-CG 3.75Å; I25-P337 WeakPolarHBondContact CG1-O 3.19Å; I25-P337 PolarHBondContact N-O 2.96Å; I25-D339 HydrophobicContact CG2-CB 3.56Å; I25-Y342 HydrophobicContact CD1-CD2 3.78Å; I25-Y342 HydrophobicContact CD1-CG 4.29Å
26	I	95.8	Very high	92.2	Very high	16 Å²	16	73.7 Å²	73.7	8%	0.082	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135	-178	-60.4	-60.1	0	0	0	110.5	V10 M28 T33 S34 I35 I335 T345	V10-I26 HydrophobicContact CB-CG2 4.15Å; V10-I26 HydrophobicContact CG1-CG2 4.19Å; V10-I26 HydrophobicContact CG2-CB 4.26Å; V10-I26 HydrophobicContact CG2-CG1 4.45Å; V10-I26 HydrophobicContact CG2-CG2 4.1Å; I26-M28 HydrophobicContact CG2-CE 4.13Å; I26-M28 HydrophobicContact CG2-CG 4.2Å; I26-T33 HydrophobicContact CG2-CG2 4.21Å; I26-S34 WeakPolarHBondContact CA-O 3.3Å; I26-I35 HydrophobicContact CD1-CB 3.83Å; I26-I35 HydrophobicContact CD1-CD1 4.31Å; I26-I35 HydrophobicContact CD1-CG1 3.75Å; I26-I335 HydrophobicContact CD1-CD1 3.94Å; I26-I335 HydrophobicContact CG1-CD1 4.06Å; I26-I335 HydrophobicContact CG2-CD1 4.15Å; I26-T345 HydrophobicContact CD1-CG2 3.77Å; I26-T345 HydrophobicContact CG1-CG2 4.42Å
27	R	93.1	Very high	92.5	Very high	163 Å²	163	66.3 Å²	66.3	62%	0.615	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	126.5	170.4	178.7	174.4	174.1	161	-2.5	108.8	E29 S34	R27-E29 IonicContact CZ-OE1 2.76Å; R27-E29 IonicContact NE-OE1 3.02Å; R27-E29 PolarHBondContact NE-OE1 2.87Å; R27-E29 IonicContact NH2-OE1 3.44Å; R27-E29 PolarHBondContact NH2-OE1 3.41Å; R27-S34 PolarHBondContact N-O 2.89Å; R27-S34 PolarHBondContact O-N 2.92Å
28	M	93.5	Very high	92.3	Very high	21 Å²	21	69.5 Å²	69.5	10%	0.103	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.6	178	-68.5	-172.5	178.1	0	0	111	V8 V10 I26 K32 T33 D63 I335	V8-M28 HydrophobicContact CB-CE 4.34Å; V8-M28 HydrophobicContact CG1-CE 3.64Å; V10-M28 HydrophobicContact CB-CE 3.7Å; V10-M28 HydrophobicContact CB-SD 4.5Å; V10-M28 HydrophobicContact CG1-CE 3.52Å; V10-M28 HydrophobicContact CG1-CG 4.43Å; V10-M28 HydrophobicContact CG1-SD 3.67Å; I26-M28 HydrophobicContact CG2-CE 4.13Å; I26-M28 HydrophobicContact CG2-CG 4.2Å; M28-K32 WeakPolarHBondContact CA-O 3.04Å; M28-T33 HydrophobicContact CE-CG2 3.8Å; M28-T33 WeakPolarHBondContact CE-OG1 3.27Å; M28-T33 HydrophobicContact CG-CG2 4.17Å; M28-D63 HydrophobicContact CB-CB 4.3Å; M28-D63 HydrophobicContact SD-CB 4.38Å; M28-I335 HydrophobicContact CE-CD1 3.97Å
29	E	89.1	Confident	92	Very high	104 Å²	104	72 Å²	72	49%	0.486	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	103.1	179.2	-69.6	-177.4	177.9	0	0	109.5	R27 S31 K32	R27-E29 IonicContact CZ-OE1 2.76Å; R27-E29 IonicContact NE-OE1 3.02Å; R27-E29 PolarHBondContact NE-OE1 2.87Å; R27-E29 IonicContact NH2-OE1 3.44Å; R27-E29 PolarHBondContact NH2-OE1 3.41Å; E29-S31 PolarHBondContact O-N 2.93Å; E29-K32 PolarHBondContact N-O 3.04Å; E29-K32 WeakPolarHBondContact O-CB 2.99Å; E29-K32 PolarHBondContact O-N 2.9Å
30	G	88.9	Confident	91.6	Very high	71 Å²	71	67.9 Å²	67.9	73%	0.732	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	-117.8	-174.3	0	0	0	0	0	111.5	S61	G30-S61 WeakPolarHBondContact O-CB 3.45Å
31	S	92.7	Very high	90.9	Very high	50 Å²	50	67.3 Å²	67.3	35%	0.35	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.6	176.7	56.6	0	0	0	0	114.5	E29 Y58 S61	E29-S31 PolarHBondContact O-N 2.93Å; S31-Y58 PolarHBondContact O-N 3.3Å; S31-S61 PolarHBondContact O-OG 3.14Å; S31-S61 VanDerWaalsContact O-OG 3.14Å
32	K	95.2	Very high	89.4	Confident	110 Å²	110	66.6 Å²	66.6	48%	0.478	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.3	-178	-62.1	176.9	-177.4	174	0	111.3	M28 E29 T55 F56	M28-K32 WeakPolarHBondContact CA-O 3.04Å; E29-K32 PolarHBondContact N-O 3.04Å; E29-K32 WeakPolarHBondContact O-CB 2.99Å; E29-K32 PolarHBondContact O-N 2.9Å; K32-T55 HydrophobicContact CB-CG2 4.07Å; K32-T55 HydrophobicContact CD-CG2 4.42Å; K32-T55 HydrophobicContact CG-CG2 4.44Å; K32-F56 CarbonylContact C-O 3.59Å; K32-F56 WeakPolarHBondContact CA-O 3.04Å
33	T	96.3	Very high	88	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.3	168	-63.3	0	0	0	0	109.4	V8 I26 M28 T55 F56 S61 I335 L349	V8-T33 HydrophobicContact CG1-CG2 4.49Å; I26-T33 HydrophobicContact CG2-CG2 4.21Å; M28-T33 HydrophobicContact CE-CG2 3.8Å; M28-T33 WeakPolarHBondContact CE-OG1 3.27Å; M28-T33 HydrophobicContact CG-CG2 4.17Å; T33-T55 WeakPolarHBondContact O-CA 3.36Å; T33-F56 PolarHBondContact N-O 3.17Å; T33-F56 PolarHBondContact O-N 2.84Å; T33-S61 WeakPolarHBondContact OG1-CB 3.35Å; T33-S61 PolarHBondContact OG1-OG 2.97Å; T33-I335 HydrophobicContact CG2-CD1 4.31Å; T33-L349 HydrophobicContact CG2-CD1 4.34Å; T33-L349 HydrophobicContact CG2-CD2 3.84Å
34	S	95.2	Very high	86.3	Confident	23 Å²	23	65.8 Å²	65.8	16%	0.161	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	136.9	176.3	-58.2	0	0	0	0	111.2	I26 R27 R54 T55	I26-S34 WeakPolarHBondContact CA-O 3.3Å; R27-S34 PolarHBondContact N-O 2.89Å; R27-S34 PolarHBondContact O-N 2.92Å; S34-R54 CarbonylContact C-O 3.58Å; S34-R54 WeakPolarHBondContact CA-O 3.41Å; S34-T55 WeakPolarHBondContact OG-CG2 3.36Å; S34-T55 PolarHBondContact OG-OG1 2.85Å
35	I	95.6	Very high	84.7	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.5	175.2	-170.6	-177.3	0	0	0	110.4	I25 I26 R54 F56 Y342 T345 L346 L349	I25-I35 HydrophobicContact CD1-CD1 4.08Å; I25-I35 HydrophobicContact CD1-CG1 3.94Å; I25-I35 CarbonylContact O-C 3.56Å; I25-I35 WeakPolarHBondContact O-CA 3.36Å; I26-I35 HydrophobicContact CD1-CB 3.83Å; I26-I35 HydrophobicContact CD1-CD1 4.31Å; I26-I35 HydrophobicContact CD1-CG1 3.75Å; I35-R54 HydrophobicContact CG2-CB 3.93Å; I35-R54 PolarHBondContact N-O 2.8Å; I35-R54 PolarHBondContact O-N 2.79Å; I35-F56 HydrophobicContact CG2-CE2 4.2Å; I35-Y342 HydrophobicContact CD1-CD2 3.56Å; I35-Y342 HydrophobicContact CD1-CE2 3.62Å; I35-Y342 HydrophobicContact CD1-CG 4.27Å; I35-Y342 HydrophobicContact CG1-CD2 3.82Å; I35-Y342 HydrophobicContact CG1-CE2 3.73Å; I35-T345 HydrophobicContact CD1-CG2 3.96Å; I35-L346 HydrophobicContact CD1-CB 4.02Å; I35-L346 HydrophobicContact CG2-CD1 4.12Å; I35-L349 HydrophobicContact CB-CD1 4.07Å; I35-L349 HydrophobicContact CD1-CD1 4.41Å; I35-L349 HydrophobicContact CG2-CD1 4.07Å
36	T	93.9	Very high	83.3	Confident	30 Å²	30	71.1 Å²	71.1	18%	0.184	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.1	-178	-52.3	0	0	0	0	111.4	I25 L38 R52 I53	I25-T36 WeakPolarHBondContact CB-O 3.29Å; I25-T36 WeakPolarHBondContact CG2-O 3.15Å; I25-T36 PolarHBondContact O-N 3.39Å; T36-L38 HydrophobicContact CG2-CD2 4.04Å; T36-R52 CarbonylContact C-O 3.56Å; T36-R52 WeakPolarHBondContact CA-O 3.49Å; T36-I53 HydrophobicContact CG2-CG1 4.25Å
37	N	90.7	Very high	81.5	Confident	30 Å²	30	75.9 Å²	75.9	16%	0.16	44%	0.435	C	S	.	.			trans	-91.6	100.7	175.3	-171	-2	0	0	0	110.9	K39 V40 R52 Y342	N37-K39 PolarHBondContact O-N 2.86Å; N37-K39 WeakPolarHBondContact OD1-CB 3.47Å; N37-K39 PolarHBondContact OD1-N 2.97Å; N37-K39 VanDerWaalsContact OD1-N 3.16Å; N37-V40 HydrophobicContact CB-CG2 4.31Å; N37-V40 PolarHBondContact O-N 3.18Å; N37-R52 PolarHBondContact N-O 2.82Å; N37-Y342 HydrophobicContact CB-CD2 4.43Å; N37-Y342 HydrophobicContact CB-CE1 4.44Å; N37-Y342 HydrophobicContact CB-CE2 3.63Å
38	L	86.9	Confident	79.9	Confident	73 Å²	73	70.3 Å²	70.3	38%	0.382	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-8.7	-179.9	-57.4	-177.2	0	0	0	114.1	K23 I25 T36 V40 D339	K23-L38 HydrophobicContact CB-CD1 3.54Å; K23-L38 HydrophobicContact CD-CD1 3.84Å; K23-L38 HydrophobicContact CG-CD1 4.3Å; I25-L38 HydrophobicContact CG2-CD1 3.75Å; I25-L38 HydrophobicContact CG2-CD2 4.45Å; I25-L38 HydrophobicContact CG2-CG 3.75Å; T36-L38 HydrophobicContact CG2-CD2 4.04Å; L38-V40 PolarHBondContact O-N 2.66Å; L38-D339 HydrophobicContact CD1-CB 3.76Å
39	K	83.1	Confident	78.3	Confident	194 Å²	194	75 Å²	75	84%	0.843	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-10.4	172.4	-58.5	-174.2	178.9	-175.3	0	113.1	N37	N37-K39 PolarHBondContact O-N 2.86Å; N37-K39 WeakPolarHBondContact OD1-CB 3.47Å; N37-K39 PolarHBondContact OD1-N 2.97Å; N37-K39 VanDerWaalsContact OD1-N 3.16Å
40	V	80.8	Confident	76.9	Confident	30 Å²	30	78.8 Å²	78.8	18%	0.182	45%	0.454	C	S	.	.	S	Bend	trans	-101.2	122.6	176.8	-176.3	0	0	0	0	109.1	N37 L38 R52	N37-V40 HydrophobicContact CB-CG2 4.31Å; N37-V40 PolarHBondContact O-N 3.18Å; L38-V40 PolarHBondContact O-N 2.66Å; V40-R52 HydrophobicContact CB-CB 4.15Å; V40-R52 HydrophobicContact CB-CG 4.07Å; V40-R52 HydrophobicContact CG1-CB 4.01Å; V40-R52 HydrophobicContact CG1-CG 4.26Å; V40-R52 PolarHBondContact O-NE 2.94Å; V40-R52 VanDerWaalsContact O-NE 3.14Å
41	P	74.4	Confident	76	Confident	92 Å²	92	80.7 Å²	80.7	60%	0.597	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-58.4	161.7	-176.3	-27.2	35.4	0	0	0	115.5
42	E	59.4	Low	75.6	Confident	160 Å²	160	80.5 Å²	80.5	75%	0.748	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	133.7	170.2	-58.7	-150.4	123.1	0	0	110.8	R52	E42-R52 VanDerWaalsContact CG-NH2 3.27Å; E42-R52 IonicContact OE1-CZ 3.46Å; E42-R52 IonicContact OE1-NH1 3.49Å; E42-R52 PolarHBondContact OE1-NH1 3.1Å; E42-R52 VanDerWaalsContact OE1-NH1 3.17Å; E42-R52 IonicContact OE1-NH2 3.55Å; E42-R52 PolarHBondContact OE1-NH2 2.8Å
43	G	61.8	Low	75.3	Confident	71 Å²	71	78.2 Å²	78.2	73%	0.732	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.8	-3	176.9	0	0	0	0	0	116.5	V45	G43-V45 PolarHBondContact O-N 3.21Å
44	V	58.5	Low	75.1	Confident	66 Å²	66	82 Å²	82	40%	0.4	44%	0.442	S	S	.	.			trans	-77.7	120.9	179.2	-156.7	0	0	0	0	111.4	S48	V44-S48 VanDerWaalsContact CG1-CB 3.4Å
45	V	58.8	Low	75	Confident	138 Å²	138	84.5 Å²	84.5	84%	0.836	46%	0.457	S	S	*	.			trans	-96.2	147.2	-178	-173.4	0	0	0	0	110.6	G43	G43-V45 PolarHBondContact O-N 3.21Å
46	G	65.9	Low	75.1	Confident	51 Å²	51	85.8 Å²	85.8	53%	0.526	46%	0.462	S	S	.	.	S	Bend	trans	94.7	-151.2	177.4	0	0	0	0	0	113.8	S48 M49	G46-S48 PolarHBondContact O-N 3.26Å; G46-S48 VanDerWaalsContact O-N 3.13Å; G46-M49 WeakPolarHBondContact O-CB 3.24Å; G46-M49 PolarHBondContact O-N 2.96Å
47	D	57.9	Low	75.2	Confident	117 Å²	117	87.6 Å²	87.6	63%	0.626	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.1	-174.5	-94.2	-41.6	0	0	0	113.6	M49 R50 E51	D47-M49 PolarHBondContact O-N 2.87Å; D47-M49 VanDerWaalsContact O-N 3.14Å; D47-R50 WeakPolarHBondContact O-CB 3.44Å; D47-R50 PolarHBondContact O-N 3Å; D47-R50 IonicContact OD1-CZ 2.89Å; D47-R50 IonicContact OD1-NH1 2.65Å; D47-R50 PolarHBondContact OD1-NH1 3.47Å; D47-E51 PolarHBondContact O-N 2.71Å
48	S	59.1	Low	75.4	Confident	45 Å²	45	86.3 Å²	86.3	32%	0.315	47%	0.466	S	S	.	.	H	α-helix	trans	-60.5	-21.9	174.3	-52.6	0	0	0	0	113.7	V44 G46 R50 E51 R52	V44-S48 VanDerWaalsContact CG1-CB 3.4Å; G46-S48 PolarHBondContact O-N 3.26Å; G46-S48 VanDerWaalsContact O-N 3.13Å; S48-R50 VanDerWaalsContact C-N 3.33Å; S48-E51 PolarHBondContact O-N 2.92Å; S48-R52 PolarHBondContact O-N 3Å
49	M	59.7	Low	75.9	Confident	119 Å²	119	85.3 Å²	85.3	59%	0.586	46%	0.462	S	S	*	.	H	α-helix	trans	-69	-31.6	173.2	-167.9	171.2	-175.5	0	0	112.2	G46 D47 E51 R52 I53	G46-M49 WeakPolarHBondContact O-CB 3.24Å; G46-M49 PolarHBondContact O-N 2.96Å; D47-M49 PolarHBondContact O-N 2.87Å; D47-M49 VanDerWaalsContact O-N 3.14Å; M49-E51 VanDerWaalsContact C-N 3.31Å; M49-R52 PolarHBondContact O-N 3.28Å; M49-I53 PolarHBondContact O-N 3.04Å
50	R	61.2	Low	76.5	Confident	184 Å²	184	78.4 Å²	78.4	69%	0.694	43%	0.431	S	S	*	.	H	α-helix	trans	-71.9	-24.4	171.6	-67.7	171.4	162.7	167.7	-10	112.7	D47 S48 R54	D47-R50 WeakPolarHBondContact O-CB 3.44Å; D47-R50 PolarHBondContact O-N 3Å; D47-R50 IonicContact OD1-CZ 2.89Å; D47-R50 IonicContact OD1-NH1 2.65Å; D47-R50 PolarHBondContact OD1-NH1 3.47Å; S48-R50 VanDerWaalsContact C-N 3.33Å; R50-R54 WeakPolarHBondContact O-CG 3.21Å
51	E	68.5	Low	77.3	Confident	112 Å²	112	77.7 Å²	77.7	52%	0.523	43%	0.428	S	S	.	.	H	α-helix	trans	-75.9	-34.2	170.5	-64.3	-155.8	114.5	0	0	112.2	D47 S48 M49	D47-E51 PolarHBondContact O-N 2.71Å; S48-E51 PolarHBondContact O-N 2.92Å; M49-E51 VanDerWaalsContact C-N 3.31Å
52	R	83.9	Confident	78.3	Confident	45 Å²	45	73.6 Å²	73.6	17%	0.17	40%	0.401	C	S	.	.	H	α-helix	trans	-72.9	-45.5	177.9	-171.4	169.8	-174.3	-112.9	-15.7	113.2	T36 N37 V40 E42 S48 M49	T36-R52 CarbonylContact C-O 3.56Å; T36-R52 WeakPolarHBondContact CA-O 3.49Å; N37-R52 PolarHBondContact N-O 2.82Å; V40-R52 HydrophobicContact CB-CB 4.15Å; V40-R52 HydrophobicContact CB-CG 4.07Å; V40-R52 HydrophobicContact CG1-CB 4.01Å; V40-R52 HydrophobicContact CG1-CG 4.26Å; V40-R52 PolarHBondContact O-NE 2.94Å; V40-R52 VanDerWaalsContact O-NE 3.14Å; E42-R52 VanDerWaalsContact CG-NH2 3.27Å; E42-R52 IonicContact OE1-CZ 3.46Å; E42-R52 IonicContact OE1-NH1 3.49Å; E42-R52 PolarHBondContact OE1-NH1 3.1Å; E42-R52 VanDerWaalsContact OE1-NH1 3.17Å; E42-R52 IonicContact OE1-NH2 3.55Å; E42-R52 PolarHBondContact OE1-NH2 2.8Å; S48-R52 PolarHBondContact O-N 3Å; M49-R52 PolarHBondContact O-N 3.28Å
53	I	89.4	Confident	80	Confident	63 Å²	63	67.4 Å²	67.4	32%	0.323	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.5	177.7	-56.7	176.2	0	0	0	109.3	T36 M49	T36-I53 HydrophobicContact CG2-CG1 4.25Å; M49-I53 PolarHBondContact O-N 3.04Å
54	R	92.1	Very high	81.4	Confident	78 Å²	78	64.1 Å²	64.1	29%	0.294	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.2	175.5	-65.1	178.2	-177.7	-112.1	0.7	109.7	S34 I35 R50 F56	S34-R54 CarbonylContact C-O 3.58Å; S34-R54 WeakPolarHBondContact CA-O 3.41Å; I35-R54 HydrophobicContact CG2-CB 3.93Å; I35-R54 PolarHBondContact N-O 2.8Å; I35-R54 PolarHBondContact O-N 2.79Å; R50-R54 WeakPolarHBondContact O-CG 3.21Å; R54-F56 HydrophobicContact CB-CE2 4.08Å
55	T	94.3	Very high	82.9	Confident	76 Å²	76	63.1 Å²	63.1	47%	0.466	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.8	178.6	-55.1	0	0	0	0	110.4	K32 T33 S34	K32-T55 HydrophobicContact CB-CG2 4.07Å; K32-T55 HydrophobicContact CD-CG2 4.42Å; K32-T55 HydrophobicContact CG-CG2 4.44Å; T33-T55 WeakPolarHBondContact O-CA 3.36Å; S34-T55 WeakPolarHBondContact OG-CG2 3.36Å; S34-T55 PolarHBondContact OG-OG1 2.85Å
56	F	95.8	Very high	84.2	Confident	28 Å²	28	60.3 Å²	60.3	12%	0.123	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.3	177.3	-59.1	-93	0	0	0	109.6	K32 T33 I35 R54 Y58 L346 L349 R350 N353	K32-F56 CarbonylContact C-O 3.59Å; K32-F56 WeakPolarHBondContact CA-O 3.04Å; T33-F56 PolarHBondContact N-O 3.17Å; T33-F56 PolarHBondContact O-N 2.84Å; I35-F56 HydrophobicContact CG2-CE2 4.2Å; R54-F56 HydrophobicContact CB-CE2 4.08Å; F56-Y58 HydrophobicContact CB-CD2 4.38Å; F56-Y58 HydrophobicContact CB-CE1 4.5Å; F56-Y58 HydrophobicContact CB-CE2 3.39Å; F56-Y58 VanDerWaalsContact CB-CZ 3.47Å; F56-Y58 WeakPolarHBondContact CB-OH 3.35Å; F56-Y58 HydrophobicContact CG-CE2 4.42Å; F56-Y58 WeakPolarHBondContact CG-OH 3Å; F56-L346 HydrophobicContact CE2-CD1 3.97Å; F56-L346 HydrophobicContact CZ-CD1 3.83Å; F56-L349 HydrophobicContact CD2-CB 3.99Å; F56-L349 HydrophobicContact CD2-CD1 4.1Å; F56-L349 HydrophobicContact CE2-CB 3.9Å; F56-L349 HydrophobicContact CE2-CD1 4.1Å; F56-L349 HydrophobicContact CG-CB 4.43Å; F56-L349 HydrophobicContact CZ-CB 4.26Å; F56-R350 HydrophobicContact CE1-CG 4.05Å; F56-R350 HydrophobicContact CZ-CG 3.99Å; F56-N353 HydrophobicContact CD1-CB 4.17Å
57	T	96.1	Very high	85	Confident	68 Å²	68	60.6 Å²	60.6	42%	0.417	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	117.5	-176.8	-51.8	0	0	0	0	110.8
58	Y	96.6	Very high	86.2	Confident	3 Å²	3	66.3 Å²	66.3	1%	0.012	33%	0.329	C	S	.	.			trans	-110.1	-171.9	-176	-58.8	-74.4	0	0	0	110.8	V6 V8 S31 F56 F60 L349 A352 N353 K356	V6-Y58 HydrophobicContact CB-CD1 4.34Å; V6-Y58 HydrophobicContact CG1-CD1 3.65Å; V6-Y58 HydrophobicContact CG1-CE1 4.25Å; V8-Y58 HydrophobicContact CB-CD2 4.17Å; V8-Y58 HydrophobicContact CB-CE2 4.41Å; V8-Y58 HydrophobicContact CG2-CD1 3.85Å; V8-Y58 HydrophobicContact CG2-CD2 3.32Å; V8-Y58 HydrophobicContact CG2-CE1 3.9Å; V8-Y58 HydrophobicContact CG2-CE2 3.39Å; V8-Y58 HydrophobicContact CG2-CG 3.54Å; S31-Y58 PolarHBondContact O-N 3.3Å; F56-Y58 HydrophobicContact CB-CD2 4.38Å; F56-Y58 HydrophobicContact CB-CE1 4.5Å; F56-Y58 HydrophobicContact CB-CE2 3.39Å; F56-Y58 VanDerWaalsContact CB-CZ 3.47Å; F56-Y58 WeakPolarHBondContact CB-OH 3.35Å; F56-Y58 HydrophobicContact CG-CE2 4.42Å; F56-Y58 WeakPolarHBondContact CG-OH 3Å; Y58-F60 WeakPolarHBondContact CB-O 3.45Å; Y58-L349 HydrophobicContact CE2-CD2 3.9Å; Y58-L349 VanDerWaalsContact OH-C 3.25Å; Y58-L349 VanDerWaalsContact OH-CA 3.29Å; Y58-L349 WeakPolarHBondContact OH-CA 3.13Å; Y58-L349 WeakPolarHBondContact OH-CB 3.45Å; Y58-L349 WeakPolarHBondContact OH-CD2 3.41Å; Y58-L349 PolarHBondContact OH-O 3.19Å; Y58-A352 HydrophobicContact CD1-CB 4.4Å; Y58-A352 HydrophobicContact CE1-CB 3.7Å; Y58-N353 HydrophobicContact CE1-CB 4.16Å; Y58-K356 PolarHBondContact O-NZ 2.76Å
59	D	96.1	Very high	87.5	Confident	52 Å²	52	66.5 Å²	66.5	28%	0.278	33%	0.33	S	S	.	.	S	Bend	trans	-82.7	-34.8	171.1	-53.1	-45.8	0	0	0	110	R5 V6 K356	R5-D59 VanDerWaalsContact CA-OD2 3.31Å; R5-D59 WeakPolarHBondContact CA-OD2 3.27Å; V6-D59 PolarHBondContact N-OD2 3.13Å; V6-D59 WeakPolarHBondContact O-CB 3.49Å; V6-D59 PolarHBondContact O-N 2.71Å; D59-K356 WeakPolarHBondContact OD1-CE 3.42Å; D59-K356 IonicContact OD1-NZ 3.36Å; D59-K356 PolarHBondContact OD1-NZ 2.9Å
60	F	96.4	Very high	88.5	Confident	48 Å²	48	73.4 Å²	73.4	21%	0.211	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.8	168.8	-56.8	-83.6	0	0	0	111.7	R5 V6 A7 V8 Y58 Y62 D81 L82	R5-F60 VanDerWaalsContact NH2-CE2 3.27Å; V6-F60 PolarHBondContact O-N 2.67Å; A7-F60 WeakPolarHBondContact CA-O 3Å; A7-F60 HydrophobicContact CB-CB 4Å; A7-F60 HydrophobicContact CB-CD2 4.36Å; V8-F60 PolarHBondContact N-O 2.89Å; Y58-F60 WeakPolarHBondContact CB-O 3.45Å; F60-Y62 HydrophobicContact CB-CD1 4.28Å; F60-Y62 HydrophobicContact CB-CE1 3.72Å; F60-Y62 HydrophobicContact CB-CE2 3.96Å; F60-Y62 HydrophobicContact CD1-CE1 4.01Å; F60-Y62 HydrophobicContact CG-CE1 4.04Å; F60-Y62 HydrophobicContact CG-CE2 4.5Å; F60-Y62 AromaticContact CG-CZ 3.74Å; F60-Y62 WeakPolarHBondContact CG-OH 3.45Å; F60-D81 HydrophobicContact CE1-CB 4.18Å; F60-D81 HydrophobicContact CZ-CB 4.23Å; F60-L82 HydrophobicContact CD2-CD2 3.71Å; F60-L82 HydrophobicContact CE2-CD2 3.57Å
61	S	96.6	Very high	89.5	Confident	15 Å²	15	67.3 Å²	67.3	11%	0.105	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	110.2	166.4	-63.8	0	0	0	0	108.1	V8 G30 S31 T33	V8-S61 CarbonylContact O-C 3.6Å; V8-S61 WeakPolarHBondContact O-CA 3.47Å; G30-S61 WeakPolarHBondContact O-CB 3.45Å; S31-S61 PolarHBondContact O-OG 3.14Å; S31-S61 VanDerWaalsContact O-OG 3.14Å; T33-S61 WeakPolarHBondContact OG1-CB 3.35Å; T33-S61 PolarHBondContact OG1-OG 2.97Å
62	Y	96.1	Very high	90.6	Very high	7 Å²	7	65.5 Å²	65.5	3%	0.027	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	109.6	-173.8	-60.4	-48.2	0	0	0	111	A7 V8 R9 V10 F60 S64 V73 V78 D81 L82	A7-Y62 HydrophobicContact CB-CD2 4.23Å; A7-Y62 HydrophobicContact CB-CE2 3.72Å; V8-Y62 PolarHBondContact O-N 3.39Å; R9-Y62 WeakPolarHBondContact CA-O 3.45Å; R9-Y62 HydrophobicContact CB-CD2 4.4Å; V10-Y62 PolarHBondContact N-O 3.21Å; F60-Y62 HydrophobicContact CB-CD1 4.28Å; F60-Y62 HydrophobicContact CB-CE1 3.72Å; F60-Y62 HydrophobicContact CB-CE2 3.96Å; F60-Y62 HydrophobicContact CD1-CE1 4.01Å; F60-Y62 HydrophobicContact CG-CE1 4.04Å; F60-Y62 HydrophobicContact CG-CE2 4.5Å; F60-Y62 AromaticContact CG-CZ 3.74Å; F60-Y62 WeakPolarHBondContact CG-OH 3.45Å; Y62-S64 PolarHBondContact O-N 3.28Å; Y62-V73 HydrophobicContact CD1-CB 4.32Å; Y62-V73 HydrophobicContact CD1-CG1 3.62Å; Y62-V73 HydrophobicContact CD1-CG2 4.08Å; Y62-V73 HydrophobicContact CE1-CG1 4.29Å; Y62-V73 HydrophobicContact CG-CG1 3.93Å; Y62-V78 HydrophobicContact CD2-CG1 4.44Å; Y62-V78 HydrophobicContact CD2-CG2 3.89Å; Y62-V78 HydrophobicContact CE2-CB 4.44Å; Y62-V78 HydrophobicContact CE2-CG1 4.02Å; Y62-V78 HydrophobicContact CE2-CG2 4.04Å; Y62-V78 HydrophobicContact CG-CG2 4.2Å; Y62-D81 VanDerWaalsContact OH-CB 3.26Å; Y62-D81 WeakPolarHBondContact OH-CB 3.4Å; Y62-L82 HydrophobicContact CE2-CD1 4.03Å; Y62-L82 HydrophobicContact CE2-CG 4.42Å
63	D	94.3	Very high	91	Very high	30 Å²	30	64.2 Å²	64.2	16%	0.16	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	104.9	172.8	-164.7	-22.8	0	0	0	110	V10 M28 T65 F72 V73	V10-D63 HydrophobicContact CG1-CB 4.46Å; M28-D63 HydrophobicContact CB-CB 4.3Å; M28-D63 HydrophobicContact SD-CB 4.38Å; D63-T65 VanDerWaalsContact OD1-CB 3.24Å; D63-T65 WeakPolarHBondContact OD1-CB 3.33Å; D63-T65 VanDerWaalsContact OD1-CG2 3.29Å; D63-T65 WeakPolarHBondContact OD1-CG2 3.43Å; D63-T65 PolarHBondContact OD1-N 2.83Å; D63-T65 PolarHBondContact OD1-OG1 2.91Å; D63-F72 CarbonylContact O-C 3.56Å; D63-F72 WeakPolarHBondContact O-CA 3.42Å; D63-V73 PolarHBondContact O-N 3.29Å
64	S	92.7	Very high	91.3	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.014	32%	0.322	C	S	.	.			trans	-106.2	25	170.1	-53.6	0	0	0	0	111.3	R9 V10 P12 Y62 V73	R9-S64 PolarHBondContact NE-OG 2.96Å; V10-S64 WeakPolarHBondContact O-CA 3.35Å; V10-S64 VanDerWaalsContact O-CB 3.3Å; V10-S64 WeakPolarHBondContact O-CB 3.27Å; V10-S64 PolarHBondContact O-N 3.47Å; P12-S64 WeakPolarHBondContact CD-O 3.26Å; P12-S64 WeakPolarHBondContact CG-O 3.26Å; Y62-S64 PolarHBondContact O-N 3.28Å; S64-V73 PolarHBondContact OG-O 2.86Å
65	T	89.6	Confident	91.4	Very high	44 Å²	44	59.4 Å²	59.4	27%	0.27	31%	0.309	S	S	.	.	S	Bend	trans	-72.7	-42.9	-172.6	56.4	0	0	0	0	114.8	V10 P12 D63 P337	V10-T65 HydrophobicContact CB-CG2 4.49Å; V10-T65 HydrophobicContact CG1-CG2 3.87Å; V10-T65 HydrophobicContact CG2-CG2 3.86Å; P12-T65 WeakPolarHBondContact CB-O 3.37Å; D63-T65 VanDerWaalsContact OD1-CB 3.24Å; D63-T65 WeakPolarHBondContact OD1-CB 3.33Å; D63-T65 VanDerWaalsContact OD1-CG2 3.29Å; D63-T65 WeakPolarHBondContact OD1-CG2 3.43Å; D63-T65 PolarHBondContact OD1-N 2.83Å; D63-T65 PolarHBondContact OD1-OG1 2.91Å; T65-P337 HydrophobicContact CG2-CB 4.38Å
66	D	85.9	Confident	91.4	Very high	79 Å²	79	61.7 Å²	61.7	42%	0.422	31%	0.314	S	S	.	.			trans	-131.6	113.9	-178.4	174.3	21.1	0	0	0	111.2	R68 S69 F72	D66-R68 PolarHBondContact O-N 2.89Å; D66-R68 VanDerWaalsContact O-N 3.1Å; D66-R68 WeakPolarHBondContact OD1-CB 3.31Å; D66-R68 PolarHBondContact OD1-N 2.83Å; D66-S69 VanDerWaalsContact O-CB 3.32Å; D66-S69 WeakPolarHBondContact O-CB 3.37Å; D66-S69 PolarHBondContact O-N 3.3Å; D66-F72 WeakPolarHBondContact O-CB 3.31Å; D66-F72 WeakPolarHBondContact O-CD2 3.42Å
67	G	81.9	Confident	91.3	Very high	58 Å²	58	61.8 Å²	61.8	60%	0.598	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.2	177.8	0	0	0	0	0	115.5
68	R	82.9	Confident	91.3	Very high	237 Å²	237	58.6 Å²	58.6	89%	0.894	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-11.8	173.6	-61.1	179.3	177	-179.8	-1.1	113.2	D66	D66-R68 PolarHBondContact O-N 2.89Å; D66-R68 VanDerWaalsContact O-N 3.1Å; D66-R68 WeakPolarHBondContact OD1-CB 3.31Å; D66-R68 PolarHBondContact OD1-N 2.83Å
69	S	87.3	Confident	91.3	Very high	48 Å²	48	60.1 Å²	60.1	34%	0.336	31%	0.305	S	S	.	.	S	Bend	trans	-73.9	140.8	179.3	-177.7	0	0	0	0	111.5	D66 A71 F72	D66-S69 VanDerWaalsContact O-CB 3.32Å; D66-S69 WeakPolarHBondContact O-CB 3.37Å; D66-S69 PolarHBondContact O-N 3.3Å; S69-A71 PolarHBondContact O-N 2.84Å; S69-A71 PolarHBondContact OG-N 3.39Å; S69-A71 VanDerWaalsContact OG-N 3.13Å; S69-F72 WeakPolarHBondContact O-CB 3.35Å; S69-F72 PolarHBondContact O-N 3.43Å
70	R	81.4	Confident	91.3	Very high	265 Å²	265	64.3 Å²	64.3	100%	1	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.4	168.2	-77.3	-175.4	170.2	-172.3	-3.3	113.3	F72	R70-F72 VanDerWaalsContact C-N 3.32Å
71	A	82.3	Confident	91.2	Very high	55 Å²	55	63.8 Å²	63.8	46%	0.455	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.3	174.7	0	0	0	0	0	113.2	S69 V73	S69-A71 PolarHBondContact O-N 2.84Å; S69-A71 PolarHBondContact OG-N 3.39Å; S69-A71 VanDerWaalsContact OG-N 3.13Å; A71-V73 PolarHBondContact O-N 3.18Å
72	F	90.8	Very high	91.1	Very high	75 Å²	75	63.1 Å²	63.1	33%	0.329	31%	0.311	S	S	.	.			trans	-65.1	131.2	-176.6	-177.5	-103.6	0	0	0	112.9	D63 D66 S69 R70	D63-F72 CarbonylContact O-C 3.56Å; D63-F72 WeakPolarHBondContact O-CA 3.42Å; D66-F72 WeakPolarHBondContact O-CB 3.31Å; D66-F72 WeakPolarHBondContact O-CD2 3.42Å; S69-F72 WeakPolarHBondContact O-CB 3.35Å; S69-F72 PolarHBondContact O-N 3.43Å; R70-F72 VanDerWaalsContact C-N 3.32Å
73	V	93.5	Very high	91	Very high	17 Å²	17	62.9 Å²	62.9	10%	0.103	31%	0.31	C	S	.	.			trans	-109.5	113.6	178.3	-175	0	0	0	0	111.1	Y62 D63 S64 A71 T77 V78	Y62-V73 HydrophobicContact CD1-CB 4.32Å; Y62-V73 HydrophobicContact CD1-CG1 3.62Å; Y62-V73 HydrophobicContact CD1-CG2 4.08Å; Y62-V73 HydrophobicContact CE1-CG1 4.29Å; Y62-V73 HydrophobicContact CG-CG1 3.93Å; D63-V73 PolarHBondContact O-N 3.29Å; S64-V73 PolarHBondContact OG-O 2.86Å; A71-V73 PolarHBondContact O-N 3.18Å; V73-T77 HydrophobicContact CG1-CG2 3.64Å; V73-V78 HydrophobicContact CG1-CG2 3.78Å
74	S	93.9	Very high	91	Very high	36 Å²	36	63 Å²	63	25%	0.252	31%	0.314	S	S	.	.			trans	-77.5	164.6	176	65.1	0	0	0	0	113.4	E76 T77 V78	S74-E76 PolarHBondContact O-N 2.86Å; S74-T77 PolarHBondContact O-N 2.95Å; S74-T77 PolarHBondContact OG-N 2.88Å; S74-T77 PolarHBondContact OG-OG1 3.05Å; S74-V78 PolarHBondContact O-N 3.16Å
75	Q	95	Very high	91	Very high	4 Å²	4	66 Å²	66	2%	0.019	33%	0.33	C	S	.	.	H	α-helix	trans	-54.3	-41.5	171	-63.8	-76.9	61.3	0	0	112.2	R9 T77 V78 F79 Y110 D118 A119	R9-Q75 VanDerWaalsContact CZ-OE1 3.25Å; Q75-T77 VanDerWaalsContact C-N 3.33Å; Q75-T77 PolarHBondContact O-N 2.88Å; Q75-V78 PolarHBondContact O-N 3.37Å; Q75-F79 WeakPolarHBondContact O-CB 3.16Å; Q75-F79 PolarHBondContact O-N 2.85Å; Q75-Y110 PolarHBondContact NE2-O 2.8Å; Q75-D118 WeakPolarHBondContact CG-OD1 3.45Å; Q75-D118 WeakPolarHBondContact CG-OD2 3.38Å; Q75-D118 PolarHBondContact NE2-O 2.97Å; Q75-A119 WeakPolarHBondContact CB-O 3.35Å; Q75-A119 PolarHBondContact NE2-O 3.1Å
76	E	94.1	Very high	91.3	Very high	124 Å²	124	64.1 Å²	64.1	58%	0.579	32%	0.318	S	S	*	.	H	α-helix	trans	-60.4	-41.2	178.6	-174.6	-172.5	173.5	0	0	112	S74 F79 R80	S74-E76 PolarHBondContact O-N 2.86Å; E76-F79 PolarHBondContact O-N 3.06Å; E76-R80 WeakPolarHBondContact O-CB 3.45Å; E76-R80 PolarHBondContact O-N 2.65Å
77	T	94.1	Very high	91.8	Very high	30 Å²	30	60.5 Å²	60.5	18%	0.184	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-45	176	-63.9	0	0	0	0	111.3	V73 S74 Q75 F79 R80 D81	V73-T77 HydrophobicContact CG1-CG2 3.64Å; S74-T77 PolarHBondContact O-N 2.95Å; S74-T77 PolarHBondContact OG-N 2.88Å; S74-T77 PolarHBondContact OG-OG1 3.05Å; Q75-T77 VanDerWaalsContact C-N 3.33Å; Q75-T77 PolarHBondContact O-N 2.88Å; T77-F79 VanDerWaalsContact C-N 3.29Å; T77-F79 PolarHBondContact O-N 3.05Å; T77-R80 PolarHBondContact O-N 2.7Å; T77-D81 WeakPolarHBondContact O-CB 3.24Å; T77-D81 PolarHBondContact O-N 3.48Å
78	V	95.9	Very high	92.4	Very high	1 Å²	1	63 Å²	63	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-39	175.8	-178.4	0	0	0	0	111.2	Y62 V73 S74 Q75 L82 T111 L121	Y62-V78 HydrophobicContact CD2-CG1 4.44Å; Y62-V78 HydrophobicContact CD2-CG2 3.89Å; Y62-V78 HydrophobicContact CE2-CB 4.44Å; Y62-V78 HydrophobicContact CE2-CG1 4.02Å; Y62-V78 HydrophobicContact CE2-CG2 4.04Å; Y62-V78 HydrophobicContact CG-CG2 4.2Å; V73-V78 HydrophobicContact CG1-CG2 3.78Å; S74-V78 PolarHBondContact O-N 3.16Å; Q75-V78 PolarHBondContact O-N 3.37Å; V78-L82 HydrophobicContact CG1-CD1 4.02Å; V78-L82 WeakPolarHBondContact O-CB 3.39Å; V78-L82 PolarHBondContact O-N 2.82Å; V78-T111 HydrophobicContact CG1-CG2 4.35Å; V78-L121 HydrophobicContact CG1-CD1 4.31Å; V78-L121 HydrophobicContact CG1-CD2 4.31Å; V78-L121 HydrophobicContact CG1-CG 4.47Å
79	F	96.8	Very high	93	Very high	35 Å²	35	51.8 Å²	51.8	15%	0.154	25%	0.251	C	S	.	.	I	π-helix	trans	-66.4	-45.5	174.5	170.3	-107.4	0	0	0	112.8	Q75 E76 T77 D81 G83 S84 L87 L121 R124 I125	Q75-F79 WeakPolarHBondContact O-CB 3.16Å; Q75-F79 PolarHBondContact O-N 2.85Å; E76-F79 PolarHBondContact O-N 3.06Å; T77-F79 VanDerWaalsContact C-N 3.29Å; T77-F79 PolarHBondContact O-N 3.05Å; F79-D81 VanDerWaalsContact C-N 3.32Å; F79-D81 PolarHBondContact O-N 2.85Å; F79-G83 CarbonylContact O-C 3.54Å; F79-G83 WeakPolarHBondContact O-CA 3.27Å; F79-G83 PolarHBondContact O-N 3Å; F79-S84 PolarHBondContact O-N 3.37Å; F79-L87 HydrophobicContact CE2-CD1 4.26Å; F79-L87 HydrophobicContact CZ-CD1 3.98Å; F79-L121 HydrophobicContact CB-CD2 4.03Å; F79-L121 HydrophobicContact CD2-CD2 4.26Å; F79-R124 HydrophobicContact CB-CB 4.32Å; F79-R124 HydrophobicContact CD1-CB 4.11Å; F79-R124 HydrophobicContact CD2-CB 3.47Å; F79-R124 VanDerWaalsContact CD2-CB 3.47Å; F79-R124 HydrophobicContact CE1-CB 4.32Å; F79-R124 VanDerWaalsContact CE2-C 3.43Å; F79-R124 HydrophobicContact CE2-CB 3.73Å; F79-R124 VanDerWaalsContact CE2-O 3.3Å; F79-R124 WeakPolarHBondContact CE2-O 2.94Å; F79-R124 HydrophobicContact CG-CB 3.68Å; F79-R124 HydrophobicContact CG-CG 4.39Å; F79-R124 HydrophobicContact CZ-CB 4.14Å; F79-R124 VanDerWaalsContact CZ-O 3.3Å; F79-R124 WeakPolarHBondContact CZ-O 3.45Å; F79-I125 HydrophobicContact CD2-CG1 4.12Å; F79-I125 HydrophobicContact CE2-CG1 3.83Å
80	R	95.8	Very high	93.4	Very high	141 Å²	141	49.5 Å²	49.5	53%	0.532	24%	0.235	S	C	.	.	I	π-helix	trans	-59.4	-45.7	177.9	-175.3	-170.1	64.4	-143	-4.5	111.1	E76 T77 S84	E76-R80 WeakPolarHBondContact O-CB 3.45Å; E76-R80 PolarHBondContact O-N 2.65Å; T77-R80 PolarHBondContact O-N 2.7Å; R80-S84 WeakPolarHBondContact CA-OG 3.25Å; R80-S84 WeakPolarHBondContact O-CB 3.35Å; R80-S84 PolarHBondContact O-OG 3.17Å
81	D	94.1	Very high	93.9	Very high	36 Å²	36	38.9 Å²	38.9	19%	0.193	20%	0.196	C	C	.	.	I	π-helix	trans	-80.3	-26.1	-171.9	-63.6	1.6	0	0	0	113.6	F60 Y62 T77 F79	F60-D81 HydrophobicContact CE1-CB 4.18Å; F60-D81 HydrophobicContact CZ-CB 4.23Å; Y62-D81 VanDerWaalsContact OH-CB 3.26Å; Y62-D81 WeakPolarHBondContact OH-CB 3.4Å; T77-D81 WeakPolarHBondContact O-CB 3.24Å; T77-D81 PolarHBondContact O-N 3.48Å; F79-D81 VanDerWaalsContact C-N 3.32Å; F79-D81 PolarHBondContact O-N 2.85Å
82	L	95.8	Very high	94.3	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	19%	0.191	C	C	.	.	I	π-helix	trans	-117.6	-48.1	-179.8	-56.5	-178	0	0	0	113.8	A7 F60 Y62 V78 D85 V86 I330 I332	A7-L82 HydrophobicContact CB-CD1 3.94Å; A7-L82 HydrophobicContact CB-CD2 4.43Å; F60-L82 HydrophobicContact CD2-CD2 3.71Å; F60-L82 HydrophobicContact CE2-CD2 3.57Å; Y62-L82 HydrophobicContact CE2-CD1 4.03Å; Y62-L82 HydrophobicContact CE2-CG 4.42Å; V78-L82 HydrophobicContact CG1-CD1 4.02Å; V78-L82 WeakPolarHBondContact O-CB 3.39Å; V78-L82 PolarHBondContact O-N 2.82Å; L82-D85 PolarHBondContact O-N 2.83Å; L82-V86 PolarHBondContact O-N 2.86Å; L82-I330 HydrophobicContact CB-CD1 4.3Å; L82-I330 HydrophobicContact CD1-CG2 4.14Å; L82-I330 HydrophobicContact CD2-CG2 4.07Å; L82-I332 HydrophobicContact CD1-CD1 3.63Å; L82-I332 HydrophobicContact CD1-CG1 3.87Å
83	G	94	Very high	94.3	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.01	18%	0.175	C	C	.	.	I	π-helix	trans	-67.5	-35.7	-176.4	0	0	0	0	0	113.6	F79 D85 V86 L87	F79-G83 CarbonylContact O-C 3.54Å; F79-G83 WeakPolarHBondContact O-CA 3.27Å; F79-G83 PolarHBondContact O-N 3Å; G83-D85 PolarHBondContact O-N 3.37Å; G83-V86 WeakPolarHBondContact O-CB 3.31Å; G83-V86 PolarHBondContact O-N 2.89Å; G83-V86 VanDerWaalsContact O-N 3.16Å; G83-L87 PolarHBondContact O-N 3.28Å
84	S	93.1	Very high	94.4	Very high	34 Å²	34	38.2 Å²	38.2	24%	0.238	18%	0.182	C	C	.	.	H	α-helix	trans	-59	-35.3	174.9	-53.7	0	0	0	0	113.1	F79 R80 K88	F79-S84 PolarHBondContact O-N 3.37Å; R80-S84 WeakPolarHBondContact CA-OG 3.25Å; R80-S84 WeakPolarHBondContact O-CB 3.35Å; R80-S84 PolarHBondContact O-OG 3.17Å; S84-K88 WeakPolarHBondContact O-CB 3.39Å; S84-K88 PolarHBondContact O-N 3.13Å
85	D	93.4	Very high	94.5	Very high	64 Å²	64	37.4 Å²	37.4	34%	0.342	18%	0.175	S	C	.	.	H	α-helix	trans	-76.4	-31.6	178.4	-78	-33.7	0	0	0	112.2	R5 L82 G83 A89	R5-D85 IonicContact CZ-OD2 2.99Å; R5-D85 IonicContact NH1-OD2 2.74Å; R5-D85 PolarHBondContact NH1-OD2 2.76Å; R5-D85 IonicContact NH2-OD2 3.58Å; L82-D85 PolarHBondContact O-N 2.83Å; G83-D85 PolarHBondContact O-N 3.37Å; D85-A89 VanDerWaalsContact O-CB 3.26Å; D85-A89 WeakPolarHBondContact O-CB 3.43Å; D85-A89 PolarHBondContact O-N 2.89Å
86	V	96.3	Very high	94.5	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.024	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-47.3	169.4	176	0	0	0	0	110.2	L82 G83 A89 A90 A96 V98 I125 I248 I330	L82-V86 PolarHBondContact O-N 2.86Å; G83-V86 WeakPolarHBondContact O-CB 3.31Å; G83-V86 PolarHBondContact O-N 2.89Å; G83-V86 VanDerWaalsContact O-N 3.16Å; V86-A89 WeakPolarHBondContact O-CB 3.29Å; V86-A89 PolarHBondContact O-N 2.65Å; V86-A90 PolarHBondContact O-N 3.35Å; V86-A96 HydrophobicContact CG1-CB 3.89Å; V86-V98 HydrophobicContact CG2-CG2 3.42Å; V86-V98 VanDerWaalsContact CG2-CG2 3.42Å; V86-I125 HydrophobicContact CB-CD1 4.43Å; V86-I125 HydrophobicContact CG1-CD1 4.33Å; V86-I125 HydrophobicContact CG1-CG2 4.41Å; V86-I248 HydrophobicContact CG1-CG2 3.64Å; V86-I330 HydrophobicContact CG2-CD1 3.93Å
87	L	96	Very high	94.7	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-61.2	-47.3	175.6	-69.9	175.8	0	0	0	111.4	F79 G83 A89 A90 F91 I125 L129	F79-L87 HydrophobicContact CE2-CD1 4.26Å; F79-L87 HydrophobicContact CZ-CD1 3.98Å; G83-L87 PolarHBondContact O-N 3.28Å; L87-A89 VanDerWaalsContact C-N 3.31Å; L87-A89 PolarHBondContact O-N 3.12Å; L87-A90 PolarHBondContact O-N 3.5Å; L87-F91 WeakPolarHBondContact O-CD2 3.14Å; L87-F91 PolarHBondContact O-N 2.99Å; L87-F91 VanDerWaalsContact O-N 3.13Å; L87-I125 HydrophobicContact CD2-CG2 4.06Å; L87-I125 WeakPolarHBondContact CD2-O 3.18Å; L87-L129 HydrophobicContact CD2-CB 3.76Å; L87-L129 HydrophobicContact CD2-CD1 4.43Å
88	K	94.9	Very high	94.9	Very high	111 Å²	111	30 Å²	30	48%	0.483	14%	0.138	S	C	.	.	H	α-helix	trans	-57.4	-44.3	175.6	179.9	173.1	174.2	175.4	0	111.6	S84 A90 E92	S84-K88 WeakPolarHBondContact O-CB 3.39Å; S84-K88 PolarHBondContact O-N 3.13Å; K88-A90 PolarHBondContact O-N 2.84Å; K88-E92 WeakPolarHBondContact CE-OE1 3.46Å; K88-E92 HydrophobicContact CG-CG 4.48Å; K88-E92 WeakPolarHBondContact CG-OE1 3.42Å; K88-E92 WeakPolarHBondContact O-CB 3.44Å; K88-E92 VanDerWaalsContact O-CG 3.26Å; K88-E92 WeakPolarHBondContact O-CG 3.46Å; K88-E92 PolarHBondContact O-N 3.49Å
89	A	95.1	Very high	94.9	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-60.4	-42.1	176.9	0	0	0	0	0	113	D85 V86 L87 E92 G93 Y94 A96 K328	D85-A89 VanDerWaalsContact O-CB 3.26Å; D85-A89 WeakPolarHBondContact O-CB 3.43Å; D85-A89 PolarHBondContact O-N 2.89Å; V86-A89 WeakPolarHBondContact O-CB 3.29Å; V86-A89 PolarHBondContact O-N 2.65Å; L87-A89 VanDerWaalsContact C-N 3.31Å; L87-A89 PolarHBondContact O-N 3.12Å; A89-E92 PolarHBondContact O-N 2.94Å; A89-G93 PolarHBondContact O-N 2.9Å; A89-Y94 WeakPolarHBondContact O-CB 3.15Å; A89-Y94 PolarHBondContact O-N 2.84Å; A89-A96 HydrophobicContact CB-CB 4.33Å; A89-K328 HydrophobicContact CB-CD 3.75Å
90	A	94.4	Very high	94.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-47.5	-179.7	0	0	0	0	0	112.6	V86 L87 K88 E92 G93 F231 S246 I248	V86-A90 PolarHBondContact O-N 3.35Å; L87-A90 PolarHBondContact O-N 3.5Å; K88-A90 PolarHBondContact O-N 2.84Å; A90-E92 VanDerWaalsContact C-N 3.26Å; A90-E92 PolarHBondContact O-N 2.78Å; A90-G93 WeakPolarHBondContact O-CA 3.37Å; A90-G93 PolarHBondContact O-N 2.98Å; A90-F231 HydrophobicContact CB-CD1 4.22Å; A90-S246 PolarHBondContact O-OG 3.44Å; A90-I248 HydrophobicContact CB-CD1 3.62Å; A90-I248 HydrophobicContact CB-CG1 4.08Å
91	F	92.9	Very high	94.9	Very high	43 Å²	43	22.5 Å²	22.5	19%	0.189	11%	0.109	C	C	.	.	H	α-helix	trans	-69.1	-20.2	175	-79.2	-88.8	0	0	0	113.5	L87 G93 L129 R132 I133 F144 F231 Q233	L87-F91 WeakPolarHBondContact O-CD2 3.14Å; L87-F91 PolarHBondContact O-N 2.99Å; L87-F91 VanDerWaalsContact O-N 3.13Å; F91-G93 VanDerWaalsContact C-N 3.25Å; F91-L129 HydrophobicContact CD2-CD1 4.47Å; F91-L129 HydrophobicContact CE2-CD1 3.62Å; F91-L129 HydrophobicContact CZ-CD1 3.99Å; F91-R132 HydrophobicContact CE1-CB 4.16Å; F91-R132 HydrophobicContact CE2-CB 3.61Å; F91-R132 HydrophobicContact CE2-CG 4.29Å; F91-R132 HydrophobicContact CZ-CB 3.34Å; F91-R132 HydrophobicContact CZ-CG 4.44Å; F91-I133 HydrophobicContact CZ-CG1 4.13Å; F91-F144 HydrophobicContact CD1-CE1 4.33Å; F91-F144 AromaticContact CE1-CE1 3.77Å; F91-F144 HydrophobicContact CE1-CE1 3.77Å; F91-F144 HydrophobicContact CE1-CZ 4.16Å; F91-F231 AromaticContact CD1-CE1 3.98Å; F91-F231 HydrophobicContact CD1-CE1 3.98Å; F91-F231 AromaticContact CD1-CZ 3.99Å; F91-F231 HydrophobicContact CD1-CZ 3.99Å; F91-F231 HydrophobicContact CD2-CE1 4.3Å; F91-F231 HydrophobicContact CE1-CE1 4.06Å; F91-F231 AromaticContact CE1-CZ 3.63Å; F91-F231 HydrophobicContact CE1-CZ 3.63Å; F91-F231 HydrophobicContact CE2-CE1 4.37Å; F91-F231 HydrophobicContact CE2-CZ 4.33Å; F91-F231 HydrophobicContact CG-CE1 4.1Å; F91-F231 HydrophobicContact CG-CZ 4.49Å; F91-F231 HydrophobicContact CZ-CE1 4.25Å; F91-F231 AromaticContact CZ-CZ 3.8Å; F91-F231 HydrophobicContact CZ-CZ 3.8Å; F91-Q233 PolarHBondContact O-OE1 3.11Å
92	E	91.4	Very high	94.9	Very high	73 Å²	73	20.8 Å²	20.8	34%	0.341	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-1.1	167.9	-75.3	171.7	-179	0	0	112.9	K88 A89 A90 Y94 K328	K88-E92 WeakPolarHBondContact CE-OE1 3.46Å; K88-E92 HydrophobicContact CG-CG 4.48Å; K88-E92 WeakPolarHBondContact CG-OE1 3.42Å; K88-E92 WeakPolarHBondContact O-CB 3.44Å; K88-E92 VanDerWaalsContact O-CG 3.26Å; K88-E92 WeakPolarHBondContact O-CG 3.46Å; K88-E92 PolarHBondContact O-N 3.49Å; A89-E92 PolarHBondContact O-N 2.94Å; A90-E92 VanDerWaalsContact C-N 3.26Å; A90-E92 PolarHBondContact O-N 2.78Å; E92-Y94 HydrophobicContact CB-CD2 3.54Å; E92-Y94 HydrophobicContact CB-CE2 3.8Å; E92-Y94 WeakPolarHBondContact OE2-CD2 3.49Å; E92-Y94 WeakPolarHBondContact OE2-CE2 3.41Å; E92-K328 IonicContact OE2-NZ 3.17Å; E92-K328 PolarHBondContact OE2-NZ 2.77Å
93	G	90.8	Very high	94.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	17.8	-178.4	0	0	0	0	0	115	A89 A90 F91 V364 N365	A89-G93 PolarHBondContact O-N 2.9Å; A90-G93 WeakPolarHBondContact O-CA 3.37Å; A90-G93 PolarHBondContact O-N 2.98Å; F91-G93 VanDerWaalsContact C-N 3.25Å; G93-V364 WeakPolarHBondContact O-CA 3.39Å; G93-N365 PolarHBondContact O-N 3.38Å; G93-N365 PolarHBondContact O-ND2 2.97Å; G93-N365 VanDerWaalsContact O-ND2 3.12Å
94	Y	94.9	Very high	94.3	Very high	60 Å²	60	23.6 Å²	23.6	24%	0.235	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-91.4	144.9	173.2	-66.8	-81.1	0	0	0	111.7	A89 E92 S246 K328 P362 T363 V364	A89-Y94 WeakPolarHBondContact O-CB 3.15Å; A89-Y94 PolarHBondContact O-N 2.84Å; E92-Y94 HydrophobicContact CB-CD2 3.54Å; E92-Y94 HydrophobicContact CB-CE2 3.8Å; E92-Y94 WeakPolarHBondContact OE2-CD2 3.49Å; E92-Y94 WeakPolarHBondContact OE2-CE2 3.41Å; Y94-S246 VanDerWaalsContact O-CB 3.29Å; Y94-S246 WeakPolarHBondContact O-CB 3.33Å; Y94-K328 VanDerWaalsContact CD2-NZ 3.26Å; Y94-K328 HydrophobicContact CG-CD 4.45Å; Y94-P362 HydrophobicContact CD1-CB 3.86Å; Y94-P362 HydrophobicContact CE1-CB 4.28Å; Y94-T363 VanDerWaalsContact CD1-C 3.43Å; Y94-T363 WeakPolarHBondContact CD1-O 3.41Å; Y94-V364 HydrophobicContact CD1-CG2 4.32Å; Y94-V364 HydrophobicContact CD2-CG2 4.36Å; Y94-V364 HydrophobicContact CE1-CG2 3.82Å; Y94-V364 HydrophobicContact CE2-CG2 3.85Å
95	N	95.2	Very high	94	Very high	19 Å²	19	24.3 Å²	24.3	10%	0.102	13%	0.128	C	C	.	.			trans	-66.8	144.5	164.6	-57.5	-36	0	0	0	110.6	K247 N326 A327 K328 N365	N95-K247 WeakPolarHBondContact CA-O 3.39Å; N95-K247 WeakPolarHBondContact OD1-CB 3.27Å; N95-K247 PolarHBondContact OD1-N 3.45Å; N95-N326 WeakPolarHBondContact CB-O 3.39Å; N95-N326 PolarHBondContact ND2-ND2 3.41Å; N95-N326 PolarHBondContact ND2-O 2.87Å; N95-A327 HydrophobicContact CB-CB 4.08Å; N95-A327 CarbonylContact O-C 3.55Å; N95-A327 WeakPolarHBondContact O-CA 3.41Å; N95-K328 PolarHBondContact O-N 3.15Å; N95-N365 PolarHBondContact ND2-OD1 3.44Å; N95-N365 PolarHBondContact OD1-ND2 3.37Å
96	A	96.6	Very high	93.9	Very high	2 Å²	2	21.3 Å²	21.3	2%	0.017	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.7	178.6	0	0	0	0	0	110.9	V86 A89 K247 I248 H249 K328	V86-A96 HydrophobicContact CG1-CB 3.89Å; A89-A96 HydrophobicContact CB-CB 4.33Å; A96-K247 PolarHBondContact N-O 2.9Å; A96-I248 HydrophobicContact CB-CG2 4.41Å; A96-I248 CarbonylContact O-C 3.44Å; A96-I248 WeakPolarHBondContact O-CA 3.02Å; A96-H249 PolarHBondContact O-N 2.73Å; A96-K328 WeakPolarHBondContact CA-O 3.32Å
97	C	97.1	Very high	93.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	128.6	175.9	-175.6	0	0	0	0	110.6	H249 S322 K328 T329 I330	C97-H249 CarbonylContact C-O 3.54Å; C97-H249 WeakPolarHBondContact CA-O 3.42Å; C97-H249 HydrophobicContact CB-CB 4.32Å; C97-S322 WeakPolarHBondContact CB-OG 3.43Å; C97-S322 VanDerWaalsContact SG-CB 3.59Å; C97-S322 PolarHBondContact SG-OG 3.42Å; C97-K328 PolarHBondContact N-O 3.22Å; C97-T329 HydrophobicContact CB-CG2 4.1Å; C97-T329 CarbonylContact O-C 3.51Å; C97-T329 VanDerWaalsContact O-CA 3.32Å; C97-T329 WeakPolarHBondContact O-CA 3.35Å; C97-I330 PolarHBondContact O-N 2.73Å
98	V	97.9	Very high	93.7	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.006	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.5	170.7	-172.6	0	0	0	0	108.2	V86 M112 L121 H249 L250 V251 I330 I332	V86-V98 HydrophobicContact CG2-CG2 3.42Å; V86-V98 VanDerWaalsContact CG2-CG2 3.42Å; V98-M112 HydrophobicContact CB-CE 4.43Å; V98-M112 HydrophobicContact CG1-CE 4.26Å; V98-M112 HydrophobicContact CG1-SD 4.29Å; V98-L121 HydrophobicContact CG1-CD1 4.25Å; V98-H249 PolarHBondContact N-O 2.95Å; V98-L250 HydrophobicContact CB-CD2 3.91Å; V98-L250 HydrophobicContact CG2-CD2 3.9Å; V98-V251 PolarHBondContact O-N 3.47Å; V98-I330 WeakPolarHBondContact CA-O 3.42Å; V98-I330 HydrophobicContact CG2-CB 4.34Å; V98-I330 HydrophobicContact CG2-CD1 4.45Å; V98-I332 HydrophobicContact CG1-CD1 3.71Å; V98-I332 HydrophobicContact CG1-CG1 4.22Å
99	F	97.1	Very high	93.5	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.009	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.6	175	67.5	-90	0	0	0	112.8	V251 L253 L323 T329 I330 M331 I332	F99-V251 WeakPolarHBondContact CA-O 3.42Å; F99-V251 HydrophobicContact CB-CB 3.7Å; F99-V251 HydrophobicContact CB-CG1 4.19Å; F99-V251 HydrophobicContact CB-CG2 4.35Å; F99-L253 HydrophobicContact CD2-CD1 3.84Å; F99-L323 HydrophobicContact CE1-CD2 4.08Å; F99-L323 HydrophobicContact CZ-CD2 4.29Å; F99-T329 HydrophobicContact CD1-CG2 4.1Å; F99-T329 HydrophobicContact CE1-CG2 3.71Å; F99-I330 PolarHBondContact N-O 2.72Å; F99-M331 HydrophobicContact CD2-CG 4.18Å; F99-M331 HydrophobicContact CE1-CB 4.05Å; F99-M331 HydrophobicContact CE2-CB 3.9Å; F99-M331 HydrophobicContact CE2-CE 4.47Å; F99-M331 HydrophobicContact CE2-CG 3.49Å; F99-M331 VanDerWaalsContact CE2-CG 3.49Å; F99-M331 HydrophobicContact CE2-SD 3.96Å; F99-M331 HydrophobicContact CZ-CB 3.61Å; F99-M331 HydrophobicContact CZ-CG 3.72Å; F99-M331 HydrophobicContact CZ-SD 4.13Å; F99-I332 PolarHBondContact O-N 3.41Å
100	A	97	Very high	93.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	131.9	173.2	0	0	0	0	0	111	K108 M112 V251 L253 I332	A100-K108 HydrophobicContact CB-CB 3.98Å; A100-K108 HydrophobicContact CB-CG 4.21Å; A100-M112 HydrophobicContact CB-CG 3.53Å; A100-M112 HydrophobicContact CB-SD 3.87Å; A100-V251 PolarHBondContact N-O 2.7Å; A100-L253 VanDerWaalsContact O-CB 3.29Å; A100-L253 WeakPolarHBondContact O-CB 3.29Å; A100-L253 WeakPolarHBondContact O-CG 3.5Å; A100-L253 PolarHBondContact O-N 3.31Å; A100-I332 CarbonylContact C-O 3.54Å; A100-I332 WeakPolarHBondContact CA-O 3.43Å
101	Y	95.8	Very high	93.5	Very high	17 Å²	17	22.3 Å²	22.3	7%	0.067	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154	-179.5	-178	-89.6	0	0	0	110.8	L253 S256 L279 M331 I332 T334 T348 Y351	Y101-L253 HydrophobicContact CD2-CD1 3.88Å; Y101-S256 WeakPolarHBondContact OH-CB 3.37Å; Y101-L279 HydrophobicContact CE2-CD2 4.24Å; Y101-M331 HydrophobicContact CD1-CE 3.72Å; Y101-M331 HydrophobicContact CG-CE 3.8Å; Y101-I332 PolarHBondContact N-O 3.24Å; Y101-T334 PolarHBondContact O-N 2.97Å; Y101-T334 PolarHBondContact O-OG1 3.48Å; Y101-T348 HydrophobicContact CD1-CG2 4.07Å; Y101-T348 HydrophobicContact CE1-CG2 4.33Å; Y101-Y351 HydrophobicContact CD1-CD1 4.25Å; Y101-Y351 HydrophobicContact CD2-CE1 4.2Å; Y101-Y351 AromaticContact CE1-CD1 3.97Å; Y101-Y351 HydrophobicContact CE1-CD1 3.97Å; Y101-Y351 HydrophobicContact CE1-CD2 4.35Å; Y101-Y351 HydrophobicContact CE1-CE1 4.35Å; Y101-Y351 AromaticContact CE1-CG 3.94Å; Y101-Y351 HydrophobicContact CE1-CG 3.94Å; Y101-Y351 HydrophobicContact CE2-CD1 4.37Å; Y101-Y351 AromaticContact CE2-CE1 3.93Å; Y101-Y351 HydrophobicContact CE2-CE1 3.93Å; Y101-Y351 HydrophobicContact CE2-CE2 4.21Å; Y101-Y351 AromaticContact CE2-CZ 3.82Å; Y101-Y351 AromaticContact CZ-CD2 3.94Å; Y101-Y351 AromaticContact CZ-CE2 3.93Å; Y101-Y351 AromaticContact CZ-CG 3.96Å; Y101-Y351 AromaticContact CZ-CZ 3.95Å
102	G	93.7	Very high	93.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	139	175.7	178.4	0	0	0	0	0	113	K108 S256	G102-K108 PolarHBondContact O-NZ 2.69Å; G102-S256 PolarHBondContact O-N 3.16Å; G102-S256 VanDerWaalsContact O-N 3.11Å; G102-S256 PolarHBondContact O-OG 2.85Å
103	Q	90.3	Very high	93.7	Very high	18 Å²	18	18.7 Å²	18.7	8%	0.084	11%	0.108	C	C	.	.	S	Bend	trans	-65.2	163.7	-179.1	66.7	174.6	99.6	0	0	113	G105 S106 K108 S256 E257 N341 E344	Q103-G105 PolarHBondContact O-N 2.8Å; Q103-S106 VanDerWaalsContact O-CB 3.23Å; Q103-S106 WeakPolarHBondContact O-CB 3.49Å; Q103-S106 PolarHBondContact O-N 2.86Å; Q103-S106 VanDerWaalsContact O-N 3.14Å; Q103-S106 PolarHBondContact O-OG 2.98Å; Q103-K108 VanDerWaalsContact C-NZ 3.29Å; Q103-K108 PolarHBondContact O-NZ 2.94Å; Q103-S256 PolarHBondContact N-OG 2.89Å; Q103-S256 VanDerWaalsContact N-OG 3.12Å; Q103-E257 VanDerWaalsContact CA-OE2 3.27Å; Q103-E257 WeakPolarHBondContact CA-OE2 3.36Å; Q103-N341 PolarHBondContact NE2-OD1 3.23Å; Q103-E344 HydrophobicContact CB-CB 4.23Å
104	T	87.6	Confident	93.8	Very high	44 Å²	44	19.4 Å²	19.4	27%	0.27	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	136.7	169.3	-65.5	0	0	0	0	111.1	S106 S221 G255 E257	T104-S106 VanDerWaalsContact C-N 3.27Å; T104-S106 PolarHBondContact O-N 2.93Å; T104-S221 VanDerWaalsContact CG2-CB 3.44Å; T104-S221 WeakPolarHBondContact OG1-CB 3.19Å; T104-G255 WeakPolarHBondContact OG1-CA 3.36Å; T104-E257 WeakPolarHBondContact CB-OE1 3.38Å; T104-E257 PolarHBondContact N-OE2 2.94Å; T104-E257 PolarHBondContact OG1-OE1 2.65Å; T104-E257 PolarHBondContact OG1-OE2 3.01Å
105	G	86.6	Confident	93.4	Very high	49 Å²	49	20.2 Å²	20.2	51%	0.505	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	14.4	-174.8	0	0	0	0	0	115.1	R11 Q103	R11-G105 PolarHBondContact NE-O 3.24Å; R11-G105 PolarHBondContact NH2-O 3.14Å; R11-G105 VanDerWaalsContact NH2-O 3.1Å; Q103-G105 PolarHBondContact O-N 2.8Å
106	S	91.6	Very high	92.7	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.007	16%	0.164	C	C	.	.	S	Bend	trans	-77.3	-21.7	173	64.4	0	0	0	0	114.5	R11 Q103 T104 T334	R11-S106 WeakPolarHBondContact CG-O 3.43Å; Q103-S106 VanDerWaalsContact O-CB 3.23Å; Q103-S106 WeakPolarHBondContact O-CB 3.49Å; Q103-S106 PolarHBondContact O-N 2.86Å; Q103-S106 VanDerWaalsContact O-N 3.14Å; Q103-S106 PolarHBondContact O-OG 2.98Å; T104-S106 VanDerWaalsContact C-N 3.27Å; T104-S106 PolarHBondContact O-N 2.93Å; S106-T334 VanDerWaalsContact CB-O 3.28Å; S106-T334 WeakPolarHBondContact CB-O 3.44Å; S106-T334 PolarHBondContact OG-O 3.46Å; S106-T334 PolarHBondContact OG-OG1 3Å
107	G	92.1	Very high	92.2	Very high	14 Å²	14	30.2 Å²	30.2	14%	0.144	21%	0.209	C	C	.	.	S	Bend	trans	113.7	15	-175.8	0	0	0	0	0	116.1	Y110 T111	G107-Y110 PolarHBondContact O-N 3.14Å; G107-T111 WeakPolarHBondContact O-CB 3.29Å; G107-T111 PolarHBondContact O-N 3.45Å; G107-T111 PolarHBondContact O-OG1 3.47Å
108	K	93.9	Very high	91.9	Very high	10 Å²	10	32.5 Å²	32.5	4%	0.043	22%	0.221	C	C	.	.	H	α-helix	trans	-51.8	-66.5	174.8	-65.2	-172.2	-63.7	-72.6	0	112.6	A100 G102 Q103 Y110 T111 M112 D252 L253 A254 T334	A100-K108 HydrophobicContact CB-CB 3.98Å; A100-K108 HydrophobicContact CB-CG 4.21Å; G102-K108 PolarHBondContact O-NZ 2.69Å; Q103-K108 VanDerWaalsContact C-NZ 3.29Å; Q103-K108 PolarHBondContact O-NZ 2.94Å; K108-Y110 VanDerWaalsContact C-N 3.28Å; K108-Y110 PolarHBondContact O-N 3.07Å; K108-T111 WeakPolarHBondContact O-CA 3.48Å; K108-T111 PolarHBondContact O-N 2.88Å; K108-M112 PolarHBondContact O-N 2.88Å; K108-D252 WeakPolarHBondContact CB-OD1 3.42Å; K108-L253 WeakPolarHBondContact CD-O 3.43Å; K108-L253 WeakPolarHBondContact CE-O 3.44Å; K108-A254 WeakPolarHBondContact CE-O 3.33Å; K108-T334 VanDerWaalsContact CG-OG1 3.23Å; K108-T334 WeakPolarHBondContact CG-OG1 3.15Å; K108-T334 PolarHBondContact N-OG1 3.22Å
109	S	91.8	Very high	91.8	Very high	42 Å²	42	34 Å²	34	29%	0.294	23%	0.234	S	C	.	.	H	α-helix	trans	-66.1	-28.2	-177.9	-38.5	0	0	0	0	112.7	T111 M113 G114 D252	S109-T111 VanDerWaalsContact C-N 3.35Å; S109-M113 WeakPolarHBondContact O-CA 3.32Å; S109-M113 WeakPolarHBondContact O-CB 3.47Å; S109-M113 PolarHBondContact O-N 3.41Å; S109-G114 PolarHBondContact O-N 2.95Å; S109-D252 WeakPolarHBondContact CA-OD1 3.22Å; S109-D252 PolarHBondContact N-OD1 3.06Å; S109-D252 PolarHBondContact OG-OD1 3.38Å; S109-D252 VanDerWaalsContact OG-OD1 3.12Å; S109-D252 PolarHBondContact OG-OD2 2.94Å
110	Y	93.5	Very high	91.7	Very high	73 Å²	73	34 Å²	34	29%	0.286	23%	0.234	S	C	.	.	H	α-helix	trans	-65.2	-36.2	168.9	173.2	-100.3	0	0	0	112.3	Q75 G107 K108 G114 V115 D118	Q75-Y110 PolarHBondContact NE2-O 2.8Å; G107-Y110 PolarHBondContact O-N 3.14Å; K108-Y110 VanDerWaalsContact C-N 3.28Å; K108-Y110 PolarHBondContact O-N 3.07Å; Y110-G114 WeakPolarHBondContact O-CA 3.49Å; Y110-G114 PolarHBondContact O-N 3.39Å; Y110-G114 VanDerWaalsContact O-N 3.15Å; Y110-V115 HydrophobicContact CD2-CG1 4.29Å; Y110-V115 HydrophobicContact CE2-CG2 4.26Å; Y110-D118 PolarHBondContact OH-OD2 3.23Å
111	T	96.3	Very high	91.7	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-77.3	-37.3	176.8	-54.8	0	0	0	0	111.9	R9 V78 G107 K108 S109 L121 I332	R9-T111 PolarHBondContact NH1-OG1 2.96Å; V78-T111 HydrophobicContact CG1-CG2 4.35Å; G107-T111 WeakPolarHBondContact O-CB 3.29Å; G107-T111 PolarHBondContact O-N 3.45Å; G107-T111 PolarHBondContact O-OG1 3.47Å; K108-T111 WeakPolarHBondContact O-CA 3.48Å; K108-T111 PolarHBondContact O-N 2.88Å; S109-T111 VanDerWaalsContact C-N 3.35Å; T111-L121 HydrophobicContact CG2-CD1 4.1Å; T111-L121 PolarHBondContact O-N 2.92Å; T111-I332 HydrophobicContact CG2-CD1 4.1Å; T111-I332 HydrophobicContact CG2-CG2 4.12Å
112	M	95.8	Very high	91.7	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-79	-57.6	-179.9	-62.8	-53.8	-71.7	0	0	112.4	V98 A100 K108 G120 L121 I122 L250 D252	V98-M112 HydrophobicContact CB-CE 4.43Å; V98-M112 HydrophobicContact CG1-CE 4.26Å; V98-M112 HydrophobicContact CG1-SD 4.29Å; A100-M112 HydrophobicContact CB-CG 3.53Å; A100-M112 HydrophobicContact CB-SD 3.87Å; K108-M112 PolarHBondContact O-N 2.88Å; M112-G120 CarbonylContact O-C 3.59Å; M112-L121 PolarHBondContact O-N 2.83Å; M112-L121 VanDerWaalsContact O-N 3.09Å; M112-L121 HydrophobicContact SD-CD1 4.44Å; M112-I122 HydrophobicContact CB-CD1 3.98Å; M112-I122 HydrophobicContact CB-CG1 4.35Å; M112-I122 HydrophobicContact CE-CD1 4.26Å; M112-I122 HydrophobicContact CE-CG1 4.16Å; M112-I122 WeakPolarHBondContact O-CB 3.47Å; M112-I122 WeakPolarHBondContact O-CG1 3.32Å; M112-I122 PolarHBondContact O-N 2.92Å; M112-L250 HydrophobicContact CE-CB 4Å; M112-D252 HydrophobicContact CB-CB 4.35Å; M112-D252 HydrophobicContact CG-CB 4.28Å
113	M	92.8	Very high	91.8	Very high	39 Å²	39	34 Å²	34	19%	0.192	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-42.8	-177.6	-165.2	62.8	62	0	0	112.2	S109 G120 I122 P123 M202 N206	S109-M113 WeakPolarHBondContact O-CA 3.32Å; S109-M113 WeakPolarHBondContact O-CB 3.47Å; S109-M113 PolarHBondContact O-N 3.41Å; M113-G120 PolarHBondContact O-N 3.43Å; M113-I122 HydrophobicContact CE-CD1 4.16Å; M113-P123 WeakPolarHBondContact O-CG 3.35Å; M113-M202 HydrophobicContact CE-CE 4.07Å; M113-M202 HydrophobicContact SD-CE 3.42Å; M113-M202 WeakPolarHBondContact SD-CE 3.32Å; M113-N206 WeakPolarHBondContact CE-ND2 3.44Å; M113-N206 PolarHBondContact SD-ND2 3.22Å
114	G	91.6	Very high	92.1	Very high	14 Å²	14	35.4 Å²	35.4	14%	0.144	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	86.9	-159.9	-171.1	0	0	0	0	0	113	S109 Y110 D118	S109-G114 PolarHBondContact O-N 2.95Å; Y110-G114 WeakPolarHBondContact O-CA 3.49Å; Y110-G114 PolarHBondContact O-N 3.39Å; Y110-G114 VanDerWaalsContact O-N 3.15Å; G114-D118 WeakPolarHBondContact CA-O 3.35Å
115	V	86.8	Confident	92.5	Very high	77 Å²	77	33.3 Å²	33.3	47%	0.467	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	159	171.7	-68.9	0	0	0	0	109.1	Y110 G117 D118	Y110-V115 HydrophobicContact CD2-CG1 4.29Å; Y110-V115 HydrophobicContact CE2-CG2 4.26Å; V115-G117 PolarHBondContact O-N 2.8Å; V115-D118 HydrophobicContact CG2-CB 4.01Å; V115-D118 PolarHBondContact N-O 3.31Å; V115-D118 CarbonylContact O-C 3.6Å; V115-D118 PolarHBondContact O-N 3.04Å
116	P	82.1	Confident	93	Very high	139 Å²	139	31 Å²	31	90%	0.903	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	126.3	172.1	-26.9	36	0	0	0	111.1
117	G	85.9	Confident	93.1	Very high	93 Å²	93	35.6 Å²	35.6	96%	0.959	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.8	-14.2	-174.1	0	0	0	0	0	116.1	V115	V115-G117 PolarHBondContact O-N 2.8Å
118	D	90.9	Very high	93.3	Very high	48 Å²	48	35.6 Å²	35.6	26%	0.257	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	71.5	172.7	-165.4	25.9	0	0	0	111.6	Q75 Y110 G114 V115 R124	Q75-D118 WeakPolarHBondContact CG-OD1 3.45Å; Q75-D118 WeakPolarHBondContact CG-OD2 3.38Å; Q75-D118 PolarHBondContact NE2-O 2.97Å; Y110-D118 PolarHBondContact OH-OD2 3.23Å; G114-D118 WeakPolarHBondContact CA-O 3.35Å; V115-D118 HydrophobicContact CG2-CB 4.01Å; V115-D118 PolarHBondContact N-O 3.31Å; V115-D118 CarbonylContact O-C 3.6Å; V115-D118 PolarHBondContact O-N 3.04Å; D118-R124 IonicContact OD1-NH2 3.61Å
119	A	94.1	Very high	93.4	Very high	33 Å²	33	35.2 Å²	35.2	27%	0.273	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	142.2	-175.8	0	0	0	0	0	113.1	Q75 P123 R124	Q75-A119 WeakPolarHBondContact CB-O 3.35Å; Q75-A119 PolarHBondContact NE2-O 3.1Å; A119-P123 HydrophobicContact CB-CB 4.06Å; A119-P123 HydrophobicContact CB-CG 4.18Å; A119-R124 HydrophobicContact CB-CG 4.35Å; A119-R124 PolarHBondContact O-NE 3.27Å; A119-R124 PolarHBondContact O-NH2 3.15Å
120	G	95.7	Very high	93.5	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.01	21%	0.213	C	C	.	.			trans	-85.8	-160.1	178.8	0	0	0	0	0	113.6	M112 M113 R124	M112-G120 CarbonylContact O-C 3.59Å; M113-G120 PolarHBondContact O-N 3.43Å; G120-R124 WeakPolarHBondContact O-CB 3.48Å; G120-R124 WeakPolarHBondContact O-CD 3.49Å; G120-R124 VanDerWaalsContact O-CG 3.23Å; G120-R124 WeakPolarHBondContact O-CG 3.49Å; G120-R124 PolarHBondContact O-N 3.32Å
121	L	96.9	Very high	93.5	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-67.7	-41	-179.4	-74.3	173.4	0	0	0	113.9	V78 F79 V98 T111 M112 I125 I332	V78-L121 HydrophobicContact CG1-CD1 4.31Å; V78-L121 HydrophobicContact CG1-CD2 4.31Å; V78-L121 HydrophobicContact CG1-CG 4.47Å; F79-L121 HydrophobicContact CB-CD2 4.03Å; F79-L121 HydrophobicContact CD2-CD2 4.26Å; V98-L121 HydrophobicContact CG1-CD1 4.25Å; T111-L121 HydrophobicContact CG2-CD1 4.1Å; T111-L121 PolarHBondContact O-N 2.92Å; M112-L121 PolarHBondContact O-N 2.83Å; M112-L121 VanDerWaalsContact O-N 3.09Å; M112-L121 HydrophobicContact SD-CD1 4.44Å; L121-I125 HydrophobicContact CB-CD1 4.2Å; L121-I125 VanDerWaalsContact O-CB 3.22Å; L121-I125 WeakPolarHBondContact O-CB 3.24Å; L121-I125 WeakPolarHBondContact O-CD1 3.45Å; L121-I125 WeakPolarHBondContact O-CG1 3.47Å; L121-I125 PolarHBondContact O-N 3.01Å; L121-I332 HydrophobicContact CD1-CD1 3.26Å
122	I	95.9	Very high	93.3	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.015	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-53.9	-176	-59	172.1	0	0	0	110.9	M112 M113 R124 I125 C126 M202 F227 L250	M112-I122 HydrophobicContact CB-CD1 3.98Å; M112-I122 HydrophobicContact CB-CG1 4.35Å; M112-I122 HydrophobicContact CE-CD1 4.26Å; M112-I122 HydrophobicContact CE-CG1 4.16Å; M112-I122 WeakPolarHBondContact O-CB 3.47Å; M112-I122 WeakPolarHBondContact O-CG1 3.32Å; M112-I122 PolarHBondContact O-N 2.92Å; M113-I122 HydrophobicContact CE-CD1 4.16Å; I122-R124 PolarHBondContact O-N 2.95Å; I122-I125 PolarHBondContact O-N 2.94Å; I122-C126 PolarHBondContact O-N 3.08Å; I122-C126 PolarHBondContact O-SG 3.01Å; I122-M202 HydrophobicContact CB-CE 4.13Å; I122-M202 HydrophobicContact CG2-CE 3.51Å; I122-M202 HydrophobicContact CG2-SD 3.73Å; I122-F227 HydrophobicContact CD1-CB 4.49Å; I122-F227 HydrophobicContact CG2-CD1 3.86Å; I122-F227 HydrophobicContact CG2-CE1 4.23Å; I122-F227 HydrophobicContact CG2-CG 4.27Å; I122-L250 HydrophobicContact CB-CD1 4.25Å; I122-L250 HydrophobicContact CD1-CB 4.14Å; I122-L250 HydrophobicContact CG1-CB 3.8Å; I122-L250 HydrophobicContact CG1-CD1 3.95Å; I122-L250 HydrophobicContact CG1-CG 4.46Å; I122-L250 HydrophobicContact CG2-CD1 4.05Å
123	P	95.6	Very high	93	Very high	11 Å²	11	38.6 Å²	38.6	7%	0.071	24%	0.24	C	C	.	.	H	α-helix	trans	-59.7	-47.7	178.3	-18.9	29.5	0	0	0	111.8	M113 A119 I125 C126 E127 Y195 M202	M113-P123 WeakPolarHBondContact O-CG 3.35Å; A119-P123 HydrophobicContact CB-CB 4.06Å; A119-P123 HydrophobicContact CB-CG 4.18Å; P123-I125 PolarHBondContact O-N 3.11Å; P123-C126 PolarHBondContact O-N 3.4Å; P123-E127 WeakPolarHBondContact O-CB 3.49Å; P123-E127 PolarHBondContact O-N 3.07Å; P123-Y195 HydrophobicContact CB-CE2 4.41Å; P123-Y195 WeakPolarHBondContact CB-OH 3.35Å; P123-Y195 WeakPolarHBondContact O-CE2 3.48Å; P123-M202 HydrophobicContact CB-CE 4.45Å; P123-M202 HydrophobicContact CG-CE 3.87Å
124	R	96.3	Very high	92.7	Very high	47 Å²	47	39 Å²	39	18%	0.177	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-33.4	-178.3	-65.5	176.3	-174	-87	4.1	113.6	F79 D118 A119 G120 I122 G128	F79-R124 HydrophobicContact CB-CB 4.32Å; F79-R124 HydrophobicContact CD1-CB 4.11Å; F79-R124 HydrophobicContact CD2-CB 3.47Å; F79-R124 VanDerWaalsContact CD2-CB 3.47Å; F79-R124 HydrophobicContact CE1-CB 4.32Å; F79-R124 VanDerWaalsContact CE2-C 3.43Å; F79-R124 HydrophobicContact CE2-CB 3.73Å; F79-R124 VanDerWaalsContact CE2-O 3.3Å; F79-R124 WeakPolarHBondContact CE2-O 2.94Å; F79-R124 HydrophobicContact CG-CB 3.68Å; F79-R124 HydrophobicContact CG-CG 4.39Å; F79-R124 HydrophobicContact CZ-CB 4.14Å; F79-R124 VanDerWaalsContact CZ-O 3.3Å; F79-R124 WeakPolarHBondContact CZ-O 3.45Å; D118-R124 IonicContact OD1-NH2 3.61Å; A119-R124 HydrophobicContact CB-CG 4.35Å; A119-R124 PolarHBondContact O-NE 3.27Å; A119-R124 PolarHBondContact O-NH2 3.15Å; G120-R124 WeakPolarHBondContact O-CB 3.48Å; G120-R124 WeakPolarHBondContact O-CD 3.49Å; G120-R124 VanDerWaalsContact O-CG 3.23Å; G120-R124 WeakPolarHBondContact O-CG 3.49Å; G120-R124 PolarHBondContact O-N 3.32Å; I122-R124 PolarHBondContact O-N 2.95Å; R124-G128 PolarHBondContact O-N 3.33Å
125	I	97.3	Very high	92.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.7	-40.9	172.2	-71.3	166.7	0	0	0	109.9	F79 V86 L87 L121 I122 P123 L129 L250	F79-I125 HydrophobicContact CD2-CG1 4.12Å; F79-I125 HydrophobicContact CE2-CG1 3.83Å; V86-I125 HydrophobicContact CB-CD1 4.43Å; V86-I125 HydrophobicContact CG1-CD1 4.33Å; V86-I125 HydrophobicContact CG1-CG2 4.41Å; L87-I125 HydrophobicContact CD2-CG2 4.06Å; L87-I125 WeakPolarHBondContact CD2-O 3.18Å; L121-I125 HydrophobicContact CB-CD1 4.2Å; L121-I125 VanDerWaalsContact O-CB 3.22Å; L121-I125 WeakPolarHBondContact O-CB 3.24Å; L121-I125 WeakPolarHBondContact O-CD1 3.45Å; L121-I125 WeakPolarHBondContact O-CG1 3.47Å; L121-I125 PolarHBondContact O-N 3.01Å; I122-I125 PolarHBondContact O-N 2.94Å; P123-I125 PolarHBondContact O-N 3.11Å; I125-L129 WeakPolarHBondContact O-CB 3.44Å; I125-L129 PolarHBondContact O-N 3.17Å; I125-L250 HydrophobicContact CB-CD1 4.42Å; I125-L250 HydrophobicContact CD1-CD1 4.32Å; I125-L250 HydrophobicContact CD1-CD2 3.85Å; I125-L250 HydrophobicContact CG2-CD1 4.2Å
126	C	96	Very high	92.2	Very high	1 Å²	1	38 Å²	38	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-66.6	-46.9	176.7	-60.1	0	0	0	0	111.5	I122 P123 G128 L129 F130 Y195 V198	I122-C126 PolarHBondContact O-N 3.08Å; I122-C126 PolarHBondContact O-SG 3.01Å; P123-C126 PolarHBondContact O-N 3.4Å; C126-G128 PolarHBondContact O-N 2.88Å; C126-L129 WeakPolarHBondContact O-CB 3.46Å; C126-L129 PolarHBondContact O-N 2.91Å; C126-F130 WeakPolarHBondContact O-CD2 3.42Å; C126-F130 PolarHBondContact O-N 3.37Å; C126-Y195 HydrophobicContact CB-CD2 3.83Å; C126-Y195 HydrophobicContact CB-CE2 3.98Å; C126-V198 HydrophobicContact CB-CG1 3.9Å
127	E	94.9	Very high	91.9	Very high	98 Å²	98	34.1 Å²	34.1	46%	0.458	22%	0.215	S	C	.	.	H	α-helix	trans	-58.3	-48.3	175.4	-177.9	-175.2	-151.1	0	0	111.6	P123 L129 F130 S131 Y195	P123-E127 WeakPolarHBondContact O-CB 3.49Å; P123-E127 PolarHBondContact O-N 3.07Å; E127-L129 VanDerWaalsContact C-N 3.33Å; E127-L129 PolarHBondContact O-N 3.23Å; E127-F130 PolarHBondContact O-N 3.33Å; E127-S131 WeakPolarHBondContact O-CB 3.1Å; E127-S131 PolarHBondContact O-N 3.42Å; E127-S131 PolarHBondContact O-OG 3.12Å; E127-Y195 HydrophobicContact CB-CD2 3.88Å; E127-Y195 HydrophobicContact CB-CE2 4.06Å; E127-Y195 HydrophobicContact CB-CG 4.27Å; E127-Y195 VanDerWaalsContact N-CD2 3.34Å
128	G	95.3	Very high	91.4	Very high	14 Å²	14	38.9 Å²	38.9	14%	0.144	20%	0.204	C	C	.	.	H	α-helix	trans	-67.6	-29.7	177.9	0	0	0	0	0	113.9	R124 C126 R132	R124-G128 PolarHBondContact O-N 3.33Å; C126-G128 PolarHBondContact O-N 2.88Å; G128-R132 WeakPolarHBondContact O-CG 3.47Å; G128-R132 PolarHBondContact O-N 2.9Å
129	L	95.6	Very high	90.5	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-54.3	171.3	177.4	62.8	0	0	0	110.1	L87 F91 I125 C126 E127 S131 R132 I133 T146 I229 F231	L87-L129 HydrophobicContact CD2-CB 3.76Å; L87-L129 HydrophobicContact CD2-CD1 4.43Å; F91-L129 HydrophobicContact CD2-CD1 4.47Å; F91-L129 HydrophobicContact CE2-CD1 3.62Å; F91-L129 HydrophobicContact CZ-CD1 3.99Å; I125-L129 WeakPolarHBondContact O-CB 3.44Å; I125-L129 PolarHBondContact O-N 3.17Å; C126-L129 WeakPolarHBondContact O-CB 3.46Å; C126-L129 PolarHBondContact O-N 2.91Å; E127-L129 VanDerWaalsContact C-N 3.33Å; E127-L129 PolarHBondContact O-N 3.23Å; L129-S131 VanDerWaalsContact C-N 3.33Å; L129-S131 PolarHBondContact O-N 3.24Å; L129-R132 PolarHBondContact O-N 2.94Å; L129-I133 HydrophobicContact CD1-CD1 4.18Å; L129-I133 HydrophobicContact CG-CD1 3.95Å; L129-I133 WeakPolarHBondContact O-CG1 3.33Å; L129-I133 PolarHBondContact O-N 3.49Å; L129-T146 HydrophobicContact CD2-CG2 4.2Å; L129-I229 HydrophobicContact CD2-CD1 4.33Å; L129-I229 HydrophobicContact CD2-CG2 3.93Å; L129-F231 HydrophobicContact CD1-CD1 4.25Å; L129-F231 HydrophobicContact CD1-CD2 3.98Å; L129-F231 HydrophobicContact CD1-CE1 4.23Å; L129-F231 HydrophobicContact CD1-CE2 3.96Å; L129-F231 HydrophobicContact CD1-CG 4.12Å; L129-F231 HydrophobicContact CD1-CZ 4.06Å
130	F	93.9	Very high	89.2	Confident	19 Å²	19	48.7 Å²	48.7	8%	0.083	24%	0.242	C	C	.	.	H	α-helix	trans	-67.7	-30.5	-178.8	-80.1	-73.9	0	0	0	113.6	C126 E127 I133 A134 T146 V192 Q193 V198	C126-F130 WeakPolarHBondContact O-CD2 3.42Å; C126-F130 PolarHBondContact O-N 3.37Å; E127-F130 PolarHBondContact O-N 3.33Å; F130-I133 HydrophobicContact CD1-CD1 3.93Å; F130-I133 HydrophobicContact CE1-CD1 4.06Å; F130-I133 HydrophobicContact CG-CD1 4.48Å; F130-I133 PolarHBondContact O-N 2.89Å; F130-A134 WeakPolarHBondContact O-CB 3.44Å; F130-A134 PolarHBondContact O-N 3.44Å; F130-T146 HydrophobicContact CE2-CG2 4.33Å; F130-T146 HydrophobicContact CZ-CG2 3.89Å; F130-V192 HydrophobicContact CE2-CG2 4.47Å; F130-V192 HydrophobicContact CZ-CB 4.29Å; F130-V192 HydrophobicContact CZ-CG2 3.93Å; F130-Q193 WeakPolarHBondContact CD1-O 3.22Å; F130-Q193 VanDerWaalsContact CE1-O 3.22Å; F130-Q193 WeakPolarHBondContact CE1-O 3.47Å; F130-V198 HydrophobicContact CE2-CG2 3.74Å; F130-V198 HydrophobicContact CZ-CG2 4.36Å
131	S	93.3	Very high	87.8	Confident	63 Å²	63	53.4 Å²	53.4	44%	0.441	26%	0.264	S	S	.	.	H	α-helix	trans	-61.1	-47.2	171.8	-61.9	0	0	0	0	111.5	E127 L129 A134 D135	E127-S131 WeakPolarHBondContact O-CB 3.1Å; E127-S131 PolarHBondContact O-N 3.42Å; E127-S131 PolarHBondContact O-OG 3.12Å; L129-S131 VanDerWaalsContact C-N 3.33Å; L129-S131 PolarHBondContact O-N 3.24Å; S131-A134 PolarHBondContact O-N 2.97Å; S131-D135 PolarHBondContact O-N 3.05Å
132	R	92.1	Very high	86.7	Confident	89 Å²	89	53.6 Å²	53.6	34%	0.336	27%	0.266	S	S	.	.	H	α-helix	trans	-68.9	-34.8	176.6	-72	-176.7	-173.1	-175.1	7.4	113.1	F91 G128 L129 D135 A136	F91-R132 HydrophobicContact CE1-CB 4.16Å; F91-R132 HydrophobicContact CE2-CB 3.61Å; F91-R132 HydrophobicContact CE2-CG 4.29Å; F91-R132 HydrophobicContact CZ-CB 3.34Å; F91-R132 HydrophobicContact CZ-CG 4.44Å; G128-R132 WeakPolarHBondContact O-CG 3.47Å; G128-R132 PolarHBondContact O-N 2.9Å; L129-R132 PolarHBondContact O-N 2.94Å; R132-D135 PolarHBondContact O-N 3.5Å; R132-A136 WeakPolarHBondContact O-CB 3.49Å; R132-A136 PolarHBondContact O-N 3.32Å
133	I	89.5	Confident	85.6	Confident	18 Å²	18	55.3 Å²	55.3	9%	0.092	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-52.6	171.2	-71.3	168.3	0	0	0	109.5	F91 L129 F130 D135 A136 S137 F144 F231	F91-I133 HydrophobicContact CZ-CG1 4.13Å; L129-I133 HydrophobicContact CD1-CD1 4.18Å; L129-I133 HydrophobicContact CG-CD1 3.95Å; L129-I133 WeakPolarHBondContact O-CG1 3.33Å; L129-I133 PolarHBondContact O-N 3.49Å; F130-I133 HydrophobicContact CD1-CD1 3.93Å; F130-I133 HydrophobicContact CE1-CD1 4.06Å; F130-I133 HydrophobicContact CG-CD1 4.48Å; F130-I133 PolarHBondContact O-N 2.89Å; I133-D135 VanDerWaalsContact C-N 3.3Å; I133-D135 PolarHBondContact O-N 3.44Å; I133-A136 PolarHBondContact O-N 3.28Å; I133-S137 WeakPolarHBondContact O-CB 3.48Å; I133-S137 PolarHBondContact O-N 3.5Å; I133-S137 PolarHBondContact O-OG 3.2Å; I133-F144 HydrophobicContact CB-CD2 4.35Å; I133-F144 HydrophobicContact CD1-CB 4.49Å; I133-F144 HydrophobicContact CG1-CB 4.35Å; I133-F144 HydrophobicContact CG1-CD1 4.22Å; I133-F144 HydrophobicContact CG1-CD2 4.35Å; I133-F144 HydrophobicContact CG1-CG 4.05Å; I133-F144 HydrophobicContact CG2-CB 4.14Å; I133-F144 HydrophobicContact CG2-CD2 3.73Å; I133-F144 HydrophobicContact CG2-CE2 4.36Å; I133-F144 HydrophobicContact CG2-CG 4.05Å; I133-F231 HydrophobicContact CD1-CD2 4.25Å; I133-F231 HydrophobicContact CD1-CE2 3.62Å; I133-F231 HydrophobicContact CD1-CZ 4.48Å; I133-F231 HydrophobicContact CG1-CE2 3.83Å; I133-F231 HydrophobicContact CG1-CZ 4.25Å
134	A	86.9	Confident	85	Confident	46 Å²	46	56.2 Å²	56.2	38%	0.38	28%	0.281	S	S	.	.	H	α-helix	trans	-60.4	-38.4	179.5	0	0	0	0	0	112.5	F130 S131 R138	F130-A134 WeakPolarHBondContact O-CB 3.44Å; F130-A134 PolarHBondContact O-N 3.44Å; S131-A134 PolarHBondContact O-N 2.97Å; A134-R138 WeakPolarHBondContact O-CB 3.43Å; A134-R138 VanDerWaalsContact O-CG 3.27Å; A134-R138 WeakPolarHBondContact O-CG 3.32Å; A134-R138 PolarHBondContact O-N 3.3Å
135	D	85.9	Confident	84.4	Confident	65 Å²	65	57.2 Å²	57.2	35%	0.348	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-46.5	173.4	-82.1	-27.7	0	0	0	113.2	S131 R132 I133 R138 R139	S131-D135 PolarHBondContact O-N 3.05Å; R132-D135 PolarHBondContact O-N 3.5Å; I133-D135 VanDerWaalsContact C-N 3.3Å; I133-D135 PolarHBondContact O-N 3.44Å; D135-R138 IonicContact OD1-CZ 2.69Å; D135-R138 IonicContact OD1-NH2 3.79Å; D135-R138 PolarHBondContact OD1-NH2 3.24Å; D135-R139 PolarHBondContact O-NH1 2.96Å; D135-R139 VanDerWaalsContact O-NH1 3.14Å
136	A	81.8	Confident	84	Confident	7 Å²	7	57.4 Å²	57.4	6%	0.058	29%	0.286	C	S	.	.	H	α-helix	trans	-73.5	-39.3	-178.6	0	0	0	0	0	112.6	R132 I133 R138 R139 D140 E141 F144	R132-A136 WeakPolarHBondContact O-CB 3.49Å; R132-A136 PolarHBondContact O-N 3.32Å; I133-A136 PolarHBondContact O-N 3.28Å; A136-R138 VanDerWaalsContact C-N 3.33Å; A136-R138 PolarHBondContact O-N 3.32Å; A136-R139 PolarHBondContact O-N 2.72Å; A136-R139 VanDerWaalsContact O-N 3.12Å; A136-D140 PolarHBondContact O-N 3.13Å; A136-E141 PolarHBondContact O-N 3.16Å; A136-F144 HydrophobicContact CB-CE2 3.69Å; A136-F144 HydrophobicContact CB-CZ 3.56Å
137	S	76.4	Confident	83.8	Confident	56 Å²	56	58.9 Å²	58.9	39%	0.392	29%	0.293	S	S	.	.	H	α-helix	trans	-67.1	-31.3	174.9	-63.3	0	0	0	0	112.6	I133 R139 D140 F144	I133-S137 WeakPolarHBondContact O-CB 3.48Å; I133-S137 PolarHBondContact O-N 3.5Å; I133-S137 PolarHBondContact O-OG 3.2Å; S137-R139 PolarHBondContact O-N 3.37Å; S137-D140 PolarHBondContact O-N 3.01Å; S137-D140 VanDerWaalsContact O-N 3.16Å; S137-F144 WeakPolarHBondContact OG-CD2 3.27Å
138	R	74.4	Confident	83.8	Confident	193 Å²	193	54.3 Å²	54.3	73%	0.728	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.7	171	-82.6	-170.6	-64.8	-146	6.2	114.1	A134 D135 A136	A134-R138 WeakPolarHBondContact O-CB 3.43Å; A134-R138 VanDerWaalsContact O-CG 3.27Å; A134-R138 WeakPolarHBondContact O-CG 3.32Å; A134-R138 PolarHBondContact O-N 3.3Å; D135-R138 IonicContact OD1-CZ 2.69Å; D135-R138 IonicContact OD1-NH2 3.79Å; D135-R138 PolarHBondContact OD1-NH2 3.24Å; A136-R138 VanDerWaalsContact C-N 3.33Å; A136-R138 PolarHBondContact O-N 3.32Å
139	R	73.4	Confident	83.8	Confident	140 Å²	140	53.9 Å²	53.9	53%	0.528	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	3.2	176.5	-62.7	-170.1	-59.3	-84.4	-9.3	112.8	D135 A136 S137 E141	D135-R139 PolarHBondContact O-NH1 2.96Å; D135-R139 VanDerWaalsContact O-NH1 3.14Å; A136-R139 PolarHBondContact O-N 2.72Å; A136-R139 VanDerWaalsContact O-N 3.12Å; S137-R139 PolarHBondContact O-N 3.37Å; R139-E141 HydrophobicContact CB-CG 3.71Å; R139-E141 WeakPolarHBondContact CD-OE1 3.37Å; R139-E141 IonicContact CZ-OE1 2.7Å; R139-E141 IonicContact CZ-OE2 2.98Å; R139-E141 IonicContact NE-OE1 3.52Å; R139-E141 PolarHBondContact NE-OE1 2.95Å; R139-E141 IonicContact NE-OE2 3.84Å; R139-E141 PolarHBondContact NE-OE2 3.05Å; R139-E141 VanDerWaalsContact NE-OE2 3.17Å; R139-E141 IonicContact NH2-OE1 3.41Å; R139-E141 IonicContact NH2-OE2 3.34Å; R139-E141 PolarHBondContact NH2-OE2 2.7Å; R139-E141 PolarHBondContact O-N 3.49Å; R139-E141 VanDerWaalsContact O-N 3.16Å
140	D	66.1	Low	83.8	Confident	148 Å²	148	54 Å²	54	79%	0.791	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	27.8	-175.1	-149	20.9	0	0	0	113.7	A136 S137	A136-D140 PolarHBondContact O-N 3.13Å; S137-D140 PolarHBondContact O-N 3.01Å; S137-D140 VanDerWaalsContact O-N 3.16Å
141	E	67.3	Low	83.7	Confident	99 Å²	99	53.3 Å²	53.3	46%	0.463	26%	0.263	S	S	.	.			trans	-77.8	-29.8	-174.2	-74	170.8	172	0	0	113.1	A136 R139 K235	A136-E141 PolarHBondContact O-N 3.16Å; R139-E141 HydrophobicContact CB-CG 3.71Å; R139-E141 WeakPolarHBondContact CD-OE1 3.37Å; R139-E141 IonicContact CZ-OE1 2.7Å; R139-E141 IonicContact CZ-OE2 2.98Å; R139-E141 IonicContact NE-OE1 3.52Å; R139-E141 PolarHBondContact NE-OE1 2.95Å; R139-E141 IonicContact NE-OE2 3.84Å; R139-E141 PolarHBondContact NE-OE2 3.05Å; R139-E141 VanDerWaalsContact NE-OE2 3.17Å; R139-E141 IonicContact NH2-OE1 3.41Å; R139-E141 IonicContact NH2-OE2 3.34Å; R139-E141 PolarHBondContact NH2-OE2 2.7Å; R139-E141 PolarHBondContact O-N 3.49Å; R139-E141 VanDerWaalsContact O-N 3.16Å; E141-K235 WeakPolarHBondContact O-CB 3.38Å
142	A	72.4	Confident	83.6	Confident	7 Å²	7	50.5 Å²	50.5	6%	0.058	24%	0.243	C	C	.	.			trans	-161.9	151.4	-172.8	0	0	0	0	0	112.1	F144 Q233 A234 K235	A142-F144 HydrophobicContact CB-CE1 4.12Å; A142-F144 HydrophobicContact CB-CE2 3.86Å; A142-F144 HydrophobicContact CB-CZ 3.56Å; A142-F144 VanDerWaalsContact O-CE2 3.31Å; A142-F144 WeakPolarHBondContact O-CE2 3.39Å; A142-Q233 HydrophobicContact CB-CG 4.18Å; A142-A234 WeakPolarHBondContact CA-O 3.29Å; A142-K235 HydrophobicContact CB-CB 3.99Å
143	S	74.1	Confident	83.6	Confident	39 Å²	39	46.3 Å²	46.3	27%	0.273	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	147.9	167.8	-74.3	0	0	0	0	110.4	A234 W426	S143-A234 PolarHBondContact N-O 3.37Å; S143-A234 PolarHBondContact O-N 3.4Å; S143-A234 VanDerWaalsContact O-O 3.12Å; S143-W426 VanDerWaalsContact CB-CH2 3.43Å
144	F	82.9	Confident	83.4	Confident	31 Å²	31	49.4 Å²	49.4	14%	0.136	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.8	-171.1	-58.1	-81	0	0	0	111.5	F91 I133 A136 S137 A142 F231 T232 Q233	F91-F144 HydrophobicContact CD1-CE1 4.33Å; F91-F144 AromaticContact CE1-CE1 3.77Å; F91-F144 HydrophobicContact CE1-CE1 3.77Å; F91-F144 HydrophobicContact CE1-CZ 4.16Å; I133-F144 HydrophobicContact CB-CD2 4.35Å; I133-F144 HydrophobicContact CD1-CB 4.49Å; I133-F144 HydrophobicContact CG1-CB 4.35Å; I133-F144 HydrophobicContact CG1-CD1 4.22Å; I133-F144 HydrophobicContact CG1-CD2 4.35Å; I133-F144 HydrophobicContact CG1-CG 4.05Å; I133-F144 HydrophobicContact CG2-CB 4.14Å; I133-F144 HydrophobicContact CG2-CD2 3.73Å; I133-F144 HydrophobicContact CG2-CE2 4.36Å; I133-F144 HydrophobicContact CG2-CG 4.05Å; A136-F144 HydrophobicContact CB-CE2 3.69Å; A136-F144 HydrophobicContact CB-CZ 3.56Å; S137-F144 WeakPolarHBondContact OG-CD2 3.27Å; A142-F144 HydrophobicContact CB-CE1 4.12Å; A142-F144 HydrophobicContact CB-CE2 3.86Å; A142-F144 HydrophobicContact CB-CZ 3.56Å; A142-F144 VanDerWaalsContact O-CE2 3.31Å; A142-F144 WeakPolarHBondContact O-CE2 3.39Å; F144-F231 HydrophobicContact CB-CE2 4.18Å; F144-F231 AromaticContact CD1-CE2 3.49Å; F144-F231 HydrophobicContact CD1-CE2 3.49Å; F144-F231 VanDerWaalsContact CD1-CE2 3.49Å; F144-F231 AromaticContact CD1-CZ 3.37Å; F144-F231 HydrophobicContact CD1-CZ 3.37Å; F144-F231 HydrophobicContact CE1-CE2 4.24Å; F144-F231 AromaticContact CE1-CZ 3.67Å; F144-F231 HydrophobicContact CE1-CZ 3.67Å; F144-F231 HydrophobicContact CG-CE2 4.19Å; F144-F231 HydrophobicContact CG-CZ 4.43Å; F144-T232 WeakPolarHBondContact CA-O 3.46Å; F144-Q233 HydrophobicContact CD1-CB 3.98Å; F144-Q233 HydrophobicContact CD1-CG 3.94Å; F144-Q233 HydrophobicContact CE1-CB 4Å; F144-Q233 HydrophobicContact CE1-CG 3.54Å; F144-Q233 HydrophobicContact CZ-CG 4.42Å
145	R	83.9	Confident	83.2	Confident	68 Å²	68	49.6 Å²	49.6	26%	0.257	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	123.5	169.6	174.8	178.7	176.5	133.1	1.3	108.4	E147 L191 T232 L433	R145-E147 IonicContact CZ-OE1 2.65Å; R145-E147 VanDerWaalsContact CZ-OE1 3.27Å; R145-E147 IonicContact NE-OE1 2.93Å; R145-E147 PolarHBondContact NE-OE1 3.37Å; R145-E147 IonicContact NH2-OE1 3.74Å; R145-E147 PolarHBondContact NH2-OE1 3.04Å; R145-L191 HydrophobicContact CG-CD1 3.95Å; R145-T232 PolarHBondContact N-O 2.71Å; R145-T232 PolarHBondContact O-N 3.39Å; R145-L433 HydrophobicContact CB-CD2 4.38Å; R145-L433 HydrophobicContact CG-CD2 4.2Å
146	T	88.6	Confident	83.3	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.025	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.3	-179	-53.6	0	0	0	0	109.2	L129 F130 V192 I229	L129-T146 HydrophobicContact CD2-CG2 4.2Å; F130-T146 HydrophobicContact CE2-CG2 4.33Å; F130-T146 HydrophobicContact CZ-CG2 3.89Å; T146-V192 HydrophobicContact CG2-CG2 3.73Å; T146-V192 WeakPolarHBondContact O-CG2 3.4Å; T146-V192 PolarHBondContact O-N 3.37Å; T146-I229 HydrophobicContact CG2-CG2 3.6Å
147	E	91.5	Very high	83.5	Confident	32 Å²	32	54.3 Å²	54.3	15%	0.15	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.7	174.9	-60.8	176.5	173.2	0	0	109.6	R145 K189 H190 I229 N230	R145-E147 IonicContact CZ-OE1 2.65Å; R145-E147 VanDerWaalsContact CZ-OE1 3.27Å; R145-E147 IonicContact NE-OE1 2.93Å; R145-E147 PolarHBondContact NE-OE1 3.37Å; R145-E147 IonicContact NH2-OE1 3.74Å; R145-E147 PolarHBondContact NH2-OE1 3.04Å; E147-K189 VanDerWaalsContact OE2-CD 3.29Å; E147-K189 WeakPolarHBondContact OE2-CD 3.45Å; E147-K189 IonicContact OE2-NZ 3.11Å; E147-H190 CarbonylContact C-O 3.5Å; E147-H190 WeakPolarHBondContact CA-O 3.25Å; E147-I229 WeakPolarHBondContact O-CA 3.43Å; E147-N230 HydrophobicContact CB-CB 4.33Å; E147-N230 PolarHBondContact N-O 2.98Å; E147-N230 PolarHBondContact O-N 2.92Å
148	V	95.1	Very high	84.2	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	147	174.9	-62.1	0	0	0	0	111.6	K189 H190 V192 V198 L201 F227 T228 I229	V148-K189 WeakPolarHBondContact O-CA 3.41Å; V148-H190 HydrophobicContact CG2-CB 4.16Å; V148-H190 PolarHBondContact N-O 2.58Å; V148-H190 PolarHBondContact O-N 3.03Å; V148-V192 HydrophobicContact CG1-CG2 3.85Å; V148-V192 HydrophobicContact CG2-CG1 3.8Å; V148-V192 HydrophobicContact CG2-CG2 4.28Å; V148-V198 HydrophobicContact CG1-CG2 4.05Å; V148-L201 HydrophobicContact CG2-CD1 3.55Å; V148-F227 HydrophobicContact CB-CE2 4.28Å; V148-F227 HydrophobicContact CB-CZ 3.85Å; V148-F227 HydrophobicContact CG1-CE1 4.23Å; V148-F227 HydrophobicContact CG1-CZ 3.76Å; V148-T228 WeakPolarHBondContact CA-O 3.29Å; V148-I229 HydrophobicContact CG1-CG1 4.3Å; V148-I229 HydrophobicContact CG1-CG2 4.37Å
149	S	94.9	Very high	84.8	Confident	5 Å²	5	45.7 Å²	45.7	4%	0.035	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	139.8	171.5	55.8	0	0	0	0	108.8	S188 T228	S149-S188 WeakPolarHBondContact CB-O 3.31Å; S149-T228 PolarHBondContact N-O 3.48Å; S149-T228 PolarHBondContact O-N 3.04Å
150	Y	94.9	Very high	85.6	Confident	3 Å²	3	39.9 Å²	39.9	1%	0.012	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.2	-179.5	-163.4	-166.1	0	0	0	109.6	L161 L162 N206 A225 F227	Y150-L161 HydrophobicContact CD1-CB 4.18Å; Y150-L161 HydrophobicContact CD1-CD1 3.87Å; Y150-L161 HydrophobicContact CD2-CD1 3.95Å; Y150-L161 HydrophobicContact CE1-CD1 3.89Å; Y150-L161 HydrophobicContact CE2-CD1 4.02Å; Y150-L161 HydrophobicContact CG-CB 4.22Å; Y150-L161 HydrophobicContact CG-CD1 3.88Å; Y150-L161 WeakPolarHBondContact O-CB 3.43Å; Y150-L161 PolarHBondContact O-N 2.7Å; Y150-L162 HydrophobicContact CD1-CD2 4.37Å; Y150-N206 PolarHBondContact OH-OD1 2.84Å; Y150-A225 HydrophobicContact CE2-CB 3.77Å; Y150-F227 HydrophobicContact CD1-CD2 4.16Å; Y150-F227 HydrophobicContact CD2-CB 3.81Å; Y150-F227 AromaticContact CD2-CD2 3.85Å; Y150-F227 HydrophobicContact CD2-CD2 3.85Å; Y150-F227 HydrophobicContact CD2-CG 4.35Å; Y150-F227 HydrophobicContact CE2-CB 3.94Å; Y150-F227 HydrophobicContact CE2-CD2 4.39Å; Y150-F227 AromaticContact CG-CD2 3.72Å; Y150-F227 HydrophobicContact CG-CD2 3.72Å
151	L	93.2	Very high	86.8	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.026	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	155.2	-178.2	69.3	85.2	0	0	0	112.2	I153 V158 R159 V184 L187 A225 I226	L151-I153 HydrophobicContact CD1-CD1 4.23Å; L151-I153 HydrophobicContact CD1-CG1 3.69Å; L151-V158 HydrophobicContact CB-CG1 4.29Å; L151-V158 HydrophobicContact CD1-CG1 4.26Å; L151-V158 HydrophobicContact CD2-CG1 4.39Å; L151-R159 CarbonylContact C-O 3.53Å; L151-R159 VanDerWaalsContact CA-O 3.28Å; L151-R159 WeakPolarHBondContact CA-O 3.48Å; L151-R159 WeakPolarHBondContact CB-O 3.45Å; L151-V184 HydrophobicContact CD2-CG2 4.04Å; L151-L187 HydrophobicContact CB-CD1 3.99Å; L151-L187 HydrophobicContact CD2-CD1 4.36Å; L151-L187 HydrophobicContact CD2-CD2 3.8Å; L151-A225 WeakPolarHBondContact O-CA 3.43Å; L151-I226 HydrophobicContact CD1-CB 3.84Å; L151-I226 HydrophobicContact CD1-CD1 4.19Å; L151-I226 HydrophobicContact CD1-CG1 4.07Å; L151-I226 HydrophobicContact CG-CB 3.99Å; L151-I226 PolarHBondContact N-O 2.63Å; L151-I226 VanDerWaalsContact N-O 3.1Å; L151-I226 PolarHBondContact O-N 2.77Å
152	E	91.2	Very high	87.8	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.019	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136	171.7	177	177.7	-124.5	0	0	109.8	V158 R159 L161 S223 H224	E152-V158 WeakPolarHBondContact O-CA 3.43Å; E152-R159 HydrophobicContact CB-CB 4.37Å; E152-R159 PolarHBondContact N-O 3.03Å; E152-R159 PolarHBondContact O-N 3.08Å; E152-L161 HydrophobicContact CB-CD1 4.13Å; E152-L161 HydrophobicContact CB-CD2 3.92Å; E152-L161 HydrophobicContact CB-CG 4.04Å; E152-S223 WeakPolarHBondContact OE1-CB 3.3Å; E152-S223 PolarHBondContact OE1-OG 3.37Å; E152-H224 CarbonylContact C-O 3.58Å; E152-H224 WeakPolarHBondContact CA-O 3.15Å
153	I	90.9	Very high	88.3	Confident	2 Å²	2	33 Å²	33	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	107.3	167.1	-51.3	169.6	0	0	0	107.4	L151 R157 H224 I226 V314 L315 L318	L151-I153 HydrophobicContact CD1-CD1 4.23Å; L151-I153 HydrophobicContact CD1-CG1 3.69Å; I153-R157 WeakPolarHBondContact CA-O 3.46Å; I153-H224 HydrophobicContact CB-CB 4.26Å; I153-H224 PolarHBondContact N-O 2.94Å; I153-H224 PolarHBondContact O-N 3.01Å; I153-I226 HydrophobicContact CD1-CD1 3.77Å; I153-I226 HydrophobicContact CD1-CG1 4.48Å; I153-V314 HydrophobicContact CD1-CG1 4.15Å; I153-V314 HydrophobicContact CG1-CG1 4.31Å; I153-V314 HydrophobicContact CG2-CB 4.18Å; I153-V314 HydrophobicContact CG2-CG1 3.9Å; I153-L315 HydrophobicContact CD1-CB 4.25Å; I153-L315 HydrophobicContact CD1-CD1 4.01Å; I153-L318 HydrophobicContact CD1-CD1 3.92Å
154	Y	86.1	Confident	88	Confident	83 Å²	83	41.7 Å²	41.7	33%	0.325	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.2	177.2	173	-112.7	0	0	0	109.3	E156 R157 R222 E271 I275	Y154-E156 VanDerWaalsContact C-N 3.29Å; Y154-E156 PolarHBondContact O-N 3.43Å; Y154-R157 PolarHBondContact N-O 2.88Å; Y154-R157 WeakPolarHBondContact O-CB 3.17Å; Y154-R157 PolarHBondContact O-N 2.98Å; Y154-R222 HydrophobicContact CE2-CB 4.48Å; Y154-E271 HydrophobicContact CE2-CG 4.11Å; Y154-E271 WeakPolarHBondContact CE2-OE1 3.31Å; Y154-E271 PolarHBondContact OH-OE1 3.45Å; Y154-E271 VanDerWaalsContact OH-OE1 3.06Å; Y154-I275 HydrophobicContact CE2-CD1 4.41Å
155	N	82.7	Confident	86.9	Confident	49 Å²	49	49.9 Å²	49.9	26%	0.262	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	43.4	177.6	-169.9	28.5	0	0	0	113.3	R157 N274	N155-R157 PolarHBondContact O-N 3.16Å; N155-N274 VanDerWaalsContact OD1-CB 3.26Å; N155-N274 WeakPolarHBondContact OD1-CB 3.33Å; N155-N274 PolarHBondContact OD1-ND2 3.5Å
156	E	87.5	Confident	84.8	Confident	38 Å²	38	50.9 Å²	50.9	18%	0.178	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	28	-176.6	-63.8	-76.4	87	0	0	114.6	Y154 K277 S313 V314	Y154-E156 VanDerWaalsContact C-N 3.29Å; Y154-E156 PolarHBondContact O-N 3.43Å; E156-K277 HydrophobicContact CG-CD 4.28Å; E156-K277 IonicContact OE2-NZ 2.75Å; E156-K277 PolarHBondContact OE2-NZ 3.43Å; E156-S313 VanDerWaalsContact OE2-CA 3.29Å; E156-S313 WeakPolarHBondContact OE2-CA 3.09Å; E156-S313 WeakPolarHBondContact OE2-CB 3.47Å; E156-V314 HydrophobicContact CB-CG2 4.43Å; E156-V314 PolarHBondContact OE2-N 3.21Å
157	R	86.6	Confident	82.8	Confident	134 Å²	134	54.7 Å²	54.7	51%	0.506	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.6	177.2	-64.9	159.8	169.4	-124	6.4	109.6	I153 Y154 N155 N171	I153-R157 WeakPolarHBondContact CA-O 3.46Å; Y154-R157 PolarHBondContact N-O 2.88Å; Y154-R157 WeakPolarHBondContact O-CB 3.17Å; Y154-R157 PolarHBondContact O-N 2.98Å; N155-R157 PolarHBondContact O-N 3.16Å; R157-N171 WeakPolarHBondContact CB-OD1 3.27Å; R157-N171 WeakPolarHBondContact CD-OD1 3.29Å; R157-N171 WeakPolarHBondContact CG-OD1 3.25Å; R157-N171 PolarHBondContact NE-OD1 3.03Å; R157-N171 PolarHBondContact NH1-ND2 3.05Å; R157-N171 PolarHBondContact NH1-OD1 3.39Å
158	V	90.1	Very high	80.7	Confident	2 Å²	2	61 Å²	61	1%	0.012	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	130.9	177.5	-175.3	0	0	0	0	109.8	L151 E152 N171 L172 V174 V184 V314	L151-V158 HydrophobicContact CB-CG1 4.29Å; L151-V158 HydrophobicContact CD1-CG1 4.26Å; L151-V158 HydrophobicContact CD2-CG1 4.39Å; E152-V158 WeakPolarHBondContact O-CA 3.43Å; V158-N171 WeakPolarHBondContact O-CA 3.37Å; V158-L172 HydrophobicContact CB-CB 4.11Å; V158-L172 HydrophobicContact CG1-CB 4.12Å; V158-L172 PolarHBondContact O-N 3.2Å; V158-V174 HydrophobicContact CG2-CG2 3.96Å; V158-V184 HydrophobicContact CB-CG1 4.5Å; V158-V184 HydrophobicContact CG1-CG1 3.82Å; V158-V184 HydrophobicContact CG1-CG2 4.2Å; V158-V314 HydrophobicContact CG2-CG1 3.5Å
159	R	87.8	Confident	78.6	Confident	66 Å²	66	65.2 Å²	65.2	25%	0.249	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137	174.6	176.3	176.8	-175.5	174.6	-1.2	109.6	L151 E152	L151-R159 CarbonylContact C-O 3.53Å; L151-R159 VanDerWaalsContact CA-O 3.28Å; L151-R159 WeakPolarHBondContact CA-O 3.48Å; L151-R159 WeakPolarHBondContact CB-O 3.45Å; E152-R159 HydrophobicContact CB-CB 4.37Å; E152-R159 PolarHBondContact N-O 3.03Å; E152-R159 PolarHBondContact O-N 3.08Å
160	D	90.8	Very high	77	Confident	17 Å²	17	71.1 Å²	71.1	9%	0.091	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	130.9	169.3	-166	-41.2	0	0	0	110.2	L162 R163 L172 L187 S188	D160-L162 PolarHBondContact OD1-N 2.82Å; D160-R163 HydrophobicContact CB-CB 4.02Å; D160-R163 PolarHBondContact OD1-N 3Å; D160-L172 HydrophobicContact CB-CD1 4.03Å; D160-L187 HydrophobicContact CB-CD1 4.32Å; D160-S188 PolarHBondContact OD1-OG 3.11Å; D160-S188 WeakPolarHBondContact OD2-CB 3.15Å; D160-S188 PolarHBondContact OD2-N 3.3Å; D160-S188 PolarHBondContact OD2-OG 2.82Å
161	L	89.8	Confident	75.9	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	35%	0.346	C	S	.	.	S	Bend	trans	-96.2	-13.7	178.2	-65.8	177.8	0	0	0	113.7	Y150 E152 N208 R209	Y150-L161 HydrophobicContact CD1-CB 4.18Å; Y150-L161 HydrophobicContact CD1-CD1 3.87Å; Y150-L161 HydrophobicContact CD2-CD1 3.95Å; Y150-L161 HydrophobicContact CE1-CD1 3.89Å; Y150-L161 HydrophobicContact CE2-CD1 4.02Å; Y150-L161 HydrophobicContact CG-CB 4.22Å; Y150-L161 HydrophobicContact CG-CD1 3.88Å; Y150-L161 WeakPolarHBondContact O-CB 3.43Å; Y150-L161 PolarHBondContact O-N 2.7Å; E152-L161 HydrophobicContact CB-CD1 4.13Å; E152-L161 HydrophobicContact CB-CD2 3.92Å; E152-L161 HydrophobicContact CB-CG 4.04Å; L161-N208 HydrophobicContact CD2-CB 4.29Å; L161-N208 PolarHBondContact O-ND2 2.93Å; L161-R209 HydrophobicContact CD1-CB 4.36Å; L161-R209 HydrophobicContact CD2-CB 4.18Å
162	L	88.7	Confident	75.6	Confident	11 Å²	11	75.4 Å²	75.4	6%	0.058	35%	0.35	C	S	.	.	S	Bend	trans	-104.5	-21.8	-176.9	-53.2	-176	0	0	0	113.2	Y150 D160 R164 H190 L201	Y150-L162 HydrophobicContact CD1-CD2 4.37Å; D160-L162 PolarHBondContact OD1-N 2.82Å; L162-R164 PolarHBondContact O-N 3.17Å; L162-R164 VanDerWaalsContact O-N 3.16Å; L162-H190 WeakPolarHBondContact CB-NE2 3.18Å; L162-L201 HydrophobicContact CD1-CD2 4.47Å; L162-L201 HydrophobicContact CD2-CB 4.16Å; L162-L201 HydrophobicContact CD2-CD2 4.38Å; L162-L201 WeakPolarHBondContact CD2-O 3.18Å
163	R	82.4	Confident	75.5	Confident	99 Å²	99	83.8 Å²	83.8	37%	0.374	38%	0.382	S	S	.	.	S	Bend	trans	-57.5	118.4	178.2	-177.5	177.8	-77.4	-156.9	-3.3	111.9	D160 D186	D160-R163 HydrophobicContact CB-CB 4.02Å; D160-R163 PolarHBondContact OD1-N 3Å; R163-D186 PolarHBondContact NH2-O 3.48Å
164	R	68	Low	75.5	Confident	222 Å²	222	84.7 Å²	84.7	84%	0.838	39%	0.387	S	S	*	.			trans	-59.2	147.6	173.5	-58.9	-175.5	-170	173.8	4.5	110.7	L162 S166	L162-R164 PolarHBondContact O-N 3.17Å; L162-R164 VanDerWaalsContact O-N 3.16Å; R164-S166 PolarHBondContact O-N 2.68Å
165	K	59.7	Low	75.6	Confident	202 Å²	202	86.6 Å²	86.6	88%	0.878	39%	0.394	S	S	*	.	S	Bend	trans	-65.5	88.9	-167.8	-67.6	175.1	-179.8	170.1	0	114
166	S	40.9	Very low	75.7	Confident	89 Å²	89	87 Å²	87	62%	0.622	39%	0.394	S	S	*	.			trans	-144.6	134.8	160.3	69.9	0	0	0	0	113.5	R164	R164-S166 PolarHBondContact O-N 2.68Å
167	S	44.8	Very low	75.3	Confident	85 Å²	85	89 Å²	89	59%	0.594	40%	0.403	S	S	*	.	S	Bend	trans	64.7	146.2	-176.8	88.3	0	0	0	0	117.6	T169	S167-T169 VanDerWaalsContact C-N 3.33Å; S167-T169 PolarHBondContact O-N 2.95Å; S167-T169 PolarHBondContact OG-OG1 2.84Å
168	H	47.7	Very low	74.7	Confident	164 Å²	164	88.7 Å²	88.7	76%	0.759	42%	0.419	S	S	*	.			trans	-88.1	35.7	-169.1	-65.5	5.9	0	0	0	114.8	Y170	H168-Y170 VanDerWaalsContact C-N 3.32Å; H168-Y170 HydrophobicContact CB-CD2 4.34Å; H168-Y170 HydrophobicContact CB-CE2 4.04Å; H168-Y170 WeakPolarHBondContact O-CD2 3.36Å; H168-Y170 PolarHBondContact O-N 3.39Å
169	T	52.3	Low	73.7	Confident	89 Å²	89	96.9 Å²	96.9	55%	0.546	45%	0.454	S	S	.	.			trans	-86.7	60.2	-174.4	43.3	0	0	0	0	113.5	S167 N171	S167-T169 VanDerWaalsContact C-N 3.33Å; S167-T169 PolarHBondContact O-N 2.95Å; S167-T169 PolarHBondContact OG-OG1 2.84Å; T169-N171 PolarHBondContact O-N 3.14Å
170	Y	61.7	Low	72.8	Confident	130 Å²	130	98.5 Å²	98.5	51%	0.51	47%	0.468	S	S	.	.			trans	-69.4	26.7	-176	-63.9	-76	0	0	0	116.9	H168	H168-Y170 VanDerWaalsContact C-N 3.32Å; H168-Y170 HydrophobicContact CB-CD2 4.34Å; H168-Y170 HydrophobicContact CB-CE2 4.04Å; H168-Y170 WeakPolarHBondContact O-CD2 3.36Å; H168-Y170 PolarHBondContact O-N 3.39Å
171	N	71.9	Confident	72.2	Confident	76 Å²	76	98.1 Å²	98.1	41%	0.406	47%	0.468	S	S	.	.			trans	-149.4	90	176.8	-50.8	-87.6	0	0	0	110.7	R157 V158 T169	R157-N171 WeakPolarHBondContact CB-OD1 3.27Å; R157-N171 WeakPolarHBondContact CD-OD1 3.29Å; R157-N171 WeakPolarHBondContact CG-OD1 3.25Å; R157-N171 PolarHBondContact NE-OD1 3.03Å; R157-N171 PolarHBondContact NH1-ND2 3.05Å; R157-N171 PolarHBondContact NH1-OD1 3.39Å; V158-N171 WeakPolarHBondContact O-CA 3.37Å; T169-N171 PolarHBondContact O-N 3.14Å
172	L	86.8	Confident	72.1	Confident	22 Å²	22	98.5 Å²	98.5	12%	0.115	47%	0.47	C	S	.	.	B	Isolated β-bridge	trans	-68.7	150.7	167.8	-59.1	-172.8	0	0	0	110.2	V158 D160 V184 D186 L187	V158-L172 HydrophobicContact CB-CB 4.11Å; V158-L172 HydrophobicContact CG1-CB 4.12Å; V158-L172 PolarHBondContact O-N 3.2Å; D160-L172 HydrophobicContact CB-CD1 4.03Å; L172-V184 HydrophobicContact CB-CG1 3.44Å; L172-V184 VanDerWaalsContact CB-CG1 3.44Å; L172-V184 HydrophobicContact CD1-CG1 3.67Å; L172-V184 HydrophobicContact CG-CG1 4.22Å; L172-D186 HydrophobicContact CD2-CB 4.14Å; L172-L187 HydrophobicContact CD1-CB 4.02Å; L172-L187 HydrophobicContact CD1-CD1 3.97Å
173	R	88.6	Confident	72.1	Confident	180 Å²	180	102.5 Å²	102.5	68%	0.679	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-101.8	135	-176.2	-67.7	179.9	174.9	-171.8	-0.8	110.6	E185	R173-E185 HydrophobicContact CB-CB 4.4Å; R173-E185 WeakPolarHBondContact O-CB 3.42Å; R173-E185 PolarHBondContact O-N 3.16Å
174	V	90.4	Very high	72.5	Confident	21 Å²	21	98.6 Å²	98.6	13%	0.127	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	131.2	167	-174.2	0	0	0	0	109	V158 P182 Y183 V184 V314 W317 L318	V158-V174 HydrophobicContact CG2-CG2 3.96Å; V174-P182 HydrophobicContact CG1-CB 4.41Å; V174-Y183 WeakPolarHBondContact CA-O 3.13Å; V174-V184 HydrophobicContact CG2-CG2 4.41Å; V174-V314 HydrophobicContact CG2-CG1 3.93Å; V174-W317 HydrophobicContact CB-CE3 3.74Å; V174-W317 HydrophobicContact CB-CH2 4.46Å; V174-W317 HydrophobicContact CB-CZ3 3.7Å; V174-W317 HydrophobicContact CG1-CD2 3.75Å; V174-W317 HydrophobicContact CG1-CE3 3.45Å; V174-W317 VanDerWaalsContact CG1-CE3 3.45Å; V174-W317 HydrophobicContact CG1-CG 4.34Å; V174-W317 HydrophobicContact CG1-CH2 4.23Å; V174-W317 HydrophobicContact CG1-CZ2 4.49Å; V174-W317 HydrophobicContact CG1-CZ3 3.71Å; V174-W317 WeakPolarHBondContact O-CH2 3.33Å; V174-W317 WeakPolarHBondContact O-CZ3 3.18Å; V174-L318 HydrophobicContact CG1-CD2 3.83Å; V174-L318 HydrophobicContact CG1-CG 4.27Å; V174-L318 HydrophobicContact CG2-CD1 4.17Å; V174-L318 HydrophobicContact CG2-CD2 4.08Å; V174-L318 HydrophobicContact CG2-CG 4.11Å
175	R	89.1	Confident	73.5	Confident	123 Å²	123	90.2 Å²	90.2	46%	0.464	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	173	174.1	-54.5	-170.6	79.5	176.1	-0.1	108.1	P182 Y183 E185	R175-P182 CarbonylContact O-C 3.5Å; R175-P182 VanDerWaalsContact O-CA 3.3Å; R175-P182 WeakPolarHBondContact O-CA 3.2Å; R175-Y183 HydrophobicContact CB-CD1 4.47Å; R175-Y183 HydrophobicContact CB-CE1 3.86Å; R175-Y183 HydrophobicContact CB-CE2 4.26Å; R175-Y183 PolarHBondContact N-O 2.91Å; R175-Y183 PolarHBondContact O-N 3.29Å; R175-Y183 VanDerWaalsContact O-O 3.13Å; R175-E185 VanDerWaalsContact CD-CD 3.48Å; R175-E185 VanDerWaalsContact CD-OE1 3.25Å; R175-E185 WeakPolarHBondContact CD-OE1 3.37Å; R175-E185 HydrophobicContact CG-CB 4.34Å; R175-E185 IonicContact CZ-OE1 2.82Å; R175-E185 IonicContact NE-OE1 3.74Å; R175-E185 IonicContact NH1-OE1 3.84Å; R175-E185 PolarHBondContact NH1-OE1 3.34Å
176	E	84.9	Confident	74.7	Confident	57 Å²	57	86.1 Å²	86.1	27%	0.266	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	122.8	-178.2	-172.3	167.3	-175	0	0	109.1	G181 R311 W317 K320	E176-G181 WeakPolarHBondContact CA-O 3.41Å; E176-R311 IonicContact OE2-CZ 2.65Å; E176-R311 IonicContact OE2-NE 2.65Å; E176-R311 PolarHBondContact OE2-NE 3.33Å; E176-R311 IonicContact OE2-NH2 2.92Å; E176-R311 PolarHBondContact OE2-NH2 2.8Å; E176-W317 HydrophobicContact CB-CZ2 3.97Å; E176-W317 PolarHBondContact OE2-NE1 2.69Å; E176-K320 IonicContact OE1-NZ 3.29Å; E176-K320 PolarHBondContact OE1-NZ 2.9Å
177	H	78.8	Confident	77.1	Confident	80 Å²	80	83.4 Å²	83.4	37%	0.37	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	140.8	176.5	-170.1	-122.3	0	0	0	109.7	K179 D180 G181 Y183	H177-K179 PolarHBondContact O-N 3.26Å; H177-K179 VanDerWaalsContact O-N 3.15Å; H177-D180 HydrophobicContact CB-CB 4.33Å; H177-D180 IonicContact CE1-OD2 2.72Å; H177-D180 PolarHBondContact CE1-OD2 3.26Å; H177-D180 IonicContact CG-OD2 2.71Å; H177-D180 IonicContact ND1-OD2 3.17Å; H177-D180 PolarHBondContact ND1-OD2 2.95Å; H177-G181 PolarHBondContact N-O 2.87Å; H177-G181 PolarHBondContact O-N 3.44Å; H177-Y183 HydrophobicContact CB-CD1 4.05Å; H177-Y183 HydrophobicContact CB-CE1 3.91Å
178	P	73.2	Confident	79.1	Confident	128 Å²	128	80.4 Å²	80.4	83%	0.831	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.5	-177.6	-27.3	37.1	0	0	0	115.4
179	K	68.7	Low	81	Confident	173 Å²	173	78.8 Å²	78.8	75%	0.752	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-48.8	176.7	-67.4	-173.9	176.8	-176.6	0	113.1	H177	H177-K179 PolarHBondContact O-N 3.26Å; H177-K179 VanDerWaalsContact O-N 3.15Å
180	D	68.8	Low	82.6	Confident	101 Å²	101	76.9 Å²	76.9	54%	0.54	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	4.4	-166.5	-47.9	-55.6	0	0	0	114.3	H177	H177-D180 HydrophobicContact CB-CB 4.33Å; H177-D180 IonicContact CE1-OD2 2.72Å; H177-D180 PolarHBondContact CE1-OD2 3.26Å; H177-D180 IonicContact CG-OD2 2.71Å; H177-D180 IonicContact ND1-OD2 3.17Å; H177-D180 PolarHBondContact ND1-OD2 2.95Å
181	G	80	Confident	83.7	Confident	9 Å²	9	73.5 Å²	73.5	9%	0.093	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73	-155.6	177.5	0	0	0	0	0	113.4	E176 H177	E176-G181 WeakPolarHBondContact CA-O 3.41Å; H177-G181 PolarHBondContact N-O 2.87Å; H177-G181 PolarHBondContact O-N 3.44Å
182	P	86.4	Confident	84.3	Confident	7 Å²	7	70.1 Å²	70.1	5%	0.045	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.5	-179.7	22.6	-20.7	0	0	0	111.9	V174 R175 W317 K320	V174-P182 HydrophobicContact CG1-CB 4.41Å; R175-P182 CarbonylContact O-C 3.5Å; R175-P182 VanDerWaalsContact O-CA 3.3Å; R175-P182 WeakPolarHBondContact O-CA 3.2Å; P182-W317 HydrophobicContact CB-CG 4.42Å; P182-W317 WeakPolarHBondContact CB-O 3.44Å; P182-W317 WeakPolarHBondContact CG-O 3.36Å; P182-K320 HydrophobicContact CG-CB 4.06Å
183	Y	89.4	Confident	84.1	Confident	96 Å²	96	74 Å²	74	38%	0.376	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	163.4	179.4	73.3	-86.7	0	0	0	111.3	V174 R175 H177	V174-Y183 WeakPolarHBondContact CA-O 3.13Å; R175-Y183 HydrophobicContact CB-CD1 4.47Å; R175-Y183 HydrophobicContact CB-CE1 3.86Å; R175-Y183 HydrophobicContact CB-CE2 4.26Å; R175-Y183 PolarHBondContact N-O 2.91Å; R175-Y183 PolarHBondContact O-N 3.29Å; R175-Y183 VanDerWaalsContact O-O 3.13Å; H177-Y183 HydrophobicContact CB-CD1 4.05Å; H177-Y183 HydrophobicContact CB-CE1 3.91Å
184	V	91.2	Very high	83.9	Confident	16 Å²	16	69 Å²	69	10%	0.097	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	120.8	176	-176.7	0	0	0	0	109.1	L151 V158 L172 V174 L187 L318	L151-V184 HydrophobicContact CD2-CG2 4.04Å; V158-V184 HydrophobicContact CB-CG1 4.5Å; V158-V184 HydrophobicContact CG1-CG1 3.82Å; V158-V184 HydrophobicContact CG1-CG2 4.2Å; L172-V184 HydrophobicContact CB-CG1 3.44Å; L172-V184 VanDerWaalsContact CB-CG1 3.44Å; L172-V184 HydrophobicContact CD1-CG1 3.67Å; L172-V184 HydrophobicContact CG-CG1 4.22Å; V174-V184 HydrophobicContact CG2-CG2 4.41Å; V184-L187 HydrophobicContact CB-CB 3.91Å; V184-L187 HydrophobicContact CB-CD2 4.15Å; V184-L187 HydrophobicContact CG1-CB 3.9Å; V184-L318 HydrophobicContact CG2-CD1 4.13Å; V184-L318 HydrophobicContact CG2-CD2 3.7Å
185	E	87.8	Confident	83.9	Confident	46 Å²	46	70.3 Å²	70.3	22%	0.215	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	136.9	173.5	-178.1	169.1	-116	0	0	110.3	R173 R175 L187	R173-E185 HydrophobicContact CB-CB 4.4Å; R173-E185 WeakPolarHBondContact O-CB 3.42Å; R173-E185 PolarHBondContact O-N 3.16Å; R175-E185 VanDerWaalsContact CD-CD 3.48Å; R175-E185 VanDerWaalsContact CD-OE1 3.25Å; R175-E185 WeakPolarHBondContact CD-OE1 3.37Å; R175-E185 HydrophobicContact CG-CB 4.34Å; R175-E185 IonicContact CZ-OE1 2.82Å; R175-E185 IonicContact NE-OE1 3.74Å; R175-E185 IonicContact NH1-OE1 3.84Å; R175-E185 PolarHBondContact NH1-OE1 3.34Å; E185-L187 PolarHBondContact O-N 2.81Å; E185-L187 VanDerWaalsContact O-N 3.17Å
186	D	86.4	Confident	84	Confident	116 Å²	116	65.6 Å²	65.6	62%	0.62	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	16.8	-179.1	-51.6	-31.6	0	0	0	116.8	R163 L172 S188	R163-D186 PolarHBondContact NH2-O 3.48Å; L172-D186 HydrophobicContact CD2-CB 4.14Å; D186-S188 PolarHBondContact O-N 2.76Å
187	L	89.8	Confident	84.1	Confident	33 Å²	33	65.2 Å²	65.2	17%	0.173	33%	0.333	C	S	.	.			trans	-66.6	128.1	172.3	-179.3	66.6	0	0	0	110.7	L151 D160 L172 V184 E185	L151-L187 HydrophobicContact CB-CD1 3.99Å; L151-L187 HydrophobicContact CD2-CD1 4.36Å; L151-L187 HydrophobicContact CD2-CD2 3.8Å; D160-L187 HydrophobicContact CB-CD1 4.32Å; L172-L187 HydrophobicContact CD1-CB 4.02Å; L172-L187 HydrophobicContact CD1-CD1 3.97Å; V184-L187 HydrophobicContact CB-CB 3.91Å; V184-L187 HydrophobicContact CB-CD2 4.15Å; V184-L187 HydrophobicContact CG1-CB 3.9Å; E185-L187 PolarHBondContact O-N 2.81Å; E185-L187 VanDerWaalsContact O-N 3.17Å
188	S	87.3	Confident	84.7	Confident	21 Å²	21	61.5 Å²	61.5	15%	0.147	32%	0.315	C	S	.	.			trans	-64.3	139.6	175.8	63.7	0	0	0	0	111.6	S149 D160 D186 H190	S149-S188 WeakPolarHBondContact CB-O 3.31Å; D160-S188 PolarHBondContact OD1-OG 3.11Å; D160-S188 WeakPolarHBondContact OD2-CB 3.15Å; D160-S188 PolarHBondContact OD2-N 3.3Å; D160-S188 PolarHBondContact OD2-OG 2.82Å; D186-S188 PolarHBondContact O-N 2.76Å; S188-H190 PolarHBondContact OG-NE2 2.82Å
189	K	87.4	Confident	85.6	Confident	131 Å²	131	59.4 Å²	59.4	57%	0.57	29%	0.294	S	S	*	.			trans	-123.4	127.4	170.3	-59.3	-174	-174.9	-179.1	0	107.2	E147 V148	E147-K189 VanDerWaalsContact OE2-CD 3.29Å; E147-K189 WeakPolarHBondContact OE2-CD 3.45Å; E147-K189 IonicContact OE2-NZ 3.11Å; V148-K189 WeakPolarHBondContact O-CA 3.41Å
190	H	85.5	Confident	86.6	Confident	48 Å²	48	58.1 Å²	58.1	22%	0.222	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	121.7	-177.6	-70.4	-100.8	0	0	0	108.8	E147 V148 L162 S188 L201	E147-H190 CarbonylContact C-O 3.5Å; E147-H190 WeakPolarHBondContact CA-O 3.25Å; V148-H190 HydrophobicContact CG2-CB 4.16Å; V148-H190 PolarHBondContact N-O 2.58Å; V148-H190 PolarHBondContact O-N 3.03Å; L162-H190 WeakPolarHBondContact CB-NE2 3.18Å; S188-H190 PolarHBondContact OG-NE2 2.82Å; H190-L201 HydrophobicContact CB-CD1 3.61Å; H190-L201 HydrophobicContact CB-CD2 4.47Å
191	L	85.1	Confident	87.7	Confident	60 Å²	60	54.9 Å²	54.9	31%	0.314	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	135.9	170.9	-175.1	69.5	0	0	0	108.9	R145 L433	R145-L191 HydrophobicContact CG-CD1 3.95Å; L191-L433 HydrophobicContact CD1-CD2 4.32Å; L191-L433 HydrophobicContact CD2-CD2 4.45Å
192	V	84.6	Confident	88.2	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.03	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	139.7	-178.4	-73.1	0	0	0	0	110.4	F130 T146 V148 D197 V198 L201	F130-V192 HydrophobicContact CE2-CG2 4.47Å; F130-V192 HydrophobicContact CZ-CB 4.29Å; F130-V192 HydrophobicContact CZ-CG2 3.93Å; T146-V192 HydrophobicContact CG2-CG2 3.73Å; T146-V192 WeakPolarHBondContact O-CG2 3.4Å; T146-V192 PolarHBondContact O-N 3.37Å; V148-V192 HydrophobicContact CG1-CG2 3.85Å; V148-V192 HydrophobicContact CG2-CG1 3.8Å; V148-V192 HydrophobicContact CG2-CG2 4.28Å; V192-D197 HydrophobicContact CB-CB 4.04Å; V192-D197 HydrophobicContact CG1-CB 3.76Å; V192-V198 HydrophobicContact CB-CG2 3.78Å; V192-V198 HydrophobicContact CG1-CG2 3.84Å; V192-V198 HydrophobicContact CG2-CG2 3.68Å; V192-L201 HydrophobicContact CG1-CD1 3.64Å
193	Q	81.9	Confident	88.3	Confident	102 Å²	102	60.1 Å²	60.1	48%	0.477	30%	0.295	S	S	.	.	S	Bend	trans	-114.6	-27.6	-170.9	-53.8	-167.5	-5.7	0	0	112.5	F130 D197 T437	F130-Q193 WeakPolarHBondContact CD1-O 3.22Å; F130-Q193 VanDerWaalsContact CE1-O 3.22Å; F130-Q193 WeakPolarHBondContact CE1-O 3.47Å; Q193-D197 WeakPolarHBondContact CA-OD2 3.27Å; Q193-D197 PolarHBondContact N-OD2 2.82Å; Q193-T437 VanDerWaalsContact NE2-CG2 3.28Å; Q193-T437 PolarHBondContact NE2-OG1 3.44Å
194	N	85.1	Confident	88.2	Confident	75 Å²	75	57.6 Å²	57.6	40%	0.401	29%	0.294	S	S	.	.	S	Bend	trans	-139.6	171.9	177.1	69.2	82.6	0	0	0	111.4	G196 D197	N194-G196 VanDerWaalsContact C-N 3.32Å; N194-G196 PolarHBondContact O-N 3.21Å; N194-G196 VanDerWaalsContact OD1-CA 3.25Å; N194-G196 WeakPolarHBondContact OD1-CA 3.13Å; N194-G196 PolarHBondContact OD1-N 2.92Å; N194-D197 PolarHBondContact N-OD2 2.69Å; N194-D197 PolarHBondContact ND2-OD1 3.45Å; N194-D197 PolarHBondContact ND2-OD2 3.32Å; N194-D197 PolarHBondContact O-N 2.83Å; N194-D197 PolarHBondContact OD1-N 3.07Å
195	Y	91.3	Very high	88.1	Confident	49 Å²	49	56.8 Å²	56.8	19%	0.192	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-33.8	179.3	170.2	-100.9	0	0	0	113.1	P123 C126 E127 D197 V198 E199	P123-Y195 HydrophobicContact CB-CE2 4.41Å; P123-Y195 WeakPolarHBondContact CB-OH 3.35Å; P123-Y195 WeakPolarHBondContact O-CE2 3.48Å; C126-Y195 HydrophobicContact CB-CD2 3.83Å; C126-Y195 HydrophobicContact CB-CE2 3.98Å; E127-Y195 HydrophobicContact CB-CD2 3.88Å; E127-Y195 HydrophobicContact CB-CE2 4.06Å; E127-Y195 HydrophobicContact CB-CG 4.27Å; E127-Y195 VanDerWaalsContact N-CD2 3.34Å; Y195-D197 PolarHBondContact O-N 3.42Å; Y195-V198 WeakPolarHBondContact O-CB 3.34Å; Y195-V198 PolarHBondContact O-N 2.86Å; Y195-V198 VanDerWaalsContact O-N 3.13Å; Y195-E199 HydrophobicContact CE1-CB 4.12Å; Y195-E199 VanDerWaalsContact CE1-CD 3.49Å; Y195-E199 HydrophobicContact CE1-CG 4.35Å; Y195-E199 VanDerWaalsContact CE1-OE1 3.29Å; Y195-E199 WeakPolarHBondContact CE1-OE1 3.45Å; Y195-E199 VanDerWaalsContact CZ-OE1 3.32Å; Y195-E199 PolarHBondContact O-N 3.27Å; Y195-E199 PolarHBondContact OH-OE1 3.36Å
196	G	89.7	Confident	88	Confident	25 Å²	25	56.6 Å²	56.6	26%	0.258	29%	0.29	S	S	.	.	H	α-helix	trans	-61.6	-42.9	177.8	0	0	0	0	0	112.7	N194 V198 E199 E200	N194-G196 VanDerWaalsContact C-N 3.32Å; N194-G196 PolarHBondContact O-N 3.21Å; N194-G196 VanDerWaalsContact OD1-CA 3.25Å; N194-G196 WeakPolarHBondContact OD1-CA 3.13Å; N194-G196 PolarHBondContact OD1-N 2.92Å; G196-V198 PolarHBondContact O-N 3.08Å; G196-E199 PolarHBondContact O-N 3.08Å; G196-E199 VanDerWaalsContact O-N 3.11Å; G196-E200 PolarHBondContact O-N 3.03Å
197	D	88.4	Confident	87.8	Confident	49 Å²	49	55.8 Å²	55.8	26%	0.262	29%	0.285	S	S	.	.	H	α-helix	trans	-57.4	-37.4	174.8	-44.9	-29.7	0	0	0	111.5	V192 Q193 N194 Y195 L201	V192-D197 HydrophobicContact CB-CB 4.04Å; V192-D197 HydrophobicContact CG1-CB 3.76Å; Q193-D197 WeakPolarHBondContact CA-OD2 3.27Å; Q193-D197 PolarHBondContact N-OD2 2.82Å; N194-D197 PolarHBondContact N-OD2 2.69Å; N194-D197 PolarHBondContact ND2-OD1 3.45Å; N194-D197 PolarHBondContact ND2-OD2 3.32Å; N194-D197 PolarHBondContact O-N 2.83Å; N194-D197 PolarHBondContact OD1-N 3.07Å; Y195-D197 PolarHBondContact O-N 3.42Å; D197-L201 WeakPolarHBondContact O-CD1 3.45Å; D197-L201 VanDerWaalsContact O-CG 3.27Å; D197-L201 WeakPolarHBondContact O-CG 3.25Å; D197-L201 PolarHBondContact O-N 2.97Å
198	V	91.1	Very high	87.4	Confident	1 Å²	1	56 Å²	56	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-73.4	-41.1	177.3	173.8	0	0	0	0	111.5	C126 F130 V148 V192 Y195 G196 L201 M202 F227	C126-V198 HydrophobicContact CB-CG1 3.9Å; F130-V198 HydrophobicContact CE2-CG2 3.74Å; F130-V198 HydrophobicContact CZ-CG2 4.36Å; V148-V198 HydrophobicContact CG1-CG2 4.05Å; V192-V198 HydrophobicContact CB-CG2 3.78Å; V192-V198 HydrophobicContact CG1-CG2 3.84Å; V192-V198 HydrophobicContact CG2-CG2 3.68Å; Y195-V198 WeakPolarHBondContact O-CB 3.34Å; Y195-V198 PolarHBondContact O-N 2.86Å; Y195-V198 VanDerWaalsContact O-N 3.13Å; G196-V198 PolarHBondContact O-N 3.08Å; V198-L201 PolarHBondContact O-N 3.46Å; V198-M202 HydrophobicContact CG1-CG 4.14Å; V198-M202 HydrophobicContact CG1-SD 3.65Å; V198-M202 WeakPolarHBondContact O-CB 3.49Å; V198-M202 VanDerWaalsContact O-CG 3.25Å; V198-M202 WeakPolarHBondContact O-CG 3.44Å; V198-M202 PolarHBondContact O-N 3.45Å; V198-F227 HydrophobicContact CG1-CE1 4.45Å; V198-F227 HydrophobicContact CG1-CZ 3.85Å
199	E	90.9	Very high	87.2	Confident	84 Å²	84	55.6 Å²	55.6	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-60.5	-47.5	177.2	-170.5	161.3	-113.6	0	0	110.9	Y195 G196 L201 M202 E203	Y195-E199 HydrophobicContact CE1-CB 4.12Å; Y195-E199 VanDerWaalsContact CE1-CD 3.49Å; Y195-E199 HydrophobicContact CE1-CG 4.35Å; Y195-E199 VanDerWaalsContact CE1-OE1 3.29Å; Y195-E199 WeakPolarHBondContact CE1-OE1 3.45Å; Y195-E199 VanDerWaalsContact CZ-OE1 3.32Å; Y195-E199 PolarHBondContact O-N 3.27Å; Y195-E199 PolarHBondContact OH-OE1 3.36Å; G196-E199 PolarHBondContact O-N 3.08Å; G196-E199 VanDerWaalsContact O-N 3.11Å; E199-L201 PolarHBondContact O-N 2.8Å; E199-M202 PolarHBondContact O-N 2.85Å; E199-E203 WeakPolarHBondContact O-CG 3.42Å; E199-E203 PolarHBondContact O-N 2.8Å
200	E	90.4	Very high	86.1	Confident	146 Å²	146	53.6 Å²	53.6	68%	0.682	28%	0.28	S	S	*	.	H	α-helix	trans	-57.7	-44.6	174.2	-72.1	-173.1	-172	0	0	112.6	G196 E203 A204	G196-E200 PolarHBondContact O-N 3.03Å; E200-E203 PolarHBondContact O-N 3.38Å; E200-A204 VanDerWaalsContact O-CB 3.3Å; E200-A204 WeakPolarHBondContact O-CB 3.42Å; E200-A204 PolarHBondContact O-N 3.49Å
201	L	91.6	Very high	84.6	Confident	33 Å²	33	55.8 Å²	55.8	17%	0.173	30%	0.297	C	S	.	.	H	α-helix	trans	-68.5	-36.7	177.7	-71.3	170.4	0	0	0	112.3	V148 L162 H190 V192 D197 V198 E199 G205	V148-L201 HydrophobicContact CG2-CD1 3.55Å; L162-L201 HydrophobicContact CD1-CD2 4.47Å; L162-L201 HydrophobicContact CD2-CB 4.16Å; L162-L201 HydrophobicContact CD2-CD2 4.38Å; L162-L201 WeakPolarHBondContact CD2-O 3.18Å; H190-L201 HydrophobicContact CB-CD1 3.61Å; H190-L201 HydrophobicContact CB-CD2 4.47Å; V192-L201 HydrophobicContact CG1-CD1 3.64Å; D197-L201 WeakPolarHBondContact O-CD1 3.45Å; D197-L201 VanDerWaalsContact O-CG 3.27Å; D197-L201 WeakPolarHBondContact O-CG 3.25Å; D197-L201 PolarHBondContact O-N 2.97Å; V198-L201 PolarHBondContact O-N 3.46Å; E199-L201 PolarHBondContact O-N 2.8Å; L201-G205 PolarHBondContact O-N 2.82Å
202	M	90.9	Very high	83	Confident	7 Å²	7	54.7 Å²	54.7	3%	0.034	30%	0.296	C	S	.	.	H	α-helix	trans	-65.3	-45.5	174.3	-77.4	174.2	52	0	0	111.3	M113 I122 P123 V198 E199 G205 N206 F227	M113-M202 HydrophobicContact CE-CE 4.07Å; M113-M202 HydrophobicContact SD-CE 3.42Å; M113-M202 WeakPolarHBondContact SD-CE 3.32Å; I122-M202 HydrophobicContact CB-CE 4.13Å; I122-M202 HydrophobicContact CG2-CE 3.51Å; I122-M202 HydrophobicContact CG2-SD 3.73Å; P123-M202 HydrophobicContact CB-CE 4.45Å; P123-M202 HydrophobicContact CG-CE 3.87Å; V198-M202 HydrophobicContact CG1-CG 4.14Å; V198-M202 HydrophobicContact CG1-SD 3.65Å; V198-M202 WeakPolarHBondContact O-CB 3.49Å; V198-M202 VanDerWaalsContact O-CG 3.25Å; V198-M202 WeakPolarHBondContact O-CG 3.44Å; V198-M202 PolarHBondContact O-N 3.45Å; E199-M202 PolarHBondContact O-N 2.85Å; M202-G205 PolarHBondContact O-N 2.94Å; M202-N206 WeakPolarHBondContact O-CB 3.5Å; M202-N206 PolarHBondContact O-N 3.27Å; M202-N206 PolarHBondContact O-ND2 3.45Å; M202-N206 VanDerWaalsContact O-ND2 3.09Å; M202-F227 HydrophobicContact CG-CD2 4.24Å; M202-F227 HydrophobicContact CG-CE2 3.65Å; M202-F227 HydrophobicContact CG-CZ 3.92Å; M202-F227 HydrophobicContact SD-CE2 4.46Å; M202-F227 HydrophobicContact SD-CZ 4.2Å
203	E	88.7	Confident	81.3	Confident	119 Å²	119	56.7 Å²	56.7	56%	0.556	31%	0.311	S	S	*	.	H	α-helix	trans	-61.4	-49.6	174.9	-72.6	-164.2	162.1	0	0	111.7	E199 E200 G205 N206 I207	E199-E203 WeakPolarHBondContact O-CG 3.42Å; E199-E203 PolarHBondContact O-N 2.8Å; E200-E203 PolarHBondContact O-N 3.38Å; E203-G205 VanDerWaalsContact C-N 3.3Å; E203-G205 PolarHBondContact O-N 3.46Å; E203-N206 PolarHBondContact O-N 2.77Å; E203-N206 VanDerWaalsContact O-N 3.16Å; E203-I207 VanDerWaalsContact O-CG1 3.29Å; E203-I207 WeakPolarHBondContact O-CG1 3.28Å; E203-I207 PolarHBondContact O-N 3.15Å
204	A	88.2	Confident	79.3	Confident	43 Å²	43	58 Å²	58	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-57.3	-43.1	176.8	0	0	0	0	0	112	E200 I207 N208	E200-A204 VanDerWaalsContact O-CB 3.3Å; E200-A204 WeakPolarHBondContact O-CB 3.42Å; E200-A204 PolarHBondContact O-N 3.49Å; A204-I207 PolarHBondContact O-N 3.37Å; A204-N208 WeakPolarHBondContact O-CB 3.5Å; A204-N208 VanDerWaalsContact O-CG 3.32Å; A204-N208 PolarHBondContact O-N 3.3Å; A204-N208 PolarHBondContact O-ND2 3.36Å
205	G	88	Confident	77.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.5	-39.7	176	0	0	0	0	0	113.6	L201 M202 E203 N208 R209	L201-G205 PolarHBondContact O-N 2.82Å; M202-G205 PolarHBondContact O-N 2.94Å; E203-G205 VanDerWaalsContact C-N 3.3Å; E203-G205 PolarHBondContact O-N 3.46Å; G205-N208 PolarHBondContact O-N 3.4Å; G205-R209 WeakPolarHBondContact O-CB 3.48Å; G205-R209 PolarHBondContact O-N 3.15Å
206	N	85	Confident	74.6	Confident	41 Å²	41	63 Å²	63	22%	0.219	37%	0.371	C	S	.	.	H	α-helix	trans	-64.5	-40.3	174.6	-75.7	-33.4	0	0	0	111.9	M113 Y150 M202 E203 R209 T210	M113-N206 WeakPolarHBondContact CE-ND2 3.44Å; M113-N206 PolarHBondContact SD-ND2 3.22Å; Y150-N206 PolarHBondContact OH-OD1 2.84Å; M202-N206 WeakPolarHBondContact O-CB 3.5Å; M202-N206 PolarHBondContact O-N 3.27Å; M202-N206 PolarHBondContact O-ND2 3.45Å; M202-N206 VanDerWaalsContact O-ND2 3.09Å; E203-N206 PolarHBondContact O-N 2.77Å; E203-N206 VanDerWaalsContact O-N 3.16Å; N206-R209 PolarHBondContact O-N 2.94Å; N206-T210 WeakPolarHBondContact O-CB 3.12Å; N206-T210 PolarHBondContact O-N 3.26Å; N206-T210 PolarHBondContact O-OG1 2.81Å
207	I	83.2	Confident	72.6	Confident	100 Å²	100	64.4 Å²	64.4	51%	0.513	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-42	173.1	-67.3	163.5	0	0	0	110.3	E203 A204 T210 T211	E203-I207 VanDerWaalsContact O-CG1 3.29Å; E203-I207 WeakPolarHBondContact O-CG1 3.28Å; E203-I207 PolarHBondContact O-N 3.15Å; A204-I207 PolarHBondContact O-N 3.37Å; I207-T210 PolarHBondContact O-N 2.85Å; I207-T211 HydrophobicContact CG2-CG2 4.15Å; I207-T211 WeakPolarHBondContact O-CB 3.33Å; I207-T211 WeakPolarHBondContact O-CG2 3.36Å; I207-T211 PolarHBondContact O-N 3.25Å; I207-T211 PolarHBondContact O-OG1 3.44Å
208	N	82.1	Confident	71.1	Confident	36 Å²	36	66.7 Å²	66.7	19%	0.193	39%	0.385	C	S	.	.	H	α-helix	trans	-67.6	-35.7	177.3	-76.4	-29.8	0	0	0	113.2	L161 A204 G205	L161-N208 HydrophobicContact CD2-CB 4.29Å; L161-N208 PolarHBondContact O-ND2 2.93Å; A204-N208 WeakPolarHBondContact O-CB 3.5Å; A204-N208 VanDerWaalsContact O-CG 3.32Å; A204-N208 PolarHBondContact O-N 3.3Å; A204-N208 PolarHBondContact O-ND2 3.36Å; G205-N208 PolarHBondContact O-N 3.4Å
209	R	81.8	Confident	69.4	Low	14 Å²	14	67.6 Å²	67.6	5%	0.053	39%	0.391	C	S	.	.	H	α-helix	trans	-64.5	-40.4	170.7	-170.3	-179.9	-179.5	-164.3	1.4	111	L161 G205 N206 S220 S223 D252	L161-R209 HydrophobicContact CD1-CB 4.36Å; L161-R209 HydrophobicContact CD2-CB 4.18Å; G205-R209 WeakPolarHBondContact O-CB 3.48Å; G205-R209 PolarHBondContact O-N 3.15Å; N206-R209 PolarHBondContact O-N 2.94Å; R209-S220 PolarHBondContact NH2-O 3.28Å; R209-S223 PolarHBondContact NH2-O 3.45Å; R209-S223 VanDerWaalsContact NH2-O 3.09Å; R209-D252 IonicContact CZ-OD2 2.65Å; R209-D252 IonicContact NH1-OD2 2.72Å; R209-D252 PolarHBondContact NH1-OD2 3.47Å; R209-D252 IonicContact NH2-OD2 3.62Å; R209-D252 PolarHBondContact NH2-OD2 2.78Å; R209-D252 VanDerWaalsContact NH2-OD2 3.14Å
210	T	64.7	Low	68.1	Low	89 Å²	89	65.6 Å²	65.6	55%	0.546	39%	0.386	S	S	.	.	H	α-helix	trans	-74.7	-45.9	-177.8	-55	0	0	0	0	112.8	N206 I207 A212 S213	N206-T210 WeakPolarHBondContact O-CB 3.12Å; N206-T210 PolarHBondContact O-N 3.26Å; N206-T210 PolarHBondContact O-OG1 2.81Å; I207-T210 PolarHBondContact O-N 2.85Å; T210-A212 PolarHBondContact O-N 3.44Å; T210-A212 VanDerWaalsContact O-N 3.14Å; T210-S213 VanDerWaalsContact O-CB 3.27Å; T210-S213 WeakPolarHBondContact O-CB 3.15Å; T210-S213 PolarHBondContact O-N 3.12Å; T210-S213 PolarHBondContact O-OG 2.96Å
211	T	53.9	Low	67.1	Low	94 Å²	94	59.7 Å²	59.7	58%	0.577	36%	0.36	S	S	*	.	H	α-helix	trans	-68.8	-10.3	-176.5	49.1	0	0	0	0	114.4	I207 S213	I207-T211 HydrophobicContact CG2-CG2 4.15Å; I207-T211 WeakPolarHBondContact O-CB 3.33Å; I207-T211 WeakPolarHBondContact O-CG2 3.36Å; I207-T211 PolarHBondContact O-N 3.25Å; I207-T211 PolarHBondContact O-OG1 3.44Å; T211-S213 PolarHBondContact O-N 2.77Å
212	A	51.3	Low	66.3	Low	36 Å²	36	59.9 Å²	59.9	30%	0.298	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-12.4	166.8	0	0	0	0	0	113.4	T210 T214	T210-A212 PolarHBondContact O-N 3.44Å; T210-A212 VanDerWaalsContact O-N 3.14Å; A212-T214 PolarHBondContact O-N 3.42Å
213	S	49.2	Very low	66.1	Low	48 Å²	48	59.6 Å²	59.6	34%	0.336	36%	0.357	S	S	.	.			trans	-72.5	103.5	177.2	64.5	0	0	0	0	112.2	T210 T211 G215	T210-S213 VanDerWaalsContact O-CB 3.27Å; T210-S213 WeakPolarHBondContact O-CB 3.15Å; T210-S213 PolarHBondContact O-N 3.12Å; T210-S213 PolarHBondContact O-OG 2.96Å; T211-S213 PolarHBondContact O-N 2.77Å; S213-G215 PolarHBondContact O-N 3.09Å
214	T	39.7	Very low	66.2	Low	130 Å²	130	54 Å²	54	80%	0.798	33%	0.332	S	S	*	.			trans	-75.4	89.6	168.2	35.8	0	0	0	0	110.2	A212 M216	A212-T214 PolarHBondContact O-N 3.42Å; T214-M216 VanDerWaalsContact C-N 3.25Å; T214-M216 PolarHBondContact O-N 2.88Å
215	G	39	Very low	66.4	Low	78 Å²	78	52 Å²	52	80%	0.804	32%	0.315	S	S	*	.	S	Bend	trans	64	-9.9	153.9	0	0	0	0	0	120.2	S213	S213-G215 PolarHBondContact O-N 3.09Å
216	M	38.5	Very low	66.8	Low	150 Å²	150	52.3 Å²	52.3	74%	0.739	32%	0.316	S	S	*	.	S	Bend	trans	-157.4	9.9	-169.1	-125.1	167.5	113.9	0	0	117.8	T214	T214-M216 VanDerWaalsContact C-N 3.25Å; T214-M216 PolarHBondContact O-N 2.88Å
217	N	47.7	Very low	67.4	Low	55 Å²	55	50.4 Å²	50.4	29%	0.294	31%	0.306	S	S	.	.			trans	-144.2	142.4	176.9	-51.4	-73	0	0	0	111.8	V219 R268	N217-V219 PolarHBondContact O-N 2.82Å; N217-V219 VanDerWaalsContact O-N 3.12Å; N217-R268 PolarHBondContact OD1-NH1 2.96Å
218	D	57.1	Low	68	Low	96 Å²	96	46 Å²	46	51%	0.513	28%	0.284	S	S	.	.			trans	-72.7	96.2	167.1	176.8	4.2	0	0	0	109.7	S220 S221	D218-S220 PolarHBondContact O-N 3.4Å; D218-S220 WeakPolarHBondContact OD1-CB 3.22Å; D218-S220 PolarHBondContact OD1-N 2.93Å; D218-S220 VanDerWaalsContact OD1-N 3.1Å; D218-S220 PolarHBondContact OD1-OG 2.85Å; D218-S220 PolarHBondContact OD2-OG 3.19Å; D218-S221 PolarHBondContact O-N 3.11Å; D218-S221 PolarHBondContact O-OG 3.23Å
219	V	55	Low	68.7	Low	21 Å²	21	44.4 Å²	44.4	13%	0.127	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-64.2	-27.9	-178.2	170.5	0	0	0	0	112.2	N217 S221 R222 S223	N217-V219 PolarHBondContact O-N 2.82Å; N217-V219 VanDerWaalsContact O-N 3.12Å; V219-S221 PolarHBondContact O-N 2.87Å; V219-R222 PolarHBondContact O-N 3.13Å; V219-S223 PolarHBondContact O-N 3.4Å; V219-S223 PolarHBondContact O-OG 3.31Å
220	S	63.6	Low	69.3	Low	41 Å²	41	44.9 Å²	44.9	29%	0.287	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-60.1	-33.5	-179.5	77.1	0	0	0	0	112.3	R209 D218 R222	R209-S220 PolarHBondContact NH2-O 3.28Å; D218-S220 PolarHBondContact O-N 3.4Å; D218-S220 WeakPolarHBondContact OD1-CB 3.22Å; D218-S220 PolarHBondContact OD1-N 2.93Å; D218-S220 VanDerWaalsContact OD1-N 3.1Å; D218-S220 PolarHBondContact OD1-OG 2.85Å; D218-S220 PolarHBondContact OD2-OG 3.19Å; S220-R222 VanDerWaalsContact C-N 3.26Å; S220-R222 PolarHBondContact O-N 2.91Å
221	S	69.3	Low	70.6	Confident	22 Å²	22	40.8 Å²	40.8	15%	0.154	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-70	-18.8	175.9	70.4	0	0	0	0	114.5	T104 D218 V219 G255	T104-S221 VanDerWaalsContact CG2-CB 3.44Å; T104-S221 WeakPolarHBondContact OG1-CB 3.19Å; D218-S221 PolarHBondContact O-N 3.11Å; D218-S221 PolarHBondContact O-OG 3.23Å; V219-S221 PolarHBondContact O-N 2.87Å; S221-G255 PolarHBondContact O-N 3.31Å
222	R	75.9	Confident	72.3	Confident	38 Å²	38	37.8 Å²	37.8	14%	0.143	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-114.3	-2.9	-167.6	-56.8	-168.7	98.7	-160.9	-7	113.8	Y154 V219 S220 R268 E271 I275	Y154-R222 HydrophobicContact CE2-CB 4.48Å; V219-R222 PolarHBondContact O-N 3.13Å; S220-R222 VanDerWaalsContact C-N 3.26Å; S220-R222 PolarHBondContact O-N 2.91Å; R222-R268 PolarHBondContact NH2-O 3.5Å; R222-E271 VanDerWaalsContact CZ-CD 3.42Å; R222-E271 IonicContact CZ-OE1 2.66Å; R222-E271 IonicContact CZ-OE2 2.74Å; R222-E271 IonicContact NE-OE1 3.38Å; R222-E271 PolarHBondContact NE-OE1 3.12Å; R222-E271 IonicContact NH1-OE1 3.61Å; R222-E271 PolarHBondContact NH1-OE1 3.41Å; R222-E271 IonicContact NH1-OE2 2.77Å; R222-E271 PolarHBondContact NH1-OE2 3.14Å; R222-E271 IonicContact NH2-OE1 2.65Å; R222-E271 IonicContact NH2-OE2 3.99Å; R222-I275 HydrophobicContact CB-CD1 3.71Å; R222-I275 HydrophobicContact CG-CD1 4.38Å; R222-I275 VanDerWaalsContact O-CD1 3.31Å; R222-I275 WeakPolarHBondContact O-CD1 3.49Å; R222-I275 WeakPolarHBondContact O-CG1 3.47Å
223	S	85.8	Confident	73.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.228	C	C	.	.	S	Bend	trans	-128.8	146.9	176.3	70	0	0	0	0	112.3	E152 R209 V219	E152-S223 WeakPolarHBondContact OE1-CB 3.3Å; E152-S223 PolarHBondContact OE1-OG 3.37Å; R209-S223 PolarHBondContact NH2-O 3.45Å; R209-S223 VanDerWaalsContact NH2-O 3.09Å; V219-S223 PolarHBondContact O-N 3.4Å; V219-S223 PolarHBondContact O-OG 3.31Å
224	H	91.4	Very high	75.2	Confident	3 Å²	3	35.3 Å²	35.3	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	134.4	170.5	-46	-80.9	0	0	0	108.8	E152 I153 D252 L253 A254 S278 L315	E152-H224 CarbonylContact C-O 3.58Å; E152-H224 WeakPolarHBondContact CA-O 3.15Å; I153-H224 HydrophobicContact CB-CB 4.26Å; I153-H224 PolarHBondContact N-O 2.94Å; I153-H224 PolarHBondContact O-N 3.01Å; H224-D252 CarbonylContact C-O 3.58Å; H224-D252 WeakPolarHBondContact CA-O 3.08Å; H224-L253 HydrophobicContact CB-CD2 4.39Å; H224-L253 WeakPolarHBondContact ND1-CA 3.34Å; H224-L253 WeakPolarHBondContact ND1-CD2 3.48Å; H224-A254 VanDerWaalsContact CE1-CB 3.5Å; H224-A254 WeakPolarHBondContact CE1-CB 3.42Å; H224-A254 PolarHBondContact CE1-N 2.75Å; H224-A254 PolarHBondContact ND1-N 2.85Å; H224-S278 PolarHBondContact NE2-OG 2.72Å; H224-L315 HydrophobicContact CB-CD1 4.37Å
225	A	93.3	Very high	76.9	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.4	172.4	0	0	0	0	0	109.7	Y150 L151 V251 D252	Y150-A225 HydrophobicContact CE2-CB 3.77Å; L151-A225 WeakPolarHBondContact O-CA 3.43Å; A225-V251 WeakPolarHBondContact O-CA 3.49Å; A225-D252 HydrophobicContact CB-CB 4.48Å; A225-D252 PolarHBondContact N-O 2.76Å; A225-D252 PolarHBondContact O-N 3.26Å
226	I	95.9	Very high	78.2	Confident	5 Å²	5	34.6 Å²	34.6	3%	0.026	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	106.1	177	-56.1	-176.1	0	0	0	107.7	L151 I153 V251 L315	L151-I226 HydrophobicContact CD1-CB 3.84Å; L151-I226 HydrophobicContact CD1-CD1 4.19Å; L151-I226 HydrophobicContact CD1-CG1 4.07Å; L151-I226 HydrophobicContact CG-CB 3.99Å; L151-I226 PolarHBondContact N-O 2.63Å; L151-I226 VanDerWaalsContact N-O 3.1Å; L151-I226 PolarHBondContact O-N 2.77Å; I153-I226 HydrophobicContact CD1-CD1 3.77Å; I153-I226 HydrophobicContact CD1-CG1 4.48Å; I226-V251 HydrophobicContact CG1-CG1 4.08Å; I226-V251 HydrophobicContact CG1-CG2 4.14Å; I226-V251 HydrophobicContact CG2-CG2 4.2Å; I226-L315 HydrophobicContact CD1-CD1 4.27Å
227	F	96.7	Very high	79.1	Confident	1 Å²	1	31.4 Å²	31.4	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	125.1	167.6	-171.1	-98.9	0	0	0	108.1	I122 V148 Y150 V198 M202 I229 L250	I122-F227 HydrophobicContact CD1-CB 4.49Å; I122-F227 HydrophobicContact CG2-CD1 3.86Å; I122-F227 HydrophobicContact CG2-CE1 4.23Å; I122-F227 HydrophobicContact CG2-CG 4.27Å; V148-F227 HydrophobicContact CB-CE2 4.28Å; V148-F227 HydrophobicContact CB-CZ 3.85Å; V148-F227 HydrophobicContact CG1-CE1 4.23Å; V148-F227 HydrophobicContact CG1-CZ 3.76Å; Y150-F227 HydrophobicContact CD1-CD2 4.16Å; Y150-F227 HydrophobicContact CD2-CB 3.81Å; Y150-F227 AromaticContact CD2-CD2 3.85Å; Y150-F227 HydrophobicContact CD2-CD2 3.85Å; Y150-F227 HydrophobicContact CD2-CG 4.35Å; Y150-F227 HydrophobicContact CE2-CB 3.94Å; Y150-F227 HydrophobicContact CE2-CD2 4.39Å; Y150-F227 AromaticContact CG-CD2 3.72Å; Y150-F227 HydrophobicContact CG-CD2 3.72Å; V198-F227 HydrophobicContact CG1-CE1 4.45Å; V198-F227 HydrophobicContact CG1-CZ 3.85Å; M202-F227 HydrophobicContact CG-CD2 4.24Å; M202-F227 HydrophobicContact CG-CE2 3.65Å; M202-F227 HydrophobicContact CG-CZ 3.92Å; M202-F227 HydrophobicContact SD-CE2 4.46Å; M202-F227 HydrophobicContact SD-CZ 4.2Å; F227-I229 HydrophobicContact CD1-CG1 4.07Å; F227-I229 HydrophobicContact CE1-CD1 4.06Å; F227-I229 HydrophobicContact CE1-CG1 3.62Å; F227-L250 HydrophobicContact CB-CB 4.47Å; F227-L250 HydrophobicContact CD1-CD1 4.36Å; F227-L250 PolarHBondContact N-O 2.87Å; F227-L250 PolarHBondContact O-N 2.74Å
228	T	96.4	Very high	79.5	Confident	9 Å²	9	33 Å²	33	6%	0.055	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.3	-177.5	-55.8	0	0	0	0	110.5	V148 S149 K247 I248 H249	V148-T228 WeakPolarHBondContact CA-O 3.29Å; S149-T228 PolarHBondContact N-O 3.48Å; S149-T228 PolarHBondContact O-N 3.04Å; T228-K247 HydrophobicContact CG2-CG 3.89Å; T228-I248 VanDerWaalsContact CA-O 3.3Å; T228-I248 WeakPolarHBondContact CA-O 3.43Å; T228-H249 WeakPolarHBondContact CG2-ND1 3.37Å; T228-H249 PolarHBondContact OG1-CE1 3.31Å; T228-H249 PolarHBondContact OG1-ND1 2.8Å
229	I	96.4	Very high	79.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120.3	170.9	-45.6	173	0	0	0	107.1	L129 T146 E147 V148 F227 I248 L250	L129-I229 HydrophobicContact CD2-CD1 4.33Å; L129-I229 HydrophobicContact CD2-CG2 3.93Å; T146-I229 HydrophobicContact CG2-CG2 3.6Å; E147-I229 WeakPolarHBondContact O-CA 3.43Å; V148-I229 HydrophobicContact CG1-CG1 4.3Å; V148-I229 HydrophobicContact CG1-CG2 4.37Å; F227-I229 HydrophobicContact CD1-CG1 4.07Å; F227-I229 HydrophobicContact CE1-CD1 4.06Å; F227-I229 HydrophobicContact CE1-CG1 3.62Å; I229-I248 HydrophobicContact CB-CB 4.17Å; I229-I248 HydrophobicContact CB-CD1 4.37Å; I229-I248 HydrophobicContact CD1-CD1 4.42Å; I229-I248 PolarHBondContact N-O 2.82Å; I229-I248 PolarHBondContact O-N 3.17Å; I229-L250 HydrophobicContact CD1-CD1 4.4Å
230	N	93.8	Very high	79.6	Confident	25 Å²	25	36.7 Å²	36.7	13%	0.134	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	116.1	162.6	-51.3	-62.2	0	0	0	106.7	E147	E147-N230 HydrophobicContact CB-CB 4.33Å; E147-N230 PolarHBondContact N-O 2.98Å; E147-N230 PolarHBondContact O-N 2.92Å
231	F	93.3	Very high	79.7	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.009	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	113.6	-179.2	172.9	-114.9	0	0	0	109.1	A90 F91 L129 I133 F144 Q233 S246	A90-F231 HydrophobicContact CB-CD1 4.22Å; F91-F231 AromaticContact CD1-CE1 3.98Å; F91-F231 HydrophobicContact CD1-CE1 3.98Å; F91-F231 AromaticContact CD1-CZ 3.99Å; F91-F231 HydrophobicContact CD1-CZ 3.99Å; F91-F231 HydrophobicContact CD2-CE1 4.3Å; F91-F231 HydrophobicContact CE1-CE1 4.06Å; F91-F231 AromaticContact CE1-CZ 3.63Å; F91-F231 HydrophobicContact CE1-CZ 3.63Å; F91-F231 HydrophobicContact CE2-CE1 4.37Å; F91-F231 HydrophobicContact CE2-CZ 4.33Å; F91-F231 HydrophobicContact CG-CE1 4.1Å; F91-F231 HydrophobicContact CG-CZ 4.49Å; F91-F231 HydrophobicContact CZ-CE1 4.25Å; F91-F231 AromaticContact CZ-CZ 3.8Å; F91-F231 HydrophobicContact CZ-CZ 3.8Å; L129-F231 HydrophobicContact CD1-CD1 4.25Å; L129-F231 HydrophobicContact CD1-CD2 3.98Å; L129-F231 HydrophobicContact CD1-CE1 4.23Å; L129-F231 HydrophobicContact CD1-CE2 3.96Å; L129-F231 HydrophobicContact CD1-CG 4.12Å; L129-F231 HydrophobicContact CD1-CZ 4.06Å; I133-F231 HydrophobicContact CD1-CD2 4.25Å; I133-F231 HydrophobicContact CD1-CE2 3.62Å; I133-F231 HydrophobicContact CD1-CZ 4.48Å; I133-F231 HydrophobicContact CG1-CE2 3.83Å; I133-F231 HydrophobicContact CG1-CZ 4.25Å; F144-F231 HydrophobicContact CB-CE2 4.18Å; F144-F231 AromaticContact CD1-CE2 3.49Å; F144-F231 HydrophobicContact CD1-CE2 3.49Å; F144-F231 VanDerWaalsContact CD1-CE2 3.49Å; F144-F231 AromaticContact CD1-CZ 3.37Å; F144-F231 HydrophobicContact CD1-CZ 3.37Å; F144-F231 HydrophobicContact CE1-CE2 4.24Å; F144-F231 AromaticContact CE1-CZ 3.67Å; F144-F231 HydrophobicContact CE1-CZ 3.67Å; F144-F231 HydrophobicContact CG-CE2 4.19Å; F144-F231 HydrophobicContact CG-CZ 4.43Å; F231-Q233 HydrophobicContact CE1-CB 4.27Å; F231-Q233 HydrophobicContact CZ-CB 4.3Å; F231-S246 WeakPolarHBondContact CD1-OG 3.18Å; F231-S246 PolarHBondContact N-O 2.95Å; F231-S246 PolarHBondContact O-N 3.26Å; F231-S246 PolarHBondContact O-OG 3.43Å
232	T	88.6	Confident	80	Confident	31 Å²	31	35.3 Å²	35.3	19%	0.19	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.9	174.6	-60.5	0	0	0	0	108.9	F144 R145 E243 T244 V245	F144-T232 WeakPolarHBondContact CA-O 3.46Å; R145-T232 PolarHBondContact N-O 2.71Å; R145-T232 PolarHBondContact O-N 3.39Å; T232-E243 HydrophobicContact CG2-CG 4.23Å; T232-T244 WeakPolarHBondContact CA-O 3.44Å; T232-V245 HydrophobicContact CG2-CG2 4.22Å
233	Q	84.5	Confident	80.2	Confident	30 Å²	30	34.9 Å²	34.9	14%	0.14	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.6	170.9	175.9	175.2	24.1	0	0	109	F91 A142 F144 F231 E243 T244	F91-Q233 PolarHBondContact O-OE1 3.11Å; A142-Q233 HydrophobicContact CB-CG 4.18Å; F144-Q233 HydrophobicContact CD1-CB 3.98Å; F144-Q233 HydrophobicContact CD1-CG 3.94Å; F144-Q233 HydrophobicContact CE1-CB 4Å; F144-Q233 HydrophobicContact CE1-CG 3.54Å; F144-Q233 HydrophobicContact CZ-CG 4.42Å; F231-Q233 HydrophobicContact CE1-CB 4.27Å; F231-Q233 HydrophobicContact CZ-CB 4.3Å; Q233-E243 WeakPolarHBondContact O-CA 3.17Å; Q233-T244 PolarHBondContact N-O 3.29Å; Q233-T244 PolarHBondContact O-N 3.25Å
234	A	77.6	Confident	80.3	Confident	3 Å²	3	35.7 Å²	35.7	3%	0.025	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.6	171.8	0	0	0	0	0	110	A142 S143 S242 W426	A142-A234 WeakPolarHBondContact CA-O 3.29Å; S143-A234 PolarHBondContact N-O 3.37Å; S143-A234 PolarHBondContact O-N 3.4Å; S143-A234 VanDerWaalsContact O-O 3.12Å; A234-S242 CarbonylContact C-O 3.2Å; A234-S242 VanDerWaalsContact CA-O 3.29Å; A234-S242 WeakPolarHBondContact CA-O 3.21Å; A234-W426 HydrophobicContact CB-CE3 4.01Å; A234-W426 HydrophobicContact CB-CH2 3.36Å; A234-W426 HydrophobicContact CB-CZ2 4.17Å; A234-W426 HydrophobicContact CB-CZ3 3.25Å
235	K	74.4	Confident	80.2	Confident	72 Å²	72	38.2 Å²	38.2	31%	0.313	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	157.2	178	65.5	173.2	-176.7	157.5	0	110.6	E141 A142 D237 S242	E141-K235 WeakPolarHBondContact O-CB 3.38Å; A142-K235 HydrophobicContact CB-CB 3.99Å; K235-D237 HydrophobicContact CD-CB 4.18Å; K235-D237 HydrophobicContact CG-CB 4.41Å; K235-D237 IonicContact NZ-OD2 3.59Å; K235-D237 PolarHBondContact NZ-OD2 3.2Å; K235-S242 PolarHBondContact N-O 3.43Å; K235-S242 PolarHBondContact O-N 2.86Å
236	F	66.1	Low	80.2	Confident	120 Å²	120	38.2 Å²	38.2	53%	0.526	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	95.4	174.5	-149.6	-101.4	0	0	0	108.4	M240 P241 W422	F236-M240 WeakPolarHBondContact CA-O 3.25Å; F236-P241 HydrophobicContact CD2-CB 4.14Å; F236-P241 HydrophobicContact CE2-CB 3.98Å; F236-P241 HydrophobicContact CE2-CG 4.46Å; F236-W422 HydrophobicContact CD2-CH2 4.28Å; F236-W422 HydrophobicContact CD2-CZ3 4.02Å; F236-W422 HydrophobicContact CE2-CZ3 4.04Å
237	D	57.9	Low	80.1	Confident	83 Å²	83	40.3 Å²	40.3	44%	0.444	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	114.7	-165.4	-169.1	-5	0	0	0	109	K235 E239 M240	K235-D237 HydrophobicContact CD-CB 4.18Å; K235-D237 HydrophobicContact CG-CB 4.41Å; K235-D237 IonicContact NZ-OD2 3.59Å; K235-D237 PolarHBondContact NZ-OD2 3.2Å; D237-E239 PolarHBondContact O-N 3Å; D237-M240 PolarHBondContact N-O 3.33Å; D237-M240 WeakPolarHBondContact O-CA 3.09Å; D237-M240 VanDerWaalsContact O-CB 3.22Å; D237-M240 WeakPolarHBondContact O-CB 3.42Å; D237-M240 PolarHBondContact O-N 2.94Å
238	A	56.3	Low	80.1	Confident	90 Å²	90	40.2 Å²	40.2	74%	0.744	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.5	55.2	-175.9	0	0	0	0	0	113.8	M240	A238-M240 PolarHBondContact O-N 2.69Å; A238-M240 VanDerWaalsContact O-N 3.1Å
239	E	53.5	Low	80.1	Confident	149 Å²	149	41.2 Å²	41.2	70%	0.696	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.8	3.4	-174.5	-53.1	-174.7	146.4	0	0	116	D237 R377	D237-E239 PolarHBondContact O-N 3Å; E239-R377 VanDerWaalsContact O-CZ 3.3Å; E239-R377 PolarHBondContact O-NH1 2.84Å; E239-R377 PolarHBondContact O-NH2 2.92Å
240	M	60.6	Low	80.2	Confident	45 Å²	45	41.2 Å²	41.2	22%	0.222	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.5	176.7	-66.3	-66.5	-56.1	0	0	111.5	F236 D237 A238 I373 R374 R377	F236-M240 WeakPolarHBondContact CA-O 3.25Å; D237-M240 PolarHBondContact N-O 3.33Å; D237-M240 WeakPolarHBondContact O-CA 3.09Å; D237-M240 VanDerWaalsContact O-CB 3.22Å; D237-M240 WeakPolarHBondContact O-CB 3.42Å; D237-M240 PolarHBondContact O-N 2.94Å; A238-M240 PolarHBondContact O-N 2.69Å; A238-M240 VanDerWaalsContact O-N 3.1Å; M240-I373 HydrophobicContact CE-CG2 3.99Å; M240-R374 HydrophobicContact CE-CB 3.88Å; M240-R374 HydrophobicContact CE-CG 4.28Å; M240-R377 HydrophobicContact SD-CB 4.38Å; M240-R377 VanDerWaalsContact SD-CD 3.53Å; M240-R377 HydrophobicContact SD-CG 4.34Å; M240-R377 PolarHBondContact SD-NH1 2.84Å
241	P	66.3	Low	80.3	Confident	2 Å²	2	40 Å²	40	1%	0.013	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	135.7	163.4	29.6	-33.6	0	0	0	109.7	F236 V370 I373 W422	F236-P241 HydrophobicContact CD2-CB 4.14Å; F236-P241 HydrophobicContact CE2-CB 3.98Å; F236-P241 HydrophobicContact CE2-CG 4.46Å; P241-V370 WeakPolarHBondContact O-CG1 3.37Å; P241-I373 HydrophobicContact CG-CD1 4.14Å; P241-I373 HydrophobicContact CG-CG2 4.38Å; P241-W422 HydrophobicContact CB-CD2 3.55Å; P241-W422 HydrophobicContact CB-CE3 3.41Å; P241-W422 VanDerWaalsContact CB-CE3 3.41Å; P241-W422 HydrophobicContact CB-CG 4.35Å; P241-W422 HydrophobicContact CB-CH2 3.64Å; P241-W422 HydrophobicContact CB-CZ2 3.76Å; P241-W422 HydrophobicContact CB-CZ3 3.48Å; P241-W422 VanDerWaalsContact CB-CZ3 3.48Å; P241-W422 HydrophobicContact CG-CD2 4.31Å; P241-W422 HydrophobicContact CG-CE3 4.21Å
242	S	76	Confident	80.4	Confident	31 Å²	31	40.2 Å²	40.2	22%	0.217	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	111.2	174.5	179.6	0	0	0	0	109.2	A234 K235	A234-S242 CarbonylContact C-O 3.2Å; A234-S242 VanDerWaalsContact CA-O 3.29Å; A234-S242 WeakPolarHBondContact CA-O 3.21Å; K235-S242 PolarHBondContact N-O 3.43Å; K235-S242 PolarHBondContact O-N 2.86Å
243	E	79.6	Confident	80.6	Confident	29 Å²	29	38.8 Å²	38.8	14%	0.136	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.1	176.3	-172.3	-179.2	168.8	0	0	108.3	T232 Q233 E366 D367 V370 W422 K425	T232-E243 HydrophobicContact CG2-CG 4.23Å; Q233-E243 WeakPolarHBondContact O-CA 3.17Å; E243-E366 WeakPolarHBondContact O-CA 3.27Å; E243-D367 HydrophobicContact CB-CB 4.25Å; E243-D367 PolarHBondContact O-N 3.4Å; E243-V370 HydrophobicContact CB-CG2 4.03Å; E243-W422 PolarHBondContact OE2-NE1 3.17Å; E243-K425 IonicContact OE1-NZ 3.36Å; E243-K425 IonicContact OE2-NZ 2.7Å; E243-K425 PolarHBondContact OE2-NZ 2.89Å
244	T	87.3	Confident	80.9	Confident	18 Å²	18	37.3 Å²	37.3	11%	0.11	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	142.1	177.7	57.8	0	0	0	0	110.2	T232 Q233 V364 N365	T232-T244 WeakPolarHBondContact CA-O 3.44Å; Q233-T244 PolarHBondContact N-O 3.29Å; Q233-T244 PolarHBondContact O-N 3.25Å; T244-V364 HydrophobicContact CG2-CG1 4.21Å; T244-N365 WeakPolarHBondContact CA-O 3.48Å
245	V	89	Confident	81.4	Confident	56 Å²	56	37.4 Å²	37.4	34%	0.339	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.6	-179.6	-175.6	0	0	0	0	108.6	T232 N365	T232-V245 HydrophobicContact CG2-CG2 4.22Å; V245-N365 PolarHBondContact N-O 3.45Å; V245-N365 WeakPolarHBondContact O-CB 3.4Å; V245-N365 PolarHBondContact O-ND2 2.66Å
246	S	93.8	Very high	82	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136	174.1	62.1	0	0	0	0	110.7	A90 Y94 F231	A90-S246 PolarHBondContact O-OG 3.44Å; Y94-S246 VanDerWaalsContact O-CB 3.29Å; Y94-S246 WeakPolarHBondContact O-CB 3.33Å; F231-S246 WeakPolarHBondContact CD1-OG 3.18Å; F231-S246 PolarHBondContact N-O 2.95Å; F231-S246 PolarHBondContact O-N 3.26Å; F231-S246 PolarHBondContact O-OG 3.43Å
247	K	94.1	Very high	82.7	Confident	49 Å²	49	31 Å²	31	21%	0.213	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	115.7	173.3	-166.2	-174.7	-60	172.9	0	108.3	N95 A96 T228 H249	N95-K247 WeakPolarHBondContact CA-O 3.39Å; N95-K247 WeakPolarHBondContact OD1-CB 3.27Å; N95-K247 PolarHBondContact OD1-N 3.45Å; A96-K247 PolarHBondContact N-O 2.9Å; T228-K247 HydrophobicContact CG2-CG 3.89Å; K247-H249 VanDerWaalsContact CD-NE2 3.26Å; K247-H249 WeakPolarHBondContact CD-NE2 3.3Å
248	I	96.9	Very high	83.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	112.2	177.2	-47	175.6	0	0	0	108.3	V86 A90 A96 T228 I229 L250	V86-I248 HydrophobicContact CG1-CG2 3.64Å; A90-I248 HydrophobicContact CB-CD1 3.62Å; A90-I248 HydrophobicContact CB-CG1 4.08Å; A96-I248 HydrophobicContact CB-CG2 4.41Å; A96-I248 CarbonylContact O-C 3.44Å; A96-I248 WeakPolarHBondContact O-CA 3.02Å; T228-I248 VanDerWaalsContact CA-O 3.3Å; T228-I248 WeakPolarHBondContact CA-O 3.43Å; I229-I248 HydrophobicContact CB-CB 4.17Å; I229-I248 HydrophobicContact CB-CD1 4.37Å; I229-I248 HydrophobicContact CD1-CD1 4.42Å; I229-I248 PolarHBondContact N-O 2.82Å; I229-I248 PolarHBondContact O-N 3.17Å; I248-L250 HydrophobicContact CG2-CD2 3.92Å; I248-L250 HydrophobicContact CG2-CG 4.06Å
249	H	96.7	Very high	83.8	Confident	30 Å²	30	31.6 Å²	31.6	14%	0.139	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.2	172.2	-69.8	-49.8	0	0	0	110.8	A96 C97 V98 T228 K247 V251	A96-H249 PolarHBondContact O-N 2.73Å; C97-H249 CarbonylContact C-O 3.54Å; C97-H249 WeakPolarHBondContact CA-O 3.42Å; C97-H249 HydrophobicContact CB-CB 4.32Å; V98-H249 PolarHBondContact N-O 2.95Å; T228-H249 WeakPolarHBondContact CG2-ND1 3.37Å; T228-H249 PolarHBondContact OG1-CE1 3.31Å; T228-H249 PolarHBondContact OG1-ND1 2.8Å; K247-H249 VanDerWaalsContact CD-NE2 3.26Å; K247-H249 WeakPolarHBondContact CD-NE2 3.3Å; H249-V251 HydrophobicContact CB-CG2 4.32Å
250	L	97.3	Very high	84.1	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	109.7	175.6	-54.1	175.3	0	0	0	108.2	V98 M112 I122 I125 F227 I229 I248	V98-L250 HydrophobicContact CB-CD2 3.91Å; V98-L250 HydrophobicContact CG2-CD2 3.9Å; M112-L250 HydrophobicContact CE-CB 4Å; I122-L250 HydrophobicContact CB-CD1 4.25Å; I122-L250 HydrophobicContact CD1-CB 4.14Å; I122-L250 HydrophobicContact CG1-CB 3.8Å; I122-L250 HydrophobicContact CG1-CD1 3.95Å; I122-L250 HydrophobicContact CG1-CG 4.46Å; I122-L250 HydrophobicContact CG2-CD1 4.05Å; I125-L250 HydrophobicContact CB-CD1 4.42Å; I125-L250 HydrophobicContact CD1-CD1 4.32Å; I125-L250 HydrophobicContact CD1-CD2 3.85Å; I125-L250 HydrophobicContact CG2-CD1 4.2Å; F227-L250 HydrophobicContact CB-CB 4.47Å; F227-L250 HydrophobicContact CD1-CD1 4.36Å; F227-L250 PolarHBondContact N-O 2.87Å; F227-L250 PolarHBondContact O-N 2.74Å; I229-L250 HydrophobicContact CD1-CD1 4.4Å; I248-L250 HydrophobicContact CG2-CD2 3.92Å; I248-L250 HydrophobicContact CG2-CG 4.06Å
251	V	96.9	Very high	83.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.9	-163.4	-175.3	0	0	0	0	111.7	V98 F99 A100 A225 I226 H249 L253 L319	V98-V251 PolarHBondContact O-N 3.47Å; F99-V251 WeakPolarHBondContact CA-O 3.42Å; F99-V251 HydrophobicContact CB-CB 3.7Å; F99-V251 HydrophobicContact CB-CG1 4.19Å; F99-V251 HydrophobicContact CB-CG2 4.35Å; A100-V251 PolarHBondContact N-O 2.7Å; A225-V251 WeakPolarHBondContact O-CA 3.49Å; I226-V251 HydrophobicContact CG1-CG1 4.08Å; I226-V251 HydrophobicContact CG1-CG2 4.14Å; I226-V251 HydrophobicContact CG2-CG2 4.2Å; H249-V251 HydrophobicContact CB-CG2 4.32Å; V251-L253 HydrophobicContact CG1-CD2 3.48Å; V251-L253 VanDerWaalsContact CG1-CD2 3.48Å; V251-L253 HydrophobicContact CG1-CG 3.98Å; V251-L319 HydrophobicContact CG2-CD2 4.16Å
252	D	94.9	Very high	83.6	Confident	5 Å²	5	35.7 Å²	35.7	3%	0.027	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	101.8	168.7	-177.5	42.1	0	0	0	108.2	K108 S109 M112 R209 H224 A225	K108-D252 WeakPolarHBondContact CB-OD1 3.42Å; S109-D252 WeakPolarHBondContact CA-OD1 3.22Å; S109-D252 PolarHBondContact N-OD1 3.06Å; S109-D252 PolarHBondContact OG-OD1 3.38Å; S109-D252 VanDerWaalsContact OG-OD1 3.12Å; S109-D252 PolarHBondContact OG-OD2 2.94Å; M112-D252 HydrophobicContact CB-CB 4.35Å; M112-D252 HydrophobicContact CG-CB 4.28Å; R209-D252 IonicContact CZ-OD2 2.65Å; R209-D252 IonicContact NH1-OD2 2.72Å; R209-D252 PolarHBondContact NH1-OD2 3.47Å; R209-D252 IonicContact NH2-OD2 3.62Å; R209-D252 PolarHBondContact NH2-OD2 2.78Å; R209-D252 VanDerWaalsContact NH2-OD2 3.14Å; H224-D252 CarbonylContact C-O 3.58Å; H224-D252 WeakPolarHBondContact CA-O 3.08Å; A225-D252 HydrophobicContact CB-CB 4.48Å; A225-D252 PolarHBondContact N-O 2.76Å; A225-D252 PolarHBondContact O-N 3.26Å
253	L	93.4	Very high	82.7	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-75.7	159.9	-178.1	-61.3	176.4	0	0	0	111.8	F99 A100 Y101 K108 H224 V251 L279 L282 L315	F99-L253 HydrophobicContact CD2-CD1 3.84Å; A100-L253 VanDerWaalsContact O-CB 3.29Å; A100-L253 WeakPolarHBondContact O-CB 3.29Å; A100-L253 WeakPolarHBondContact O-CG 3.5Å; A100-L253 PolarHBondContact O-N 3.31Å; Y101-L253 HydrophobicContact CD2-CD1 3.88Å; K108-L253 WeakPolarHBondContact CD-O 3.43Å; K108-L253 WeakPolarHBondContact CE-O 3.44Å; H224-L253 HydrophobicContact CB-CD2 4.39Å; H224-L253 WeakPolarHBondContact ND1-CA 3.34Å; H224-L253 WeakPolarHBondContact ND1-CD2 3.48Å; V251-L253 HydrophobicContact CG1-CD2 3.48Å; V251-L253 VanDerWaalsContact CG1-CD2 3.48Å; V251-L253 HydrophobicContact CG1-CG 3.98Å; L253-L279 HydrophobicContact CB-CD2 4.45Å; L253-L279 HydrophobicContact CD1-CD2 4.3Å; L253-L282 HydrophobicContact CD1-CD2 3.89Å; L253-L315 HydrophobicContact CD2-CD1 3.83Å; L253-L315 HydrophobicContact CD2-CD2 3.74Å; L253-L315 HydrophobicContact CD2-CG 4.4Å
254	A	90.1	Very high	81.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-63.8	169.4	168.4	0	0	0	0	0	112.4	K108 H224 I275	K108-A254 WeakPolarHBondContact CE-O 3.33Å; H224-A254 VanDerWaalsContact CE1-CB 3.5Å; H224-A254 WeakPolarHBondContact CE1-CB 3.42Å; H224-A254 PolarHBondContact CE1-N 2.75Å; H224-A254 PolarHBondContact ND1-N 2.85Å; A254-I275 HydrophobicContact CB-CG2 3.85Å
255	G	87.6	Confident	80.3	Confident	4 Å²	4	41.2 Å²	41.2	4%	0.041	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-57.1	132.5	172.8	0	0	0	0	0	113.3	T104 S221 E257 L279	T104-G255 WeakPolarHBondContact OG1-CA 3.36Å; S221-G255 PolarHBondContact O-N 3.31Å; G255-E257 VanDerWaalsContact C-N 3.28Å; G255-E257 VanDerWaalsContact C-OE2 3.24Å; G255-E257 WeakPolarHBondContact CA-OE2 3.22Å; G255-L279 WeakPolarHBondContact O-CD1 3.42Å
256	S	87.3	Confident	79.4	Confident	15 Å²	15	41.2 Å²	41.2	11%	0.105	26%	0.262	C	S	.	.			trans	-79.4	-5.4	177.1	67.7	0	0	0	0	114.8	Y101 G102 Q103	Y101-S256 WeakPolarHBondContact OH-CB 3.37Å; G102-S256 PolarHBondContact O-N 3.16Å; G102-S256 VanDerWaalsContact O-N 3.11Å; G102-S256 PolarHBondContact O-OG 2.85Å; Q103-S256 PolarHBondContact N-OG 2.89Å; Q103-S256 VanDerWaalsContact N-OG 3.12Å
257	E	81.6	Confident	77.9	Confident	44 Å²	44	47 Å²	47	21%	0.206	30%	0.298	C	S	.	.	S	Bend	trans	-68	145.6	-176.7	65	-80.1	-174.4	0	0	113.4	Q103 T104 G255 N276 E344	Q103-E257 VanDerWaalsContact CA-OE2 3.27Å; Q103-E257 WeakPolarHBondContact CA-OE2 3.36Å; T104-E257 WeakPolarHBondContact CB-OE1 3.38Å; T104-E257 PolarHBondContact N-OE2 2.94Å; T104-E257 PolarHBondContact OG1-OE1 2.65Å; T104-E257 PolarHBondContact OG1-OE2 3.01Å; G255-E257 VanDerWaalsContact C-N 3.28Å; G255-E257 VanDerWaalsContact C-OE2 3.24Å; G255-E257 WeakPolarHBondContact CA-OE2 3.22Å; E257-N276 PolarHBondContact O-OD1 3.25Å; E257-E344 HydrophobicContact CB-CG 4.44Å
258	R	72.4	Confident	76.4	Confident	170 Å²	170	49.4 Å²	49.4	64%	0.642	31%	0.305	S	S	*	.			trans	-70.8	136.6	-175.7	-51	-176.5	78.5	-161.4	2.6	110.6	D260 A261	R258-D260 PolarHBondContact O-N 2.66Å; R258-D260 VanDerWaalsContact O-N 3.09Å; R258-A261 WeakPolarHBondContact O-CB 3.34Å; R258-A261 PolarHBondContact O-N 3.43Å
259	A	65.3	Low	75.1	Confident	15 Å²	15	53.2 Å²	53.2	12%	0.124	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-52.1	-37.5	-178.8	0	0	0	0	0	113.6	A261 T262 L269 N276	A259-A261 PolarHBondContact O-N 2.81Å; A259-T262 WeakPolarHBondContact O-CB 3.39Å; A259-T262 PolarHBondContact O-N 3.38Å; A259-T262 PolarHBondContact O-OG1 3.23Å; A259-L269 HydrophobicContact CB-CD1 4.4Å; A259-N276 PolarHBondContact N-ND2 3.48Å
260	D	59.8	Low	73.7	Confident	125 Å²	125	59.6 Å²	59.6	67%	0.668	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-61.9	-31.7	-179.6	-48.8	-40.2	0	0	0	112.5	R258 T262 G263	R258-D260 PolarHBondContact O-N 2.66Å; R258-D260 VanDerWaalsContact O-N 3.09Å; D260-T262 PolarHBondContact O-N 3.33Å; D260-G263 PolarHBondContact O-N 3.26Å
261	A	56	Low	72.3	Confident	80 Å²	80	60.6 Å²	60.6	66%	0.661	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-71.2	-13.2	177	0	0	0	0	0	113.2	R258 A259	R258-A261 WeakPolarHBondContact O-CB 3.34Å; R258-A261 PolarHBondContact O-N 3.43Å; A259-A261 PolarHBondContact O-N 2.81Å
262	T	59.5	Low	70.9	Confident	76 Å²	76	60.9 Å²	60.9	47%	0.466	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-88.4	-8.8	179.9	72.8	0	0	0	0	113.8	A259 D260 A264	A259-T262 WeakPolarHBondContact O-CB 3.39Å; A259-T262 PolarHBondContact O-N 3.38Å; A259-T262 PolarHBondContact O-OG1 3.23Å; D260-T262 PolarHBondContact O-N 3.33Å; T262-A264 PolarHBondContact O-N 3.19Å; T262-A264 VanDerWaalsContact O-N 3.16Å; T262-A264 WeakPolarHBondContact OG1-CB 3.45Å
263	G	58.1	Low	69.8	Low	72 Å²	72	62.3 Å²	62.3	74%	0.742	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	12.4	-178.4	0	0	0	0	0	115.1	D260	D260-G263 PolarHBondContact O-N 3.26Å
264	A	58	Low	68.9	Low	23 Å²	23	65.4 Å²	65.4	19%	0.19	39%	0.393	C	S	.	.			trans	-76	131.7	-172.9	0	0	0	0	0	112.9	T262 R268	T262-A264 PolarHBondContact O-N 3.19Å; T262-A264 VanDerWaalsContact O-N 3.16Å; T262-A264 WeakPolarHBondContact OG1-CB 3.45Å; A264-R268 HydrophobicContact CB-CB 3.86Å
265	S	57	Low	68	Low	99 Å²	99	66 Å²	66	69%	0.692	40%	0.396	S	S	*	.			trans	-112.2	162.8	177.9	67.4	0	0	0	0	113.4	V267 R268	S265-V267 PolarHBondContact O-N 3.4Å; S265-R268 PolarHBondContact O-N 3.1Å
266	G	70.6	Confident	67.5	Low	56 Å²	56	67.2 Å²	67.2	58%	0.577	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	-125.1	173.1	0	0	0	0	0	114.7	R268 L269 K270	G266-R268 VanDerWaalsContact C-N 3.31Å; G266-R268 PolarHBondContact O-N 3.11Å; G266-L269 PolarHBondContact O-N 3.07Å; G266-K270 PolarHBondContact O-N 3.47Å
267	V	62	Low	67.4	Low	123 Å²	123	70.6 Å²	70.6	75%	0.745	41%	0.414	S	S	*	.	H	α-helix	trans	-63.2	-37.5	-176.8	179.5	0	0	0	0	111.6	S265 L269 K270 E271	S265-V267 PolarHBondContact O-N 3.4Å; V267-L269 VanDerWaalsContact C-N 3.26Å; V267-L269 PolarHBondContact O-N 2.83Å; V267-K270 PolarHBondContact O-N 3.03Å; V267-E271 WeakPolarHBondContact O-CB 3.42Å; V267-E271 PolarHBondContact O-N 2.94Å
268	R	63.5	Low	67.8	Low	98 Å²	98	68.6 Å²	68.6	37%	0.37	41%	0.405	S	S	.	.	H	α-helix	trans	-66.7	-25.6	179.5	-65.6	-177.1	179.8	-170.4	-3.7	113	N217 R222 A264 S265 G266 G272	N217-R268 PolarHBondContact OD1-NH1 2.96Å; R222-R268 PolarHBondContact NH2-O 3.5Å; A264-R268 HydrophobicContact CB-CB 3.86Å; S265-R268 PolarHBondContact O-N 3.1Å; G266-R268 VanDerWaalsContact C-N 3.31Å; G266-R268 PolarHBondContact O-N 3.11Å; R268-G272 PolarHBondContact O-N 2.65Å
269	L	68.9	Low	68.5	Low	80 Å²	80	60.9 Å²	60.9	42%	0.419	38%	0.377	S	S	.	.	H	α-helix	trans	-74	-40.4	173.5	-173.1	63	0	0	0	111.7	A259 G266 V267 G272 G273	A259-L269 HydrophobicContact CB-CD1 4.4Å; G266-L269 PolarHBondContact O-N 3.07Å; V267-L269 VanDerWaalsContact C-N 3.26Å; V267-L269 PolarHBondContact O-N 2.83Å; L269-G272 PolarHBondContact O-N 3.2Å; L269-G273 PolarHBondContact O-N 2.59Å
270	K	67.9	Low	69.6	Low	164 Å²	164	64.1 Å²	64.1	71%	0.713	40%	0.395	S	S	*	.	H	α-helix	trans	-64.8	-41.2	173.9	-69.9	-178	178	176.2	0	111.8	G266 V267 G273 N274	G266-K270 PolarHBondContact O-N 3.47Å; V267-K270 PolarHBondContact O-N 3.03Å; K270-G273 PolarHBondContact O-N 3.33Å; K270-N274 PolarHBondContact O-N 3.28Å; K270-N274 VanDerWaalsContact O-N 3.14Å
271	E	67.8	Low	71.2	Confident	22 Å²	22	58.6 Å²	58.6	10%	0.103	37%	0.365	C	S	.	.	H	α-helix	trans	-59.8	-53.4	172.6	-173.1	-152.9	150.1	0	0	111.1	Y154 R222 V267 G273 N274 I275	Y154-E271 HydrophobicContact CE2-CG 4.11Å; Y154-E271 WeakPolarHBondContact CE2-OE1 3.31Å; Y154-E271 PolarHBondContact OH-OE1 3.45Å; Y154-E271 VanDerWaalsContact OH-OE1 3.06Å; R222-E271 VanDerWaalsContact CZ-CD 3.42Å; R222-E271 IonicContact CZ-OE1 2.66Å; R222-E271 IonicContact CZ-OE2 2.74Å; R222-E271 IonicContact NE-OE1 3.38Å; R222-E271 PolarHBondContact NE-OE1 3.12Å; R222-E271 IonicContact NH1-OE1 3.61Å; R222-E271 PolarHBondContact NH1-OE1 3.41Å; R222-E271 IonicContact NH1-OE2 2.77Å; R222-E271 PolarHBondContact NH1-OE2 3.14Å; R222-E271 IonicContact NH2-OE1 2.65Å; R222-E271 IonicContact NH2-OE2 3.99Å; V267-E271 WeakPolarHBondContact O-CB 3.42Å; V267-E271 PolarHBondContact O-N 2.94Å; E271-G273 PolarHBondContact O-N 2.96Å; E271-N274 PolarHBondContact O-N 3.34Å; E271-I275 HydrophobicContact CG-CD1 4.06Å; E271-I275 WeakPolarHBondContact O-CG1 3.5Å; E271-I275 PolarHBondContact O-N 3.46Å
272	G	66.9	Low	72.9	Confident	6 Å²	6	54.9 Å²	54.9	6%	0.062	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-32.7	175.9	0	0	0	0	0	113.8	R268 L269 N276	R268-G272 PolarHBondContact O-N 2.65Å; L269-G272 PolarHBondContact O-N 3.2Å; G272-N276 VanDerWaalsContact O-CB 3.28Å; G272-N276 WeakPolarHBondContact O-CB 3.33Å; G272-N276 PolarHBondContact O-N 2.92Å; G272-N276 PolarHBondContact O-ND2 3.28Å
273	G	72.3	Confident	74.4	Confident	36 Å²	36	51.7 Å²	51.7	37%	0.371	32%	0.316	S	S	.	.	H	α-helix	trans	-65.7	-40.2	172.6	0	0	0	0	0	113.3	L269 K270 E271 K277	L269-G273 PolarHBondContact O-N 2.59Å; K270-G273 PolarHBondContact O-N 3.33Å; E271-G273 PolarHBondContact O-N 2.96Å; G273-K277 WeakPolarHBondContact O-CB 3.4Å; G273-K277 PolarHBondContact O-N 3.04Å
274	N	74.6	Confident	76	Confident	65 Å²	65	52.2 Å²	52.2	35%	0.348	30%	0.302	S	S	.	.	H	α-helix	trans	-77.4	-31.1	177.8	-73	-18	0	0	0	113.1	N155 K270 E271 K277	N155-N274 VanDerWaalsContact OD1-CB 3.26Å; N155-N274 WeakPolarHBondContact OD1-CB 3.33Å; N155-N274 PolarHBondContact OD1-ND2 3.5Å; K270-N274 PolarHBondContact O-N 3.28Å; K270-N274 VanDerWaalsContact O-N 3.14Å; E271-N274 PolarHBondContact O-N 3.34Å; N274-K277 WeakPolarHBondContact O-CB 3.37Å; N274-K277 PolarHBondContact O-N 3.12Å
275	I	70.3	Confident	77.6	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.062	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-51.3	169.6	-62.6	160.3	0	0	0	108.9	Y154 R222 A254 E271 K277 S278	Y154-I275 HydrophobicContact CE2-CD1 4.41Å; R222-I275 HydrophobicContact CB-CD1 3.71Å; R222-I275 HydrophobicContact CG-CD1 4.38Å; R222-I275 VanDerWaalsContact O-CD1 3.31Å; R222-I275 WeakPolarHBondContact O-CD1 3.49Å; R222-I275 WeakPolarHBondContact O-CG1 3.47Å; A254-I275 HydrophobicContact CB-CG2 3.85Å; E271-I275 HydrophobicContact CG-CD1 4.06Å; E271-I275 WeakPolarHBondContact O-CG1 3.5Å; E271-I275 PolarHBondContact O-N 3.46Å; I275-K277 VanDerWaalsContact C-N 3.27Å; I275-K277 PolarHBondContact O-N 2.97Å; I275-S278 PolarHBondContact O-N 3.41Å; I275-S278 PolarHBondContact O-OG 3.22Å
276	N	77.3	Confident	79.3	Confident	30 Å²	30	46.5 Å²	46.5	16%	0.16	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-30.7	176.9	-81.7	-57.8	0	0	0	113.3	E257 A259 G272 S278 L279 V280	E257-N276 PolarHBondContact O-OD1 3.25Å; A259-N276 PolarHBondContact N-ND2 3.48Å; G272-N276 VanDerWaalsContact O-CB 3.28Å; G272-N276 WeakPolarHBondContact O-CB 3.33Å; G272-N276 PolarHBondContact O-N 2.92Å; G272-N276 PolarHBondContact O-ND2 3.28Å; N276-S278 VanDerWaalsContact C-N 3.31Å; N276-S278 PolarHBondContact O-N 2.83Å; N276-L279 PolarHBondContact O-N 3.5Å; N276-V280 VanDerWaalsContact O-CB 3.27Å; N276-V280 WeakPolarHBondContact O-CB 3.48Å; N276-V280 VanDerWaalsContact O-CG2 3.22Å; N276-V280 WeakPolarHBondContact O-CG2 3.38Å; N276-V280 PolarHBondContact O-N 3.16Å
277	K	86.6	Confident	80.2	Confident	87 Å²	87	44.9 Å²	44.9	38%	0.378	24%	0.24	S	C	.	.	H	α-helix	trans	-51.1	-50.6	173.2	178.6	177.9	176	-103.2	0	111.3	E156 G273 N274 I275 L279 V280 T281 D312	E156-K277 HydrophobicContact CG-CD 4.28Å; E156-K277 IonicContact OE2-NZ 2.75Å; E156-K277 PolarHBondContact OE2-NZ 3.43Å; G273-K277 WeakPolarHBondContact O-CB 3.4Å; G273-K277 PolarHBondContact O-N 3.04Å; N274-K277 WeakPolarHBondContact O-CB 3.37Å; N274-K277 PolarHBondContact O-N 3.12Å; I275-K277 VanDerWaalsContact C-N 3.27Å; I275-K277 PolarHBondContact O-N 2.97Å; K277-L279 PolarHBondContact O-N 3.48Å; K277-V280 PolarHBondContact O-N 2.66Å; K277-T281 WeakPolarHBondContact O-CB 3.44Å; K277-T281 PolarHBondContact O-N 3.37Å; K277-T281 PolarHBondContact O-OG1 3.21Å; K277-D312 WeakPolarHBondContact CE-O 3.46Å; K277-D312 PolarHBondContact NZ-O 3.04Å
278	S	88.1	Confident	81.5	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.014	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-40.9	-179.2	64.6	0	0	0	0	113.8	H224 I275 N276 L282	H224-S278 PolarHBondContact NE2-OG 2.72Å; I275-S278 PolarHBondContact O-N 3.41Å; I275-S278 PolarHBondContact O-OG 3.22Å; N276-S278 VanDerWaalsContact C-N 3.31Å; N276-S278 PolarHBondContact O-N 2.83Å; S278-L282 WeakPolarHBondContact O-CB 3.41Å; S278-L282 PolarHBondContact O-N 2.61Å
279	L	88.4	Confident	82.7	Confident	8 Å²	8	35.8 Å²	35.8	4%	0.042	20%	0.197	C	C	.	.	H	α-helix	trans	-77.6	-33.4	178.9	-67.2	-179.9	0	0	0	113.4	Y101 L253 G255 N276 K277 L282 G283 L315	Y101-L279 HydrophobicContact CE2-CD2 4.24Å; L253-L279 HydrophobicContact CB-CD2 4.45Å; L253-L279 HydrophobicContact CD1-CD2 4.3Å; G255-L279 WeakPolarHBondContact O-CD1 3.42Å; N276-L279 PolarHBondContact O-N 3.5Å; K277-L279 PolarHBondContact O-N 3.48Å; L279-L282 HydrophobicContact CD2-CD2 4.2Å; L279-L282 WeakPolarHBondContact O-CB 3.5Å; L279-L282 PolarHBondContact O-N 2.61Å; L279-G283 PolarHBondContact O-N 3.03Å; L279-L315 HydrophobicContact CD2-CD2 4.32Å
280	V	88.9	Confident	83.5	Confident	83 Å²	83	32.4 Å²	32.4	50%	0.503	18%	0.18	S	C	.	.	H	α-helix	trans	-66.8	-44.7	172.1	169.4	0	0	0	0	110	N276 K277 L282 G283 N284	N276-V280 VanDerWaalsContact O-CB 3.27Å; N276-V280 WeakPolarHBondContact O-CB 3.48Å; N276-V280 VanDerWaalsContact O-CG2 3.22Å; N276-V280 WeakPolarHBondContact O-CG2 3.38Å; N276-V280 PolarHBondContact O-N 3.16Å; K277-V280 PolarHBondContact O-N 2.66Å; V280-L282 VanDerWaalsContact C-N 3.33Å; V280-L282 PolarHBondContact O-N 3.1Å; V280-G283 PolarHBondContact O-N 3.37Å; V280-G283 VanDerWaalsContact O-N 3.14Å; V280-N284 VanDerWaalsContact O-CG 3.28Å; V280-N284 PolarHBondContact O-N 3.4Å; V280-N284 PolarHBondContact O-OD1 3.36Å
281	T	91.8	Very high	84.1	Confident	9 Å²	9	30.9 Å²	30.9	6%	0.055	18%	0.18	C	C	.	.	H	α-helix	trans	-61.8	-41.2	173.1	-60.1	0	0	0	0	111.2	K277 G283 N284 V285 P309 D312 T316	K277-T281 WeakPolarHBondContact O-CB 3.44Å; K277-T281 PolarHBondContact O-N 3.37Å; K277-T281 PolarHBondContact O-OG1 3.21Å; T281-G283 VanDerWaalsContact C-N 3.29Å; T281-G283 PolarHBondContact O-N 2.83Å; T281-N284 PolarHBondContact O-N 3.06Å; T281-V285 WeakPolarHBondContact O-CG2 3.39Å; T281-V285 PolarHBondContact O-N 2.92Å; T281-P309 WeakPolarHBondContact CG2-O 3.29Å; T281-D312 HydrophobicContact CG2-CB 3.59Å; T281-T316 HydrophobicContact CG2-CG2 3.84Å; T281-T316 VanDerWaalsContact CG2-OG1 3.29Å; T281-T316 WeakPolarHBondContact CG2-OG1 3.45Å
282	L	92.4	Very high	84.4	Confident	1 Å²	1	34 Å²	34	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-41.8	173	-169.9	71.6	0	0	0	111.5	L253 S278 L279 V280 V285 I286 L315 T316 L323 Y351	L253-L282 HydrophobicContact CD1-CD2 3.89Å; S278-L282 WeakPolarHBondContact O-CB 3.41Å; S278-L282 PolarHBondContact O-N 2.61Å; L279-L282 HydrophobicContact CD2-CD2 4.2Å; L279-L282 WeakPolarHBondContact O-CB 3.5Å; L279-L282 PolarHBondContact O-N 2.61Å; V280-L282 VanDerWaalsContact C-N 3.33Å; V280-L282 PolarHBondContact O-N 3.1Å; L282-V285 PolarHBondContact O-N 3.5Å; L282-I286 HydrophobicContact CG-CD1 4.15Å; L282-I286 WeakPolarHBondContact O-CB 3.21Å; L282-I286 WeakPolarHBondContact O-CG1 3.49Å; L282-I286 PolarHBondContact O-N 3.33Å; L282-L315 HydrophobicContact CD2-CD2 4.31Å; L282-T316 VanDerWaalsContact CA-CG2 3.42Å; L282-T316 HydrophobicContact CB-CG2 3.87Å; L282-T316 HydrophobicContact CD1-CG2 3.85Å; L282-L323 HydrophobicContact CD1-CD1 3.56Å; L282-Y351 WeakPolarHBondContact CB-OH 3.4Å; L282-Y351 WeakPolarHBondContact CD2-OH 3.26Å; L282-Y351 VanDerWaalsContact CG-OH 3.24Å; L282-Y351 WeakPolarHBondContact CG-OH 3.12Å
283	G	90.3	Very high	84.1	Confident	9 Å²	9	35 Å²	35	9%	0.093	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-35.6	176.2	0	0	0	0	0	113.9	L279 V280 T281 S287 Y351	L279-G283 PolarHBondContact O-N 3.03Å; V280-G283 PolarHBondContact O-N 3.37Å; V280-G283 VanDerWaalsContact O-N 3.14Å; T281-G283 VanDerWaalsContact C-N 3.29Å; T281-G283 PolarHBondContact O-N 2.83Å; G283-S287 WeakPolarHBondContact O-CB 3.43Å; G283-S287 PolarHBondContact O-N 2.74Å; G283-S287 PolarHBondContact O-OG 2.92Å; G283-Y351 VanDerWaalsContact CA-CE2 3.45Å; G283-Y351 WeakPolarHBondContact CA-OH 3.16Å; G283-Y351 PolarHBondContact N-OH 3.28Å
284	N	91.3	Very high	83.4	Confident	84 Å²	84	38.5 Å²	38.5	45%	0.449	22%	0.219	S	C	.	.	H	α-helix	trans	-68.8	-43.4	174.4	-67	-14.5	0	0	0	111.3	V280 T281 S287 A288 P309	V280-N284 VanDerWaalsContact O-CG 3.28Å; V280-N284 PolarHBondContact O-N 3.4Å; V280-N284 PolarHBondContact O-OD1 3.36Å; T281-N284 PolarHBondContact O-N 3.06Å; N284-S287 PolarHBondContact O-N 3Å; N284-A288 VanDerWaalsContact O-CB 3.27Å; N284-A288 WeakPolarHBondContact O-CB 3.23Å; N284-A288 PolarHBondContact O-N 2.85Å; N284-P309 HydrophobicContact CB-CG 4.15Å
285	V	93.4	Very high	81.9	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-49.4	173.7	166.2	0	0	0	0	110.7	T281 L282 S287 A288 L289 V308 P309 Y310 T316 L323	T281-V285 WeakPolarHBondContact O-CG2 3.39Å; T281-V285 PolarHBondContact O-N 2.92Å; L282-V285 PolarHBondContact O-N 3.5Å; V285-S287 PolarHBondContact O-N 3.09Å; V285-A288 PolarHBondContact O-N 2.92Å; V285-L289 HydrophobicContact CG1-CD1 3.84Å; V285-L289 WeakPolarHBondContact O-CB 2.99Å; V285-L289 VanDerWaalsContact O-CG 3.29Å; V285-L289 WeakPolarHBondContact O-CG 3.37Å; V285-L289 PolarHBondContact O-N 3.26Å; V285-V308 HydrophobicContact CB-CG1 4.17Å; V285-V308 HydrophobicContact CG1-CG1 3.82Å; V285-V308 HydrophobicContact CG2-CG1 4.05Å; V285-P309 HydrophobicContact CG2-CG 4.11Å; V285-Y310 HydrophobicContact CG1-CD1 3.91Å; V285-Y310 HydrophobicContact CG1-CE1 3.5Å; V285-Y310 HydrophobicContact CG2-CD1 4.19Å; V285-T316 HydrophobicContact CG2-CG2 4.09Å; V285-L323 HydrophobicContact CG1-CB 4.49Å; V285-L323 HydrophobicContact CG1-CD1 4.31Å
286	I	91.1	Very high	80.7	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-63.3	-40.7	179.8	-77.1	173.5	0	0	0	111.9	L282 A290 L323 Y351 R354 A355 I358	L282-I286 HydrophobicContact CG-CD1 4.15Å; L282-I286 WeakPolarHBondContact O-CB 3.21Å; L282-I286 WeakPolarHBondContact O-CG1 3.49Å; L282-I286 PolarHBondContact O-N 3.33Å; I286-A290 VanDerWaalsContact O-CB 3.27Å; I286-A290 WeakPolarHBondContact O-CB 3.14Å; I286-A290 PolarHBondContact O-N 3.25Å; I286-L323 HydrophobicContact CG1-CD1 4.31Å; I286-Y351 HydrophobicContact CD1-CD1 4.35Å; I286-Y351 HydrophobicContact CD1-CE1 3.42Å; I286-Y351 VanDerWaalsContact CD1-CE1 3.42Å; I286-R354 HydrophobicContact CG2-CB 4.08Å; I286-A355 HydrophobicContact CG2-CB 4.22Å; I286-I358 HydrophobicContact CB-CD1 4.05Å; I286-I358 HydrophobicContact CG1-CD1 3.71Å; I286-I358 HydrophobicContact CG2-CD1 4.05Å
287	S	89.3	Confident	78.9	Confident	21 Å²	21	48 Å²	48	15%	0.147	31%	0.307	C	S	.	.	H	α-helix	trans	-68.3	-46	177.5	-53.8	0	0	0	0	111.3	G283 N284 V285 L289 A290 D291 R354	G283-S287 WeakPolarHBondContact O-CB 3.43Å; G283-S287 PolarHBondContact O-N 2.74Å; G283-S287 PolarHBondContact O-OG 2.92Å; N284-S287 PolarHBondContact O-N 3Å; V285-S287 PolarHBondContact O-N 3.09Å; S287-L289 VanDerWaalsContact C-N 3.28Å; S287-L289 PolarHBondContact O-N 3.47Å; S287-A290 PolarHBondContact O-N 3.45Å; S287-D291 WeakPolarHBondContact O-CB 3.34Å; S287-D291 PolarHBondContact O-N 3.27Å; S287-R354 PolarHBondContact OG-NH1 3.45Å
288	A	90.2	Very high	76.5	Confident	12 Å²	12	50.5 Å²	50.5	10%	0.099	33%	0.325	C	S	.	.	H	α-helix	trans	-60.1	-35.3	176.9	0	0	0	0	0	113.1	N284 V285 M292 V306 V308	N284-A288 VanDerWaalsContact O-CB 3.27Å; N284-A288 WeakPolarHBondContact O-CB 3.23Å; N284-A288 PolarHBondContact O-N 2.85Å; V285-A288 PolarHBondContact O-N 2.92Å; A288-M292 VanDerWaalsContact O-CG 3.27Å; A288-M292 WeakPolarHBondContact O-CG 3.41Å; A288-V306 HydrophobicContact CB-CG1 3.98Å; A288-V308 HydrophobicContact CB-CG2 4.27Å
289	L	88.4	Confident	74.3	Confident	18 Å²	18	55.5 Å²	55.5	9%	0.094	37%	0.366	C	S	.	.	H	α-helix	trans	-76.8	-35.1	175.3	-71.2	170.7	0	0	0	113.3	V285 S287 M292 V308 L323 I358	V285-L289 HydrophobicContact CG1-CD1 3.84Å; V285-L289 WeakPolarHBondContact O-CB 2.99Å; V285-L289 VanDerWaalsContact O-CG 3.29Å; V285-L289 WeakPolarHBondContact O-CG 3.37Å; V285-L289 PolarHBondContact O-N 3.26Å; S287-L289 VanDerWaalsContact C-N 3.28Å; S287-L289 PolarHBondContact O-N 3.47Å; L289-M292 HydrophobicContact CD2-SD 4.31Å; L289-M292 PolarHBondContact O-N 3.22Å; L289-V308 HydrophobicContact CD2-CG1 4.4Å; L289-V308 HydrophobicContact CD2-CG2 4.05Å; L289-V308 HydrophobicContact CG-CG1 4.14Å; L289-V308 HydrophobicContact CG-CG2 4.42Å; L289-L323 HydrophobicContact CD1-CB 4Å; L289-I358 HydrophobicContact CB-CB 4.5Å; L289-I358 HydrophobicContact CB-CD1 4.05Å; L289-I358 HydrophobicContact CB-CG1 3.79Å; L289-I358 HydrophobicContact CB-CG2 4.15Å; L289-I358 HydrophobicContact CD1-CD1 4.15Å; L289-I358 HydrophobicContact CD1-CG2 4.01Å
290	A	85.3	Confident	72	Confident	9 Å²	9	63 Å²	63	7%	0.074	41%	0.406	C	S	.	.	H	α-helix	trans	-69	-39.6	176.4	0	0	0	0	0	111.7	I286 S287 M292 A293 R354 N357	I286-A290 VanDerWaalsContact O-CB 3.27Å; I286-A290 WeakPolarHBondContact O-CB 3.14Å; I286-A290 PolarHBondContact O-N 3.25Å; S287-A290 PolarHBondContact O-N 3.45Å; A290-M292 PolarHBondContact O-N 2.86Å; A290-A293 VanDerWaalsContact O-CB 3.24Å; A290-A293 WeakPolarHBondContact O-CB 3.2Å; A290-A293 PolarHBondContact O-N 3.44Å; A290-A293 VanDerWaalsContact O-N 3.11Å; A290-R354 HydrophobicContact CB-CB 4.29Å; A290-R354 WeakPolarHBondContact CB-O 3.22Å; A290-N357 HydrophobicContact CB-CB 4.14Å
291	D	80.7	Confident	69.9	Low	133 Å²	133	66.9 Å²	66.9	71%	0.711	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-12.7	177.9	-61.2	-17.7	0	0	0	112.8	S287	S287-D291 WeakPolarHBondContact O-CB 3.34Å; S287-D291 PolarHBondContact O-N 3.27Å
292	M	74.8	Confident	67.7	Low	87 Å²	87	76 Å²	76	43%	0.429	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.1	170.3	-75.9	176.5	-178.4	0	0	113.7	A288 L289 A290 V306 V308	A288-M292 VanDerWaalsContact O-CG 3.27Å; A288-M292 WeakPolarHBondContact O-CG 3.41Å; L289-M292 HydrophobicContact CD2-SD 4.31Å; L289-M292 PolarHBondContact O-N 3.22Å; A290-M292 PolarHBondContact O-N 2.86Å; M292-V306 HydrophobicContact CE-CB 3.58Å; M292-V306 HydrophobicContact CE-CG1 4.02Å; M292-V306 WeakPolarHBondContact CE-O 3.49Å; M292-V306 HydrophobicContact CG-CB 4.36Å; M292-V308 HydrophobicContact CE-CG2 3.48Å; M292-V308 VanDerWaalsContact CE-CG2 3.48Å; M292-V308 HydrophobicContact SD-CG2 4.29Å
293	A	61.6	Low	65.5	Low	26 Å²	26	83.9 Å²	83.9	22%	0.215	49%	0.492	C	S	.	.	S	Bend	trans	-64.7	139	-178.2	0	0	0	0	0	110	A290 D295 N357	A290-A293 VanDerWaalsContact O-CB 3.24Å; A290-A293 WeakPolarHBondContact O-CB 3.2Å; A290-A293 PolarHBondContact O-N 3.44Å; A290-A293 VanDerWaalsContact O-N 3.11Å; A293-D295 PolarHBondContact O-N 2.93Å; A293-N357 HydrophobicContact CB-CB 4.25Å; A293-N357 WeakPolarHBondContact CB-O 3.45Å
294	P	55.8	Low	63.5	Low	110 Å²	110	92.2 Å²	92.2	71%	0.714	53%	0.525	S	S	*	.			trans	-74.3	90.5	-177.5	30	-34.4	0	0	0	110.9	G296 I359	P294-G296 PolarHBondContact O-N 3.05Å; P294-G296 VanDerWaalsContact O-N 3.16Å; P294-I359 HydrophobicContact CG-CD1 4.5Å
295	D	43.2	Very low	61.6	Low	153 Å²	153	95.1 Å²	95.1	82%	0.818	55%	0.546	S	S	*	.			trans	-64.3	111.5	163.7	-95.3	-14.8	0	0	0	109	A293 G297	A293-D295 PolarHBondContact O-N 2.93Å; D295-G297 PolarHBondContact O-N 3.27Å
296	G	45.1	Very low	60.5	Low	88 Å²	88	98 Å²	98	91%	0.907	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	97.6	177	0	0	0	0	0	110.9	P294	P294-G296 PolarHBondContact O-N 3.05Å; P294-G296 VanDerWaalsContact O-N 3.16Å
297	G	39.5	Very low	60.2	Low	67 Å²	67	106 Å²	106	69%	0.691	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.6	-37.7	176.7	0	0	0	0	0	117.3	D295	D295-G297 PolarHBondContact O-N 3.27Å
298	N	36.8	Very low	60.1	Low	139 Å²	139	106 Å²	106	74%	0.743	60%	0.598	S	S	*	*			trans	-138.8	96.9	-171.1	-83.1	-51.2	0	0	0	113.8	N300	N298-N300 PolarHBondContact O-N 2.96Å
299	A	42.6	Very low	60.2	Low	106 Å²	106	106.2 Å²	106.2	88%	0.876	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-8.9	179.4	0	0	0	0	0	115.1
300	N	39.9	Very low	60.4	Low	166 Å²	166	107 Å²	107	89%	0.888	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	10.2	-170.4	-93.8	-5.2	0	0	0	116.1	N298	N298-N300 PolarHBondContact O-N 2.96Å
301	Q	45	Very low	60.6	Low	164 Å²	164	114.8 Å²	114.8	77%	0.766	63%	0.628	S	S	*	*	S	Bend	trans	-102.3	120.7	169.7	-66.7	-166.3	6.5	0	0	110.9	K303	Q301-K303 PolarHBondContact O-N 3.06Å; Q301-K303 VanDerWaalsContact O-N 3.16Å
302	K	45.5	Very low	61.1	Low	202 Å²	202	112.6 Å²	112.6	88%	0.878	62%	0.616	S	S	*	*			trans	-50.5	121.4	173.6	-69.9	179.7	176.8	179	0	109.7	K304	K302-K304 PolarHBondContact O-N 2.84Å
303	K	46.5	Very low	62	Low	165 Å²	165	108.6 Å²	108.6	72%	0.717	60%	0.597	S	S	*	*			trans	-49.6	100.4	172.8	-74.9	179	-178.7	173.2	0	109	Q301 T305 D1049	Q301-K303 PolarHBondContact O-N 3.06Å; Q301-K303 VanDerWaalsContact O-N 3.16Å; K303-T305 PolarHBondContact O-N 3.1Å; K303-D1049 VanDerWaalsContact NZ-CG 3.29Å; K303-D1049 IonicContact NZ-OD1 2.73Å; K303-D1049 PolarHBondContact NZ-OD1 2.79Å; K303-D1049 IonicContact NZ-OD2 3.7Å; K303-D1049 PolarHBondContact NZ-OD2 2.87Å
304	K	47.5	Very low	63.5	Low	184 Å²	184	108.5 Å²	108.5	80%	0.8	59%	0.593	S	S	*	*			trans	-67	127.1	170.7	-83.4	179.9	176	173.9	0	107.6	K302 V306	K302-K304 PolarHBondContact O-N 2.84Å; K304-V306 HydrophobicContact CB-CG2 4.16Å; K304-V306 PolarHBondContact O-N 2.9Å
305	T	51.7	Low	65.3	Low	146 Å²	146	103.2 Å²	103.2	90%	0.896	56%	0.559	S	S	*	*			trans	-71.5	79.7	167.7	40.5	0	0	0	0	109.2	K303 F307	K303-T305 PolarHBondContact O-N 3.1Å; T305-F307 PolarHBondContact O-N 2.84Å
306	V	70.3	Confident	67.8	Low	62 Å²	62	96 Å²	96	38%	0.376	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-65.5	127.8	178.2	175.1	0	0	0	0	108.9	A288 M292 K304	A288-V306 HydrophobicContact CB-CG1 3.98Å; M292-V306 HydrophobicContact CE-CB 3.58Å; M292-V306 HydrophobicContact CE-CG1 4.02Å; M292-V306 WeakPolarHBondContact CE-O 3.49Å; M292-V306 HydrophobicContact CG-CB 4.36Å; K304-V306 HydrophobicContact CB-CG2 4.16Å; K304-V306 PolarHBondContact O-N 2.9Å
307	F	83.8	Confident	70.1	Confident	168 Å²	168	94.2 Å²	94.2	74%	0.737	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-83.4	128.2	177.2	172.7	-96.3	0	0	0	110	T305 P309	T305-F307 PolarHBondContact O-N 2.84Å; F307-P309 HydrophobicContact CE1-CB 4.06Å
308	V	88.5	Confident	72.6	Confident	21 Å²	21	91.9 Å²	91.9	13%	0.127	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-101.4	116.2	-179.1	-171.3	0	0	0	0	110.1	V285 A288 L289 M292 Y310	V285-V308 HydrophobicContact CB-CG1 4.17Å; V285-V308 HydrophobicContact CG1-CG1 3.82Å; V285-V308 HydrophobicContact CG2-CG1 4.05Å; A288-V308 HydrophobicContact CB-CG2 4.27Å; L289-V308 HydrophobicContact CD2-CG1 4.4Å; L289-V308 HydrophobicContact CD2-CG2 4.05Å; L289-V308 HydrophobicContact CG-CG1 4.14Å; L289-V308 HydrophobicContact CG-CG2 4.42Å; M292-V308 HydrophobicContact CE-CG2 3.48Å; M292-V308 VanDerWaalsContact CE-CG2 3.48Å; M292-V308 HydrophobicContact SD-CG2 4.29Å; V308-Y310 VanDerWaalsContact C-N 3.29Å; V308-Y310 HydrophobicContact CB-CD2 4.1Å; V308-Y310 HydrophobicContact CB-CE2 3.61Å; V308-Y310 HydrophobicContact CG1-CD1 4.45Å; V308-Y310 HydrophobicContact CG1-CD2 3.93Å; V308-Y310 HydrophobicContact CG1-CE1 3.99Å; V308-Y310 HydrophobicContact CG1-CE2 3.42Å; V308-Y310 VanDerWaalsContact CG1-CE2 3.42Å; V308-Y310 HydrophobicContact CG1-CG 4.42Å; V308-Y310 VanDerWaalsContact CG1-CZ 3.44Å; V308-Y310 WeakPolarHBondContact O-CD2 3.48Å; V308-Y310 PolarHBondContact O-N 2.9Å
309	P	91.4	Very high	75.3	Confident	16 Å²	16	85.4 Å²	85.4	10%	0.104	42%	0.423	C	S	.	.			trans	-84	53.4	-165.6	34.5	-38.1	0	0	0	114.2	T281 N284 V285 F307 R311 D312	T281-P309 WeakPolarHBondContact CG2-O 3.29Å; N284-P309 HydrophobicContact CB-CG 4.15Å; V285-P309 HydrophobicContact CG2-CG 4.11Å; F307-P309 HydrophobicContact CE1-CB 4.06Å; P309-R311 VanDerWaalsContact C-N 3.27Å; P309-R311 PolarHBondContact O-N 2.89Å; P309-D312 HydrophobicContact CB-CB 4.35Å; P309-D312 PolarHBondContact O-N 3Å
310	Y	92.4	Very high	77.6	Confident	36 Å²	36	83.5 Å²	83.5	14%	0.141	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-56.6	-37.8	-178.4	-63.4	-75.9	0	0	0	113.8	V285 V308 D312 T316 W317 K320 L323	V285-Y310 HydrophobicContact CG1-CD1 3.91Å; V285-Y310 HydrophobicContact CG1-CE1 3.5Å; V285-Y310 HydrophobicContact CG2-CD1 4.19Å; V308-Y310 VanDerWaalsContact C-N 3.29Å; V308-Y310 HydrophobicContact CB-CD2 4.1Å; V308-Y310 HydrophobicContact CB-CE2 3.61Å; V308-Y310 HydrophobicContact CG1-CD1 4.45Å; V308-Y310 HydrophobicContact CG1-CD2 3.93Å; V308-Y310 HydrophobicContact CG1-CE1 3.99Å; V308-Y310 HydrophobicContact CG1-CE2 3.42Å; V308-Y310 VanDerWaalsContact CG1-CE2 3.42Å; V308-Y310 HydrophobicContact CG1-CG 4.42Å; V308-Y310 VanDerWaalsContact CG1-CZ 3.44Å; V308-Y310 WeakPolarHBondContact O-CD2 3.48Å; V308-Y310 PolarHBondContact O-N 2.9Å; Y310-D312 VanDerWaalsContact C-N 3.26Å; Y310-D312 PolarHBondContact O-N 3.49Å; Y310-T316 CarbonylContact O-C 3.6Å; Y310-T316 VanDerWaalsContact O-C 3.22Å; Y310-T316 WeakPolarHBondContact O-CB 3.35Å; Y310-T316 PolarHBondContact O-OG1 3.01Å; Y310-W317 WeakPolarHBondContact O-CA 3.19Å; Y310-W317 PolarHBondContact O-N 2.81Å; Y310-K320 HydrophobicContact CD1-CB 3.96Å; Y310-K320 HydrophobicContact CD1-CG 4.08Å; Y310-K320 HydrophobicContact CD2-CG 4.11Å; Y310-K320 HydrophobicContact CE1-CB 4.47Å; Y310-K320 HydrophobicContact CE1-CG 4.38Å; Y310-K320 HydrophobicContact CE2-CG 4.39Å; Y310-K320 HydrophobicContact CG-CB 4.13Å; Y310-K320 HydrophobicContact CG-CG 3.94Å; Y310-L323 HydrophobicContact CE1-CB 4.45Å; Y310-L323 WeakPolarHBondContact CE1-O 3.06Å; Y310-L323 PolarHBondContact OH-O 3.13Å
311	R	90.8	Very high	80	Confident	171 Å²	171	77.5 Å²	77.5	65%	0.645	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-76.4	-7.1	-175.6	-73.3	-174.4	170.5	-172.2	-1.3	114.6	E176 P309 S313 W317	E176-R311 IonicContact OE2-CZ 2.65Å; E176-R311 IonicContact OE2-NE 2.65Å; E176-R311 PolarHBondContact OE2-NE 3.33Å; E176-R311 IonicContact OE2-NH2 2.92Å; E176-R311 PolarHBondContact OE2-NH2 2.8Å; P309-R311 VanDerWaalsContact C-N 3.27Å; P309-R311 PolarHBondContact O-N 2.89Å; R311-S313 PolarHBondContact O-N 2.93Å; R311-W317 HydrophobicContact CG-CD2 4.29Å; R311-W317 HydrophobicContact CG-CG 4.22Å
312	D	91.3	Very high	82.2	Confident	87 Å²	87	69.8 Å²	69.8	47%	0.465	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-72.8	-18.1	-176.5	-77.3	11.4	0	0	0	112.6	K277 T281 P309 Y310	K277-D312 WeakPolarHBondContact CE-O 3.46Å; K277-D312 PolarHBondContact NZ-O 3.04Å; T281-D312 HydrophobicContact CG2-CB 3.59Å; P309-D312 HydrophobicContact CB-CB 4.35Å; P309-D312 PolarHBondContact O-N 3Å; Y310-D312 VanDerWaalsContact C-N 3.26Å; Y310-D312 PolarHBondContact O-N 3.49Å
313	S	93.6	Very high	84.4	Confident	4 Å²	4	60.3 Å²	60.3	3%	0.028	29%	0.286	C	S	.	.	S	Bend	trans	-138.9	156.3	170.5	84	0	0	0	0	113	E156 R311 L315 T316 W317	E156-S313 VanDerWaalsContact OE2-CA 3.29Å; E156-S313 WeakPolarHBondContact OE2-CA 3.09Å; E156-S313 WeakPolarHBondContact OE2-CB 3.47Å; R311-S313 PolarHBondContact O-N 2.93Å; S313-L315 VanDerWaalsContact C-N 3.33Å; S313-L315 PolarHBondContact O-N 2.78Å; S313-T316 PolarHBondContact N-OG1 3.46Å; S313-T316 PolarHBondContact O-OG1 2.87Å; S313-T316 PolarHBondContact OG-N 3.26Å; S313-T316 VanDerWaalsContact OG-N 3.14Å; S313-T316 PolarHBondContact OG-OG1 2.66Å; S313-W317 WeakPolarHBondContact O-CB 3.29Å; S313-W317 PolarHBondContact O-N 2.9Å
314	V	92.9	Very high	86.3	Confident	23 Å²	23	53.8 Å²	53.8	14%	0.139	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-43.2	177.8	171.2	0	0	0	0	111.2	I153 E156 V158 V174 W317 L318	I153-V314 HydrophobicContact CD1-CG1 4.15Å; I153-V314 HydrophobicContact CG1-CG1 4.31Å; I153-V314 HydrophobicContact CG2-CB 4.18Å; I153-V314 HydrophobicContact CG2-CG1 3.9Å; E156-V314 HydrophobicContact CB-CG2 4.43Å; E156-V314 PolarHBondContact OE2-N 3.21Å; V158-V314 HydrophobicContact CG2-CG1 3.5Å; V174-V314 HydrophobicContact CG2-CG1 3.93Å; V314-W317 PolarHBondContact O-N 3.39Å; V314-L318 HydrophobicContact CG1-CD1 4.11Å; V314-L318 WeakPolarHBondContact O-CG 3.48Å; V314-L318 PolarHBondContact O-N 3.48Å
315	L	93.8	Very high	88.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-52.4	179.2	177.6	67.8	0	0	0	111.8	I153 H224 I226 L253 L279 L282 S313 W317 L318 L319	I153-L315 HydrophobicContact CD1-CB 4.25Å; I153-L315 HydrophobicContact CD1-CD1 4.01Å; H224-L315 HydrophobicContact CB-CD1 4.37Å; I226-L315 HydrophobicContact CD1-CD1 4.27Å; L253-L315 HydrophobicContact CD2-CD1 3.83Å; L253-L315 HydrophobicContact CD2-CD2 3.74Å; L253-L315 HydrophobicContact CD2-CG 4.4Å; L279-L315 HydrophobicContact CD2-CD2 4.32Å; L282-L315 HydrophobicContact CD2-CD2 4.31Å; S313-L315 VanDerWaalsContact C-N 3.33Å; S313-L315 PolarHBondContact O-N 2.78Å; L315-W317 VanDerWaalsContact C-N 3.26Å; L315-W317 PolarHBondContact O-N 3.14Å; L315-L318 PolarHBondContact O-N 2.8Å; L315-L319 HydrophobicContact CD1-CD1 3.69Å; L315-L319 HydrophobicContact CD1-CG 4.24Å; L315-L319 HydrophobicContact CG-CD1 4.07Å; L315-L319 WeakPolarHBondContact O-CB 3.48Å; L315-L319 WeakPolarHBondContact O-CG 3.42Å; L315-L319 PolarHBondContact O-N 3.48Å
316	T	94	Very high	90.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.2	-24.8	-179	50	0	0	0	0	113.4	T281 L282 V285 Y310 S313 K320	T281-T316 HydrophobicContact CG2-CG2 3.84Å; T281-T316 VanDerWaalsContact CG2-OG1 3.29Å; T281-T316 WeakPolarHBondContact CG2-OG1 3.45Å; L282-T316 VanDerWaalsContact CA-CG2 3.42Å; L282-T316 HydrophobicContact CB-CG2 3.87Å; L282-T316 HydrophobicContact CD1-CG2 3.85Å; V285-T316 HydrophobicContact CG2-CG2 4.09Å; Y310-T316 CarbonylContact O-C 3.6Å; Y310-T316 VanDerWaalsContact O-C 3.22Å; Y310-T316 WeakPolarHBondContact O-CB 3.35Å; Y310-T316 PolarHBondContact O-OG1 3.01Å; S313-T316 PolarHBondContact N-OG1 3.46Å; S313-T316 PolarHBondContact O-OG1 2.87Å; S313-T316 PolarHBondContact OG-N 3.26Å; S313-T316 VanDerWaalsContact OG-N 3.14Å; S313-T316 PolarHBondContact OG-OG1 2.66Å; T316-K320 PolarHBondContact O-N 3.25Å; T316-K320 VanDerWaalsContact O-N 3.17Å
317	W	93.6	Very high	91.3	Very high	51 Å²	51	38 Å²	38	19%	0.193	19%	0.187	C	C	.	.	H	α-helix	trans	-72.7	-47.3	174.4	-165.3	13.1	0	0	0	110	V174 E176 P182 Y310 R311 S313 V314 L315 L319 K320	V174-W317 HydrophobicContact CB-CE3 3.74Å; V174-W317 HydrophobicContact CB-CH2 4.46Å; V174-W317 HydrophobicContact CB-CZ3 3.7Å; V174-W317 HydrophobicContact CG1-CD2 3.75Å; V174-W317 HydrophobicContact CG1-CE3 3.45Å; V174-W317 VanDerWaalsContact CG1-CE3 3.45Å; V174-W317 HydrophobicContact CG1-CG 4.34Å; V174-W317 HydrophobicContact CG1-CH2 4.23Å; V174-W317 HydrophobicContact CG1-CZ2 4.49Å; V174-W317 HydrophobicContact CG1-CZ3 3.71Å; V174-W317 WeakPolarHBondContact O-CH2 3.33Å; V174-W317 WeakPolarHBondContact O-CZ3 3.18Å; E176-W317 HydrophobicContact CB-CZ2 3.97Å; E176-W317 PolarHBondContact OE2-NE1 2.69Å; P182-W317 HydrophobicContact CB-CG 4.42Å; P182-W317 WeakPolarHBondContact CB-O 3.44Å; P182-W317 WeakPolarHBondContact CG-O 3.36Å; Y310-W317 WeakPolarHBondContact O-CA 3.19Å; Y310-W317 PolarHBondContact O-N 2.81Å; R311-W317 HydrophobicContact CG-CD2 4.29Å; R311-W317 HydrophobicContact CG-CG 4.22Å; S313-W317 WeakPolarHBondContact O-CB 3.29Å; S313-W317 PolarHBondContact O-N 2.9Å; V314-W317 PolarHBondContact O-N 3.39Å; L315-W317 VanDerWaalsContact C-N 3.26Å; L315-W317 PolarHBondContact O-N 3.14Å; W317-L319 VanDerWaalsContact C-N 3.33Å; W317-L319 PolarHBondContact O-N 3.23Å; W317-K320 WeakPolarHBondContact O-CB 3.33Å; W317-K320 PolarHBondContact O-N 3.34Å
318	L	92.9	Very high	91.8	Very high	18 Å²	18	32.9 Å²	32.9	9%	0.094	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-36	175.2	-69.4	170.3	0	0	0	112.8	I153 V174 V184 V314 L315 K320	I153-L318 HydrophobicContact CD1-CD1 3.92Å; V174-L318 HydrophobicContact CG1-CD2 3.83Å; V174-L318 HydrophobicContact CG1-CG 4.27Å; V174-L318 HydrophobicContact CG2-CD1 4.17Å; V174-L318 HydrophobicContact CG2-CD2 4.08Å; V174-L318 HydrophobicContact CG2-CG 4.11Å; V184-L318 HydrophobicContact CG2-CD1 4.13Å; V184-L318 HydrophobicContact CG2-CD2 3.7Å; V314-L318 HydrophobicContact CG1-CD1 4.11Å; V314-L318 WeakPolarHBondContact O-CG 3.48Å; V314-L318 PolarHBondContact O-N 3.48Å; L315-L318 PolarHBondContact O-N 2.8Å; L318-K320 VanDerWaalsContact C-N 3.3Å; L318-K320 PolarHBondContact O-N 3.39Å
319	L	92.9	Very high	92.2	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.016	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-86.2	10	177.1	-61.8	-177.9	0	0	0	114.3	V251 L315 W317 D321 S322 L323	V251-L319 HydrophobicContact CG2-CD2 4.16Å; L315-L319 HydrophobicContact CD1-CD1 3.69Å; L315-L319 HydrophobicContact CD1-CG 4.24Å; L315-L319 HydrophobicContact CG-CD1 4.07Å; L315-L319 WeakPolarHBondContact O-CB 3.48Å; L315-L319 WeakPolarHBondContact O-CG 3.42Å; L315-L319 PolarHBondContact O-N 3.48Å; W317-L319 VanDerWaalsContact C-N 3.33Å; W317-L319 PolarHBondContact O-N 3.23Å; L319-D321 VanDerWaalsContact C-N 3.28Å; L319-D321 PolarHBondContact O-N 2.76Å; L319-S322 WeakPolarHBondContact O-CA 3.47Å; L319-S322 WeakPolarHBondContact O-CB 3.48Å; L319-S322 PolarHBondContact O-N 2.78Å; L319-L323 PolarHBondContact O-N 2.74Å; L319-L323 VanDerWaalsContact O-N 3.11Å
320	K	91.8	Very high	92.5	Very high	67 Å²	67	31.9 Å²	31.9	29%	0.291	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-54.1	-42.4	178.1	174.7	-176.2	161.7	-176.6	0	112.6	E176 P182 Y310 T316 W317 L318 S322	E176-K320 IonicContact OE1-NZ 3.29Å; E176-K320 PolarHBondContact OE1-NZ 2.9Å; P182-K320 HydrophobicContact CG-CB 4.06Å; Y310-K320 HydrophobicContact CD1-CB 3.96Å; Y310-K320 HydrophobicContact CD1-CG 4.08Å; Y310-K320 HydrophobicContact CD2-CG 4.11Å; Y310-K320 HydrophobicContact CE1-CB 4.47Å; Y310-K320 HydrophobicContact CE1-CG 4.38Å; Y310-K320 HydrophobicContact CE2-CG 4.39Å; Y310-K320 HydrophobicContact CG-CB 4.13Å; Y310-K320 HydrophobicContact CG-CG 3.94Å; T316-K320 PolarHBondContact O-N 3.25Å; T316-K320 VanDerWaalsContact O-N 3.17Å; W317-K320 WeakPolarHBondContact O-CB 3.33Å; W317-K320 PolarHBondContact O-N 3.34Å; L318-K320 VanDerWaalsContact C-N 3.3Å; L318-K320 PolarHBondContact O-N 3.39Å; K320-S322 VanDerWaalsContact C-N 3.27Å; K320-S322 PolarHBondContact O-N 2.73Å
321	D	89.4	Confident	92.8	Very high	40 Å²	40	30.1 Å²	30.1	21%	0.214	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-76.4	-20.9	179.8	-60.2	-20.5	0	0	0	111.9	L319 G325 N326 A327	L319-D321 VanDerWaalsContact C-N 3.28Å; L319-D321 PolarHBondContact O-N 2.76Å; D321-G325 CarbonylContact O-C 3.46Å; D321-G325 VanDerWaalsContact O-CA 3.29Å; D321-G325 WeakPolarHBondContact O-CA 3.41Å; D321-N326 CarbonylContact O-C 3.51Å; D321-N326 PolarHBondContact O-N 3.46Å; D321-N326 VanDerWaalsContact O-N 3.13Å; D321-A327 PolarHBondContact O-N 3.49Å
322	S	92.3	Very high	93.1	Very high	2 Å²	2	22 Å²	22	1%	0.014	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-25.3	178.3	-60.7	0	0	0	0	113.7	C97 L319 K320 T329 N360	C97-S322 WeakPolarHBondContact CB-OG 3.43Å; C97-S322 VanDerWaalsContact SG-CB 3.59Å; C97-S322 PolarHBondContact SG-OG 3.42Å; L319-S322 WeakPolarHBondContact O-CA 3.47Å; L319-S322 WeakPolarHBondContact O-CB 3.48Å; L319-S322 PolarHBondContact O-N 2.78Å; K320-S322 VanDerWaalsContact C-N 3.27Å; K320-S322 PolarHBondContact O-N 2.73Å; S322-T329 WeakPolarHBondContact O-CB 3.46Å; S322-T329 WeakPolarHBondContact O-CG2 3.5Å; S322-T329 PolarHBondContact O-OG1 2.93Å; S322-N360 PolarHBondContact O-ND2 2.91Å
323	L	91.4	Very high	93.4	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.01	10%	0.098	C	C	.	.	S	Bend	trans	-122.8	111.1	-176.7	-64.6	173.2	0	0	0	109.3	F99 L282 V285 I286 L289 Y310 L319 G325 T329 I358	F99-L323 HydrophobicContact CE1-CD2 4.08Å; F99-L323 HydrophobicContact CZ-CD2 4.29Å; L282-L323 HydrophobicContact CD1-CD1 3.56Å; V285-L323 HydrophobicContact CG1-CB 4.49Å; V285-L323 HydrophobicContact CG1-CD1 4.31Å; I286-L323 HydrophobicContact CG1-CD1 4.31Å; L289-L323 HydrophobicContact CD1-CB 4Å; Y310-L323 HydrophobicContact CE1-CB 4.45Å; Y310-L323 WeakPolarHBondContact CE1-O 3.06Å; Y310-L323 PolarHBondContact OH-O 3.13Å; L319-L323 PolarHBondContact O-N 2.74Å; L319-L323 VanDerWaalsContact O-N 3.11Å; L323-G325 PolarHBondContact O-N 2.93Å; L323-T329 HydrophobicContact CD2-CG2 4.41Å; L323-I358 HydrophobicContact CD2-CD1 4.45Å
324	G	85.3	Confident	93.6	Very high	28 Å²	28	17.7 Å²	17.7	29%	0.289	10%	0.097	S	C	.	.	S	Bend	trans	73.9	2.6	-174.1	0	0	0	0	0	115.1	N360	G324-N360 WeakPolarHBondContact CA-OD1 3.5Å; G324-N360 PolarHBondContact N-OD1 2.84Å
325	G	89.2	Confident	93.8	Very high	18 Å²	18	16.7 Å²	16.7	19%	0.186	9%	0.091	C	C	.	.	S	Bend	trans	-112.6	-154.5	-173.3	0	0	0	0	0	115.5	D321 L323 A327 K361	D321-G325 CarbonylContact O-C 3.46Å; D321-G325 VanDerWaalsContact O-CA 3.29Å; D321-G325 WeakPolarHBondContact O-CA 3.41Å; L323-G325 PolarHBondContact O-N 2.93Å; G325-A327 PolarHBondContact O-N 3.28Å; G325-K361 CarbonylContact O-C 3.56Å; G325-K361 PolarHBondContact O-N 3.06Å
326	N	91.3	Very high	93.9	Very high	39 Å²	39	16.7 Å²	16.7	21%	0.209	9%	0.091	C	C	.	.	S	Bend	trans	-87.3	73.9	178.2	176.5	22.7	0	0	0	111.6	N95 D321 P362 T363 N365	N95-N326 WeakPolarHBondContact CB-O 3.39Å; N95-N326 PolarHBondContact ND2-ND2 3.41Å; N95-N326 PolarHBondContact ND2-O 2.87Å; D321-N326 CarbonylContact O-C 3.51Å; D321-N326 PolarHBondContact O-N 3.46Å; D321-N326 VanDerWaalsContact O-N 3.13Å; N326-P362 WeakPolarHBondContact OD1-CA 3.49Å; N326-T363 VanDerWaalsContact CG-OG1 3.27Å; N326-T363 PolarHBondContact ND2-OG1 3.41Å; N326-T363 PolarHBondContact OD1-N 2.94Å; N326-T363 PolarHBondContact OD1-O 2.77Å; N326-T363 PolarHBondContact OD1-OG1 2.89Å; N326-N365 PolarHBondContact ND2-OD1 3.02Å
327	A	93.6	Very high	93.9	Very high	3 Å²	3	16.7 Å²	16.7	3%	0.025	9%	0.091	C	C	.	.	S	Bend	trans	-157.7	152	167.3	0	0	0	0	0	112.2	N95 D321 G325 N360	N95-A327 HydrophobicContact CB-CB 4.08Å; N95-A327 CarbonylContact O-C 3.55Å; N95-A327 WeakPolarHBondContact O-CA 3.41Å; D321-A327 PolarHBondContact O-N 3.49Å; G325-A327 PolarHBondContact O-N 3.28Å; A327-N360 WeakPolarHBondContact O-CB 3.45Å; A327-N360 PolarHBondContact O-ND2 2.82Å
328	K	95.6	Very high	94	Very high	61 Å²	61	14.2 Å²	14.2	27%	0.265	8%	0.082	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	114.6	161.6	-63.8	-175.1	-167.3	169.4	0	108.1	A89 E92 Y94 N95 A96 C97 P362	A89-K328 HydrophobicContact CB-CD 3.75Å; E92-K328 IonicContact OE2-NZ 3.17Å; E92-K328 PolarHBondContact OE2-NZ 2.77Å; Y94-K328 VanDerWaalsContact CD2-NZ 3.26Å; Y94-K328 HydrophobicContact CG-CD 4.45Å; N95-K328 PolarHBondContact O-N 3.15Å; A96-K328 WeakPolarHBondContact CA-O 3.32Å; C97-K328 PolarHBondContact N-O 3.22Å; K328-P362 HydrophobicContact CG-CB 3.89Å; K328-P362 HydrophobicContact CG-CG 4Å
329	T	96.8	Very high	94	Very high	6 Å²	6	15.9 Å²	15.9	4%	0.037	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.2	-167.9	-60	0	0	0	0	112.8	V4 R5 C97 F99 S322 L323 N360	V4-T329 HydrophobicContact CG1-CG2 4.24Å; V4-T329 HydrophobicContact CG2-CG2 4.48Å; R5-T329 PolarHBondContact N-O 3.33Å; C97-T329 HydrophobicContact CB-CG2 4.1Å; C97-T329 CarbonylContact O-C 3.51Å; C97-T329 VanDerWaalsContact O-CA 3.32Å; C97-T329 WeakPolarHBondContact O-CA 3.35Å; F99-T329 HydrophobicContact CD1-CG2 4.1Å; F99-T329 HydrophobicContact CE1-CG2 3.71Å; S322-T329 WeakPolarHBondContact O-CB 3.46Å; S322-T329 WeakPolarHBondContact O-CG2 3.5Å; S322-T329 PolarHBondContact O-OG1 2.93Å; L323-T329 HydrophobicContact CD2-CG2 4.41Å; T329-N360 PolarHBondContact OG1-ND2 2.85Å; T329-N360 VanDerWaalsContact OG1-ND2 3.17Å
330	I	97.7	Very high	93.8	Very high	10 Å²	10	20.1 Å²	20.1	5%	0.051	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.2	-179.8	-53.3	179.7	0	0	0	108.8	R5 L82 V86 C97 V98 F99 I332	R5-I330 CarbonylContact O-C 3.53Å; R5-I330 WeakPolarHBondContact O-CA 3.47Å; L82-I330 HydrophobicContact CB-CD1 4.3Å; L82-I330 HydrophobicContact CD1-CG2 4.14Å; L82-I330 HydrophobicContact CD2-CG2 4.07Å; V86-I330 HydrophobicContact CG2-CD1 3.93Å; C97-I330 PolarHBondContact O-N 2.73Å; V98-I330 WeakPolarHBondContact CA-O 3.42Å; V98-I330 HydrophobicContact CG2-CB 4.34Å; V98-I330 HydrophobicContact CG2-CD1 4.45Å; F99-I330 PolarHBondContact N-O 2.72Å; I330-I332 HydrophobicContact CG2-CG1 4.28Å
331	M	97.5	Very high	93.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132	169.6	178.7	-179.6	175.6	0	0	109.8	V4 R5 V6 A7 F99 Y101 A333 Y351 A352 A355	V4-M331 HydrophobicContact CG1-CB 4.48Å; R5-M331 PolarHBondContact O-N 3.38Å; V6-M331 WeakPolarHBondContact CA-O 3.21Å; V6-M331 HydrophobicContact CG2-CB 4.37Å; A7-M331 PolarHBondContact N-O 2.98Å; F99-M331 HydrophobicContact CD2-CG 4.18Å; F99-M331 HydrophobicContact CE1-CB 4.05Å; F99-M331 HydrophobicContact CE2-CB 3.9Å; F99-M331 HydrophobicContact CE2-CE 4.47Å; F99-M331 HydrophobicContact CE2-CG 3.49Å; F99-M331 VanDerWaalsContact CE2-CG 3.49Å; F99-M331 HydrophobicContact CE2-SD 3.96Å; F99-M331 HydrophobicContact CZ-CB 3.61Å; F99-M331 HydrophobicContact CZ-CG 3.72Å; F99-M331 HydrophobicContact CZ-SD 4.13Å; Y101-M331 HydrophobicContact CD1-CE 3.72Å; Y101-M331 HydrophobicContact CG-CE 3.8Å; M331-A333 HydrophobicContact CE-CB 4.13Å; M331-Y351 HydrophobicContact CE-CD1 3.69Å; M331-Y351 HydrophobicContact CE-CE1 4.2Å; M331-Y351 HydrophobicContact SD-CD1 4.39Å; M331-A352 HydrophobicContact CE-CB 4.08Å; M331-A352 HydrophobicContact SD-CB 4.4Å; M331-A355 HydrophobicContact SD-CB 3.48Å; M331-A355 WeakPolarHBondContact SD-CB 3.11Å
332	I	98.1	Very high	94	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	104.7	172.6	-50.6	176.5	0	0	0	109.5	A7 L82 V98 F99 A100 Y101 T111 L121 I330 T334	A7-I332 CarbonylContact O-C 3.6Å; A7-I332 WeakPolarHBondContact O-CA 3.35Å; L82-I332 HydrophobicContact CD1-CD1 3.63Å; L82-I332 HydrophobicContact CD1-CG1 3.87Å; V98-I332 HydrophobicContact CG1-CD1 3.71Å; V98-I332 HydrophobicContact CG1-CG1 4.22Å; F99-I332 PolarHBondContact O-N 3.41Å; A100-I332 CarbonylContact C-O 3.54Å; A100-I332 WeakPolarHBondContact CA-O 3.43Å; Y101-I332 PolarHBondContact N-O 3.24Å; T111-I332 HydrophobicContact CG2-CD1 4.1Å; T111-I332 HydrophobicContact CG2-CG2 4.12Å; L121-I332 HydrophobicContact CD1-CD1 3.26Å; I330-I332 HydrophobicContact CG2-CG1 4.28Å; I332-T334 HydrophobicContact CG2-CG2 4.23Å; I332-T334 PolarHBondContact O-N 3.42Å
333	A	97.9	Very high	93.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	105.8	177.9	0	0	0	0	0	110.3	A7 V8 R9 M331 T348 A352	A7-A333 PolarHBondContact O-N 3.16Å; V8-A333 CarbonylContact C-O 3.56Å; V8-A333 VanDerWaalsContact CA-O 3.28Å; V8-A333 WeakPolarHBondContact CA-O 3.12Å; V8-A333 HydrophobicContact CG2-CB 4.14Å; R9-A333 PolarHBondContact N-O 2.7Å; M331-A333 HydrophobicContact CE-CB 4.13Å; A333-T348 HydrophobicContact CB-CG2 3.95Å; A333-A352 HydrophobicContact CB-CB 3.65Å
334	T	97.4	Very high	93.9	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133.9	-179.2	58.5	0	0	0	0	110.5	R9 Y101 S106 K108 I332	R9-T334 WeakPolarHBondContact O-CA 3.47Å; Y101-T334 PolarHBondContact O-N 2.97Å; Y101-T334 PolarHBondContact O-OG1 3.48Å; S106-T334 VanDerWaalsContact CB-O 3.28Å; S106-T334 WeakPolarHBondContact CB-O 3.44Å; S106-T334 PolarHBondContact OG-O 3.46Å; S106-T334 PolarHBondContact OG-OG1 3Å; K108-T334 VanDerWaalsContact CG-OG1 3.23Å; K108-T334 WeakPolarHBondContact CG-OG1 3.15Å; K108-T334 PolarHBondContact N-OG1 3.22Å; I332-T334 HydrophobicContact CG2-CG2 4.23Å; I332-T334 PolarHBondContact O-N 3.42Å
335	I	97.3	Very high	94.4	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	151.6	-172.4	60.5	172.5	0	0	0	113.4	V8 R9 V10 R11 I26 M28 T33 T345 T348 L349	V8-I335 HydrophobicContact CG1-CD1 3.76Å; V8-I335 HydrophobicContact CG1-CG1 4.13Å; R9-I335 PolarHBondContact O-N 3.28Å; V10-I335 HydrophobicContact CB-CD1 4.15Å; V10-I335 HydrophobicContact CB-CG1 3.82Å; V10-I335 HydrophobicContact CG2-CG1 4.2Å; R11-I335 PolarHBondContact N-O 3.17Å; I26-I335 HydrophobicContact CD1-CD1 3.94Å; I26-I335 HydrophobicContact CG1-CD1 4.06Å; I26-I335 HydrophobicContact CG2-CD1 4.15Å; M28-I335 HydrophobicContact CE-CD1 3.97Å; T33-I335 HydrophobicContact CG2-CD1 4.31Å; I335-T345 HydrophobicContact CB-CG2 3.77Å; I335-T345 HydrophobicContact CD1-CG2 4.03Å; I335-T345 HydrophobicContact CG1-CG2 4.44Å; I335-T345 HydrophobicContact CG2-CG2 3.94Å; I335-T348 HydrophobicContact CG2-CG2 3.65Å; I335-L349 HydrophobicContact CD1-CD2 4.26Å
336	S	95.2	Very high	94.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.117	C	C	.	.			trans	-82.6	142.4	168.6	170.5	0	0	0	0	110.1	E17 A338 N341 T345	E17-S336 PolarHBondContact OE1-OG 3.17Å; S336-A338 VanDerWaalsContact C-N 3.27Å; S336-A338 PolarHBondContact O-N 3.41Å; S336-A338 WeakPolarHBondContact OG-CB 3.34Å; S336-A338 PolarHBondContact OG-N 3.16Å; S336-A338 VanDerWaalsContact OG-N 3.07Å; S336-N341 WeakPolarHBondContact CB-ND2 3.3Å; S336-N341 PolarHBondContact OG-ND2 2.92Å; S336-T345 PolarHBondContact O-OG1 3.11Å
337	P	95.2	Very high	94.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.127	C	C	.	.			trans	-74.5	-12.1	171	31	-36	0	0	0	113.9	V10 R11 M13 C24 I25 T65	V10-P337 HydrophobicContact CG2-CB 3.8Å; V10-P337 HydrophobicContact CG2-CG 4.34Å; R11-P337 WeakPolarHBondContact O-CD 3.48Å; R11-P337 WeakPolarHBondContact O-CG 3.4Å; M13-P337 HydrophobicContact CE-CB 4.5Å; M13-P337 HydrophobicContact CE-CG 4.42Å; M13-P337 HydrophobicContact CG-CG 3.86Å; M13-P337 HydrophobicContact SD-CB 4.49Å; M13-P337 HydrophobicContact SD-CG 3.81Å; C24-P337 CarbonylContact C-O 3.59Å; C24-P337 WeakPolarHBondContact CA-O 3.36Å; I25-P337 WeakPolarHBondContact CG1-O 3.19Å; I25-P337 PolarHBondContact N-O 2.96Å; T65-P337 HydrophobicContact CG2-CB 4.38Å
338	A	94.5	Very high	94.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-84.9	139.9	-165.1	0	0	0	0	0	114.7	M13 E17 A22 S336 V340 N341	M13-A338 HydrophobicContact CE-CB 3.91Å; M13-A338 HydrophobicContact SD-CB 3.78Å; E17-A338 HydrophobicContact CB-CB 4.24Å; E17-A338 HydrophobicContact CG-CB 3.74Å; A22-A338 HydrophobicContact CB-CB 4.03Å; S336-A338 VanDerWaalsContact C-N 3.27Å; S336-A338 PolarHBondContact O-N 3.41Å; S336-A338 WeakPolarHBondContact OG-CB 3.34Å; S336-A338 PolarHBondContact OG-N 3.16Å; S336-A338 VanDerWaalsContact OG-N 3.07Å; A338-V340 VanDerWaalsContact C-N 3.32Å; A338-V340 HydrophobicContact CB-CG2 3.99Å; A338-V340 PolarHBondContact O-N 2.9Å; A338-N341 WeakPolarHBondContact O-CA 3.43Å; A338-N341 WeakPolarHBondContact O-CB 3.23Å; A338-N341 PolarHBondContact O-N 3.31Å
339	D	93.2	Very high	94.9	Very high	52 Å²	52	18.6 Å²	18.6	28%	0.278	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	-59.3	-36	179.4	67.8	-39.7	0	0	0	114.1	A22 K23 I25 L38 N341 Y342	A22-D339 WeakPolarHBondContact CA-OD1 3.37Å; A22-D339 WeakPolarHBondContact CB-OD1 3.32Å; K23-D339 HydrophobicContact CB-CB 4.44Å; K23-D339 PolarHBondContact N-OD1 2.85Å; K23-D339 PolarHBondContact O-N 3.48Å; I25-D339 HydrophobicContact CG2-CB 3.56Å; L38-D339 HydrophobicContact CD1-CB 3.76Å; D339-N341 PolarHBondContact O-N 3.35Å; D339-N341 VanDerWaalsContact O-N 3.1Å; D339-Y342 VanDerWaalsContact O-CB 3.28Å; D339-Y342 WeakPolarHBondContact O-CB 3.45Å; D339-Y342 PolarHBondContact O-N 3.01Å
340	V	89.9	Confident	94.8	Very high	93 Å²	93	23.7 Å²	23.7	56%	0.564	13%	0.132	S	C	*	.	G	3₁₀ helix	trans	-57	-23.9	172.5	-60.2	0	0	0	0	113.3	A338	A338-V340 VanDerWaalsContact C-N 3.32Å; A338-V340 HydrophobicContact CB-CG2 3.99Å; A338-V340 PolarHBondContact O-N 2.9Å
341	N	91.2	Very high	94.5	Very high	32 Å²	32	24.6 Å²	24.6	17%	0.171	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-101.1	12.2	179.7	-68.9	-52.3	0	0	0	113.7	E17 Q103 S336 A338 D339 G343 E344 T345	E17-N341 PolarHBondContact OE1-ND2 3.15Å; E17-N341 VanDerWaalsContact OE1-ND2 3.13Å; Q103-N341 PolarHBondContact NE2-OD1 3.23Å; S336-N341 WeakPolarHBondContact CB-ND2 3.3Å; S336-N341 PolarHBondContact OG-ND2 2.92Å; A338-N341 WeakPolarHBondContact O-CA 3.43Å; A338-N341 WeakPolarHBondContact O-CB 3.23Å; A338-N341 PolarHBondContact O-N 3.31Å; D339-N341 PolarHBondContact O-N 3.35Å; D339-N341 VanDerWaalsContact O-N 3.1Å; N341-G343 VanDerWaalsContact C-N 3.3Å; N341-G343 PolarHBondContact O-N 2.93Å; N341-E344 PolarHBondContact O-N 3.36Å; N341-T345 WeakPolarHBondContact O-CB 3.42Å; N341-T345 PolarHBondContact O-N 3.22Å; N341-T345 PolarHBondContact O-OG1 3.05Å
342	Y	92.8	Very high	94.4	Very high	40 Å²	40	24.6 Å²	24.6	16%	0.157	14%	0.135	C	C	.	.	H	α-helix	trans	-50.7	-44.2	-175.2	176	-88.9	0	0	0	113.7	I25 I35 N37 D339 L346	I25-Y342 HydrophobicContact CD1-CD2 3.78Å; I25-Y342 HydrophobicContact CD1-CG 4.29Å; I35-Y342 HydrophobicContact CD1-CD2 3.56Å; I35-Y342 HydrophobicContact CD1-CE2 3.62Å; I35-Y342 HydrophobicContact CD1-CG 4.27Å; I35-Y342 HydrophobicContact CG1-CD2 3.82Å; I35-Y342 HydrophobicContact CG1-CE2 3.73Å; N37-Y342 HydrophobicContact CB-CD2 4.43Å; N37-Y342 HydrophobicContact CB-CE1 4.44Å; N37-Y342 HydrophobicContact CB-CE2 3.63Å; D339-Y342 VanDerWaalsContact O-CB 3.28Å; D339-Y342 WeakPolarHBondContact O-CB 3.45Å; D339-Y342 PolarHBondContact O-N 3.01Å; Y342-L346 HydrophobicContact CE1-CD2 3.87Å; Y342-L346 VanDerWaalsContact O-CB 3.26Å; Y342-L346 WeakPolarHBondContact O-CB 3.3Å; Y342-L346 PolarHBondContact O-N 3.34Å
343	G	91.3	Very high	94.2	Very high	43 Å²	43	27.5 Å²	27.5	44%	0.443	15%	0.151	S	C	.	.	H	α-helix	trans	-66.6	-44.7	-175.3	0	0	0	0	0	114	N341 S347	N341-G343 VanDerWaalsContact C-N 3.3Å; N341-G343 PolarHBondContact O-N 2.93Å; G343-S347 WeakPolarHBondContact O-CB 3.33Å; G343-S347 PolarHBondContact O-N 3.25Å; G343-S347 VanDerWaalsContact O-N 3.09Å; G343-S347 PolarHBondContact O-OG 3.4Å
344	E	91.1	Very high	94	Very high	39 Å²	39	33.8 Å²	33.8	18%	0.182	17%	0.174	C	C	.	.	H	α-helix	trans	-72	-37.7	177.7	-66.2	-57.6	151.1	0	0	111.5	Q103 E257 N341 S347 T348	Q103-E344 HydrophobicContact CB-CB 4.23Å; E257-E344 HydrophobicContact CB-CG 4.44Å; N341-E344 PolarHBondContact O-N 3.36Å; E344-S347 PolarHBondContact O-N 3.41Å; E344-T348 WeakPolarHBondContact O-CB 3.27Å; E344-T348 PolarHBondContact O-N 3.01Å; E344-T348 PolarHBondContact O-OG1 3.5Å
345	T	94.8	Very high	93.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.7	-46.5	176.3	-61.4	0	0	0	0	111.6	I26 I35 I335 S336 N341 S347 T348 L349	I26-T345 HydrophobicContact CD1-CG2 3.77Å; I26-T345 HydrophobicContact CG1-CG2 4.42Å; I35-T345 HydrophobicContact CD1-CG2 3.96Å; I335-T345 HydrophobicContact CB-CG2 3.77Å; I335-T345 HydrophobicContact CD1-CG2 4.03Å; I335-T345 HydrophobicContact CG1-CG2 4.44Å; I335-T345 HydrophobicContact CG2-CG2 3.94Å; S336-T345 PolarHBondContact O-OG1 3.11Å; N341-T345 WeakPolarHBondContact O-CB 3.42Å; N341-T345 PolarHBondContact O-N 3.22Å; N341-T345 PolarHBondContact O-OG1 3.05Å; T345-S347 VanDerWaalsContact C-N 3.3Å; T345-S347 PolarHBondContact O-N 3.48Å; T345-T348 PolarHBondContact O-N 2.88Å; T345-L349 HydrophobicContact CG2-CD1 4.25Å; T345-L349 WeakPolarHBondContact O-CG 2.86Å; T345-L349 PolarHBondContact O-N 2.8Å
346	L	94.9	Very high	93.5	Very high	13 Å²	13	36.5 Å²	36.5	7%	0.068	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-38.6	174.1	179.4	61.4	0	0	0	112.2	I35 F56 Y342 L349 R350	I35-L346 HydrophobicContact CD1-CB 4.02Å; I35-L346 HydrophobicContact CG2-CD1 4.12Å; F56-L346 HydrophobicContact CE2-CD1 3.97Å; F56-L346 HydrophobicContact CZ-CD1 3.83Å; Y342-L346 HydrophobicContact CE1-CD2 3.87Å; Y342-L346 VanDerWaalsContact O-CB 3.26Å; Y342-L346 WeakPolarHBondContact O-CB 3.3Å; Y342-L346 PolarHBondContact O-N 3.34Å; L346-L349 PolarHBondContact O-N 3.46Å; L346-R350 HydrophobicContact CD1-CG 4.44Å; L346-R350 VanDerWaalsContact O-CG 3.32Å; L346-R350 WeakPolarHBondContact O-CG 3.37Å; L346-R350 PolarHBondContact O-N 3.4Å
347	S	93.4	Very high	93.3	Very high	58 Å²	58	40.1 Å²	40.1	41%	0.406	21%	0.205	S	C	.	.	H	α-helix	trans	-65.6	-43.6	177.3	-60.5	0	0	0	0	111.3	G343 E344 T345 R350 Y351	G343-S347 WeakPolarHBondContact O-CB 3.33Å; G343-S347 PolarHBondContact O-N 3.25Å; G343-S347 VanDerWaalsContact O-N 3.09Å; G343-S347 PolarHBondContact O-OG 3.4Å; E344-S347 PolarHBondContact O-N 3.41Å; T345-S347 VanDerWaalsContact C-N 3.3Å; T345-S347 PolarHBondContact O-N 3.48Å; S347-R350 PolarHBondContact O-N 2.92Å; S347-Y351 WeakPolarHBondContact O-CB 3.42Å; S347-Y351 PolarHBondContact O-N 3.5Å
348	T	95.8	Very high	93.1	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-45.8	174.8	-61.5	0	0	0	0	112	Y101 A333 I335 E344 T345 Y351 A352	Y101-T348 HydrophobicContact CD1-CG2 4.07Å; Y101-T348 HydrophobicContact CE1-CG2 4.33Å; A333-T348 HydrophobicContact CB-CG2 3.95Å; I335-T348 HydrophobicContact CG2-CG2 3.65Å; E344-T348 WeakPolarHBondContact O-CB 3.27Å; E344-T348 PolarHBondContact O-N 3.01Å; E344-T348 PolarHBondContact O-OG1 3.5Å; T345-T348 PolarHBondContact O-N 2.88Å; T348-Y351 WeakPolarHBondContact O-CB 3.36Å; T348-Y351 PolarHBondContact O-N 2.91Å; T348-A352 WeakPolarHBondContact O-CB 3.43Å; T348-A352 PolarHBondContact O-N 2.88Å
349	L	96.6	Very high	92.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.6	-45.6	177.1	-71.3	171.7	0	0	0	112.4	V8 T33 I35 F56 Y58 I335 T345 L346 Y351 A352 N353	V8-L349 HydrophobicContact CG1-CD2 3.86Å; V8-L349 HydrophobicContact CG2-CD2 4.1Å; T33-L349 HydrophobicContact CG2-CD1 4.34Å; T33-L349 HydrophobicContact CG2-CD2 3.84Å; I35-L349 HydrophobicContact CB-CD1 4.07Å; I35-L349 HydrophobicContact CD1-CD1 4.41Å; I35-L349 HydrophobicContact CG2-CD1 4.07Å; F56-L349 HydrophobicContact CD2-CB 3.99Å; F56-L349 HydrophobicContact CD2-CD1 4.1Å; F56-L349 HydrophobicContact CE2-CB 3.9Å; F56-L349 HydrophobicContact CE2-CD1 4.1Å; F56-L349 HydrophobicContact CG-CB 4.43Å; F56-L349 HydrophobicContact CZ-CB 4.26Å; Y58-L349 HydrophobicContact CE2-CD2 3.9Å; Y58-L349 VanDerWaalsContact OH-C 3.25Å; Y58-L349 VanDerWaalsContact OH-CA 3.29Å; Y58-L349 WeakPolarHBondContact OH-CA 3.13Å; Y58-L349 WeakPolarHBondContact OH-CB 3.45Å; Y58-L349 WeakPolarHBondContact OH-CD2 3.41Å; Y58-L349 PolarHBondContact OH-O 3.19Å; I335-L349 HydrophobicContact CD1-CD2 4.26Å; T345-L349 HydrophobicContact CG2-CD1 4.25Å; T345-L349 WeakPolarHBondContact O-CG 2.86Å; T345-L349 PolarHBondContact O-N 2.8Å; L346-L349 PolarHBondContact O-N 3.46Å; L349-Y351 VanDerWaalsContact C-N 3.33Å; L349-Y351 PolarHBondContact O-N 3.25Å; L349-A352 PolarHBondContact O-N 2.79Å; L349-N353 WeakPolarHBondContact O-CB 3.38Å; L349-N353 PolarHBondContact O-N 3.45Å
350	R	94.4	Very high	92.9	Very high	113 Å²	113	41 Å²	41	43%	0.426	21%	0.209	S	C	.	.	H	α-helix	trans	-61.5	-41	175.9	-74.7	170.6	172.7	176.8	-2.2	112.3	F56 L346 S347 N353 R354	F56-R350 HydrophobicContact CE1-CG 4.05Å; F56-R350 HydrophobicContact CZ-CG 3.99Å; L346-R350 HydrophobicContact CD1-CG 4.44Å; L346-R350 VanDerWaalsContact O-CG 3.32Å; L346-R350 WeakPolarHBondContact O-CG 3.37Å; L346-R350 PolarHBondContact O-N 3.4Å; S347-R350 PolarHBondContact O-N 2.92Å; R350-N353 PolarHBondContact O-N 3.15Å; R350-R354 PolarHBondContact O-N 3.3Å
351	Y	92.7	Very high	92.9	Very high	30 Å²	30	42.7 Å²	42.7	12%	0.118	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-47.8	179.1	-164	-78.5	0	0	0	111.3	Y101 L282 G283 I286 M331 S347 T348 L349 N353 R354 A355	Y101-Y351 HydrophobicContact CD1-CD1 4.25Å; Y101-Y351 HydrophobicContact CD2-CE1 4.2Å; Y101-Y351 AromaticContact CE1-CD1 3.97Å; Y101-Y351 HydrophobicContact CE1-CD1 3.97Å; Y101-Y351 HydrophobicContact CE1-CD2 4.35Å; Y101-Y351 HydrophobicContact CE1-CE1 4.35Å; Y101-Y351 AromaticContact CE1-CG 3.94Å; Y101-Y351 HydrophobicContact CE1-CG 3.94Å; Y101-Y351 HydrophobicContact CE2-CD1 4.37Å; Y101-Y351 AromaticContact CE2-CE1 3.93Å; Y101-Y351 HydrophobicContact CE2-CE1 3.93Å; Y101-Y351 HydrophobicContact CE2-CE2 4.21Å; Y101-Y351 AromaticContact CE2-CZ 3.82Å; Y101-Y351 AromaticContact CZ-CD2 3.94Å; Y101-Y351 AromaticContact CZ-CE2 3.93Å; Y101-Y351 AromaticContact CZ-CG 3.96Å; Y101-Y351 AromaticContact CZ-CZ 3.95Å; L282-Y351 WeakPolarHBondContact CB-OH 3.4Å; L282-Y351 WeakPolarHBondContact CD2-OH 3.26Å; L282-Y351 VanDerWaalsContact CG-OH 3.24Å; L282-Y351 WeakPolarHBondContact CG-OH 3.12Å; G283-Y351 VanDerWaalsContact CA-CE2 3.45Å; G283-Y351 WeakPolarHBondContact CA-OH 3.16Å; G283-Y351 PolarHBondContact N-OH 3.28Å; I286-Y351 HydrophobicContact CD1-CD1 4.35Å; I286-Y351 HydrophobicContact CD1-CE1 3.42Å; I286-Y351 VanDerWaalsContact CD1-CE1 3.42Å; M331-Y351 HydrophobicContact CE-CD1 3.69Å; M331-Y351 HydrophobicContact CE-CE1 4.2Å; M331-Y351 HydrophobicContact SD-CD1 4.39Å; S347-Y351 WeakPolarHBondContact O-CB 3.42Å; S347-Y351 PolarHBondContact O-N 3.5Å; T348-Y351 WeakPolarHBondContact O-CB 3.36Å; T348-Y351 PolarHBondContact O-N 2.91Å; L349-Y351 VanDerWaalsContact C-N 3.33Å; L349-Y351 PolarHBondContact O-N 3.25Å; Y351-N353 VanDerWaalsContact C-N 3.28Å; Y351-N353 PolarHBondContact O-N 3.06Å; Y351-R354 PolarHBondContact O-N 2.77Å; Y351-R354 VanDerWaalsContact O-N 3.15Å; Y351-A355 PolarHBondContact O-N 3.24Å
352	A	95.3	Very high	92.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.6	-40.2	174	0	0	0	0	0	112.2	V6 Y58 M331 A333 T348 L349 R354 A355 K356	V6-A352 HydrophobicContact CG1-CB 3.76Å; Y58-A352 HydrophobicContact CD1-CB 4.4Å; Y58-A352 HydrophobicContact CE1-CB 3.7Å; M331-A352 HydrophobicContact CE-CB 4.08Å; M331-A352 HydrophobicContact SD-CB 4.4Å; A333-A352 HydrophobicContact CB-CB 3.65Å; T348-A352 WeakPolarHBondContact O-CB 3.43Å; T348-A352 PolarHBondContact O-N 2.88Å; L349-A352 PolarHBondContact O-N 2.79Å; A352-R354 VanDerWaalsContact C-N 3.31Å; A352-R354 PolarHBondContact O-N 2.9Å; A352-A355 PolarHBondContact O-N 3.09Å; A352-K356 PolarHBondContact O-N 2.77Å
353	N	93.8	Very high	92.8	Very high	61 Å²	61	44 Å²	44	33%	0.326	22%	0.223	S	C	.	.	H	α-helix	trans	-67	-30.5	179.1	-166.3	97	0	0	0	112.7	F56 Y58 L349 R350 Y351	F56-N353 HydrophobicContact CD1-CB 4.17Å; Y58-N353 HydrophobicContact CE1-CB 4.16Å; L349-N353 WeakPolarHBondContact O-CB 3.38Å; L349-N353 PolarHBondContact O-N 3.45Å; R350-N353 PolarHBondContact O-N 3.15Å; Y351-N353 VanDerWaalsContact C-N 3.28Å; Y351-N353 PolarHBondContact O-N 3.06Å
354	R	92.3	Very high	92.8	Very high	132 Å²	132	44.7 Å²	44.7	50%	0.498	22%	0.218	S	C	.	.	H	α-helix	trans	-73.5	-43.2	172.1	-69.7	-177	-178.8	179.2	0.2	112	I286 S287 A290 R350 Y351 A352 K356 N357	I286-R354 HydrophobicContact CG2-CB 4.08Å; S287-R354 PolarHBondContact OG-NH1 3.45Å; A290-R354 HydrophobicContact CB-CB 4.29Å; A290-R354 WeakPolarHBondContact CB-O 3.22Å; R350-R354 PolarHBondContact O-N 3.3Å; Y351-R354 PolarHBondContact O-N 2.77Å; Y351-R354 VanDerWaalsContact O-N 3.15Å; A352-R354 VanDerWaalsContact C-N 3.31Å; A352-R354 PolarHBondContact O-N 2.9Å; R354-K356 PolarHBondContact O-N 2.82Å; R354-N357 PolarHBondContact O-N 3.45Å
355	A	93.1	Very high	92.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.9	-34.1	-178.4	0	0	0	0	0	112.8	V6 I286 M331 Y351 A352 N357 I358	V6-A355 HydrophobicContact CG2-CB 4.25Å; I286-A355 HydrophobicContact CG2-CB 4.22Å; M331-A355 HydrophobicContact SD-CB 3.48Å; M331-A355 WeakPolarHBondContact SD-CB 3.11Å; Y351-A355 PolarHBondContact O-N 3.24Å; A352-A355 PolarHBondContact O-N 3.09Å; A355-N357 PolarHBondContact O-N 2.89Å; A355-I358 WeakPolarHBondContact O-CB 3.46Å; A355-I358 WeakPolarHBondContact O-CG1 3.35Å; A355-I358 PolarHBondContact O-N 3.5Å; A355-I358 VanDerWaalsContact O-N 3.1Å
356	K	91.9	Very high	92.1	Very high	58 Å²	58	46.9 Å²	46.9	25%	0.252	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-29.5	176.7	-170.4	172.4	-179.2	161.5	0	114.2	V6 Y58 D59 A352 R354 I358	V6-K356 HydrophobicContact CB-CB 4.46Å; V6-K356 HydrophobicContact CG2-CB 3.79Å; V6-K356 HydrophobicContact CG2-CG 4.44Å; Y58-K356 PolarHBondContact O-NZ 2.76Å; D59-K356 WeakPolarHBondContact OD1-CE 3.42Å; D59-K356 IonicContact OD1-NZ 3.36Å; D59-K356 PolarHBondContact OD1-NZ 2.9Å; A352-K356 PolarHBondContact O-N 2.77Å; R354-K356 PolarHBondContact O-N 2.82Å; K356-I358 VanDerWaalsContact C-N 3.3Å; K356-I358 PolarHBondContact O-N 3.36Å
357	N	90.2	Very high	91.3	Very high	76 Å²	76	48 Å²	48	41%	0.406	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.7	-177.7	-66.1	1.9	0	0	0	113	A290 A293 R354 A355	A290-N357 HydrophobicContact CB-CB 4.14Å; A293-N357 HydrophobicContact CB-CB 4.25Å; A293-N357 WeakPolarHBondContact CB-O 3.45Å; R354-N357 PolarHBondContact O-N 3.45Å; A355-N357 PolarHBondContact O-N 2.89Å
358	I	91.8	Very high	90.4	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.241	C	C	.	.			trans	-73.1	131.2	-179.7	-60	176.5	0	0	0	110	S3 V4 I286 L289 L323 A355 K356	S3-I358 CarbonylContact C-O 3.21Å; S3-I358 VanDerWaalsContact CA-O 3.31Å; S3-I358 WeakPolarHBondContact CA-O 3.2Å; V4-I358 HydrophobicContact CB-CB 4.32Å; V4-I358 HydrophobicContact CG2-CB 3.73Å; V4-I358 HydrophobicContact CG2-CG2 3.77Å; V4-I358 PolarHBondContact N-O 3.06Å; I286-I358 HydrophobicContact CB-CD1 4.05Å; I286-I358 HydrophobicContact CG1-CD1 3.71Å; I286-I358 HydrophobicContact CG2-CD1 4.05Å; L289-I358 HydrophobicContact CB-CB 4.5Å; L289-I358 HydrophobicContact CB-CD1 4.05Å; L289-I358 HydrophobicContact CB-CG1 3.79Å; L289-I358 HydrophobicContact CB-CG2 4.15Å; L289-I358 HydrophobicContact CD1-CD1 4.15Å; L289-I358 HydrophobicContact CD1-CG2 4.01Å; L323-I358 HydrophobicContact CD2-CD1 4.45Å; A355-I358 WeakPolarHBondContact O-CB 3.46Å; A355-I358 WeakPolarHBondContact O-CG1 3.35Å; A355-I358 PolarHBondContact O-N 3.5Å; A355-I358 VanDerWaalsContact O-N 3.1Å; K356-I358 VanDerWaalsContact C-N 3.3Å; K356-I358 PolarHBondContact O-N 3.36Å
359	I	90.6	Very high	89.5	Confident	68 Å²	68	51.5 Å²	51.5	35%	0.349	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	112.8	179.2	-56.2	176.8	0	0	0	109.9	M1 P294	M1-I359 HydrophobicContact CB-CG2 3.74Å; M1-I359 HydrophobicContact CG-CG2 4.37Å; M1-I359 HydrophobicContact SD-CG2 3.95Å; P294-I359 HydrophobicContact CG-CD1 4.5Å
360	N	92.2	Very high	88.5	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	162.9	173.3	-73.4	13	0	0	0	112	M1 A2 S322 G324 A327 T329 P362	M1-N360 CarbonylContact C-O 3.58Å; M1-N360 WeakPolarHBondContact CA-O 3.46Å; A2-N360 PolarHBondContact N-O 3.38Å; A2-N360 WeakPolarHBondContact O-CA 3.48Å; A2-N360 PolarHBondContact O-N 3.49Å; S322-N360 PolarHBondContact O-ND2 2.91Å; G324-N360 WeakPolarHBondContact CA-OD1 3.5Å; G324-N360 PolarHBondContact N-OD1 2.84Å; A327-N360 WeakPolarHBondContact O-CB 3.45Å; A327-N360 PolarHBondContact O-ND2 2.82Å; T329-N360 PolarHBondContact OG1-ND2 2.85Å; T329-N360 VanDerWaalsContact OG1-ND2 3.17Å; N360-P362 WeakPolarHBondContact O-CD 3.42Å
361	K	91	Very high	87.9	Confident	130 Å²	130	52.3 Å²	52.3	57%	0.565	26%	0.259	S	S	*	.			trans	-123.6	65.2	176.8	-63.3	-179.5	-176.5	175.4	0	110.5	M1 G325	M1-K361 HydrophobicContact CG-CG 4.34Å; G325-K361 CarbonylContact O-C 3.56Å; G325-K361 PolarHBondContact O-N 3.06Å
362	P	91.6	Very high	87.3	Confident	23 Å²	23	53.7 Å²	53.7	15%	0.149	27%	0.268	C	S	.	.			trans	-63.9	137.5	176.8	27.9	-35	0	0	0	111.4	A2 Y94 N326 K328 N360	A2-P362 HydrophobicContact CB-CG 3.9Å; Y94-P362 HydrophobicContact CD1-CB 3.86Å; Y94-P362 HydrophobicContact CE1-CB 4.28Å; N326-P362 WeakPolarHBondContact OD1-CA 3.49Å; K328-P362 HydrophobicContact CG-CB 3.89Å; K328-P362 HydrophobicContact CG-CG 4Å; N360-P362 WeakPolarHBondContact O-CD 3.42Å
363	T	90.8	Very high	86.5	Confident	77 Å²	77	53.7 Å²	53.7	47%	0.472	27%	0.268	S	S	.	.			trans	-129.1	150.1	175.1	50.9	0	0	0	0	109.5	Y94 N326 N365	Y94-T363 VanDerWaalsContact CD1-C 3.43Å; Y94-T363 WeakPolarHBondContact CD1-O 3.41Å; N326-T363 VanDerWaalsContact CG-OG1 3.27Å; N326-T363 PolarHBondContact ND2-OG1 3.41Å; N326-T363 PolarHBondContact OD1-N 2.94Å; N326-T363 PolarHBondContact OD1-O 2.77Å; N326-T363 PolarHBondContact OD1-OG1 2.89Å; T363-N365 PolarHBondContact O-N 2.87Å
364	V	90.7	Very high	85.9	Confident	56 Å²	56	56.3 Å²	56.3	34%	0.339	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-68.7	125.1	171.1	179.4	0	0	0	0	108.2	G93 Y94 T244 E366	G93-V364 WeakPolarHBondContact O-CA 3.39Å; Y94-V364 HydrophobicContact CD1-CG2 4.32Å; Y94-V364 HydrophobicContact CD2-CG2 4.36Å; Y94-V364 HydrophobicContact CE1-CG2 3.82Å; Y94-V364 HydrophobicContact CE2-CG2 3.85Å; T244-V364 HydrophobicContact CG2-CG1 4.21Å; V364-E366 PolarHBondContact O-N 3.29Å
365	N	87.9	Confident	85.5	Confident	38 Å²	38	54.4 Å²	54.4	20%	0.203	27%	0.27	C	S	.	.			trans	-89.3	86.3	175	-26.9	-85.2	0	0	0	108.9	G93 N95 T244 V245 N326 T363	G93-N365 PolarHBondContact O-N 3.38Å; G93-N365 PolarHBondContact O-ND2 2.97Å; G93-N365 VanDerWaalsContact O-ND2 3.12Å; N95-N365 PolarHBondContact ND2-OD1 3.44Å; N95-N365 PolarHBondContact OD1-ND2 3.37Å; T244-N365 WeakPolarHBondContact CA-O 3.48Å; V245-N365 PolarHBondContact N-O 3.45Å; V245-N365 WeakPolarHBondContact O-CB 3.4Å; V245-N365 PolarHBondContact O-ND2 2.66Å; N326-N365 PolarHBondContact ND2-OD1 3.02Å; T363-N365 PolarHBondContact O-N 2.87Å
366	E	83.9	Confident	85.1	Confident	48 Å²	48	55.3 Å²	55.3	22%	0.224	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-90.5	146.9	169.3	55.6	-175.7	-170.9	0	0	110.7	E243 V364 R371 R374	E243-E366 WeakPolarHBondContact O-CA 3.27Å; V364-E366 PolarHBondContact O-N 3.29Å; E366-R371 HydrophobicContact CG-CB 4.14Å; E366-R371 VanDerWaalsContact OE1-CD 3.27Å; E366-R371 WeakPolarHBondContact OE1-CD 3.49Å; E366-R371 VanDerWaalsContact OE1-CG 3.3Å; E366-R371 WeakPolarHBondContact OE1-CG 3.31Å; E366-R371 IonicContact OE1-NE 3.45Å; E366-R374 VanDerWaalsContact CD-NH2 3.34Å; E366-R374 IonicContact OE1-CZ 2.79Å; E366-R374 IonicContact OE1-NH1 2.72Å; E366-R374 IonicContact OE1-NH2 3.32Å; E366-R374 PolarHBondContact OE1-NH2 2.57Å; E366-R374 IonicContact OE2-CZ 3.86Å; E366-R374 VanDerWaalsContact OE2-CZ 3.32Å; E366-R374 IonicContact OE2-NH1 3.12Å; E366-R374 PolarHBondContact OE2-NH1 2.85Å; E366-R374 IonicContact OE2-NH2 2.72Å; E366-R374 PolarHBondContact OE2-NH2 3.4Å; E366-R374 VanDerWaalsContact OE2-NH2 3.14Å
367	D	78	Confident	84.5	Confident	37 Å²	37	55.4 Å²	55.4	20%	0.198	27%	0.274	C	S	.	.			trans	-59.4	140	174.8	173.7	-79.4	0	0	0	111	E243 N369 V370 R371 K425	E243-D367 HydrophobicContact CB-CB 4.25Å; E243-D367 PolarHBondContact O-N 3.4Å; D367-N369 VanDerWaalsContact C-N 3.3Å; D367-N369 PolarHBondContact O-N 2.81Å; D367-N369 WeakPolarHBondContact OD1-CA 3.28Å; D367-N369 VanDerWaalsContact OD1-CB 3.26Å; D367-N369 WeakPolarHBondContact OD1-CB 3.44Å; D367-N369 PolarHBondContact OD1-N 3.14Å; D367-V370 HydrophobicContact CB-CB 4.04Å; D367-V370 HydrophobicContact CB-CG2 4.03Å; D367-V370 WeakPolarHBondContact O-CB 3.43Å; D367-V370 PolarHBondContact O-N 3.12Å; D367-V370 PolarHBondContact OD1-N 3.03Å; D367-R371 WeakPolarHBondContact O-CB 3.41Å; D367-R371 PolarHBondContact O-N 3.14Å; D367-K425 IonicContact OD2-NZ 3.12Å
368	S	74.3	Confident	84.2	Confident	72 Å²	72	54.8 Å²	54.8	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-67.1	-30.2	-174.3	53.4	0	0	0	0	113.5	L372	S368-L372 VanDerWaalsContact O-CB 3.23Å; S368-L372 WeakPolarHBondContact O-CB 3.42Å; S368-L372 PolarHBondContact O-N 3.01Å
369	N	75.7	Confident	83.6	Confident	60 Å²	60	57.7 Å²	57.7	32%	0.321	29%	0.293	S	S	.	.	H	α-helix	trans	-76.7	-40.2	176	-62.8	3.7	0	0	0	109.7	D367 R371 L372 I373 L418	D367-N369 VanDerWaalsContact C-N 3.3Å; D367-N369 PolarHBondContact O-N 2.81Å; D367-N369 WeakPolarHBondContact OD1-CA 3.28Å; D367-N369 VanDerWaalsContact OD1-CB 3.26Å; D367-N369 WeakPolarHBondContact OD1-CB 3.44Å; D367-N369 PolarHBondContact OD1-N 3.14Å; N369-R371 PolarHBondContact O-N 3.48Å; N369-L372 CarbonylContact O-C 3.59Å; N369-L372 PolarHBondContact O-N 3.26Å; N369-I373 WeakPolarHBondContact O-CB 3.45Å; N369-I373 WeakPolarHBondContact O-CD1 3.44Å; N369-I373 WeakPolarHBondContact O-CG1 3.29Å; N369-I373 PolarHBondContact O-N 2.89Å; N369-L418 HydrophobicContact CB-CD2 4.32Å
370	V	76.4	Confident	83.2	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.03	28%	0.28	C	S	.	.	H	α-helix	trans	-57.5	-48.1	171.2	162.3	0	0	0	0	111.6	P241 E243 D367 L372 I373 R374	P241-V370 WeakPolarHBondContact O-CG1 3.37Å; E243-V370 HydrophobicContact CB-CG2 4.03Å; D367-V370 HydrophobicContact CB-CB 4.04Å; D367-V370 HydrophobicContact CB-CG2 4.03Å; D367-V370 WeakPolarHBondContact O-CB 3.43Å; D367-V370 PolarHBondContact O-N 3.12Å; D367-V370 PolarHBondContact OD1-N 3.03Å; V370-L372 VanDerWaalsContact C-N 3.34Å; V370-L372 PolarHBondContact O-N 2.94Å; V370-I373 PolarHBondContact O-N 3.23Å; V370-R374 PolarHBondContact O-N 3.34Å
371	R	81	Confident	82.7	Confident	125 Å²	125	58 Å²	58	47%	0.472	30%	0.304	S	S	.	.	H	α-helix	trans	-59.2	-45.9	174.8	177.9	178.6	171.9	152	2.8	111.5	E366 D367 N369 I373 R374 E375	E366-R371 HydrophobicContact CG-CB 4.14Å; E366-R371 VanDerWaalsContact OE1-CD 3.27Å; E366-R371 WeakPolarHBondContact OE1-CD 3.49Å; E366-R371 VanDerWaalsContact OE1-CG 3.3Å; E366-R371 WeakPolarHBondContact OE1-CG 3.31Å; E366-R371 IonicContact OE1-NE 3.45Å; D367-R371 WeakPolarHBondContact O-CB 3.41Å; D367-R371 PolarHBondContact O-N 3.14Å; N369-R371 PolarHBondContact O-N 3.48Å; R371-I373 VanDerWaalsContact C-N 3.35Å; R371-R374 WeakPolarHBondContact O-CB 3.46Å; R371-R374 PolarHBondContact O-N 3.24Å; R371-E375 IonicContact CZ-OE1 2.7Å; R371-E375 IonicContact NE-OE1 3.48Å; R371-E375 PolarHBondContact NE-OE1 2.88Å; R371-E375 IonicContact NH2-OE1 3.29Å; R371-E375 PolarHBondContact NH2-OE1 3.04Å; R371-E375 VanDerWaalsContact NH2-OE1 3.08Å; R371-E375 WeakPolarHBondContact O-CG 3.3Å; R371-E375 PolarHBondContact O-N 3.17Å
372	L	81.1	Confident	82.3	Confident	59 Å²	59	57.4 Å²	57.4	31%	0.309	30%	0.297	S	S	.	.	H	α-helix	trans	-64.9	-36.6	177.4	-178.5	61.4	0	0	0	111.9	S368 N369 V370 R374 E375 L376 L418	S368-L372 VanDerWaalsContact O-CB 3.23Å; S368-L372 WeakPolarHBondContact O-CB 3.42Å; S368-L372 PolarHBondContact O-N 3.01Å; N369-L372 CarbonylContact O-C 3.59Å; N369-L372 PolarHBondContact O-N 3.26Å; V370-L372 VanDerWaalsContact C-N 3.34Å; V370-L372 PolarHBondContact O-N 2.94Å; L372-R374 VanDerWaalsContact C-N 3.34Å; L372-E375 PolarHBondContact O-N 3.4Å; L372-L376 HydrophobicContact CD1-CD1 4.05Å; L372-L376 HydrophobicContact CD1-CD2 4.48Å; L372-L376 HydrophobicContact CD1-CG 3.86Å; L372-L376 HydrophobicContact CD2-CD1 4.42Å; L372-L376 HydrophobicContact CG-CD1 3.8Å; L372-L376 HydrophobicContact CG-CG 4.1Å; L372-L376 WeakPolarHBondContact O-CB 3.39Å; L372-L376 VanDerWaalsContact O-CG 3.23Å; L372-L376 WeakPolarHBondContact O-CG 3.49Å; L372-L376 PolarHBondContact O-N 3.28Å; L372-L418 HydrophobicContact CD2-CD1 3.69Å; L372-L418 HydrophobicContact CG-CD1 3.98Å
373	I	78.6	Confident	81.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.8	-41.3	172.6	-68.9	159.9	0	0	0	109.8	M240 P241 N369 V370 R371 R377 V415 L418 W422	M240-I373 HydrophobicContact CE-CG2 3.99Å; P241-I373 HydrophobicContact CG-CD1 4.14Å; P241-I373 HydrophobicContact CG-CG2 4.38Å; N369-I373 WeakPolarHBondContact O-CB 3.45Å; N369-I373 WeakPolarHBondContact O-CD1 3.44Å; N369-I373 WeakPolarHBondContact O-CG1 3.29Å; N369-I373 PolarHBondContact O-N 2.89Å; V370-I373 PolarHBondContact O-N 3.23Å; R371-I373 VanDerWaalsContact C-N 3.35Å; I373-R377 HydrophobicContact CG2-CG 4.24Å; I373-R377 VanDerWaalsContact O-CB 3.24Å; I373-R377 WeakPolarHBondContact O-CB 3.49Å; I373-R377 VanDerWaalsContact O-CG 3.3Å; I373-R377 WeakPolarHBondContact O-CG 3.26Å; I373-R377 PolarHBondContact O-N 3.24Å; I373-V415 HydrophobicContact CG2-CG1 4.43Å; I373-L418 HydrophobicContact CD1-CB 3.91Å; I373-L418 HydrophobicContact CG1-CB 3.67Å; I373-L418 HydrophobicContact CG1-CD1 4.36Å; I373-W422 HydrophobicContact CD1-CB 4.45Å
374	R	81.6	Confident	81.1	Confident	117 Å²	117	57.2 Å²	57.2	44%	0.442	29%	0.288	S	S	.	.	H	α-helix	trans	-64.8	-45.1	174.8	-171.4	-179	65.5	-139.1	-10.7	112.4	M240 E366 V370 R371 L372 A378	M240-R374 HydrophobicContact CE-CB 3.88Å; M240-R374 HydrophobicContact CE-CG 4.28Å; E366-R374 VanDerWaalsContact CD-NH2 3.34Å; E366-R374 IonicContact OE1-CZ 2.79Å; E366-R374 IonicContact OE1-NH1 2.72Å; E366-R374 IonicContact OE1-NH2 3.32Å; E366-R374 PolarHBondContact OE1-NH2 2.57Å; E366-R374 IonicContact OE2-CZ 3.86Å; E366-R374 VanDerWaalsContact OE2-CZ 3.32Å; E366-R374 IonicContact OE2-NH1 3.12Å; E366-R374 PolarHBondContact OE2-NH1 2.85Å; E366-R374 IonicContact OE2-NH2 2.72Å; E366-R374 PolarHBondContact OE2-NH2 3.4Å; E366-R374 VanDerWaalsContact OE2-NH2 3.14Å; V370-R374 PolarHBondContact O-N 3.34Å; R371-R374 WeakPolarHBondContact O-CB 3.46Å; R371-R374 PolarHBondContact O-N 3.24Å; L372-R374 VanDerWaalsContact C-N 3.34Å; R374-A378 WeakPolarHBondContact O-CB 3.43Å; R374-A378 PolarHBondContact O-N 3.16Å
375	E	83.9	Confident	80.6	Confident	91 Å²	91	57 Å²	57	43%	0.425	29%	0.292	S	S	.	.	H	α-helix	trans	-65.5	-44.2	177.7	-70.7	175.2	-174.9	0	0	111.3	R371 L372 A378 E379	R371-E375 IonicContact CZ-OE1 2.7Å; R371-E375 IonicContact NE-OE1 3.48Å; R371-E375 PolarHBondContact NE-OE1 2.88Å; R371-E375 IonicContact NH2-OE1 3.29Å; R371-E375 PolarHBondContact NH2-OE1 3.04Å; R371-E375 VanDerWaalsContact NH2-OE1 3.08Å; R371-E375 WeakPolarHBondContact O-CG 3.3Å; R371-E375 PolarHBondContact O-N 3.17Å; L372-E375 PolarHBondContact O-N 3.4Å; E375-A378 PolarHBondContact O-N 3.16Å; E375-E379 WeakPolarHBondContact O-CB 3.47Å; E375-E379 PolarHBondContact O-N 3.09Å
376	L	83.5	Confident	79.9	Confident	19 Å²	19	57.7 Å²	57.7	10%	0.099	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-36.4	175.4	-71.6	174.2	0	0	0	112.8	L372 E379 I380 R414 V415 L418	L372-L376 HydrophobicContact CD1-CD1 4.05Å; L372-L376 HydrophobicContact CD1-CD2 4.48Å; L372-L376 HydrophobicContact CD1-CG 3.86Å; L372-L376 HydrophobicContact CD2-CD1 4.42Å; L372-L376 HydrophobicContact CG-CD1 3.8Å; L372-L376 HydrophobicContact CG-CG 4.1Å; L372-L376 WeakPolarHBondContact O-CB 3.39Å; L372-L376 VanDerWaalsContact O-CG 3.23Å; L372-L376 WeakPolarHBondContact O-CG 3.49Å; L372-L376 PolarHBondContact O-N 3.28Å; L376-E379 CarbonylContact O-C 3.57Å; L376-E379 PolarHBondContact O-N 3.47Å; L376-I380 WeakPolarHBondContact O-CB 3.4Å; L376-I380 WeakPolarHBondContact O-CG1 3.29Å; L376-I380 PolarHBondContact O-N 3.03Å; L376-R414 HydrophobicContact CD1-CB 4.39Å; L376-R414 HydrophobicContact CD1-CG 4.01Å; L376-V415 HydrophobicContact CB-CG2 3.38Å; L376-V415 HydrophobicContact CD1-CG2 4.04Å; L376-V415 HydrophobicContact CG-CG2 4.36Å; L376-L418 HydrophobicContact CD1-CD1 3.78Å
377	R	80.3	Confident	79.3	Confident	61 Å²	61	56.6 Å²	56.6	23%	0.23	29%	0.291	C	S	.	.	H	α-helix	trans	-71.5	-33.8	174.5	-75.3	-152.4	-151.9	167.3	3.6	112.2	E239 M240 I373 E379 I380 A381 V415	E239-R377 VanDerWaalsContact O-CZ 3.3Å; E239-R377 PolarHBondContact O-NH1 2.84Å; E239-R377 PolarHBondContact O-NH2 2.92Å; M240-R377 HydrophobicContact SD-CB 4.38Å; M240-R377 VanDerWaalsContact SD-CD 3.53Å; M240-R377 HydrophobicContact SD-CG 4.34Å; M240-R377 PolarHBondContact SD-NH1 2.84Å; I373-R377 HydrophobicContact CG2-CG 4.24Å; I373-R377 VanDerWaalsContact O-CB 3.24Å; I373-R377 WeakPolarHBondContact O-CB 3.49Å; I373-R377 VanDerWaalsContact O-CG 3.3Å; I373-R377 WeakPolarHBondContact O-CG 3.26Å; I373-R377 PolarHBondContact O-N 3.24Å; R377-E379 VanDerWaalsContact C-N 3.31Å; R377-I380 PolarHBondContact O-N 3.28Å; R377-A381 VanDerWaalsContact O-CB 3.31Å; R377-A381 WeakPolarHBondContact O-CB 3.47Å; R377-A381 PolarHBondContact O-N 3.12Å; R377-V415 HydrophobicContact CG-CB 4.5Å; R377-V415 HydrophobicContact CG-CG1 3.69Å; R377-V415 HydrophobicContact CG-CG2 4Å
378	A	82.5	Confident	78.7	Confident	63 Å²	63	60.5 Å²	60.5	52%	0.521	31%	0.312	S	S	.	.	H	α-helix	trans	-63	-40.2	168.1	0	0	0	0	0	111	R374 E375 A381 R382	R374-A378 WeakPolarHBondContact O-CB 3.43Å; R374-A378 PolarHBondContact O-N 3.16Å; E375-A378 PolarHBondContact O-N 3.16Å; A378-A381 PolarHBondContact O-N 3.31Å; A378-R382 WeakPolarHBondContact O-CB 3.15Å; A378-R382 PolarHBondContact O-N 2.64Å
379	E	80.5	Confident	77.9	Confident	62 Å²	62	61.9 Å²	61.9	29%	0.29	31%	0.31	S	S	.	.	H	α-helix	trans	-70	-35.8	175.1	-176	62.2	-172.6	0	0	112.9	E375 L376 R377 R382 L383	E375-E379 WeakPolarHBondContact O-CB 3.47Å; E375-E379 PolarHBondContact O-N 3.09Å; L376-E379 CarbonylContact O-C 3.57Å; L376-E379 PolarHBondContact O-N 3.47Å; R377-E379 VanDerWaalsContact C-N 3.31Å; E379-R382 WeakPolarHBondContact O-CB 3.47Å; E379-R382 PolarHBondContact O-N 2.83Å; E379-R382 IonicContact OE1-CZ 4Å; E379-R382 IonicContact OE1-NE 2.97Å; E379-R382 PolarHBondContact OE1-NE 2.89Å; E379-R382 IonicContact OE1-NH2 3.13Å; E379-R382 PolarHBondContact OE1-NH2 3.47Å; E379-R382 IonicContact OE2-CZ 3.84Å; E379-R382 IonicContact OE2-NE 2.76Å; E379-R382 PolarHBondContact OE2-NE 2.95Å; E379-R382 IonicContact OE2-NH2 3.55Å; E379-L383 HydrophobicContact CG-CD1 4.06Å; E379-L383 HydrophobicContact CG-CG 4.47Å; E379-L383 WeakPolarHBondContact O-CB 3.48Å; E379-L383 VanDerWaalsContact O-CG 3.22Å; E379-L383 WeakPolarHBondContact O-CG 3.05Å; E379-L383 PolarHBondContact O-N 3.28Å
380	I	81.5	Confident	76.8	Confident	15 Å²	15	60.6 Å²	60.6	8%	0.077	31%	0.311	C	S	.	.	H	α-helix	trans	-66.5	-44.9	170.8	-70.6	162.9	0	0	0	109.7	L376 R377 R382 L383 K384 L408 N411 E412 V415	L376-I380 WeakPolarHBondContact O-CB 3.4Å; L376-I380 WeakPolarHBondContact O-CG1 3.29Å; L376-I380 PolarHBondContact O-N 3.03Å; R377-I380 PolarHBondContact O-N 3.28Å; I380-R382 PolarHBondContact O-N 2.96Å; I380-L383 PolarHBondContact O-N 3.45Å; I380-L383 VanDerWaalsContact O-N 3.17Å; I380-K384 HydrophobicContact CG2-CD 3.89Å; I380-K384 HydrophobicContact CG2-CG 3.97Å; I380-K384 VanDerWaalsContact O-CB 3.32Å; I380-K384 WeakPolarHBondContact O-CB 3.41Å; I380-K384 VanDerWaalsContact O-CG 3.32Å; I380-K384 WeakPolarHBondContact O-CG 3.44Å; I380-K384 PolarHBondContact O-N 2.9Å; I380-L408 HydrophobicContact CG2-CD1 4.06Å; I380-N411 HydrophobicContact CD1-CB 4.28Å; I380-N411 WeakPolarHBondContact CD1-O 3.3Å; I380-N411 HydrophobicContact CG1-CB 3.75Å; I380-E412 HydrophobicContact CD1-CG 4.09Å; I380-E412 HydrophobicContact CG1-CG 4.26Å; I380-E412 HydrophobicContact CG2-CG 4.09Å; I380-V415 HydrophobicContact CD1-CB 3.77Å; I380-V415 HydrophobicContact CD1-CG1 4.31Å; I380-V415 HydrophobicContact CD1-CG2 3.51Å
381	A	81.1	Confident	75.4	Confident	61 Å²	61	65.5 Å²	65.5	50%	0.504	34%	0.337	S	S	.	.	H	α-helix	trans	-59.4	-39.7	176	0	0	0	0	0	110.6	R377 A378 A385	R377-A381 VanDerWaalsContact O-CB 3.31Å; R377-A381 WeakPolarHBondContact O-CB 3.47Å; R377-A381 PolarHBondContact O-N 3.12Å; A378-A381 PolarHBondContact O-N 3.31Å; A381-A385 VanDerWaalsContact O-CB 3.27Å; A381-A385 WeakPolarHBondContact O-CB 3.18Å; A381-A385 PolarHBondContact O-N 2.83Å
382	R	84.1	Confident	73.7	Confident	116 Å²	116	67.3 Å²	67.3	44%	0.438	35%	0.351	S	S	.	.	H	α-helix	trans	-62.6	-49.6	171.8	-161.1	-170.8	72	71.6	1.9	112.1	A378 E379 I380 A385 L386	A378-R382 WeakPolarHBondContact O-CB 3.15Å; A378-R382 PolarHBondContact O-N 2.64Å; E379-R382 WeakPolarHBondContact O-CB 3.47Å; E379-R382 PolarHBondContact O-N 2.83Å; E379-R382 IonicContact OE1-CZ 4Å; E379-R382 IonicContact OE1-NE 2.97Å; E379-R382 PolarHBondContact OE1-NE 2.89Å; E379-R382 IonicContact OE1-NH2 3.13Å; E379-R382 PolarHBondContact OE1-NH2 3.47Å; E379-R382 IonicContact OE2-CZ 3.84Å; E379-R382 IonicContact OE2-NE 2.76Å; E379-R382 PolarHBondContact OE2-NE 2.95Å; E379-R382 IonicContact OE2-NH2 3.55Å; I380-R382 PolarHBondContact O-N 2.96Å; R382-A385 PolarHBondContact O-N 2.65Å; R382-L386 HydrophobicContact CG-CD1 4.15Å; R382-L386 WeakPolarHBondContact O-CD1 3.14Å; R382-L386 PolarHBondContact O-N 3.29Å
383	L	79.1	Confident	71.9	Confident	8 Å²	8	68 Å²	68	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-68.8	-38.1	-178.7	-72.6	168.8	0	0	0	112.6	E379 I380 L386 L387 L408 N411	E379-L383 HydrophobicContact CG-CD1 4.06Å; E379-L383 HydrophobicContact CG-CG 4.47Å; E379-L383 WeakPolarHBondContact O-CB 3.48Å; E379-L383 VanDerWaalsContact O-CG 3.22Å; E379-L383 WeakPolarHBondContact O-CG 3.05Å; E379-L383 PolarHBondContact O-N 3.28Å; I380-L383 PolarHBondContact O-N 3.45Å; I380-L383 VanDerWaalsContact O-N 3.17Å; L383-L386 WeakPolarHBondContact O-CB 3.43Å; L383-L386 PolarHBondContact O-N 3.21Å; L383-L387 WeakPolarHBondContact O-CB 3.48Å; L383-L387 WeakPolarHBondContact O-CG 3.49Å; L383-L387 PolarHBondContact O-N 2.95Å; L383-L408 HydrophobicContact CB-CD1 3.68Å; L383-N411 VanDerWaalsContact CD1-ND2 3.3Å; L383-N411 WeakPolarHBondContact CD1-ND2 3.19Å
384	K	78.1	Confident	70.3	Confident	88 Å²	88	73.2 Å²	73.2	38%	0.383	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-43.3	171.1	-72.4	-168.1	176.4	-175.5	0	110.9	I380 L386 L387 L388 L408 E412	I380-K384 HydrophobicContact CG2-CD 3.89Å; I380-K384 HydrophobicContact CG2-CG 3.97Å; I380-K384 VanDerWaalsContact O-CB 3.32Å; I380-K384 WeakPolarHBondContact O-CB 3.41Å; I380-K384 VanDerWaalsContact O-CG 3.32Å; I380-K384 WeakPolarHBondContact O-CG 3.44Å; I380-K384 PolarHBondContact O-N 2.9Å; K384-L386 VanDerWaalsContact C-N 3.31Å; K384-L386 PolarHBondContact O-N 3.29Å; K384-L387 PolarHBondContact O-N 2.84Å; K384-L388 VanDerWaalsContact O-CB 3.3Å; K384-L388 WeakPolarHBondContact O-CB 3.2Å; K384-L388 PolarHBondContact O-N 2.97Å; K384-L408 HydrophobicContact CB-CD1 4.49Å; K384-L408 HydrophobicContact CG-CD1 3.51Å; K384-L408 HydrophobicContact CG-CD2 4.32Å; K384-E412 WeakPolarHBondContact CE-OE1 3.48Å; K384-E412 IonicContact NZ-OE1 2.83Å; K384-E412 PolarHBondContact NZ-OE1 3.39Å
385	A	79.4	Confident	68.7	Low	51 Å²	51	71.8 Å²	71.8	42%	0.421	40%	0.397	S	S	.	.	H	α-helix	trans	-60.1	-42.6	173.4	0	0	0	0	0	111.4	A381 R382 Q389	A381-A385 VanDerWaalsContact O-CB 3.27Å; A381-A385 WeakPolarHBondContact O-CB 3.18Å; A381-A385 PolarHBondContact O-N 2.83Å; R382-A385 PolarHBondContact O-N 2.65Å; A385-Q389 WeakPolarHBondContact O-CB 3.05Å; A385-Q389 WeakPolarHBondContact O-CG 3.43Å; A385-Q389 PolarHBondContact O-N 2.76Å
386	L	73.1	Confident	66.8	Low	54 Å²	54	73.4 Å²	73.4	28%	0.283	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-42.1	173.3	-92.8	84.1	0	0	0	113	R382 L383 K384 Q389 G390 M404	R382-L386 HydrophobicContact CG-CD1 4.15Å; R382-L386 WeakPolarHBondContact O-CD1 3.14Å; R382-L386 PolarHBondContact O-N 3.29Å; L383-L386 WeakPolarHBondContact O-CB 3.43Å; L383-L386 PolarHBondContact O-N 3.21Å; K384-L386 VanDerWaalsContact C-N 3.31Å; K384-L386 PolarHBondContact O-N 3.29Å; L386-Q389 PolarHBondContact O-N 3.42Å; L386-G390 PolarHBondContact O-N 2.89Å; L386-M404 HydrophobicContact CD2-CE 4.19Å; L386-M404 HydrophobicContact CD2-SD 4.05Å
387	L	71.4	Confident	65	Low	24 Å²	24	79 Å²	79	13%	0.126	44%	0.439	C	S	.	.	H	α-helix	trans	-77.1	-34.6	-178	-73.4	164.3	0	0	0	112.9	L383 K384 Q389 G390 N391 M404 E405 L408	L383-L387 WeakPolarHBondContact O-CB 3.48Å; L383-L387 WeakPolarHBondContact O-CG 3.49Å; L383-L387 PolarHBondContact O-N 2.95Å; K384-L387 PolarHBondContact O-N 2.84Å; L387-Q389 VanDerWaalsContact C-N 3.33Å; L387-G390 CarbonylContact O-C 3.54Å; L387-G390 WeakPolarHBondContact O-CA 3.49Å; L387-G390 PolarHBondContact O-N 2.88Å; L387-G390 VanDerWaalsContact O-N 3.07Å; L387-N391 PolarHBondContact O-N 2.84Å; L387-M404 HydrophobicContact CD2-CB 4.06Å; L387-E405 HydrophobicContact CD1-CB 4.23Å; L387-E405 HydrophobicContact CD2-CB 4.14Å; L387-L408 HydrophobicContact CD1-CB 3.62Å; L387-L408 HydrophobicContact CD1-CD1 4.26Å; L387-L408 HydrophobicContact CD1-CD2 3.62Å; L387-L408 HydrophobicContact CD1-CG 3.99Å
388	L	65.3	Low	63.5	Low	120 Å²	120	77.5 Å²	77.5	63%	0.628	44%	0.437	S	S	*	.	H	α-helix	trans	-65.4	-34.2	168.9	-90	141.8	0	0	0	112.1	K384	K384-L388 VanDerWaalsContact O-CB 3.3Å; K384-L388 WeakPolarHBondContact O-CB 3.2Å; K384-L388 PolarHBondContact O-N 2.97Å
389	Q	57.8	Low	62.2	Low	100 Å²	100	79 Å²	79	47%	0.467	44%	0.442	S	S	.	.	H	α-helix	trans	-66.8	-36.2	166.8	-81	-177.3	-65	0	0	112	A385 L386 L387	A385-Q389 WeakPolarHBondContact O-CB 3.05Å; A385-Q389 WeakPolarHBondContact O-CG 3.43Å; A385-Q389 PolarHBondContact O-N 2.76Å; L386-Q389 PolarHBondContact O-N 3.42Å; L387-Q389 VanDerWaalsContact C-N 3.33Å
390	G	52.1	Low	61	Low	33 Å²	33	80.3 Å²	80.3	34%	0.34	45%	0.454	S	S	.	.	H	α-helix	trans	-65	-42.4	176.1	0	0	0	0	0	113.8	L386 L387 Q392 I393	L386-G390 PolarHBondContact O-N 2.89Å; L387-G390 CarbonylContact O-C 3.54Å; L387-G390 WeakPolarHBondContact O-CA 3.49Å; L387-G390 PolarHBondContact O-N 2.88Å; L387-G390 VanDerWaalsContact O-N 3.07Å; G390-Q392 PolarHBondContact O-N 2.91Å; G390-Q392 VanDerWaalsContact O-N 3.16Å; G390-I393 PolarHBondContact O-N 3.18Å
391	N	47.9	Very low	59.7	Low	109 Å²	109	80.8 Å²	80.8	58%	0.583	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-12.1	-171.4	-121	2.6	0	0	0	115.2	L387 I393	L387-N391 PolarHBondContact O-N 2.84Å; N391-I393 VanDerWaalsContact C-N 3.31Å
392	Q	44.2	Very low	58.7	Low	162 Å²	162	82.4 Å²	82.4	76%	0.757	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-10.9	173.2	-66.1	-176	7.6	0	0	112.9	G390	G390-Q392 PolarHBondContact O-N 2.91Å; G390-Q392 VanDerWaalsContact O-N 3.16Å
393	I	43.6	Very low	57.9	Low	75 Å²	75	79 Å²	79	39%	0.385	45%	0.454	S	S	.	.	S	Bend	trans	-104.1	130.6	170.3	-50.5	169.2	0	0	0	106.2	G390 N391 L395 P965	G390-I393 PolarHBondContact O-N 3.18Å; N391-I393 VanDerWaalsContact C-N 3.31Å; I393-L395 VanDerWaalsContact C-N 3.28Å; I393-L395 HydrophobicContact CB-CD1 4.26Å; I393-L395 HydrophobicContact CG2-CD1 3.65Å; I393-L395 HydrophobicContact CG2-CG 4.06Å; I393-L395 PolarHBondContact O-N 2.86Å; I393-P965 HydrophobicContact CD1-CB 3.51Å
394	A	45.1	Very low	57.2	Low	108 Å²	108	82 Å²	82	89%	0.893	47%	0.469	S	S	*	.	S	Bend	trans	-67.4	82.9	-179.1	0	0	0	0	0	111.8
395	L	48.2	Very low	56.7	Low	87 Å²	87	81 Å²	81	46%	0.455	47%	0.465	S	S	.	.			trans	-142	32.3	-169.4	-90.8	173.2	0	0	0	113.2	I393 D397 S398	I393-L395 VanDerWaalsContact C-N 3.28Å; I393-L395 HydrophobicContact CB-CD1 4.26Å; I393-L395 HydrophobicContact CG2-CD1 3.65Å; I393-L395 HydrophobicContact CG2-CG 4.06Å; I393-L395 PolarHBondContact O-N 2.86Å; L395-D397 PolarHBondContact O-N 2.91Å; L395-S398 PolarHBondContact O-N 2.83Å
396	L	44.7	Very low	56.4	Low	125 Å²	125	83.8 Å²	83.8	65%	0.654	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-18	177	-70.8	161.7	0	0	0	114
397	D	44.8	Very low	56.4	Low	138 Å²	138	86.6 Å²	86.6	74%	0.738	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	21.2	-174.5	-55.7	-49.4	0	0	0	115	L395	L395-D397 PolarHBondContact O-N 2.91Å
398	S	49.5	Very low	56.8	Low	29 Å²	29	86 Å²	86	20%	0.203	48%	0.477	C	S	.	.			trans	-86.6	131	179.8	178	0	0	0	0	113.1	L395 T400 A401 L402	L395-S398 PolarHBondContact O-N 2.83Å; S398-T400 PolarHBondContact O-N 2.96Å; S398-A401 WeakPolarHBondContact O-CB 3.39Å; S398-A401 PolarHBondContact O-N 3.22Å; S398-L402 PolarHBondContact O-N 3.19Å
399	P	55.4	Low	57.4	Low	94 Å²	94	85.3 Å²	85.3	61%	0.61	47%	0.47	S	S	*	.	H	α-helix	trans	-56	-27.9	177.1	-26.5	34.6	0	0	0	114.8	S403	P399-S403 WeakPolarHBondContact O-CB 3.46Å; P399-S403 PolarHBondContact O-N 3.43Å
400	T	54.4	Low	58.4	Low	89 Å²	89	85.4 Å²	85.4	55%	0.546	47%	0.47	S	S	.	.	H	α-helix	trans	-79.8	-34.7	177	-50.5	0	0	0	0	112	S398 S403 M404	S398-T400 PolarHBondContact O-N 2.96Å; T400-S403 PolarHBondContact O-N 3.41Å; T400-M404 HydrophobicContact CG2-CE 4.14Å; T400-M404 WeakPolarHBondContact O-CB 3.43Å; T400-M404 WeakPolarHBondContact O-CG 3.45Å; T400-M404 PolarHBondContact O-N 3.07Å
401	A	53.8	Low	59.8	Low	26 Å²	26	85.4 Å²	85.4	22%	0.215	46%	0.462	C	S	.	.	H	α-helix	trans	-65.8	-50	171.1	0	0	0	0	0	109.2	S398 S403 M404 E405	S398-A401 WeakPolarHBondContact O-CB 3.39Å; S398-A401 PolarHBondContact O-N 3.22Å; A401-S403 VanDerWaalsContact C-N 3.29Å; A401-S403 PolarHBondContact O-N 3.08Å; A401-M404 CarbonylContact O-C 3.57Å; A401-M404 PolarHBondContact O-N 3.41Å; A401-E405 WeakPolarHBondContact O-CB 3.49Å; A401-E405 PolarHBondContact O-N 2.86Å
402	L	60.4	Low	61.5	Low	95 Å²	95	82.6 Å²	82.6	50%	0.497	45%	0.446	S	S	.	.	H	α-helix	trans	-54.5	-39.5	173.3	-68.6	170.4	0	0	0	112.7	S398 E406	S398-L402 PolarHBondContact O-N 3.19Å; L402-E406 WeakPolarHBondContact O-CA 3.37Å; L402-E406 WeakPolarHBondContact O-CB 3.43Å; L402-E406 PolarHBondContact O-N 2.64Å
403	S	68.3	Low	63.2	Low	45 Å²	45	77.7 Å²	77.7	32%	0.315	43%	0.433	S	S	.	.	H	α-helix	trans	-75.1	-29.6	175.8	-171.9	0	0	0	0	114	P399 T400 A401 K407	P399-S403 WeakPolarHBondContact O-CB 3.46Å; P399-S403 PolarHBondContact O-N 3.43Å; T400-S403 PolarHBondContact O-N 3.41Å; A401-S403 VanDerWaalsContact C-N 3.29Å; A401-S403 PolarHBondContact O-N 3.08Å; S403-K407 WeakPolarHBondContact O-CB 3.43Å; S403-K407 VanDerWaalsContact O-CG 3.29Å; S403-K407 WeakPolarHBondContact O-CG 3.47Å; S403-K407 PolarHBondContact O-N 3.44Å
404	M	64.1	Low	64.9	Low	69 Å²	69	80.9 Å²	80.9	34%	0.34	44%	0.44	S	S	.	.	H	α-helix	trans	-76	-33.8	172.9	-75.6	-174.8	-177.7	0	0	112.1	L386 L387 T400 A401 K407 L408	L386-M404 HydrophobicContact CD2-CE 4.19Å; L386-M404 HydrophobicContact CD2-SD 4.05Å; L387-M404 HydrophobicContact CD2-CB 4.06Å; T400-M404 HydrophobicContact CG2-CE 4.14Å; T400-M404 WeakPolarHBondContact O-CB 3.43Å; T400-M404 WeakPolarHBondContact O-CG 3.45Å; T400-M404 PolarHBondContact O-N 3.07Å; A401-M404 CarbonylContact O-C 3.57Å; A401-M404 PolarHBondContact O-N 3.41Å; M404-K407 CarbonylContact O-C 3.59Å; M404-K407 PolarHBondContact O-N 3.48Å; M404-L408 VanDerWaalsContact O-CB 3.3Å; M404-L408 WeakPolarHBondContact O-CB 3.46Å; M404-L408 PolarHBondContact O-N 3.07Å
405	E	66.5	Low	66.7	Low	68 Å²	68	76.3 Å²	76.3	32%	0.318	40%	0.401	S	S	.	.	H	α-helix	trans	-77.7	-36.2	176.4	-166	153.9	-133.6	0	0	110.8	L387 A401 L408 H409	L387-E405 HydrophobicContact CD1-CB 4.23Å; L387-E405 HydrophobicContact CD2-CB 4.14Å; A401-E405 WeakPolarHBondContact O-CB 3.49Å; A401-E405 PolarHBondContact O-N 2.86Å; E405-L408 WeakPolarHBondContact O-CB 3.31Å; E405-L408 PolarHBondContact O-N 3.45Å; E405-H409 VanDerWaalsContact O-CB 3.31Å; E405-H409 WeakPolarHBondContact O-CB 3.24Å; E405-H409 PolarHBondContact O-CD2 3.34Å; E405-H409 VanDerWaalsContact O-CD2 3.26Å; E405-H409 PolarHBondContact O-N 2.67Å
406	E	73.9	Confident	68.3	Low	110 Å²	110	78 Å²	78	51%	0.514	41%	0.41	S	S	.	.	H	α-helix	trans	-61.9	-45.4	165.2	-177.1	-173.4	-162.6	0	0	110.7	L402 L408 H409 Q410	L402-E406 WeakPolarHBondContact O-CA 3.37Å; L402-E406 WeakPolarHBondContact O-CB 3.43Å; L402-E406 PolarHBondContact O-N 2.64Å; E406-L408 VanDerWaalsContact C-N 3.34Å; E406-H409 PolarHBondContact O-N 3.05Å; E406-Q410 HydrophobicContact CG-CG 4.4Å; E406-Q410 VanDerWaalsContact O-CB 3.24Å; E406-Q410 WeakPolarHBondContact O-CB 3.48Å; E406-Q410 WeakPolarHBondContact O-CG 3.5Å; E406-Q410 PolarHBondContact O-N 2.86Å; E406-Q410 PolarHBondContact OE1-NE2 3.41Å
407	K	73.1	Confident	70.1	Confident	113 Å²	113	77.2 Å²	77.2	49%	0.491	40%	0.403	S	S	.	.	H	α-helix	trans	-67.8	-32.8	174.1	-79.5	172.6	-178.3	166.9	0	113.2	S403 M404 N411	S403-K407 WeakPolarHBondContact O-CB 3.43Å; S403-K407 VanDerWaalsContact O-CG 3.29Å; S403-K407 WeakPolarHBondContact O-CG 3.47Å; S403-K407 PolarHBondContact O-N 3.44Å; M404-K407 CarbonylContact O-C 3.59Å; M404-K407 PolarHBondContact O-N 3.48Å; K407-N411 VanDerWaalsContact O-CB 3.24Å; K407-N411 WeakPolarHBondContact O-CB 3.45Å; K407-N411 PolarHBondContact O-N 3.01Å; K407-N411 PolarHBondContact O-ND2 2.63Å
408	L	80.4	Confident	71.7	Confident	12 Å²	12	71.3 Å²	71.3	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-62	-57.8	171.2	-179.9	82	0	0	0	108.5	I380 L383 K384 L387 M404 E405 E406 Q410 N411 E412	I380-L408 HydrophobicContact CG2-CD1 4.06Å; L383-L408 HydrophobicContact CB-CD1 3.68Å; K384-L408 HydrophobicContact CB-CD1 4.49Å; K384-L408 HydrophobicContact CG-CD1 3.51Å; K384-L408 HydrophobicContact CG-CD2 4.32Å; L387-L408 HydrophobicContact CD1-CB 3.62Å; L387-L408 HydrophobicContact CD1-CD1 4.26Å; L387-L408 HydrophobicContact CD1-CD2 3.62Å; L387-L408 HydrophobicContact CD1-CG 3.99Å; M404-L408 VanDerWaalsContact O-CB 3.3Å; M404-L408 WeakPolarHBondContact O-CB 3.46Å; M404-L408 PolarHBondContact O-N 3.07Å; E405-L408 WeakPolarHBondContact O-CB 3.31Å; E405-L408 PolarHBondContact O-N 3.45Å; E406-L408 VanDerWaalsContact C-N 3.34Å; L408-Q410 VanDerWaalsContact C-N 3.31Å; L408-Q410 PolarHBondContact O-N 3.35Å; L408-N411 CarbonylContact O-C 3.59Å; L408-N411 PolarHBondContact O-N 3.4Å; L408-E412 HydrophobicContact CD1-CG 4.38Å; L408-E412 HydrophobicContact CG-CG 4.08Å; L408-E412 WeakPolarHBondContact O-CB 3.24Å; L408-E412 VanDerWaalsContact O-CG 3.31Å; L408-E412 WeakPolarHBondContact O-CG 3.44Å; L408-E412 PolarHBondContact O-N 2.75Å
409	H	77.8	Confident	72.9	Confident	104 Å²	104	71 Å²	71	48%	0.481	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-34.4	-179	-68.2	-31.7	0	0	0	112.7	E405 E406 E412 A413	E405-H409 VanDerWaalsContact O-CB 3.31Å; E405-H409 WeakPolarHBondContact O-CB 3.24Å; E405-H409 PolarHBondContact O-CD2 3.34Å; E405-H409 VanDerWaalsContact O-CD2 3.26Å; E405-H409 PolarHBondContact O-N 2.67Å; E406-H409 PolarHBondContact O-N 3.05Å; H409-E412 IonicContact CE1-OE2 2.95Å; H409-E412 IonicContact ND1-OE2 3.1Å; H409-E412 PolarHBondContact ND1-OE2 3.36Å; H409-A413 WeakPolarHBondContact O-CA 3.23Å; H409-A413 WeakPolarHBondContact O-CB 3.38Å; H409-A413 PolarHBondContact O-N 2.98Å
410	Q	77.8	Confident	73.9	Confident	103 Å²	103	72.7 Å²	72.7	48%	0.481	37%	0.366	S	S	.	.	H	α-helix	trans	-64.9	-44.6	170.5	-76.5	174.2	11.5	0	0	111.2	E406 L408 R414	E406-Q410 HydrophobicContact CG-CG 4.4Å; E406-Q410 VanDerWaalsContact O-CB 3.24Å; E406-Q410 WeakPolarHBondContact O-CB 3.48Å; E406-Q410 WeakPolarHBondContact O-CG 3.5Å; E406-Q410 PolarHBondContact O-N 2.86Å; E406-Q410 PolarHBondContact OE1-NE2 3.41Å; L408-Q410 VanDerWaalsContact C-N 3.31Å; L408-Q410 PolarHBondContact O-N 3.35Å; Q410-R414 WeakPolarHBondContact O-CB 3.24Å; Q410-R414 PolarHBondContact O-N 2.83Å
411	N	81.7	Confident	74.7	Confident	32 Å²	32	73.2 Å²	73.2	17%	0.171	36%	0.362	C	S	.	.	H	α-helix	trans	-70.4	-38.7	177.3	-75.1	-17.9	0	0	0	112.2	I380 L383 K407 L408 R414 V415	I380-N411 HydrophobicContact CD1-CB 4.28Å; I380-N411 WeakPolarHBondContact CD1-O 3.3Å; I380-N411 HydrophobicContact CG1-CB 3.75Å; L383-N411 VanDerWaalsContact CD1-ND2 3.3Å; L383-N411 WeakPolarHBondContact CD1-ND2 3.19Å; K407-N411 VanDerWaalsContact O-CB 3.24Å; K407-N411 WeakPolarHBondContact O-CB 3.45Å; K407-N411 PolarHBondContact O-N 3.01Å; K407-N411 PolarHBondContact O-ND2 2.63Å; L408-N411 CarbonylContact O-C 3.59Å; L408-N411 PolarHBondContact O-N 3.4Å; N411-R414 CarbonylContact O-C 3.58Å; N411-R414 PolarHBondContact O-N 3.15Å; N411-V415 WeakPolarHBondContact O-CB 3.09Å; N411-V415 WeakPolarHBondContact O-CG2 3.17Å; N411-V415 PolarHBondContact O-N 2.67Å
412	E	83.3	Confident	75.5	Confident	51 Å²	51	72.4 Å²	72.4	24%	0.238	35%	0.354	C	S	.	.	H	α-helix	trans	-64	-49.4	173.9	-74.7	-177	128.5	0	0	111	I380 K384 L408 H409 R414 V415 L416	I380-E412 HydrophobicContact CD1-CG 4.09Å; I380-E412 HydrophobicContact CG1-CG 4.26Å; I380-E412 HydrophobicContact CG2-CG 4.09Å; K384-E412 WeakPolarHBondContact CE-OE1 3.48Å; K384-E412 IonicContact NZ-OE1 2.83Å; K384-E412 PolarHBondContact NZ-OE1 3.39Å; L408-E412 HydrophobicContact CD1-CG 4.38Å; L408-E412 HydrophobicContact CG-CG 4.08Å; L408-E412 WeakPolarHBondContact O-CB 3.24Å; L408-E412 VanDerWaalsContact O-CG 3.31Å; L408-E412 WeakPolarHBondContact O-CG 3.44Å; L408-E412 PolarHBondContact O-N 2.75Å; H409-E412 IonicContact CE1-OE2 2.95Å; H409-E412 IonicContact ND1-OE2 3.1Å; H409-E412 PolarHBondContact ND1-OE2 3.36Å; E412-R414 VanDerWaalsContact C-N 3.28Å; E412-R414 PolarHBondContact O-N 3.35Å; E412-V415 PolarHBondContact O-N 2.83Å; E412-L416 WeakPolarHBondContact O-CB 3.5Å; E412-L416 PolarHBondContact O-N 2.72Å
413	A	81.3	Confident	75.9	Confident	58 Å²	58	70 Å²	70	48%	0.479	34%	0.343	S	S	.	.	H	α-helix	trans	-59	-41.6	173.9	0	0	0	0	0	110.5	H409 L416 E417	H409-A413 WeakPolarHBondContact O-CA 3.23Å; H409-A413 WeakPolarHBondContact O-CB 3.38Å; H409-A413 PolarHBondContact O-N 2.98Å; A413-L416 PolarHBondContact O-N 3.03Å; A413-E417 WeakPolarHBondContact O-CB 3.46Å; A413-E417 PolarHBondContact O-N 2.8Å
414	R	78.8	Confident	75.9	Confident	142 Å²	142	72.1 Å²	72.1	54%	0.536	35%	0.35	S	S	.	.	H	α-helix	trans	-70.8	-34.5	177.7	-165.8	171	-164.8	132.9	7.6	113.3	L376 Q410 N411 E412 L418	L376-R414 HydrophobicContact CD1-CB 4.39Å; L376-R414 HydrophobicContact CD1-CG 4.01Å; Q410-R414 WeakPolarHBondContact O-CB 3.24Å; Q410-R414 PolarHBondContact O-N 2.83Å; N411-R414 CarbonylContact O-C 3.58Å; N411-R414 PolarHBondContact O-N 3.15Å; E412-R414 VanDerWaalsContact C-N 3.28Å; E412-R414 PolarHBondContact O-N 3.35Å; R414-L418 HydrophobicContact CG-CD1 4.04Å; R414-L418 HydrophobicContact CG-CG 4.43Å; R414-L418 WeakPolarHBondContact O-CB 3.4Å; R414-L418 WeakPolarHBondContact O-CD1 3.23Å; R414-L418 WeakPolarHBondContact O-CG 3.49Å; R414-L418 PolarHBondContact O-N 3.32Å
415	V	83.3	Confident	75.9	Confident	13 Å²	13	72.7 Å²	72.7	8%	0.079	35%	0.351	C	S	.	.	H	α-helix	trans	-69.7	-39.5	170.7	160.4	0	0	0	0	110.7	I373 L376 R377 I380 N411 E412 T419	I373-V415 HydrophobicContact CG2-CG1 4.43Å; L376-V415 HydrophobicContact CB-CG2 3.38Å; L376-V415 HydrophobicContact CD1-CG2 4.04Å; L376-V415 HydrophobicContact CG-CG2 4.36Å; R377-V415 HydrophobicContact CG-CB 4.5Å; R377-V415 HydrophobicContact CG-CG1 3.69Å; R377-V415 HydrophobicContact CG-CG2 4Å; I380-V415 HydrophobicContact CD1-CB 3.77Å; I380-V415 HydrophobicContact CD1-CG1 4.31Å; I380-V415 HydrophobicContact CD1-CG2 3.51Å; N411-V415 WeakPolarHBondContact O-CB 3.09Å; N411-V415 WeakPolarHBondContact O-CG2 3.17Å; N411-V415 PolarHBondContact O-N 2.67Å; E412-V415 PolarHBondContact O-N 2.83Å; V415-T419 WeakPolarHBondContact O-CA 3.28Å; V415-T419 WeakPolarHBondContact O-CB 3.46Å; V415-T419 PolarHBondContact O-N 2.75Å; V415-T419 PolarHBondContact O-OG1 2.85Å
416	L	80.9	Confident	75.8	Confident	121 Å²	121	71.9 Å²	71.9	63%	0.634	35%	0.345	S	S	*	.	H	α-helix	trans	-70.6	-38.6	179.4	-164.6	152	0	0	0	110.4	E412 A413 K420	E412-L416 WeakPolarHBondContact O-CB 3.5Å; E412-L416 PolarHBondContact O-N 2.72Å; A413-L416 PolarHBondContact O-N 3.03Å; L416-K420 WeakPolarHBondContact O-CB 3.37Å; L416-K420 PolarHBondContact O-N 2.73Å
417	E	81.7	Confident	75.1	Confident	110 Å²	110	70.2 Å²	70.2	51%	0.514	34%	0.34	S	S	.	.	H	α-helix	trans	-63.3	-57.3	170.3	-178.1	174.9	-125.6	0	0	110.9	A413 T419 K420 E421	A413-E417 WeakPolarHBondContact O-CB 3.46Å; A413-E417 PolarHBondContact O-N 2.8Å; E417-T419 VanDerWaalsContact C-N 3.3Å; E417-T419 PolarHBondContact O-N 3.22Å; E417-K420 CarbonylContact O-C 3.54Å; E417-K420 WeakPolarHBondContact O-CA 3.48Å; E417-K420 WeakPolarHBondContact O-CB 3.27Å; E417-K420 PolarHBondContact O-N 2.94Å; E417-E421 WeakPolarHBondContact O-CB 3.17Å; E417-E421 WeakPolarHBondContact O-CG 3.47Å; E417-E421 PolarHBondContact O-N 3.06Å
418	L	78.5	Confident	74.1	Confident	14 Å²	14	70.9 Å²	70.9	7%	0.073	35%	0.345	C	S	.	.	H	α-helix	trans	-61.7	-35.6	178.1	-70.8	168.2	0	0	0	112.7	N369 L372 I373 L376 R414 W422	N369-L418 HydrophobicContact CB-CD2 4.32Å; L372-L418 HydrophobicContact CD2-CD1 3.69Å; L372-L418 HydrophobicContact CG-CD1 3.98Å; I373-L418 HydrophobicContact CD1-CB 3.91Å; I373-L418 HydrophobicContact CG1-CB 3.67Å; I373-L418 HydrophobicContact CG1-CD1 4.36Å; L376-L418 HydrophobicContact CD1-CD1 3.78Å; R414-L418 HydrophobicContact CG-CD1 4.04Å; R414-L418 HydrophobicContact CG-CG 4.43Å; R414-L418 WeakPolarHBondContact O-CB 3.4Å; R414-L418 WeakPolarHBondContact O-CD1 3.23Å; R414-L418 WeakPolarHBondContact O-CG 3.49Å; R414-L418 PolarHBondContact O-N 3.32Å; L418-W422 WeakPolarHBondContact O-CB 3.23Å; L418-W422 PolarHBondContact O-N 3.19Å
419	T	75.6	Confident	72.6	Confident	22 Å²	22	72.1 Å²	72.1	14%	0.135	35%	0.353	C	S	.	.	H	α-helix	trans	-71.1	-35.6	174.4	-56.8	0	0	0	0	110.3	V415 E417 T423	V415-T419 WeakPolarHBondContact O-CA 3.28Å; V415-T419 WeakPolarHBondContact O-CB 3.46Å; V415-T419 PolarHBondContact O-N 2.75Å; V415-T419 PolarHBondContact O-OG1 2.85Å; E417-T419 VanDerWaalsContact C-N 3.3Å; E417-T419 PolarHBondContact O-N 3.22Å; T419-T423 WeakPolarHBondContact O-CA 3.42Å; T419-T423 WeakPolarHBondContact O-CB 3.36Å; T419-T423 PolarHBondContact O-N 3.18Å; T419-T423 PolarHBondContact O-OG1 3.34Å
420	K	75.6	Confident	71.2	Confident	129 Å²	129	68.7 Å²	68.7	56%	0.561	34%	0.337	S	S	*	.	H	α-helix	trans	-71.5	-41.7	175	179.6	-177.4	177.6	-174	0	111.7	L416 E417 T423 N424	L416-K420 WeakPolarHBondContact O-CB 3.37Å; L416-K420 PolarHBondContact O-N 2.73Å; E417-K420 CarbonylContact O-C 3.54Å; E417-K420 WeakPolarHBondContact O-CA 3.48Å; E417-K420 WeakPolarHBondContact O-CB 3.27Å; E417-K420 PolarHBondContact O-N 2.94Å; K420-T423 PolarHBondContact O-N 2.82Å; K420-N424 WeakPolarHBondContact O-CB 3.41Å; K420-N424 PolarHBondContact O-N 3.31Å; K420-N424 PolarHBondContact O-OD1 2.96Å
421	E	73	Confident	69.7	Low	100 Å²	100	67.7 Å²	67.7	47%	0.467	34%	0.335	S	S	.	.	H	α-helix	trans	-60.8	-48.5	171.6	-74.7	-174.2	160.8	0	0	110.6	E417 N424 K425	E417-E421 WeakPolarHBondContact O-CB 3.17Å; E417-E421 WeakPolarHBondContact O-CG 3.47Å; E417-E421 PolarHBondContact O-N 3.06Å; E421-N424 PolarHBondContact O-N 2.95Å; E421-K425 WeakPolarHBondContact O-CB 3.47Å; E421-K425 PolarHBondContact O-N 3.48Å
422	W	70.2	Confident	67.9	Low	10 Å²	10	69.2 Å²	69.2	4%	0.038	34%	0.343	C	S	.	.	H	α-helix	trans	-62.2	-43.4	174.8	-175.9	87.9	0	0	0	111.1	F236 P241 E243 I373 L418 N424 K425 W426	F236-W422 HydrophobicContact CD2-CH2 4.28Å; F236-W422 HydrophobicContact CD2-CZ3 4.02Å; F236-W422 HydrophobicContact CE2-CZ3 4.04Å; P241-W422 HydrophobicContact CB-CD2 3.55Å; P241-W422 HydrophobicContact CB-CE3 3.41Å; P241-W422 VanDerWaalsContact CB-CE3 3.41Å; P241-W422 HydrophobicContact CB-CG 4.35Å; P241-W422 HydrophobicContact CB-CH2 3.64Å; P241-W422 HydrophobicContact CB-CZ2 3.76Å; P241-W422 HydrophobicContact CB-CZ3 3.48Å; P241-W422 VanDerWaalsContact CB-CZ3 3.48Å; P241-W422 HydrophobicContact CG-CD2 4.31Å; P241-W422 HydrophobicContact CG-CE3 4.21Å; E243-W422 PolarHBondContact OE2-NE1 3.17Å; I373-W422 HydrophobicContact CD1-CB 4.45Å; L418-W422 WeakPolarHBondContact O-CB 3.23Å; L418-W422 PolarHBondContact O-N 3.19Å; W422-N424 VanDerWaalsContact C-N 3.35Å; W422-N424 PolarHBondContact O-N 2.98Å; W422-K425 PolarHBondContact O-N 3.48Å; W422-W426 HydrophobicContact CD2-CB 4.35Å; W422-W426 HydrophobicContact CE3-CB 4.1Å; W422-W426 HydrophobicContact CH2-CB 4.14Å; W422-W426 AromaticContact CH2-CD2 3.96Å; W422-W426 HydrophobicContact CH2-CD2 3.96Å; W422-W426 HydrophobicContact CH2-CE3 4.41Å; W422-W426 AromaticContact CH2-CG 3.8Å; W422-W426 HydrophobicContact CH2-CG 3.8Å; W422-W426 HydrophobicContact CZ2-CB 4.37Å; W422-W426 HydrophobicContact CZ2-CD2 4.19Å; W422-W426 HydrophobicContact CZ2-CE3 4.19Å; W422-W426 HydrophobicContact CZ2-CG 4.27Å; W422-W426 HydrophobicContact CZ3-CB 3.99Å; W422-W426 AromaticContact CZ3-CG 3.94Å; W422-W426 HydrophobicContact CZ3-CG 3.94Å; W422-W426 WeakPolarHBondContact O-CA 3.16Å; W422-W426 WeakPolarHBondContact O-CB 3.48Å; W422-W426 PolarHBondContact O-N 3.44Å
423	T	69.1	Low	66	Low	44 Å²	44	68 Å²	68	27%	0.27	34%	0.337	S	S	.	.	H	α-helix	trans	-67.2	-34.8	178.1	-58.5	0	0	0	0	111.7	T419 K420 N427	T419-T423 WeakPolarHBondContact O-CA 3.42Å; T419-T423 WeakPolarHBondContact O-CB 3.36Å; T419-T423 PolarHBondContact O-N 3.18Å; T419-T423 PolarHBondContact O-OG1 3.34Å; K420-T423 PolarHBondContact O-N 2.82Å; T423-N427 WeakPolarHBondContact O-CB 3.35Å; T423-N427 PolarHBondContact O-N 2.89Å; T423-N427 PolarHBondContact O-ND2 2.9Å
424	N	68.1	Low	64.2	Low	89 Å²	89	71.2 Å²	71.2	48%	0.476	34%	0.341	S	S	.	.	H	α-helix	trans	-70.8	-50.8	174.9	-74.5	-6.7	0	0	0	110.6	K420 E421 W422 W426 N427 E428	K420-N424 WeakPolarHBondContact O-CB 3.41Å; K420-N424 PolarHBondContact O-N 3.31Å; K420-N424 PolarHBondContact O-OD1 2.96Å; E421-N424 PolarHBondContact O-N 2.95Å; W422-N424 VanDerWaalsContact C-N 3.35Å; W422-N424 PolarHBondContact O-N 2.98Å; N424-W426 PolarHBondContact O-N 3.08Å; N424-N427 PolarHBondContact O-N 3.41Å; N424-E428 WeakPolarHBondContact O-CB 3.29Å; N424-E428 PolarHBondContact O-N 3.41Å
425	K	64.4	Low	62.4	Low	82 Å²	82	69.6 Å²	69.6	36%	0.357	34%	0.339	S	S	.	.	H	α-helix	trans	-56.5	-37.7	172.2	-179.4	-164	170.2	-146.8	0	110.9	E243 D367 E421 W422 T429	E243-K425 IonicContact OE1-NZ 3.36Å; E243-K425 IonicContact OE2-NZ 2.7Å; E243-K425 PolarHBondContact OE2-NZ 2.89Å; D367-K425 IonicContact OD2-NZ 3.12Å; E421-K425 WeakPolarHBondContact O-CB 3.47Å; E421-K425 PolarHBondContact O-N 3.48Å; W422-K425 PolarHBondContact O-N 3.48Å; K425-T429 WeakPolarHBondContact O-CB 3.34Å; K425-T429 PolarHBondContact O-N 2.82Å; K425-T429 PolarHBondContact O-OG1 3.38Å
426	W	62.8	Low	60.3	Low	50 Å²	50	75 Å²	75	19%	0.189	36%	0.364	C	S	.	.	H	α-helix	trans	-69.1	-49.9	177.3	177.6	-110.1	0	0	0	111.2	S143 A234 W422 N424 E428 T429 Q430	S143-W426 VanDerWaalsContact CB-CH2 3.43Å; A234-W426 HydrophobicContact CB-CE3 4.01Å; A234-W426 HydrophobicContact CB-CH2 3.36Å; A234-W426 HydrophobicContact CB-CZ2 4.17Å; A234-W426 HydrophobicContact CB-CZ3 3.25Å; W422-W426 HydrophobicContact CD2-CB 4.35Å; W422-W426 HydrophobicContact CE3-CB 4.1Å; W422-W426 HydrophobicContact CH2-CB 4.14Å; W422-W426 AromaticContact CH2-CD2 3.96Å; W422-W426 HydrophobicContact CH2-CD2 3.96Å; W422-W426 HydrophobicContact CH2-CE3 4.41Å; W422-W426 AromaticContact CH2-CG 3.8Å; W422-W426 HydrophobicContact CH2-CG 3.8Å; W422-W426 HydrophobicContact CZ2-CB 4.37Å; W422-W426 HydrophobicContact CZ2-CD2 4.19Å; W422-W426 HydrophobicContact CZ2-CE3 4.19Å; W422-W426 HydrophobicContact CZ2-CG 4.27Å; W422-W426 HydrophobicContact CZ3-CB 3.99Å; W422-W426 AromaticContact CZ3-CG 3.94Å; W422-W426 HydrophobicContact CZ3-CG 3.94Å; W422-W426 WeakPolarHBondContact O-CA 3.16Å; W422-W426 WeakPolarHBondContact O-CB 3.48Å; W422-W426 PolarHBondContact O-N 3.44Å; N424-W426 PolarHBondContact O-N 3.08Å; W426-E428 VanDerWaalsContact C-N 3.32Å; W426-E428 PolarHBondContact O-N 3.28Å; W426-T429 CarbonylContact O-C 3.52Å; W426-T429 PolarHBondContact O-N 3.47Å; W426-Q430 HydrophobicContact CD2-CG 3.92Å; W426-Q430 VanDerWaalsContact CE2-CG 3.4Å; W426-Q430 HydrophobicContact CE3-CG 4.47Å; W426-Q430 HydrophobicContact CG-CG 4.35Å; W426-Q430 HydrophobicContact CH2-CG 4.07Å; W426-Q430 VanDerWaalsContact CZ2-CD 3.45Å; W426-Q430 HydrophobicContact CZ2-CG 3.51Å; W426-Q430 WeakPolarHBondContact O-CB 3.37Å; W426-Q430 VanDerWaalsContact O-CG 3.23Å; W426-Q430 WeakPolarHBondContact O-CG 3.35Å; W426-Q430 PolarHBondContact O-N 2.96Å
427	N	59.3	Low	58.3	Low	76 Å²	76	71 Å²	71	41%	0.406	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-37.3	176.1	-72.7	-19.9	0	0	0	111.6	T423 N424 N431	T423-N427 WeakPolarHBondContact O-CB 3.35Å; T423-N427 PolarHBondContact O-N 2.89Å; T423-N427 PolarHBondContact O-ND2 2.9Å; N424-N427 PolarHBondContact O-N 3.41Å; N427-N431 WeakPolarHBondContact O-CB 3.44Å; N427-N431 PolarHBondContact O-N 2.98Å; N427-N431 PolarHBondContact O-ND2 3.24Å; N427-N431 PolarHBondContact O-OD1 3.47Å
428	E	53.8	Low	56.6	Low	126 Å²	126	69.4 Å²	69.4	59%	0.589	34%	0.339	S	S	*	.	H	α-helix	trans	-67	-45.3	173	-175.4	174.2	-151.4	0	0	110.7	N424 W426 Q430 N431 I432	N424-E428 WeakPolarHBondContact O-CB 3.29Å; N424-E428 PolarHBondContact O-N 3.41Å; W426-E428 VanDerWaalsContact C-N 3.32Å; W426-E428 PolarHBondContact O-N 3.28Å; E428-Q430 VanDerWaalsContact C-N 3.35Å; E428-Q430 PolarHBondContact O-N 3.02Å; E428-N431 PolarHBondContact O-N 2.94Å; E428-I432 HydrophobicContact CG-CD1 4Å; E428-I432 WeakPolarHBondContact O-CB 3.22Å; E428-I432 WeakPolarHBondContact O-CD1 3.38Å; E428-I432 WeakPolarHBondContact O-CG1 3.27Å; E428-I432 PolarHBondContact O-N 2.87Å
429	T	47.5	Very low	54.9	Low	38 Å²	38	70.6 Å²	70.6	23%	0.233	35%	0.351	C	S	.	.	H	α-helix	trans	-66.4	-35.8	175.3	-57.9	0	0	0	0	111.8	K425 W426 L433	K425-T429 WeakPolarHBondContact O-CB 3.34Å; K425-T429 PolarHBondContact O-N 2.82Å; K425-T429 PolarHBondContact O-OG1 3.38Å; W426-T429 CarbonylContact O-C 3.52Å; W426-T429 PolarHBondContact O-N 3.47Å; T429-L433 HydrophobicContact CG2-CD1 4.01Å; T429-L433 WeakPolarHBondContact O-CB 3.44Å; T429-L433 WeakPolarHBondContact O-CD1 3.39Å; T429-L433 WeakPolarHBondContact O-CG 3.43Å; T429-L433 PolarHBondContact O-N 3.45Å
430	Q	48.9	Very low	53.5	Low	32 Å²	32	75.2 Å²	75.2	15%	0.15	37%	0.374	C	S	.	.	H	α-helix	trans	-71	-38.7	174.2	-80.2	-69.1	-58.6	0	0	111.6	W426 E428 L433 K434	W426-Q430 HydrophobicContact CD2-CG 3.92Å; W426-Q430 VanDerWaalsContact CE2-CG 3.4Å; W426-Q430 HydrophobicContact CE3-CG 4.47Å; W426-Q430 HydrophobicContact CG-CG 4.35Å; W426-Q430 HydrophobicContact CH2-CG 4.07Å; W426-Q430 VanDerWaalsContact CZ2-CD 3.45Å; W426-Q430 HydrophobicContact CZ2-CG 3.51Å; W426-Q430 WeakPolarHBondContact O-CB 3.37Å; W426-Q430 VanDerWaalsContact O-CG 3.23Å; W426-Q430 WeakPolarHBondContact O-CG 3.35Å; W426-Q430 PolarHBondContact O-N 2.96Å; E428-Q430 VanDerWaalsContact C-N 3.35Å; E428-Q430 PolarHBondContact O-N 3.02Å; Q430-L433 CarbonylContact O-C 3.58Å; Q430-L433 PolarHBondContact O-N 3.35Å; Q430-K434 WeakPolarHBondContact O-CB 3.47Å; Q430-K434 WeakPolarHBondContact O-CG 3.39Å; Q430-K434 PolarHBondContact O-N 2.91Å
431	N	46.1	Very low	51.8	Low	83 Å²	83	75.8 Å²	75.8	44%	0.444	37%	0.372	S	S	.	.	H	α-helix	trans	-69.3	-42.3	174.4	-72.2	-8.7	0	0	0	110	N427 E428 L433 K434 E435	N427-N431 WeakPolarHBondContact O-CB 3.44Å; N427-N431 PolarHBondContact O-N 2.98Å; N427-N431 PolarHBondContact O-ND2 3.24Å; N427-N431 PolarHBondContact O-OD1 3.47Å; E428-N431 PolarHBondContact O-N 2.94Å; N431-L433 PolarHBondContact O-N 3.25Å; N431-K434 CarbonylContact O-C 3.6Å; N431-K434 PolarHBondContact O-N 2.77Å; N431-K434 VanDerWaalsContact O-N 3.08Å; N431-E435 VanDerWaalsContact O-CB 3.25Å; N431-E435 WeakPolarHBondContact O-CB 3.39Å; N431-E435 VanDerWaalsContact O-CG 3.27Å; N431-E435 WeakPolarHBondContact O-CG 3.35Å; N431-E435 PolarHBondContact O-N 2.95Å
432	I	43.7	Very low	50.2	Low	64 Å²	64	79.6 Å²	79.6	33%	0.328	39%	0.387	S	S	.	.	H	α-helix	trans	-60.8	-44.8	170.6	-68.1	162.5	0	0	0	110.2	E428 K434 E435 E436	E428-I432 HydrophobicContact CG-CD1 4Å; E428-I432 WeakPolarHBondContact O-CB 3.22Å; E428-I432 WeakPolarHBondContact O-CD1 3.38Å; E428-I432 WeakPolarHBondContact O-CG1 3.27Å; E428-I432 PolarHBondContact O-N 2.87Å; I432-K434 PolarHBondContact O-N 3.03Å; I432-E435 PolarHBondContact O-N 3.29Å; I432-E436 HydrophobicContact CG2-CG 4.07Å; I432-E436 VanDerWaalsContact O-CB 3.29Å; I432-E436 WeakPolarHBondContact O-CB 3.33Å; I432-E436 WeakPolarHBondContact O-CG 3.29Å; I432-E436 PolarHBondContact O-N 3.37Å
433	L	42.9	Very low	48.6	Very low	24 Å²	24	85.5 Å²	85.5	13%	0.126	42%	0.415	C	S	.	.	H	α-helix	trans	-62.2	-26.6	174.2	-79.5	162.2	0	0	0	112.9	R145 L191 T429 Q430 N431 T437	R145-L433 HydrophobicContact CB-CD2 4.38Å; R145-L433 HydrophobicContact CG-CD2 4.2Å; L191-L433 HydrophobicContact CD1-CD2 4.32Å; L191-L433 HydrophobicContact CD2-CD2 4.45Å; T429-L433 HydrophobicContact CG2-CD1 4.01Å; T429-L433 WeakPolarHBondContact O-CB 3.44Å; T429-L433 WeakPolarHBondContact O-CD1 3.39Å; T429-L433 WeakPolarHBondContact O-CG 3.43Å; T429-L433 PolarHBondContact O-N 3.45Å; Q430-L433 CarbonylContact O-C 3.58Å; Q430-L433 PolarHBondContact O-N 3.35Å; N431-L433 PolarHBondContact O-N 3.25Å; L433-T437 WeakPolarHBondContact O-CB 3.49Å; L433-T437 PolarHBondContact O-OG1 2.89Å
434	K	43.6	Very low	47.6	Very low	126 Å²	126	86.7 Å²	86.7	55%	0.548	44%	0.437	S	S	.	.	H	α-helix	trans	-88	-35.1	174.9	-73	168.8	-177.8	-177.1	0	112.9	Q430 N431 I432 T437	Q430-K434 WeakPolarHBondContact O-CB 3.47Å; Q430-K434 WeakPolarHBondContact O-CG 3.39Å; Q430-K434 PolarHBondContact O-N 2.91Å; N431-K434 CarbonylContact O-C 3.6Å; N431-K434 PolarHBondContact O-N 2.77Å; N431-K434 VanDerWaalsContact O-N 3.08Å; I432-K434 PolarHBondContact O-N 3.03Å; K434-T437 CarbonylContact O-C 3.54Å; K434-T437 PolarHBondContact O-N 3.11Å
435	E	41	Very low	46.4	Very low	108 Å²	108	91.6 Å²	91.6	51%	0.505	46%	0.461	S	S	.	.	H	α-helix	trans	-77.4	-36.9	-179.8	-74.7	-177	172.2	0	0	111.8	N431 I432 T437	N431-E435 VanDerWaalsContact O-CB 3.25Å; N431-E435 WeakPolarHBondContact O-CB 3.39Å; N431-E435 VanDerWaalsContact O-CG 3.27Å; N431-E435 WeakPolarHBondContact O-CG 3.35Å; N431-E435 PolarHBondContact O-N 2.95Å; I432-E435 PolarHBondContact O-N 3.29Å; E435-T437 VanDerWaalsContact C-N 3.31Å
436	E	40.6	Very low	45.1	Very low	128 Å²	128	89.6 Å²	89.6	60%	0.598	46%	0.464	S	S	*	.	S	Bend	trans	-78.2	-16.4	170.7	-64.3	-172.7	146.7	0	0	112.1	I432 L438	I432-E436 HydrophobicContact CG2-CG 4.07Å; I432-E436 VanDerWaalsContact O-CB 3.29Å; I432-E436 WeakPolarHBondContact O-CB 3.33Å; I432-E436 WeakPolarHBondContact O-CG 3.29Å; I432-E436 PolarHBondContact O-N 3.37Å; E436-L438 PolarHBondContact O-N 3.38Å
437	T	38.8	Very low	44.4	Very low	35 Å²	35	91.6 Å²	91.6	22%	0.215	48%	0.481	C	S	.	.			trans	-94.3	77.2	173.2	-58	0	0	0	0	111.2	Q193 L433 K434 E435 A439	Q193-T437 VanDerWaalsContact NE2-CG2 3.28Å; Q193-T437 PolarHBondContact NE2-OG1 3.44Å; L433-T437 WeakPolarHBondContact O-CB 3.49Å; L433-T437 PolarHBondContact O-OG1 2.89Å; K434-T437 CarbonylContact O-C 3.54Å; K434-T437 PolarHBondContact O-N 3.11Å; E435-T437 VanDerWaalsContact C-N 3.31Å; T437-A439 HydrophobicContact CG2-CB 4.07Å; T437-A439 PolarHBondContact O-N 3.08Å
438	L	45.3	Very low	44	Very low	78 Å²	78	90.1 Å²	90.1	41%	0.408	48%	0.475	S	S	.	.			trans	-67.7	80.4	157.8	-77.1	168.7	0	0	0	109.2	E436 L440 L449	E436-L438 PolarHBondContact O-N 3.38Å; L438-L440 PolarHBondContact O-N 3.42Å; L438-L449 HydrophobicContact CD2-CD1 4.2Å; L438-L449 HydrophobicContact CD2-CD2 4.38Å; L438-L449 HydrophobicContact CD2-CG 4.34Å
439	A	43.3	Very low	44.1	Very low	39 Å²	39	86.3 Å²	86.3	32%	0.322	46%	0.458	S	S	.	.			trans	-67	97.3	176.2	0	0	0	0	0	110.3	T437 R441	T437-A439 HydrophobicContact CG2-CB 4.07Å; T437-A439 PolarHBondContact O-N 3.08Å; A439-R441 PolarHBondContact O-N 3Å
440	L	45	Very low	44.5	Very low	119 Å²	119	87.7 Å²	87.7	62%	0.623	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	91.9	168.6	-68.7	174.2	0	0	0	109.1	L438 V447 L449	L438-L440 PolarHBondContact O-N 3.42Å; L440-V447 HydrophobicContact CB-CG1 3.61Å; L440-V447 HydrophobicContact CD2-CG1 3.59Å; L440-V447 HydrophobicContact CG-CG1 4.09Å; L440-L449 HydrophobicContact CD2-CD1 3.85Å
441	R	40.2	Very low	45.2	Very low	140 Å²	140	87 Å²	87	53%	0.528	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	126.8	174.5	-87.7	-162.1	-83.7	-160.7	-7	110.7	A439 E443 V448 D450	A439-R441 PolarHBondContact O-N 3Å; R441-E443 PolarHBondContact O-N 3.06Å; R441-V448 PolarHBondContact N-O 3.32Å; R441-V448 PolarHBondContact O-N 3.29Å; R441-D450 IonicContact CZ-OD2 3.94Å; R441-D450 IonicContact NE-OD2 3.8Å; R441-D450 PolarHBondContact NE-OD2 3.13Å; R441-D450 VanDerWaalsContact NH2-CG 3.33Å; R441-D450 IonicContact NH2-OD1 3.32Å; R441-D450 IonicContact NH2-OD2 2.68Å; R441-D450 PolarHBondContact NH2-OD2 3.01Å
442	K	38.7	Very low	46.2	Very low	180 Å²	180	90.1 Å²	90.1	78%	0.783	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	91.3	177.9	-160.8	175.3	-172.2	176.5	0	110.1
443	E	37.2	Very low	47.7	Very low	134 Å²	134	89.8 Å²	89.8	63%	0.626	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	104.2	173.4	-71.4	-166.6	162.6	0	0	110.4	R441 G446 V448	R441-E443 PolarHBondContact O-N 3.06Å; E443-G446 PolarHBondContact N-O 2.94Å; E443-V448 HydrophobicContact CB-CG2 4.23Å
444	G	48.4	Very low	49.7	Very low	70 Å²	70	89 Å²	89	72%	0.722	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	-136.1	-179.6	0	0	0	0	0	113.4	G446	G444-G446 VanDerWaalsContact C-N 3.3Å
445	I	43.5	Very low	51.7	Low	191 Å²	191	83 Å²	83	98%	0.979	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-13.4	-177.7	-59	173.4	0	0	0	111.4
446	G	36.9	Very low	53.9	Low	40 Å²	40	78 Å²	78	41%	0.412	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	169.6	-177.6	0	0	0	0	0	114.3	E443 G444	E443-G446 PolarHBondContact N-O 2.94Å; G444-G446 VanDerWaalsContact C-N 3.3Å
447	V	47.2	Very low	55.9	Low	92 Å²	92	74 Å²	74	56%	0.558	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.2	171.5	-174.3	0	0	0	0	108.4	L440	L440-V447 HydrophobicContact CB-CG1 3.61Å; L440-V447 HydrophobicContact CD2-CG1 3.59Å; L440-V447 HydrophobicContact CG-CG1 4.09Å
448	V	52.4	Low	57.7	Low	46 Å²	46	72.8 Å²	72.8	28%	0.279	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.4	-179.4	-177.4	0	0	0	0	108.9	R441 E443	R441-V448 PolarHBondContact N-O 3.32Å; R441-V448 PolarHBondContact O-N 3.29Å; E443-V448 HydrophobicContact CB-CG2 4.23Å
449	L	55.5	Low	58.7	Low	46 Å²	46	73 Å²	73	24%	0.241	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.2	178.3	-163.8	106.8	0	0	0	109.9	L438 L440 S451 L470	L438-L449 HydrophobicContact CD2-CD1 4.2Å; L438-L449 HydrophobicContact CD2-CD2 4.38Å; L438-L449 HydrophobicContact CD2-CG 4.34Å; L440-L449 HydrophobicContact CD2-CD1 3.85Å; L449-S451 PolarHBondContact O-N 2.84Å; L449-L470 HydrophobicContact CD1-CD1 3.57Å; L449-L470 HydrophobicContact CD2-CD1 4.06Å; L449-L470 HydrophobicContact CD2-CD2 3.8Å; L449-L470 HydrophobicContact CG-CD1 4.48Å
450	D	55.6	Low	59.5	Low	66 Å²	66	75 Å²	75	35%	0.353	40%	0.403	S	S	.	.			trans	-94.1	81.1	176.2	-68.8	-52.3	0	0	0	111	R441	R441-D450 IonicContact CZ-OD2 3.94Å; R441-D450 IonicContact NE-OD2 3.8Å; R441-D450 PolarHBondContact NE-OD2 3.13Å; R441-D450 VanDerWaalsContact NH2-CG 3.33Å; R441-D450 IonicContact NH2-OD1 3.32Å; R441-D450 IonicContact NH2-OD2 2.68Å; R441-D450 PolarHBondContact NH2-OD2 3.01Å
451	S	64.2	Low	59.8	Low	18 Å²	18	74.8 Å²	74.8	13%	0.126	40%	0.403	C	S	.	.			trans	-99.3	144.5	165.8	-177.3	0	0	0	0	109.6	L449 L453 P554	L449-S451 PolarHBondContact O-N 2.84Å; S451-L453 PolarHBondContact OG-N 2.72Å; S451-L453 PolarHBondContact OG-O 3.48Å; S451-P554 WeakPolarHBondContact O-CB 3.28Å; S451-P554 WeakPolarHBondContact O-CG 3.49Å
452	E	66.9	Low	60.5	Low	148 Å²	148	72.3 Å²	72.3	69%	0.692	40%	0.4	S	S	*	.	S	Bend	trans	-93.4	-17.2	173.4	-65.2	-169	-176.6	0	0	113
453	L	74.8	Confident	60.9	Low	58 Å²	58	72.2 Å²	72.2	30%	0.304	41%	0.407	S	S	.	.	S	Bend	trans	-95.2	151.5	-176.1	-65.2	177.8	0	0	0	112.1	S451 H455 P554	S451-L453 PolarHBondContact OG-N 2.72Å; S451-L453 PolarHBondContact OG-O 3.48Å; L453-H455 PolarHBondContact O-N 3.47Å; L453-H455 PolarHBondContact O-ND1 3.34Å; L453-P554 WeakPolarHBondContact O-CD 3.47Å; L453-P554 WeakPolarHBondContact O-CG 3.47Å
454	P	85.1	Confident	61.3	Low	6 Å²	6	73.2 Å²	73.2	4%	0.039	42%	0.416	C	S	.	.			trans	-59.5	133.6	167.2	-18.1	31.5	0	0	0	111	L473 V512 F551 N552	P454-L473 PolarHBondContact O-N 2.74Å; P454-V512 HydrophobicContact CB-CG2 3.7Å; P454-V512 HydrophobicContact CG-CG2 4.02Å; P454-F551 HydrophobicContact CB-CE2 3.73Å; P454-F551 HydrophobicContact CB-CZ 3.93Å; P454-N552 WeakPolarHBondContact CA-O 3.42Å
455	H	85.6	Confident	61	Low	1 Å²	1	72.2 Å²	72.2	1%	0.005	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	155.9	-177.2	56.2	-87.1	0	0	0	112.9	L453 Y471 N552	L453-H455 PolarHBondContact O-N 3.47Å; L453-H455 PolarHBondContact O-ND1 3.34Å; H455-Y471 CarbonylContact C-O 3.58Å; H455-Y471 VanDerWaalsContact CA-O 3.22Å; H455-Y471 WeakPolarHBondContact CA-O 3.37Å; H455-Y471 WeakPolarHBondContact CB-O 3.42Å; H455-N552 PolarHBondContact CE1-ND2 2.93Å; H455-N552 PolarHBondContact N-O 2.78Å; H455-N552 WeakPolarHBondContact NE2-CB 3.24Å; H455-N552 PolarHBondContact NE2-ND2 3.34Å; H455-N552 PolarHBondContact O-N 3.1Å
456	L	86.3	Confident	61.3	Low	2 Å²	2	70 Å²	70	1%	0.01	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.2	172.4	-58.9	171.5	0	0	0	109.2	L470 Y471 L473 I491 F505 I541 F549 F551	L456-L470 WeakPolarHBondContact O-CA 3.29Å; L456-Y471 HydrophobicContact CB-CD2 4.5Å; L456-Y471 PolarHBondContact N-O 3.36Å; L456-Y471 PolarHBondContact O-N 2.98Å; L456-L473 HydrophobicContact CD1-CD1 4.38Å; L456-L473 HydrophobicContact CD1-CD2 4.22Å; L456-L473 HydrophobicContact CD2-CD1 4.39Å; L456-L473 HydrophobicContact CG-CD1 4.09Å; L456-L473 HydrophobicContact CG-CG 4.37Å; L456-I491 HydrophobicContact CD1-CD1 4.38Å; L456-F505 HydrophobicContact CD1-CD2 4.29Å; L456-F505 HydrophobicContact CD1-CE1 4.28Å; L456-F505 HydrophobicContact CD1-CE2 3.62Å; L456-F505 HydrophobicContact CD1-CZ 3.63Å; L456-F505 HydrophobicContact CD2-CE1 4.3Å; L456-F505 HydrophobicContact CD2-CZ 4.24Å; L456-I541 HydrophobicContact CD2-CD1 3.81Å; L456-F549 HydrophobicContact CB-CB 4.22Å; L456-F549 HydrophobicContact CB-CD1 4.22Å; L456-F549 HydrophobicContact CB-CG 4.44Å; L456-F549 HydrophobicContact CD2-CB 4.24Å; L456-F551 HydrophobicContact CD2-CB 4.1Å; L456-F551 HydrophobicContact CD2-CD2 4.03Å
457	I	82.1	Confident	61.8	Low	44 Å²	44	70 Å²	70	23%	0.226	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	109.1	172.7	-51.2	175.7	0	0	0	106.9	I468 L470 F549 R550 N552	I457-I468 HydrophobicContact CG2-CG2 3.58Å; I457-L470 HydrophobicContact CG1-CD2 3.86Å; I457-F549 CarbonylContact O-C 3.58Å; I457-F549 VanDerWaalsContact O-CA 3.29Å; I457-F549 WeakPolarHBondContact O-CA 3.45Å; I457-R550 HydrophobicContact CB-CB 4.39Å; I457-R550 PolarHBondContact N-O 3.18Å; I457-R550 PolarHBondContact O-N 2.9Å; I457-N552 HydrophobicContact CD1-CB 4.48Å
458	G	77.3	Confident	62.6	Low	10 Å²	10	71.7 Å²	71.7	10%	0.103	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	133.2	173.6	0	0	0	0	0	110.8	I469	G458-I469 PolarHBondContact N-O 3.37Å
459	I	66.9	Low	63.2	Low	83 Å²	83	73.4 Å²	73.4	43%	0.426	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	109.3	172.7	-58.3	171.4	0	0	0	105.8	M548	I459-M548 HydrophobicContact CB-CE 4.02Å; I459-M548 HydrophobicContact CD1-CE 4Å; I459-M548 HydrophobicContact CG2-CE 3.89Å; I459-M548 PolarHBondContact N-O 3.34Å
460	D	58.9	Low	64	Low	81 Å²	81	73.2 Å²	73.2	43%	0.433	40%	0.404	S	S	.	.			trans	-72.4	144.5	179.6	-158.8	-24.8	0	0	0	110.4	D462 S465	D460-D462 PolarHBondContact OD1-N 2.67Å; D460-D462 VanDerWaalsContact OD1-N 3.1Å; D460-S465 WeakPolarHBondContact OD2-CB 3.39Å; D460-S465 PolarHBondContact OD2-OG 2.88Å
461	D	52.9	Low	65.3	Low	115 Å²	115	72.8 Å²	72.8	62%	0.615	40%	0.397	S	S	*	.	S	Bend	trans	-84.2	-13.6	176	-89.9	-19.2	0	0	0	111.7	L463	D461-L463 PolarHBondContact O-N 3.1Å
462	D	54.6	Low	66.1	Low	87 Å²	87	75.1 Å²	75.1	47%	0.465	41%	0.406	S	S	.	.			trans	-75.6	109.6	177.1	-175.5	7.9	0	0	0	112.3	D460 L464 S465	D460-D462 PolarHBondContact OD1-N 2.67Å; D460-D462 VanDerWaalsContact OD1-N 3.1Å; D462-L464 PolarHBondContact O-N 2.72Å; D462-L464 WeakPolarHBondContact OD1-CB 3.48Å; D462-L464 PolarHBondContact OD1-N 3.33Å; D462-S465 WeakPolarHBondContact O-CB 3.35Å; D462-S465 PolarHBondContact O-N 3.11Å
463	L	46.9	Very low	67	Low	179 Å²	179	68.1 Å²	68.1	94%	0.937	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-13.7	174.5	-70.5	167.9	0	0	0	114.7	D461	D461-L463 PolarHBondContact O-N 3.1Å
464	L	45.3	Very low	67.2	Low	155 Å²	155	71.6 Å²	71.6	81%	0.812	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-10.1	176.3	-59.6	175.2	0	0	0	113.4	D462 T466	D462-L464 PolarHBondContact O-N 2.72Å; D462-L464 WeakPolarHBondContact OD1-CB 3.48Å; D462-L464 PolarHBondContact OD1-N 3.33Å; L464-T466 PolarHBondContact O-N 3.26Å
465	S	43.2	Very low	67.2	Low	48 Å²	48	76.9 Å²	76.9	34%	0.336	41%	0.41	S	S	.	.			trans	-85.6	108.1	179.2	-174.4	0	0	0	0	110.6	D460 D462 G467	D460-S465 WeakPolarHBondContact OD2-CB 3.39Å; D460-S465 PolarHBondContact OD2-OG 2.88Å; D462-S465 WeakPolarHBondContact O-CB 3.35Å; D462-S465 PolarHBondContact O-N 3.11Å; S465-G467 PolarHBondContact O-N 3.44Å
466	T	49	Very low	67.2	Low	146 Å²	146	78.5 Å²	78.5	90%	0.896	43%	0.427	S	S	*	.			trans	-84.3	13.4	171.2	63	0	0	0	0	112.8	L464	L464-T466 PolarHBondContact O-N 3.26Å
467	G	46.8	Very low	67.5	Low	39 Å²	39	85.6 Å²	85.6	40%	0.402	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-86.1	127.6	-176.7	0	0	0	0	0	112.2	S465	S465-G467 PolarHBondContact O-N 3.44Å
468	I	64.1	Low	67.9	Low	127 Å²	127	84.1 Å²	84.1	65%	0.651	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-100.5	120.6	165.9	-60.2	175.5	0	0	0	107.4	I457	I457-I468 HydrophobicContact CG2-CG2 3.58Å
469	I	65.1	Low	68.6	Low	82 Å²	82	87.5 Å²	87.5	42%	0.421	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	135.8	178.2	-50.6	179.3	0	0	0	109.3	G458 Y471	G458-I469 PolarHBondContact N-O 3.37Å; I469-Y471 HydrophobicContact CB-CE2 4.19Å; I469-Y471 HydrophobicContact CG2-CD2 4.24Å; I469-Y471 HydrophobicContact CG2-CE1 4.26Å; I469-Y471 HydrophobicContact CG2-CE2 3.48Å; I469-Y471 VanDerWaalsContact CG2-CE2 3.48Å
470	L	72.3	Confident	69.8	Low	43 Å²	43	83.6 Å²	83.6	23%	0.225	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.1	-175.8	-77.3	152	0	0	0	110.4	L449 L456 I457	L449-L470 HydrophobicContact CD1-CD1 3.57Å; L449-L470 HydrophobicContact CD2-CD1 4.06Å; L449-L470 HydrophobicContact CD2-CD2 3.8Å; L449-L470 HydrophobicContact CG-CD1 4.48Å; L456-L470 WeakPolarHBondContact O-CA 3.29Å; I457-L470 HydrophobicContact CG1-CD2 3.86Å
471	Y	82.5	Confident	71.2	Confident	56 Å²	56	79.7 Å²	79.7	22%	0.22	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	118.8	176	-54.8	-91.8	0	0	0	109.9	H455 L456 I469 I491 F549	H455-Y471 CarbonylContact C-O 3.58Å; H455-Y471 VanDerWaalsContact CA-O 3.22Å; H455-Y471 WeakPolarHBondContact CA-O 3.37Å; H455-Y471 WeakPolarHBondContact CB-O 3.42Å; L456-Y471 HydrophobicContact CB-CD2 4.5Å; L456-Y471 PolarHBondContact N-O 3.36Å; L456-Y471 PolarHBondContact O-N 2.98Å; I469-Y471 HydrophobicContact CB-CE2 4.19Å; I469-Y471 HydrophobicContact CG2-CD2 4.24Å; I469-Y471 HydrophobicContact CG2-CE1 4.26Å; I469-Y471 HydrophobicContact CG2-CE2 3.48Å; I469-Y471 VanDerWaalsContact CG2-CE2 3.48Å; Y471-I491 HydrophobicContact CD1-CB 4.49Å; Y471-I491 HydrophobicContact CD1-CD1 3.92Å; Y471-I491 HydrophobicContact CD1-CG1 3.9Å; Y471-I491 HydrophobicContact CD1-CG2 3.92Å; Y471-I491 HydrophobicContact CE1-CG1 4.47Å; Y471-I491 HydrophobicContact CE1-CG2 3.74Å; Y471-I491 HydrophobicContact CG-CD1 3.98Å; Y471-I491 HydrophobicContact CG-CG1 4.47Å; Y471-F549 HydrophobicContact CD2-CD1 4.42Å; Y471-F549 HydrophobicContact CD2-CE1 4.13Å; Y471-F549 HydrophobicContact CE2-CD1 4.42Å; Y471-F549 AromaticContact CE2-CE1 3.75Å; Y471-F549 HydrophobicContact CE2-CE1 3.75Å
472	H	81.5	Confident	72.9	Confident	68 Å²	68	78.6 Å²	78.6	32%	0.315	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	124.7	179.3	-67.9	100.8	0	0	0	110.8	K474	H472-K474 PolarHBondContact O-N 3.14Å
473	L	85.6	Confident	74.3	Confident	1 Å²	1	82 Å²	82	1%	0.005	42%	0.417	C	S	.	.			trans	-91.2	91.5	176.3	-59.8	-178	0	0	0	108.9	P454 L456 T478 F505 N507 V512 F551	P454-L473 PolarHBondContact O-N 2.74Å; L456-L473 HydrophobicContact CD1-CD1 4.38Å; L456-L473 HydrophobicContact CD1-CD2 4.22Å; L456-L473 HydrophobicContact CD2-CD1 4.39Å; L456-L473 HydrophobicContact CG-CD1 4.09Å; L456-L473 HydrophobicContact CG-CG 4.37Å; L473-T478 HydrophobicContact CD2-CG2 4.09Å; L473-F505 HydrophobicContact CD1-CB 4.14Å; L473-F505 HydrophobicContact CD1-CD1 3.96Å; L473-F505 HydrophobicContact CD1-CG 4.04Å; L473-F505 HydrophobicContact CD2-CB 4.04Å; L473-F505 HydrophobicContact CD2-CD2 4.18Å; L473-F505 HydrophobicContact CD2-CG 4.12Å; L473-N507 PolarHBondContact O-ND2 3.47Å; L473-V512 HydrophobicContact CD1-CG1 3.65Å; L473-V512 HydrophobicContact CD1-CG2 4.47Å; L473-F551 HydrophobicContact CD1-CD2 4.34Å; L473-F551 HydrophobicContact CD1-CE2 4.09Å
474	K	80	Confident	76.1	Confident	131 Å²	131	77.8 Å²	77.8	57%	0.57	40%	0.395	S	S	*	.			trans	-67	162.9	175.2	-63.4	-172.5	177.6	-169.9	0	110.6	H472 G476 N507	H472-K474 PolarHBondContact O-N 3.14Å; K474-G476 PolarHBondContact O-N 2.82Å; K474-N507 WeakPolarHBondContact O-CB 3.18Å; K474-N507 PolarHBondContact O-ND2 3.44Å
475	E	83.4	Confident	78.1	Confident	117 Å²	117	71.5 Å²	71.5	55%	0.547	37%	0.365	S	S	.	.	S	Bend	trans	-59.7	134.3	175.5	-168.7	74.5	-173.2	0	0	110.2	Q508 N509 G510	E475-Q508 WeakPolarHBondContact OE1-CA 3.43Å; E475-N509 PolarHBondContact OE1-N 3.47Å; E475-N509 PolarHBondContact OE2-N 2.68Å; E475-G510 PolarHBondContact OE2-N 3.34Å
476	G	87.3	Confident	79.9	Confident	35 Å²	35	74.8 Å²	74.8	36%	0.361	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	114.6	-144.6	-174.9	0	0	0	0	0	113.5	K474 E506 N507	K474-G476 PolarHBondContact O-N 2.82Å; G476-E506 CarbonylContact O-C 3.54Å; G476-E506 WeakPolarHBondContact O-CA 3.44Å; G476-N507 PolarHBondContact N-O 3.24Å; G476-N507 PolarHBondContact O-N 2.87Å
477	R	91	Very high	81.4	Confident	150 Å²	150	70 Å²	70	57%	0.566	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	135.6	-179.8	-71.1	-175.5	167	164.1	-1.8	110.2	Y479 V504 F505 E506	R477-Y479 HydrophobicContact CB-CE2 3.99Å; R477-V504 HydrophobicContact CB-CG1 3.83Å; R477-V504 HydrophobicContact CG-CG1 4.01Å; R477-F505 CarbonylContact C-O 3.57Å; R477-F505 WeakPolarHBondContact CA-O 3.4Å; R477-E506 HydrophobicContact CG-CG 4.21Å; R477-E506 IonicContact CZ-OE1 3.54Å; R477-E506 IonicContact NE-OE1 2.66Å; R477-E506 PolarHBondContact NE-OE1 2.96Å; R477-E506 IonicContact NH2-OE1 2.95Å; R477-E506 PolarHBondContact NH2-OE1 2.8Å
478	T	91.2	Very high	83.2	Confident	14 Å²	14	76.9 Å²	76.9	9%	0.086	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115.5	172.2	-54.9	0	0	0	0	109	L473 D490 I491 V504 F505	L473-T478 HydrophobicContact CD2-CG2 4.09Å; T478-D490 WeakPolarHBondContact CA-OD2 3.15Å; T478-D490 HydrophobicContact CG2-CB 3.67Å; T478-I491 HydrophobicContact CG2-CD1 3.86Å; T478-I491 HydrophobicContact CG2-CG1 3.97Å; T478-V504 CarbonylContact O-C 3.54Å; T478-V504 WeakPolarHBondContact O-CA 3.35Å; T478-F505 PolarHBondContact N-O 3.26Å; T478-F505 PolarHBondContact O-N 2.92Å
479	Y	91.4	Very high	84.2	Confident	81 Å²	81	71.7 Å²	71.7	32%	0.318	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	136.1	-177.9	-63.8	-90.6	0	0	0	111.1	R477 D490 I491 V504	R477-Y479 HydrophobicContact CB-CE2 3.99Å; Y479-D490 PolarHBondContact N-OD2 2.91Å; Y479-D490 PolarHBondContact O-N 3.17Å; Y479-I491 PolarHBondContact O-N 2.74Å; Y479-V504 HydrophobicContact CD1-CG2 3.63Å; Y479-V504 HydrophobicContact CE1-CG2 3.77Å; Y479-V504 HydrophobicContact CG-CG2 4.49Å
480	V	91.8	Very high	85.2	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128	-174.5	-171.5	0	0	0	0	109.4	Q489 I491 L493 H502 C503 F505 L543	V480-Q489 PolarHBondContact O-OE1 2.92Å; V480-I491 WeakPolarHBondContact CA-O 2.94Å; V480-I491 HydrophobicContact CB-CB 4.47Å; V480-I491 HydrophobicContact CG1-CB 4.17Å; V480-I491 HydrophobicContact CG1-CG2 4.21Å; V480-I491 HydrophobicContact CG2-CB 4.14Å; V480-I491 HydrophobicContact CG2-CD1 4.31Å; V480-L493 HydrophobicContact CG1-CD1 3.59Å; V480-L493 HydrophobicContact CG1-CG 4.09Å; V480-H502 WeakPolarHBondContact O-CA 3.23Å; V480-H502 WeakPolarHBondContact O-CB 3.49Å; V480-H502 PolarHBondContact O-N 2.7Å; V480-C503 WeakPolarHBondContact CB-O 3.48Å; V480-C503 PolarHBondContact N-O 2.97Å; V480-C503 PolarHBondContact O-N 3.42Å; V480-F505 HydrophobicContact CG2-CD2 3.65Å; V480-F505 HydrophobicContact CG2-CE2 3.68Å; V480-L543 HydrophobicContact CG1-CD1 3.84Å
481	G	89.3	Confident	85.9	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	-158.3	-173.8	0	0	0	0	0	112.7	I491 I492 L493 S500	G481-I491 PolarHBondContact N-O 3.14Å; G481-I491 VanDerWaalsContact N-O 3.16Å; G481-I492 WeakPolarHBondContact O-CA 3.35Å; G481-L493 PolarHBondContact O-N 2.97Å; G481-S500 CarbonylContact C-O 3.47Å; G481-S500 VanDerWaalsContact CA-O 3.24Å; G481-S500 WeakPolarHBondContact CA-O 3.41Å
482	R	87.9	Confident	86.1	Confident	92 Å²	92	72.1 Å²	72.1	35%	0.347	36%	0.362	S	S	.	.			trans	-100.2	165.2	174.4	-67.6	161.6	49.8	126.8	2.2	110.6	D484 A485 L498 S500	R482-D484 WeakPolarHBondContact CB-OD1 3.48Å; R482-D484 IonicContact CZ-OD1 3.3Å; R482-D484 IonicContact CZ-OD2 2.8Å; R482-D484 IonicContact NE-OD1 3.32Å; R482-D484 PolarHBondContact NE-OD1 3.42Å; R482-D484 IonicContact NE-OD2 2.64Å; R482-D484 PolarHBondContact NE-OD2 3.11Å; R482-D484 IonicContact NH2-OD1 3.11Å; R482-D484 IonicContact NH2-OD2 2.73Å; R482-D484 PolarHBondContact NH2-OD2 2.75Å; R482-D484 PolarHBondContact O-N 2.86Å; R482-A485 WeakPolarHBondContact O-CB 3.45Å; R482-A485 PolarHBondContact O-N 3.12Å; R482-L498 WeakPolarHBondContact CD-O 3.47Å; R482-L498 HydrophobicContact CG-CD2 3.85Å; R482-S500 PolarHBondContact N-O 2.75Å
483	E	84.2	Confident	86.2	Confident	159 Å²	159	69.1 Å²	69.1	74%	0.743	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.7	175.3	-165.7	177.4	-164.4	0	0	113.4	I492	E483-I492 HydrophobicContact CB-CG2 4.11Å
484	D	85.8	Confident	86	Confident	89 Å²	89	75.4 Å²	75.4	48%	0.476	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	13.7	178.7	59.5	10.8	0	0	0	114.9	R482 S500	R482-D484 WeakPolarHBondContact CB-OD1 3.48Å; R482-D484 IonicContact CZ-OD1 3.3Å; R482-D484 IonicContact CZ-OD2 2.8Å; R482-D484 IonicContact NE-OD1 3.32Å; R482-D484 PolarHBondContact NE-OD1 3.42Å; R482-D484 IonicContact NE-OD2 2.64Å; R482-D484 PolarHBondContact NE-OD2 3.11Å; R482-D484 IonicContact NH2-OD1 3.11Å; R482-D484 IonicContact NH2-OD2 2.73Å; R482-D484 PolarHBondContact NH2-OD2 2.75Å; R482-D484 PolarHBondContact O-N 2.86Å; D484-S500 WeakPolarHBondContact OD1-CB 3.4Å; D484-S500 PolarHBondContact OD1-OG 2.92Å
485	A	85.8	Confident	85.7	Confident	23 Å²	23	70.6 Å²	70.6	19%	0.19	37%	0.365	C	S	.	.			trans	-63.5	151	174.3	0	0	0	0	0	113.9	R482 S487 Q489 S500 E501	R482-A485 WeakPolarHBondContact O-CB 3.45Å; R482-A485 PolarHBondContact O-N 3.12Å; A485-S487 VanDerWaalsContact C-N 3.35Å; A485-S487 VanDerWaalsContact CB-O 3.25Å; A485-S487 WeakPolarHBondContact CB-O 3.43Å; A485-Q489 HydrophobicContact CB-CG 3.66Å; A485-S500 WeakPolarHBondContact CB-O 3.44Å; A485-E501 HydrophobicContact CB-CG 3.93Å
486	S	81.9	Confident	85.1	Confident	118 Å²	118	70.8 Å²	70.8	83%	0.825	37%	0.369	S	S	*	.	S	Bend	trans	-72.5	-27	170.5	31.3	0	0	0	0	113.6	E501	S486-E501 PolarHBondContact OG-OE1 3.13Å
487	S	81.6	Confident	84.7	Confident	46 Å²	46	71.8 Å²	71.8	32%	0.322	37%	0.367	S	S	.	.	S	Bend	trans	-108.6	152.1	175	55.2	0	0	0	0	111.5	A485 Q489 E501	A485-S487 VanDerWaalsContact C-N 3.35Å; A485-S487 VanDerWaalsContact CB-O 3.25Å; A485-S487 WeakPolarHBondContact CB-O 3.43Å; S487-Q489 PolarHBondContact O-N 2.87Å; S487-Q489 PolarHBondContact O-NE2 2.97Å; S487-Q489 PolarHBondContact OG-NE2 2.71Å; S487-E501 WeakPolarHBondContact CB-OE1 3.5Å; S487-E501 PolarHBondContact N-OE1 3.22Å; S487-E501 PolarHBondContact OG-OE1 3.39Å
488	E	83.4	Confident	84.4	Confident	182 Å²	182	65.1 Å²	65.1	85%	0.85	34%	0.342	S	S	*	.			trans	-63.9	127.7	176.5	-171.3	168.8	-165.9	0	0	110.3
489	Q	86	Confident	84.3	Confident	18 Å²	18	69.1 Å²	69.1	8%	0.084	36%	0.36	C	S	.	.			trans	-102.4	128	-179.2	-55.3	-56.6	-63.3	0	0	110.2	V480 A485 S487 I492	V480-Q489 PolarHBondContact O-OE1 2.92Å; A485-Q489 HydrophobicContact CB-CG 3.66Å; S487-Q489 PolarHBondContact O-N 2.87Å; S487-Q489 PolarHBondContact O-NE2 2.97Å; S487-Q489 PolarHBondContact OG-NE2 2.71Å; Q489-I492 HydrophobicContact CB-CG1 4.23Å
490	D	85.5	Confident	84	Confident	102 Å²	102	67.3 Å²	67.3	55%	0.545	36%	0.359	S	S	.	.	S	Bend	trans	-72.3	-32.1	176.7	-60.1	-71.1	0	0	0	112.4	T478 Y479	T478-D490 WeakPolarHBondContact CA-OD2 3.15Å; T478-D490 HydrophobicContact CG2-CB 3.67Å; Y479-D490 PolarHBondContact N-OD2 2.91Å; Y479-D490 PolarHBondContact O-N 3.17Å
491	I	86.8	Confident	84	Confident	10 Å²	10	70.2 Å²	70.2	5%	0.051	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	103.1	177.2	-56.3	-179.9	0	0	0	108.5	L456 Y471 T478 Y479 V480 G481 L493	L456-I491 HydrophobicContact CD1-CD1 4.38Å; Y471-I491 HydrophobicContact CD1-CB 4.49Å; Y471-I491 HydrophobicContact CD1-CD1 3.92Å; Y471-I491 HydrophobicContact CD1-CG1 3.9Å; Y471-I491 HydrophobicContact CD1-CG2 3.92Å; Y471-I491 HydrophobicContact CE1-CG1 4.47Å; Y471-I491 HydrophobicContact CE1-CG2 3.74Å; Y471-I491 HydrophobicContact CG-CD1 3.98Å; Y471-I491 HydrophobicContact CG-CG1 4.47Å; T478-I491 HydrophobicContact CG2-CD1 3.86Å; T478-I491 HydrophobicContact CG2-CG1 3.97Å; Y479-I491 PolarHBondContact O-N 2.74Å; V480-I491 WeakPolarHBondContact CA-O 2.94Å; V480-I491 HydrophobicContact CB-CB 4.47Å; V480-I491 HydrophobicContact CG1-CB 4.17Å; V480-I491 HydrophobicContact CG1-CG2 4.21Å; V480-I491 HydrophobicContact CG2-CB 4.14Å; V480-I491 HydrophobicContact CG2-CD1 4.31Å; G481-I491 PolarHBondContact N-O 3.14Å; G481-I491 VanDerWaalsContact N-O 3.16Å; I491-L493 HydrophobicContact CG2-CD1 4.46Å; I491-L493 HydrophobicContact CG2-CD2 3.75Å; I491-L493 HydrophobicContact CG2-CG 3.96Å
492	I	86.6	Confident	84.1	Confident	78 Å²	78	70.2 Å²	70.2	40%	0.4	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	121.5	175.5	-59.5	172.5	0	0	0	108.8	G481 E483 Q489	G481-I492 WeakPolarHBondContact O-CA 3.35Å; E483-I492 HydrophobicContact CB-CG2 4.11Å; Q489-I492 HydrophobicContact CB-CG1 4.23Å
493	L	84.7	Confident	84.3	Confident	6 Å²	6	65.8 Å²	65.8	3%	0.031	36%	0.356	C	S	.	.			trans	-120	152.8	178.5	-59.2	-178.9	0	0	0	111.4	V480 G481 I491 L498 L543 N547 F549	V480-L493 HydrophobicContact CG1-CD1 3.59Å; V480-L493 HydrophobicContact CG1-CG 4.09Å; G481-L493 PolarHBondContact O-N 2.97Å; I491-L493 HydrophobicContact CG2-CD1 4.46Å; I491-L493 HydrophobicContact CG2-CD2 3.75Å; I491-L493 HydrophobicContact CG2-CG 3.96Å; L493-L498 HydrophobicContact CB-CD1 3.71Å; L493-L498 HydrophobicContact CB-CD2 4.07Å; L493-L498 HydrophobicContact CD1-CD1 4.24Å; L493-L543 HydrophobicContact CD1-CB 4.42Å; L493-L543 HydrophobicContact CD1-CD1 3.81Å; L493-N547 HydrophobicContact CD1-CB 4.04Å; L493-F549 HydrophobicContact CD1-CE2 3.79Å; L493-F549 HydrophobicContact CD1-CZ 3.73Å; L493-F549 HydrophobicContact CD2-CZ 3.72Å; L493-F549 HydrophobicContact CG-CZ 4.41Å
494	H	79.5	Confident	84.7	Confident	132 Å²	132	58.6 Å²	58.6	61%	0.611	32%	0.323	S	S	*	.			trans	-124.4	137.2	176.6	-54.4	-56.8	0	0	0	109.2	N547	H494-N547 PolarHBondContact O-ND2 3.31Å
495	G	74.3	Confident	85.1	Confident	31 Å²	31	54.4 Å²	54.4	32%	0.32	30%	0.3	S	S	.	.			trans	167.1	170.5	-176.3	0	0	0	0	0	114.5	T546	G495-T546 VanDerWaalsContact CA-OG1 3.29Å; G495-T546 WeakPolarHBondContact CA-OG1 3.26Å
496	L	70.9	Confident	85.4	Confident	120 Å²	120	55 Å²	55	63%	0.628	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	146.1	171.6	-66	170.4	0	0	0	110.5	L498 R545	L496-L498 PolarHBondContact O-N 3.45Å; L496-R545 PolarHBondContact O-N 2.99Å
497	D	78.8	Confident	85.8	Confident	57 Å²	57	49.6 Å²	49.6	31%	0.305	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	28.6	-171.6	-60.8	14.6	0	0	0	114.2	R521 G544 R545	D497-R521 IonicContact OD2-NH1 2.9Å; D497-R521 PolarHBondContact OD2-NH1 3.49Å; D497-R521 VanDerWaalsContact OD2-NH1 3.11Å; D497-G544 VanDerWaalsContact O-CA 3.27Å; D497-G544 WeakPolarHBondContact O-CA 3.33Å; D497-R545 HydrophobicContact CB-CG 4.12Å; D497-R545 VanDerWaalsContact CG-NH2 3.25Å; D497-R545 IonicContact OD1-CZ 2.76Å; D497-R545 IonicContact OD1-NE 3.32Å; D497-R545 PolarHBondContact OD1-NE 2.96Å; D497-R545 IonicContact OD1-NH2 2.71Å; D497-R545 PolarHBondContact OD1-NH2 2.85Å; D497-R545 IonicContact OD2-CZ 3.68Å; D497-R545 IonicContact OD2-NE 3.19Å; D497-R545 PolarHBondContact OD2-NE 3.36Å; D497-R545 IonicContact OD2-NH2 3.83Å; D497-R545 PolarHBondContact OD2-NH2 2.94Å
498	L	86	Confident	86	Confident	9 Å²	9	53 Å²	53	5%	0.047	27%	0.272	C	S	.	.			trans	-102.1	123.3	174.2	-143.9	140.1	0	0	0	109.8	R482 L493 L496 H502 N547	R482-L498 WeakPolarHBondContact CD-O 3.47Å; R482-L498 HydrophobicContact CG-CD2 3.85Å; L493-L498 HydrophobicContact CB-CD1 3.71Å; L493-L498 HydrophobicContact CB-CD2 4.07Å; L493-L498 HydrophobicContact CD1-CD1 4.24Å; L496-L498 PolarHBondContact O-N 3.45Å; L498-H502 HydrophobicContact CD2-CB 4.16Å; L498-N547 HydrophobicContact CD1-CB 4.39Å; L498-N547 VanDerWaalsContact CD1-ND2 3.33Å; L498-N547 WeakPolarHBondContact CD1-ND2 3.2Å
499	E	88.1	Confident	85.8	Confident	99 Å²	99	52 Å²	52	46%	0.463	27%	0.272	S	S	.	.			trans	-81.6	159.3	-178	-65.9	-57.9	149.7	0	0	110.8	E501 H502 A520	E499-E501 VanDerWaalsContact C-N 3.35Å; E499-E501 PolarHBondContact O-N 3.05Å; E499-H502 HydrophobicContact CB-CB 4.34Å; E499-H502 PolarHBondContact N-ND1 2.85Å; E499-A520 HydrophobicContact CG-CB 4.11Å
500	S	86.2	Confident	85.3	Confident	43 Å²	43	51.9 Å²	51.9	30%	0.301	28%	0.276	S	S	.	.	S	Bend	trans	-61.7	-43.3	177.7	-63.3	0	0	0	0	111.9	G481 R482 D484 A485	G481-S500 CarbonylContact C-O 3.47Å; G481-S500 VanDerWaalsContact CA-O 3.24Å; G481-S500 WeakPolarHBondContact CA-O 3.41Å; R482-S500 PolarHBondContact N-O 2.75Å; D484-S500 WeakPolarHBondContact OD1-CB 3.4Å; D484-S500 PolarHBondContact OD1-OG 2.92Å; A485-S500 WeakPolarHBondContact CB-O 3.44Å
501	E	90.3	Very high	85.2	Confident	60 Å²	60	50 Å²	50	28%	0.28	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	103	168.1	-62.9	-179.3	178.7	0	0	107.8	A485 S486 S487 E499 L517	A485-E501 HydrophobicContact CB-CG 3.93Å; S486-E501 PolarHBondContact OG-OE1 3.13Å; S487-E501 WeakPolarHBondContact CB-OE1 3.5Å; S487-E501 PolarHBondContact N-OE1 3.22Å; S487-E501 PolarHBondContact OG-OE1 3.39Å; E499-E501 VanDerWaalsContact C-N 3.35Å; E499-E501 PolarHBondContact O-N 3.05Å; E501-L517 HydrophobicContact CB-CD1 4.05Å
502	H	91.1	Very high	85.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-51.1	-163.1	-166.8	76.6	0	0	0	113.3	V480 L498 E499 L517 A520 G544	V480-H502 WeakPolarHBondContact O-CA 3.23Å; V480-H502 WeakPolarHBondContact O-CB 3.49Å; V480-H502 PolarHBondContact O-N 2.7Å; L498-H502 HydrophobicContact CD2-CB 4.16Å; E499-H502 HydrophobicContact CB-CB 4.34Å; E499-H502 PolarHBondContact N-ND1 2.85Å; H502-L517 PolarHBondContact O-N 3.34Å; H502-A520 WeakPolarHBondContact ND1-CB 3.4Å; H502-A520 WeakPolarHBondContact O-CB 3.09Å; H502-G544 PolarHBondContact NE2-N 3.44Å; H502-G544 VanDerWaalsContact NE2-N 3.17Å
503	C	93.1	Very high	85.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	164	174.7	64.2	0	0	0	0	112.9	V480 V515	V480-C503 WeakPolarHBondContact CB-O 3.48Å; V480-C503 PolarHBondContact N-O 2.97Å; V480-C503 PolarHBondContact O-N 3.42Å; C503-V515 CarbonylContact C-O 3.51Å; C503-V515 VanDerWaalsContact CA-O 3.27Å; C503-V515 WeakPolarHBondContact CA-O 3.2Å; C503-V515 VanDerWaalsContact CB-O 3.31Å; C503-V515 WeakPolarHBondContact CB-O 3.03Å
504	V	93	Very high	86	Confident	7 Å²	7	47.1 Å²	47.1	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.9	170.7	-175.1	0	0	0	0	108.9	R477 T478 Y479 E506 V515 L517	R477-V504 HydrophobicContact CB-CG1 3.83Å; R477-V504 HydrophobicContact CG-CG1 4.01Å; T478-V504 CarbonylContact O-C 3.54Å; T478-V504 WeakPolarHBondContact O-CA 3.35Å; Y479-V504 HydrophobicContact CD1-CG2 3.63Å; Y479-V504 HydrophobicContact CE1-CG2 3.77Å; Y479-V504 HydrophobicContact CG-CG2 4.49Å; V504-E506 HydrophobicContact CG1-CG 4.31Å; V504-V515 HydrophobicContact CB-CB 4.41Å; V504-V515 PolarHBondContact N-O 3.32Å; V504-V515 PolarHBondContact O-N 3.38Å; V504-L517 HydrophobicContact CG2-CD1 3.82Å; V504-L517 HydrophobicContact CG2-CD2 4.18Å; V504-L517 HydrophobicContact CG2-CG 4.11Å
505	F	94.1	Very high	86.7	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.009	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	117.8	162.3	-66.5	-85.8	0	0	0	108.6	L456 L473 R477 T478 V480 V512 T513 L514 L535 I541	L456-F505 HydrophobicContact CD1-CD2 4.29Å; L456-F505 HydrophobicContact CD1-CE1 4.28Å; L456-F505 HydrophobicContact CD1-CE2 3.62Å; L456-F505 HydrophobicContact CD1-CZ 3.63Å; L456-F505 HydrophobicContact CD2-CE1 4.3Å; L456-F505 HydrophobicContact CD2-CZ 4.24Å; L473-F505 HydrophobicContact CD1-CB 4.14Å; L473-F505 HydrophobicContact CD1-CD1 3.96Å; L473-F505 HydrophobicContact CD1-CG 4.04Å; L473-F505 HydrophobicContact CD2-CB 4.04Å; L473-F505 HydrophobicContact CD2-CD2 4.18Å; L473-F505 HydrophobicContact CD2-CG 4.12Å; R477-F505 CarbonylContact C-O 3.57Å; R477-F505 WeakPolarHBondContact CA-O 3.4Å; T478-F505 PolarHBondContact N-O 3.26Å; T478-F505 PolarHBondContact O-N 2.92Å; V480-F505 HydrophobicContact CG2-CD2 3.65Å; V480-F505 HydrophobicContact CG2-CE2 3.68Å; F505-V512 HydrophobicContact CB-CG1 4.34Å; F505-V512 HydrophobicContact CD1-CG1 4.07Å; F505-T513 CarbonylContact C-O 3.22Å; F505-T513 WeakPolarHBondContact CA-O 3.2Å; F505-L514 HydrophobicContact CD1-CB 4.28Å; F505-L514 HydrophobicContact CE1-CB 4.15Å; F505-L514 HydrophobicContact CE1-CD1 3.79Å; F505-L514 HydrophobicContact CE1-CG 4.24Å; F505-L514 HydrophobicContact CZ-CD1 3.98Å; F505-L535 HydrophobicContact CD1-CD1 3.87Å; F505-L535 HydrophobicContact CE1-CD1 3.69Å; F505-I541 HydrophobicContact CE1-CD1 3.86Å; F505-I541 HydrophobicContact CZ-CD1 4.21Å
506	E	92.2	Very high	87.5	Confident	34 Å²	34	41.7 Å²	41.7	16%	0.159	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.3	170.1	-55	-155.9	149.7	0	0	109.6	G476 R477 V504 Q508 V512 T513 V515	G476-E506 CarbonylContact O-C 3.54Å; G476-E506 WeakPolarHBondContact O-CA 3.44Å; R477-E506 HydrophobicContact CG-CG 4.21Å; R477-E506 IonicContact CZ-OE1 3.54Å; R477-E506 IonicContact NE-OE1 2.66Å; R477-E506 PolarHBondContact NE-OE1 2.96Å; R477-E506 IonicContact NH2-OE1 2.95Å; R477-E506 PolarHBondContact NH2-OE1 2.8Å; V504-E506 HydrophobicContact CG1-CG 4.31Å; E506-Q508 PolarHBondContact OE2-NE2 3.43Å; E506-V512 CarbonylContact O-C 3.55Å; E506-V512 WeakPolarHBondContact O-CA 3.46Å; E506-T513 PolarHBondContact N-O 3.47Å; E506-T513 PolarHBondContact O-N 2.95Å; E506-V515 HydrophobicContact CG-CG2 4.06Å
507	N	90.3	Very high	88.3	Confident	6 Å²	6	38.2 Å²	38.2	3%	0.032	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114.3	172.5	-176.7	12.2	0	0	0	109.5	L473 K474 G476 G510 T511 V512	L473-N507 PolarHBondContact O-ND2 3.47Å; K474-N507 WeakPolarHBondContact O-CB 3.18Å; K474-N507 PolarHBondContact O-ND2 3.44Å; G476-N507 PolarHBondContact N-O 3.24Å; G476-N507 PolarHBondContact O-N 2.87Å; N507-G510 VanDerWaalsContact OD1-C 3.24Å; N507-G510 WeakPolarHBondContact OD1-CA 3.15Å; N507-G510 PolarHBondContact OD1-N 3.29Å; N507-T511 WeakPolarHBondContact CA-O 3.48Å; N507-V512 HydrophobicContact CB-CG2 4.15Å
508	Q	86.3	Confident	88.1	Confident	118 Å²	118	39.7 Å²	39.7	55%	0.551	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	118.8	179.2	-60	-175.7	30.8	0	0	110.2	E475 E506 G510 T511	E475-Q508 WeakPolarHBondContact OE1-CA 3.43Å; E506-Q508 PolarHBondContact OE2-NE2 3.43Å; Q508-G510 PolarHBondContact O-N 2.87Å; Q508-T511 PolarHBondContact N-O 3.32Å; Q508-T511 WeakPolarHBondContact O-CB 3.12Å; Q508-T511 PolarHBondContact O-N 2.93Å
509	N	79.1	Confident	87.5	Confident	159 Å²	159	43.1 Å²	43.1	85%	0.85	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	35	-173.4	-64.8	-55.9	0	0	0	113.3	E475 T511	E475-N509 PolarHBondContact OE1-N 3.47Å; E475-N509 PolarHBondContact OE2-N 2.68Å; N509-T511 VanDerWaalsContact C-N 3.29Å; N509-T511 PolarHBondContact O-N 2.97Å
510	G	73.7	Confident	87.4	Confident	17 Å²	17	38.7 Å²	38.7	18%	0.175	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-1.7	-174.5	0	0	0	0	0	115.7	E475 N507 Q508 H553	E475-G510 PolarHBondContact OE2-N 3.34Å; N507-G510 VanDerWaalsContact OD1-C 3.24Å; N507-G510 WeakPolarHBondContact OD1-CA 3.15Å; N507-G510 PolarHBondContact OD1-N 3.29Å; Q508-G510 PolarHBondContact O-N 2.87Å; G510-H553 PolarHBondContact O-NE2 3.19Å
511	T	84.3	Confident	87.4	Confident	61 Å²	61	42.7 Å²	42.7	37%	0.374	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	114.5	172.7	-59.4	0	0	0	0	109.3	N507 Q508 N509 Q534	N507-T511 WeakPolarHBondContact CA-O 3.48Å; Q508-T511 PolarHBondContact N-O 3.32Å; Q508-T511 WeakPolarHBondContact O-CB 3.12Å; Q508-T511 PolarHBondContact O-N 2.93Å; N509-T511 VanDerWaalsContact C-N 3.29Å; N509-T511 PolarHBondContact O-N 2.97Å; T511-Q534 HydrophobicContact CG2-CG 3.84Å
512	V	90.4	Very high	87.5	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	129.4	-178.2	-172.8	0	0	0	0	110.8	P454 L473 F505 E506 N507 L535 F551	P454-V512 HydrophobicContact CB-CG2 3.7Å; P454-V512 HydrophobicContact CG-CG2 4.02Å; L473-V512 HydrophobicContact CD1-CG1 3.65Å; L473-V512 HydrophobicContact CD1-CG2 4.47Å; F505-V512 HydrophobicContact CB-CG1 4.34Å; F505-V512 HydrophobicContact CD1-CG1 4.07Å; E506-V512 CarbonylContact O-C 3.55Å; E506-V512 WeakPolarHBondContact O-CA 3.46Å; N507-V512 HydrophobicContact CB-CG2 4.15Å; V512-L535 HydrophobicContact CG1-CD1 3.94Å; V512-L535 PolarHBondContact O-N 2.68Å; V512-F551 HydrophobicContact CB-CE2 4.03Å; V512-F551 HydrophobicContact CB-CZ 3.75Å; V512-F551 HydrophobicContact CG1-CE2 4.22Å; V512-F551 HydrophobicContact CG1-CZ 4.41Å; V512-F551 HydrophobicContact CG2-CE2 3.85Å; V512-F551 HydrophobicContact CG2-CZ 3.67Å
513	T	92.6	Very high	87.4	Confident	33 Å²	33	40.8 Å²	40.8	20%	0.202	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.6	177	-55.9	0	0	0	0	109.7	F505 E506 V515 P532 V533	F505-T513 CarbonylContact C-O 3.22Å; F505-T513 WeakPolarHBondContact CA-O 3.2Å; E506-T513 PolarHBondContact N-O 3.47Å; E506-T513 PolarHBondContact O-N 2.95Å; T513-V515 HydrophobicContact CG2-CG2 4.33Å; T513-P532 HydrophobicContact CG2-CB 3.87Å; T513-V533 CarbonylContact C-O 3.57Å; T513-V533 WeakPolarHBondContact CA-O 3.49Å
514	L	92.7	Very high	87.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	127.3	170.9	179.9	151.8	0	0	0	109.4	F505 C522 V524 V529 P532 V533 L535 I541 L543	F505-L514 HydrophobicContact CD1-CB 4.28Å; F505-L514 HydrophobicContact CE1-CB 4.15Å; F505-L514 HydrophobicContact CE1-CD1 3.79Å; F505-L514 HydrophobicContact CE1-CG 4.24Å; F505-L514 HydrophobicContact CZ-CD1 3.98Å; L514-C522 HydrophobicContact CD2-CB 3.91Å; L514-V524 HydrophobicContact CD1-CG2 4.21Å; L514-V529 HydrophobicContact CD2-CB 4.49Å; L514-V529 HydrophobicContact CD2-CG1 4Å; L514-P532 CarbonylContact O-C 3.59Å; L514-P532 WeakPolarHBondContact O-CA 3.48Å; L514-V533 PolarHBondContact N-O 3.46Å; L514-V533 PolarHBondContact O-N 2.87Å; L514-L535 HydrophobicContact CB-CD1 4.19Å; L514-L535 HydrophobicContact CB-CD2 4.35Å; L514-L535 HydrophobicContact CB-CG 4.35Å; L514-I541 HydrophobicContact CD1-CD1 4.47Å; L514-I541 HydrophobicContact CD1-CG2 3.67Å; L514-L543 HydrophobicContact CD1-CD2 4.31Å
515	V	92.8	Very high	86.7	Confident	28 Å²	28	46.1 Å²	46.1	17%	0.17	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	109.4	178.1	-177.9	0	0	0	0	108.8	C503 V504 E506 T513 P532	C503-V515 CarbonylContact C-O 3.51Å; C503-V515 VanDerWaalsContact CA-O 3.27Å; C503-V515 WeakPolarHBondContact CA-O 3.2Å; C503-V515 VanDerWaalsContact CB-O 3.31Å; C503-V515 WeakPolarHBondContact CB-O 3.03Å; V504-V515 HydrophobicContact CB-CB 4.41Å; V504-V515 PolarHBondContact N-O 3.32Å; V504-V515 PolarHBondContact O-N 3.38Å; E506-V515 HydrophobicContact CG-CG2 4.06Å; T513-V515 HydrophobicContact CG2-CG2 4.33Å; V515-P532 HydrophobicContact CG1-CG 4.31Å; V515-P532 HydrophobicContact CG2-CB 4.1Å; V515-P532 HydrophobicContact CG2-CG 4.18Å
516	P	91.2	Very high	86	Confident	22 Å²	22	49.5 Å²	49.5	14%	0.143	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	138.9	175.4	31	-34.1	0	0	0	110.6	C522 V529	P516-C522 HydrophobicContact CB-CB 4.26Å; P516-V529 HydrophobicContact CG-CG1 4.36Å
517	L	88.3	Confident	85.7	Confident	47 Å²	47	52.7 Å²	52.7	25%	0.246	34%	0.341	C	S	.	.			trans	-104.8	151.6	176.2	-65	-177.1	0	0	0	110.9	E501 H502 V504 G519 A520	E501-L517 HydrophobicContact CB-CD1 4.05Å; H502-L517 PolarHBondContact O-N 3.34Å; V504-L517 HydrophobicContact CG2-CD1 3.82Å; V504-L517 HydrophobicContact CG2-CD2 4.18Å; V504-L517 HydrophobicContact CG2-CG 4.11Å; L517-G519 PolarHBondContact O-N 2.88Å; L517-A520 WeakPolarHBondContact O-CB 3.49Å; L517-A520 PolarHBondContact O-N 2.92Å
518	G	73.4	Confident	85.5	Confident	88 Å²	88	57.9 Å²	57.9	91%	0.907	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	9.9	166	0	0	0	0	0	117.9
519	G	74.4	Confident	85.5	Confident	80 Å²	80	52.8 Å²	52.8	83%	0.825	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	13	-169.4	0	0	0	0	0	114.3	L517	L517-G519 PolarHBondContact O-N 2.88Å
520	A	85.6	Confident	85.6	Confident	6 Å²	6	49.8 Å²	49.8	5%	0.05	34%	0.342	C	S	.	.			trans	-50	143	177.3	0	0	0	0	0	113.8	E499 H502 L517 C522	E499-A520 HydrophobicContact CG-CB 4.11Å; H502-A520 WeakPolarHBondContact ND1-CB 3.4Å; H502-A520 WeakPolarHBondContact O-CB 3.09Å; L517-A520 WeakPolarHBondContact O-CB 3.49Å; L517-A520 PolarHBondContact O-N 2.92Å; A520-C522 VanDerWaalsContact C-N 3.35Å; A520-C522 PolarHBondContact O-N 2.98Å
521	R	87	Confident	86.1	Confident	128 Å²	128	51.7 Å²	51.7	48%	0.483	36%	0.356	S	S	.	.			trans	-80.7	77.8	-179	-164.7	-177.4	-171.2	142.2	7.2	112	D497 L528 G544	D497-R521 IonicContact OD2-NH1 2.9Å; D497-R521 PolarHBondContact OD2-NH1 3.49Å; D497-R521 VanDerWaalsContact OD2-NH1 3.11Å; R521-L528 HydrophobicContact CG-CD1 3.78Å; R521-G544 PolarHBondContact O-N 3.19Å
522	C	91.2	Very high	86.4	Confident	0 Å²	0	53 Å²	53	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	137.6	171.8	-57.5	0	0	0	0	110.5	L514 P516 A520 L528 V529 L543	L514-C522 HydrophobicContact CD2-CB 3.91Å; P516-C522 HydrophobicContact CB-CB 4.26Å; A520-C522 VanDerWaalsContact C-N 3.35Å; A520-C522 PolarHBondContact O-N 2.98Å; C522-L528 WeakPolarHBondContact O-CD1 3.46Å; C522-V529 PolarHBondContact O-N 3.3Å; C522-L543 HydrophobicContact CB-CD2 4.11Å
523	S	89.1	Confident	86.4	Confident	19 Å²	19	55.5 Å²	55.5	13%	0.133	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.7	169.3	63.6	0	0	0	0	112.6	V527 I541 L542	S523-V527 CarbonylContact C-O 3.56Å; S523-V527 WeakPolarHBondContact CA-O 3.43Å; S523-V527 WeakPolarHBondContact CB-O 3.47Å; S523-I541 WeakPolarHBondContact O-CA 3.29Å; S523-L542 PolarHBondContact N-O 3.37Å; S523-L542 PolarHBondContact O-N 3.18Å
524	V	88.5	Confident	86.3	Confident	13 Å²	13	59.4 Å²	59.4	8%	0.079	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.8	-179.6	-179.6	0	0	0	0	108.1	L514 G526 V527 V529 L535 A539 V540 I541	L514-V524 HydrophobicContact CD1-CG2 4.21Å; V524-G526 PolarHBondContact O-N 3.49Å; V524-V527 PolarHBondContact N-O 3.02Å; V524-V527 PolarHBondContact O-N 3.43Å; V524-V529 HydrophobicContact CB-CG2 3.98Å; V524-V529 HydrophobicContact CG2-CG2 3.8Å; V524-L535 HydrophobicContact CG1-CD2 3.78Å; V524-L535 HydrophobicContact CG2-CD2 3.89Å; V524-A539 HydrophobicContact CG1-CB 4.23Å; V524-V540 CarbonylContact C-O 3.52Å; V524-V540 WeakPolarHBondContact CA-O 3.42Å; V524-I541 HydrophobicContact CG2-CG1 4.43Å
525	N	83.9	Confident	86.2	Confident	107 Å²	107	59.7 Å²	59.7	57%	0.572	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	34.3	-172.9	-59	-37	0	0	0	113.5	V527 A539 V540	N525-V527 VanDerWaalsContact C-N 3.31Å; N525-V527 PolarHBondContact O-N 3.48Å; N525-A539 WeakPolarHBondContact OD1-CA 3.34Å; N525-V540 PolarHBondContact N-O 3.42Å; N525-V540 PolarHBondContact OD1-N 2.91Å
526	G	78.9	Confident	85.9	Confident	72 Å²	72	62.6 Å²	62.6	74%	0.742	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-3.8	-178.4	0	0	0	0	0	115.5	V524	V524-G526 PolarHBondContact O-N 3.49Å
527	V	85.8	Confident	85.7	Confident	101 Å²	101	64.2 Å²	64.2	61%	0.612	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	128.5	175.3	-176.7	0	0	0	0	109.4	S523 V524 N525	S523-V527 CarbonylContact C-O 3.56Å; S523-V527 WeakPolarHBondContact CA-O 3.43Å; S523-V527 WeakPolarHBondContact CB-O 3.47Å; V524-V527 PolarHBondContact N-O 3.02Å; V524-V527 PolarHBondContact O-N 3.43Å; N525-V527 VanDerWaalsContact C-N 3.31Å; N525-V527 PolarHBondContact O-N 3.48Å
528	L	85.9	Confident	85.2	Confident	115 Å²	115	63 Å²	63	60%	0.602	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.7	176.1	-170.1	76.8	0	0	0	110.3	R521 C522	R521-L528 HydrophobicContact CG-CD1 3.78Å; C522-L528 WeakPolarHBondContact O-CD1 3.46Å
529	V	85.9	Confident	85.7	Confident	11 Å²	11	59.1 Å²	59.1	7%	0.067	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.1	-174.8	175.7	0	0	0	0	109.4	L514 P516 C522 V524 A531 V533	L514-V529 HydrophobicContact CD2-CB 4.49Å; L514-V529 HydrophobicContact CD2-CG1 4Å; P516-V529 HydrophobicContact CG-CG1 4.36Å; C522-V529 PolarHBondContact O-N 3.3Å; V524-V529 HydrophobicContact CB-CG2 3.98Å; V524-V529 HydrophobicContact CG2-CG2 3.8Å; V529-A531 WeakPolarHBondContact CG1-O 3.46Å; V529-V533 HydrophobicContact CB-CG2 4.5Å; V529-V533 HydrophobicContact CG1-CB 3.93Å; V529-V533 HydrophobicContact CG1-CG2 3.57Å; V529-V533 HydrophobicContact CG2-CB 4.45Å; V529-V533 HydrophobicContact CG2-CG2 4.13Å
530	A	81.6	Confident	86.3	Confident	97 Å²	97	58.1 Å²	58.1	80%	0.802	35%	0.354	S	S	*	.			trans	-113.1	1.9	178.6	0	0	0	0	0	113.7
531	A	85.4	Confident	86.5	Confident	57 Å²	57	57.8 Å²	57.8	47%	0.471	35%	0.352	S	S	.	.	S	Bend	trans	-143.1	164.5	-179.5	0	0	0	0	0	109.4	V529 V533	V529-A531 WeakPolarHBondContact CG1-O 3.46Å; A531-V533 PolarHBondContact O-N 2.71Å
532	P	89.5	Confident	86.5	Confident	89 Å²	89	54.3 Å²	54.3	58%	0.578	34%	0.342	S	S	*	.			trans	-53	126.8	176.5	-28.3	36.3	0	0	0	113.2	T513 L514 V515	T513-P532 HydrophobicContact CG2-CB 3.87Å; L514-P532 CarbonylContact O-C 3.59Å; L514-P532 WeakPolarHBondContact O-CA 3.48Å; V515-P532 HydrophobicContact CG1-CG 4.31Å; V515-P532 HydrophobicContact CG2-CB 4.1Å; V515-P532 HydrophobicContact CG2-CG 4.18Å
533	V	90.6	Very high	86.4	Confident	52 Å²	52	54.3 Å²	54.3	32%	0.315	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	124.7	-179.8	165.7	0	0	0	0	110.9	T513 L514 V529 A531	T513-V533 CarbonylContact C-O 3.57Å; T513-V533 WeakPolarHBondContact CA-O 3.49Å; L514-V533 PolarHBondContact N-O 3.46Å; L514-V533 PolarHBondContact O-N 2.87Å; V529-V533 HydrophobicContact CB-CG2 4.5Å; V529-V533 HydrophobicContact CG1-CB 3.93Å; V529-V533 HydrophobicContact CG1-CG2 3.57Å; V529-V533 HydrophobicContact CG2-CB 4.45Å; V529-V533 HydrophobicContact CG2-CG2 4.13Å; A531-V533 PolarHBondContact O-N 2.71Å
534	Q	90.8	Very high	86.3	Confident	116 Å²	116	53.5 Å²	53.5	54%	0.542	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.7	173.7	-175.8	178.4	-9.9	0	0	111	T511	T511-Q534 HydrophobicContact CG2-CG 3.84Å
535	L	89.8	Confident	85.9	Confident	5 Å²	5	59.9 Å²	59.9	3%	0.026	36%	0.36	C	S	.	.			trans	-102.4	133.6	-179.4	-59.7	173.2	0	0	0	111.1	F505 V512 L514 V524 I541 F551	F505-L535 HydrophobicContact CD1-CD1 3.87Å; F505-L535 HydrophobicContact CE1-CD1 3.69Å; V512-L535 HydrophobicContact CG1-CD1 3.94Å; V512-L535 PolarHBondContact O-N 2.68Å; L514-L535 HydrophobicContact CB-CD1 4.19Å; L514-L535 HydrophobicContact CB-CD2 4.35Å; L514-L535 HydrophobicContact CB-CG 4.35Å; V524-L535 HydrophobicContact CG1-CD2 3.78Å; V524-L535 HydrophobicContact CG2-CD2 3.89Å; L535-I541 HydrophobicContact CD1-CD1 3.63Å; L535-I541 HydrophobicContact CD2-CD1 3.92Å; L535-I541 HydrophobicContact CD2-CG1 4.32Å; L535-I541 HydrophobicContact CG-CD1 4.42Å; L535-F551 HydrophobicContact CB-CD1 3.65Å; L535-F551 HydrophobicContact CB-CE1 3.66Å; L535-F551 HydrophobicContact CB-CG 4.23Å; L535-F551 HydrophobicContact CB-CZ 4.26Å; L535-F551 HydrophobicContact CD1-CD2 4.44Å; L535-F551 HydrophobicContact CD1-CG 4.36Å
536	N	87.6	Confident	85.5	Confident	89 Å²	89	57 Å²	57	48%	0.476	35%	0.346	S	S	.	.			trans	-112.8	160.3	178.3	-59.5	-17	0	0	0	110.7	G538 A539 F551	N536-G538 PolarHBondContact O-N 3.2Å; N536-A539 WeakPolarHBondContact O-CB 3.41Å; N536-A539 PolarHBondContact O-N 3.47Å; N536-A539 VanDerWaalsContact O-N 3.13Å; N536-F551 WeakPolarHBondContact O-CD1 3.48Å
537	Q	86.1	Confident	85.7	Confident	57 Å²	57	54.9 Å²	54.9	27%	0.266	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.2	118	179.8	174	56.5	27.7	0	0	113.9	N552 H553 E556 A557 L560	Q537-N552 PolarHBondContact NE2-OD1 3.34Å; Q537-N552 PolarHBondContact OE1-OD1 3.22Å; Q537-H553 VanDerWaalsContact OE1-C 3.3Å; Q537-H553 PolarHBondContact OE1-O 2.98Å; Q537-E556 HydrophobicContact CB-CB 4.17Å; Q537-E556 HydrophobicContact CB-CG 4.02Å; Q537-E556 WeakPolarHBondContact CB-OE2 3.32Å; Q537-E556 PolarHBondContact N-OE2 3.14Å; Q537-A557 HydrophobicContact CG-CB 4.08Å; Q537-L560 HydrophobicContact CB-CD1 4.18Å; Q537-L560 HydrophobicContact CG-CD1 4.19Å
538	G	78.1	Confident	85.6	Confident	20 Å²	20	53.1 Å²	53.1	21%	0.206	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	5	172.4	0	0	0	0	0	115.5	N536 F551	N536-G538 PolarHBondContact O-N 3.2Å; G538-F551 WeakPolarHBondContact CA-O 3.36Å; G538-F551 PolarHBondContact N-O 2.89Å
539	A	84.8	Confident	85.8	Confident	7 Å²	7	48 Å²	48	6%	0.058	28%	0.277	C	S	.	.			trans	-56.4	139.2	176.3	0	0	0	0	0	112.2	V524 N525 N536 F551	V524-A539 HydrophobicContact CG1-CB 4.23Å; N525-A539 WeakPolarHBondContact OD1-CA 3.34Å; N536-A539 WeakPolarHBondContact O-CB 3.41Å; N536-A539 PolarHBondContact O-N 3.47Å; N536-A539 VanDerWaalsContact O-N 3.13Å; A539-F551 HydrophobicContact CB-CB 4.43Å; A539-F551 PolarHBondContact O-N 2.9Å
540	V	86.3	Confident	85.8	Confident	59 Å²	59	54 Å²	54	36%	0.358	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129.1	175.1	-178.4	0	0	0	0	108.5	V524 N525 M548	V524-V540 CarbonylContact C-O 3.52Å; V524-V540 WeakPolarHBondContact CA-O 3.42Å; N525-V540 PolarHBondContact N-O 3.42Å; N525-V540 PolarHBondContact OD1-N 2.91Å; V540-M548 HydrophobicContact CG1-CG 4.06Å; V540-M548 HydrophobicContact CG1-SD 4.04Å
541	I	90.5	Very high	86.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132	-175.3	-53.5	175.7	0	0	0	107.7	L456 F505 L514 S523 V524 L535 L543 M548 F549 F551	L456-I541 HydrophobicContact CD2-CD1 3.81Å; F505-I541 HydrophobicContact CE1-CD1 3.86Å; F505-I541 HydrophobicContact CZ-CD1 4.21Å; L514-I541 HydrophobicContact CD1-CD1 4.47Å; L514-I541 HydrophobicContact CD1-CG2 3.67Å; S523-I541 WeakPolarHBondContact O-CA 3.29Å; V524-I541 HydrophobicContact CG2-CG1 4.43Å; L535-I541 HydrophobicContact CD1-CD1 3.63Å; L535-I541 HydrophobicContact CD2-CD1 3.92Å; L535-I541 HydrophobicContact CD2-CG1 4.32Å; L535-I541 HydrophobicContact CG-CD1 4.42Å; I541-L543 HydrophobicContact CG2-CD2 3.9Å; I541-L543 HydrophobicContact CG2-CG 4.21Å; I541-M548 WeakPolarHBondContact O-CA 3.43Å; I541-F549 HydrophobicContact CB-CB 4.43Å; I541-F549 PolarHBondContact N-O 3.17Å; I541-F549 PolarHBondContact O-N 3.01Å; I541-F551 HydrophobicContact CD1-CB 4.07Å
542	L	87.1	Confident	86.2	Confident	54 Å²	54	48.3 Å²	48.3	28%	0.283	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.4	173.2	178.1	71.3	0	0	0	108.8	S523 M548	S523-L542 PolarHBondContact N-O 3.37Å; S523-L542 PolarHBondContact O-N 3.18Å; L542-M548 HydrophobicContact CD1-CB 4.16Å
543	L	89.2	Confident	86	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.6	178	-58	-175.4	0	0	0	109.1	V480 L493 L514 C522 I541 R545 N547 F549	V480-L543 HydrophobicContact CG1-CD1 3.84Å; L493-L543 HydrophobicContact CD1-CB 4.42Å; L493-L543 HydrophobicContact CD1-CD1 3.81Å; L514-L543 HydrophobicContact CD1-CD2 4.31Å; C522-L543 HydrophobicContact CB-CD2 4.11Å; I541-L543 HydrophobicContact CG2-CD2 3.9Å; I541-L543 HydrophobicContact CG2-CG 4.21Å; L543-R545 PolarHBondContact O-N 3.11Å; L543-N547 HydrophobicContact CB-CB 4.32Å; L543-N547 PolarHBondContact N-O 3.29Å; L543-N547 PolarHBondContact O-N 2.81Å; L543-F549 HydrophobicContact CB-CE2 4.48Å; L543-F549 HydrophobicContact CD1-CD2 4.25Å; L543-F549 HydrophobicContact CD1-CE2 3.89Å; L543-F549 HydrophobicContact CG-CD2 4.34Å; L543-F549 HydrophobicContact CG-CE2 4.19Å
544	G	86	Confident	85.4	Confident	2 Å²	2	44.3 Å²	44.3	2%	0.021	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	-127.5	-168.4	0	0	0	0	0	111.6	D497 H502 R521	D497-G544 VanDerWaalsContact O-CA 3.27Å; D497-G544 WeakPolarHBondContact O-CA 3.33Å; H502-G544 PolarHBondContact NE2-N 3.44Å; H502-G544 VanDerWaalsContact NE2-N 3.17Å; R521-G544 PolarHBondContact O-N 3.19Å
545	R	80.1	Confident	84.8	Confident	146 Å²	146	45.1 Å²	45.1	55%	0.551	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.3	-16.1	174.4	-65.3	-170.5	-164.6	167.4	18.1	115.9	L496 D497 L543	L496-R545 PolarHBondContact O-N 2.99Å; D497-R545 HydrophobicContact CB-CG 4.12Å; D497-R545 VanDerWaalsContact CG-NH2 3.25Å; D497-R545 IonicContact OD1-CZ 2.76Å; D497-R545 IonicContact OD1-NE 3.32Å; D497-R545 PolarHBondContact OD1-NE 2.96Å; D497-R545 IonicContact OD1-NH2 2.71Å; D497-R545 PolarHBondContact OD1-NH2 2.85Å; D497-R545 IonicContact OD2-CZ 3.68Å; D497-R545 IonicContact OD2-NE 3.19Å; D497-R545 PolarHBondContact OD2-NE 3.36Å; D497-R545 IonicContact OD2-NH2 3.83Å; D497-R545 PolarHBondContact OD2-NH2 2.94Å; L543-R545 PolarHBondContact O-N 3.11Å
546	T	75.1	Confident	84.3	Confident	48 Å²	48	47.4 Å²	47.4	29%	0.294	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-16.1	-164.4	55.4	0	0	0	0	114.3	G495 M548	G495-T546 VanDerWaalsContact CA-OG1 3.29Å; G495-T546 WeakPolarHBondContact CA-OG1 3.26Å; T546-M548 PolarHBondContact O-N 3.12Å
547	N	83.9	Confident	83.8	Confident	26 Å²	26	43.8 Å²	43.8	14%	0.139	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	91.9	-173.6	-69.2	-90.6	0	0	0	110	L493 H494 L498 L543 F549	L493-N547 HydrophobicContact CD1-CB 4.04Å; H494-N547 PolarHBondContact O-ND2 3.31Å; L498-N547 HydrophobicContact CD1-CB 4.39Å; L498-N547 VanDerWaalsContact CD1-ND2 3.33Å; L498-N547 WeakPolarHBondContact CD1-ND2 3.2Å; L543-N547 HydrophobicContact CB-CB 4.32Å; L543-N547 PolarHBondContact N-O 3.29Å; L543-N547 PolarHBondContact O-N 2.81Å; N547-F549 HydrophobicContact CB-CE2 3.71Å; N547-F549 HydrophobicContact CB-CZ 3.98Å; N547-F549 WeakPolarHBondContact O-CE2 3.29Å
548	M	84.4	Confident	83.1	Confident	65 Å²	65	43.4 Å²	43.4	32%	0.32	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129	179.5	-175.9	170.4	55.5	0	0	111.7	I459 V540 I541 L542 T546	I459-M548 HydrophobicContact CB-CE 4.02Å; I459-M548 HydrophobicContact CD1-CE 4Å; I459-M548 HydrophobicContact CG2-CE 3.89Å; I459-M548 PolarHBondContact N-O 3.34Å; V540-M548 HydrophobicContact CG1-CG 4.06Å; V540-M548 HydrophobicContact CG1-SD 4.04Å; I541-M548 WeakPolarHBondContact O-CA 3.43Å; L542-M548 HydrophobicContact CD1-CB 4.16Å; T546-M548 PolarHBondContact O-N 3.12Å
549	F	88.4	Confident	83	Confident	7 Å²	7	49 Å²	49	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	149.1	177.9	-54.7	-80.9	0	0	0	111.2	L456 I457 Y471 L493 I541 L543 N547	L456-F549 HydrophobicContact CB-CB 4.22Å; L456-F549 HydrophobicContact CB-CD1 4.22Å; L456-F549 HydrophobicContact CB-CG 4.44Å; L456-F549 HydrophobicContact CD2-CB 4.24Å; I457-F549 CarbonylContact O-C 3.58Å; I457-F549 VanDerWaalsContact O-CA 3.29Å; I457-F549 WeakPolarHBondContact O-CA 3.45Å; Y471-F549 HydrophobicContact CD2-CD1 4.42Å; Y471-F549 HydrophobicContact CD2-CE1 4.13Å; Y471-F549 HydrophobicContact CE2-CD1 4.42Å; Y471-F549 AromaticContact CE2-CE1 3.75Å; Y471-F549 HydrophobicContact CE2-CE1 3.75Å; L493-F549 HydrophobicContact CD1-CE2 3.79Å; L493-F549 HydrophobicContact CD1-CZ 3.73Å; L493-F549 HydrophobicContact CD2-CZ 3.72Å; L493-F549 HydrophobicContact CG-CZ 4.41Å; I541-F549 HydrophobicContact CB-CB 4.43Å; I541-F549 PolarHBondContact N-O 3.17Å; I541-F549 PolarHBondContact O-N 3.01Å; L543-F549 HydrophobicContact CB-CE2 4.48Å; L543-F549 HydrophobicContact CD1-CD2 4.25Å; L543-F549 HydrophobicContact CD1-CE2 3.89Å; L543-F549 HydrophobicContact CG-CD2 4.34Å; L543-F549 HydrophobicContact CG-CE2 4.19Å; N547-F549 HydrophobicContact CB-CE2 3.71Å; N547-F549 HydrophobicContact CB-CZ 3.98Å; N547-F549 WeakPolarHBondContact O-CE2 3.29Å
550	R	87.4	Confident	82.3	Confident	138 Å²	138	52.3 Å²	52.3	52%	0.521	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122	165.5	-166.7	178.6	-170.4	-175.8	3.6	110.1	I457	I457-R550 HydrophobicContact CB-CB 4.39Å; I457-R550 PolarHBondContact N-O 3.18Å; I457-R550 PolarHBondContact O-N 2.9Å
551	F	89.4	Confident	81.6	Confident	1 Å²	1	57.5 Å²	57.5	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.6	176.8	177.8	-112.9	0	0	0	111.5	P454 L456 L473 V512 L535 N536 G538 A539 I541 H553	P454-F551 HydrophobicContact CB-CE2 3.73Å; P454-F551 HydrophobicContact CB-CZ 3.93Å; L456-F551 HydrophobicContact CD2-CB 4.1Å; L456-F551 HydrophobicContact CD2-CD2 4.03Å; L473-F551 HydrophobicContact CD1-CD2 4.34Å; L473-F551 HydrophobicContact CD1-CE2 4.09Å; V512-F551 HydrophobicContact CB-CE2 4.03Å; V512-F551 HydrophobicContact CB-CZ 3.75Å; V512-F551 HydrophobicContact CG1-CE2 4.22Å; V512-F551 HydrophobicContact CG1-CZ 4.41Å; V512-F551 HydrophobicContact CG2-CE2 3.85Å; V512-F551 HydrophobicContact CG2-CZ 3.67Å; L535-F551 HydrophobicContact CB-CD1 3.65Å; L535-F551 HydrophobicContact CB-CE1 3.66Å; L535-F551 HydrophobicContact CB-CG 4.23Å; L535-F551 HydrophobicContact CB-CZ 4.26Å; L535-F551 HydrophobicContact CD1-CD2 4.44Å; L535-F551 HydrophobicContact CD1-CG 4.36Å; N536-F551 WeakPolarHBondContact O-CD1 3.48Å; G538-F551 WeakPolarHBondContact CA-O 3.36Å; G538-F551 PolarHBondContact N-O 2.89Å; A539-F551 HydrophobicContact CB-CB 4.43Å; A539-F551 PolarHBondContact O-N 2.9Å; I541-F551 HydrophobicContact CD1-CB 4.07Å; F551-H553 HydrophobicContact CE1-CB 3.95Å; F551-H553 HydrophobicContact CZ-CB 4.03Å
552	N	85	Confident	80.3	Confident	33 Å²	33	64.2 Å²	64.2	18%	0.176	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.3	179.5	-169.5	23.5	0	0	0	109.5	P454 H455 I457 Q537	P454-N552 WeakPolarHBondContact CA-O 3.42Å; H455-N552 PolarHBondContact CE1-ND2 2.93Å; H455-N552 PolarHBondContact N-O 2.78Å; H455-N552 WeakPolarHBondContact NE2-CB 3.24Å; H455-N552 PolarHBondContact NE2-ND2 3.34Å; H455-N552 PolarHBondContact O-N 3.1Å; I457-N552 HydrophobicContact CD1-CB 4.48Å; Q537-N552 PolarHBondContact NE2-OD1 3.34Å; Q537-N552 PolarHBondContact OE1-OD1 3.22Å
553	H	86.5	Confident	79.3	Confident	30 Å²	30	67.5 Å²	67.5	14%	0.139	31%	0.311	C	S	.	.			trans	-116.3	94.2	176.2	-174.8	12	0	0	0	110.5	G510 Q537 F551 K555 E556 A557	G510-H553 PolarHBondContact O-NE2 3.19Å; Q537-H553 VanDerWaalsContact OE1-C 3.3Å; Q537-H553 PolarHBondContact OE1-O 2.98Å; F551-H553 HydrophobicContact CE1-CB 3.95Å; F551-H553 HydrophobicContact CZ-CB 4.03Å; H553-K555 VanDerWaalsContact C-N 3.34Å; H553-K555 PolarHBondContact O-N 3.03Å; H553-K555 VanDerWaalsContact O-N 3.17Å; H553-E556 HydrophobicContact CB-CB 4.2Å; H553-E556 IonicContact CD2-OE2 2.66Å; H553-E556 PolarHBondContact O-N 3.22Å; H553-A557 PolarHBondContact O-N 2.99Å
554	P	77.7	Confident	77.9	Confident	26 Å²	26	77.6 Å²	77.6	17%	0.169	35%	0.349	C	S	.	.	H	α-helix	trans	-54.9	-39.9	-170.6	-29.6	35.9	0	0	0	115.4	S451 L453 A557 A558	S451-P554 WeakPolarHBondContact O-CB 3.28Å; S451-P554 WeakPolarHBondContact O-CG 3.49Å; L453-P554 WeakPolarHBondContact O-CD 3.47Å; L453-P554 WeakPolarHBondContact O-CG 3.47Å; P554-A557 WeakPolarHBondContact O-CB 3.36Å; P554-A557 PolarHBondContact O-N 3.26Å; P554-A558 WeakPolarHBondContact O-CB 3.45Å; P554-A558 PolarHBondContact O-N 2.76Å
555	K	77.1	Confident	76.3	Confident	133 Å²	133	86.6 Å²	86.6	58%	0.578	39%	0.388	S	S	*	.	H	α-helix	trans	-68.6	-34.2	179.9	-62.8	179.4	-178	174.2	0	112.8	H553 K559	H553-K555 VanDerWaalsContact C-N 3.34Å; H553-K555 PolarHBondContact O-N 3.03Å; H553-K555 VanDerWaalsContact O-N 3.17Å; K555-K559 WeakPolarHBondContact O-CG 3.37Å; K555-K559 PolarHBondContact O-N 3.27Å
556	E	80.3	Confident	75	Confident	54 Å²	54	83 Å²	83	25%	0.252	39%	0.385	S	S	.	.	H	α-helix	trans	-73.1	-43.2	173.4	-168.6	-171.2	167.5	0	0	110.5	Q537 H553 A558 K559 L560	Q537-E556 HydrophobicContact CB-CB 4.17Å; Q537-E556 HydrophobicContact CB-CG 4.02Å; Q537-E556 WeakPolarHBondContact CB-OE2 3.32Å; Q537-E556 PolarHBondContact N-OE2 3.14Å; H553-E556 HydrophobicContact CB-CB 4.2Å; H553-E556 IonicContact CD2-OE2 2.66Å; H553-E556 PolarHBondContact O-N 3.22Å; E556-A558 VanDerWaalsContact C-N 3.3Å; E556-A558 PolarHBondContact O-N 2.87Å; E556-K559 PolarHBondContact O-N 3.4Å; E556-L560 HydrophobicContact CG-CD1 4.15Å; E556-L560 WeakPolarHBondContact O-CG 3.3Å; E556-L560 PolarHBondContact O-N 2.62Å
557	A	75.7	Confident	73.7	Confident	12 Å²	12	83.9 Å²	83.9	10%	0.099	40%	0.404	C	S	.	.	H	α-helix	trans	-56.5	-41.2	174.1	0	0	0	0	0	112.7	Q537 H553 P554 L560 R561	Q537-A557 HydrophobicContact CG-CB 4.08Å; H553-A557 PolarHBondContact O-N 2.99Å; P554-A557 WeakPolarHBondContact O-CB 3.36Å; P554-A557 PolarHBondContact O-N 3.26Å; A557-L560 PolarHBondContact O-N 2.71Å; A557-R561 WeakPolarHBondContact O-CB 3.37Å; A557-R561 VanDerWaalsContact O-CG 3.24Å; A557-R561 WeakPolarHBondContact O-CG 3.37Å; A557-R561 PolarHBondContact O-N 2.74Å
558	A	72.4	Confident	72.1	Confident	49 Å²	49	89.5 Å²	89.5	41%	0.405	43%	0.433	S	S	.	.	H	α-helix	trans	-61.9	-50.2	175.7	0	0	0	0	0	112	P554 E556 L560 R561 E562	P554-A558 WeakPolarHBondContact O-CB 3.45Å; P554-A558 PolarHBondContact O-N 2.76Å; E556-A558 VanDerWaalsContact C-N 3.3Å; E556-A558 PolarHBondContact O-N 2.87Å; A558-L560 VanDerWaalsContact C-N 3.28Å; A558-L560 PolarHBondContact O-N 2.98Å; A558-R561 WeakPolarHBondContact O-CB 3.41Å; A558-R561 PolarHBondContact O-N 3.22Å; A558-R561 VanDerWaalsContact O-N 3.08Å; A558-E562 PolarHBondContact O-N 3.36Å
559	K	75.4	Confident	70	Confident	138 Å²	138	92 Å²	92	60%	0.6	45%	0.447	S	S	*	.	H	α-helix	trans	-58.4	-38.5	175.9	-70.6	173.2	-179.5	177	0	112.3	K555 E556 K563	K555-K559 WeakPolarHBondContact O-CG 3.37Å; K555-K559 PolarHBondContact O-N 3.27Å; E556-K559 PolarHBondContact O-N 3.4Å; K559-K563 WeakPolarHBondContact O-CB 3.38Å; K559-K563 WeakPolarHBondContact O-CG 3.16Å; K559-K563 PolarHBondContact O-N 2.64Å
560	L	69.6	Low	67.6	Low	76 Å²	76	97 Å²	97	40%	0.398	48%	0.483	S	S	.	.	H	α-helix	trans	-69.9	-35	176	-69.8	169	0	0	0	112.5	Q537 E556 A557 A558 R564	Q537-L560 HydrophobicContact CB-CD1 4.18Å; Q537-L560 HydrophobicContact CG-CD1 4.19Å; E556-L560 HydrophobicContact CG-CD1 4.15Å; E556-L560 WeakPolarHBondContact O-CG 3.3Å; E556-L560 PolarHBondContact O-N 2.62Å; A557-L560 PolarHBondContact O-N 2.71Å; A558-L560 VanDerWaalsContact C-N 3.28Å; A558-L560 PolarHBondContact O-N 2.98Å; L560-R564 PolarHBondContact O-N 2.76Å; L560-R564 VanDerWaalsContact O-N 3.1Å
561	R	72.8	Confident	65.5	Low	169 Å²	169	94.9 Å²	94.9	64%	0.638	49%	0.489	S	S	*	.	H	α-helix	trans	-67.6	-40.5	173.1	-73.5	167.9	179.8	-175.9	0.3	111.9	A557 A558 R564 K565	A557-R561 WeakPolarHBondContact O-CB 3.37Å; A557-R561 VanDerWaalsContact O-CG 3.24Å; A557-R561 WeakPolarHBondContact O-CG 3.37Å; A557-R561 PolarHBondContact O-N 2.74Å; A558-R561 WeakPolarHBondContact O-CB 3.41Å; A558-R561 PolarHBondContact O-N 3.22Å; A558-R561 VanDerWaalsContact O-N 3.08Å; R561-R564 PolarHBondContact O-N 2.76Å; R561-K565 PolarHBondContact O-N 3.37Å
562	E	63	Low	62.7	Low	140 Å²	140	103.9 Å²	103.9	65%	0.654	53%	0.529	S	S	*	.	H	α-helix	trans	-64.7	-45.6	173.6	-72.4	-172.8	143.8	0	0	112.1	A558 R564 K565 S566	A558-E562 PolarHBondContact O-N 3.36Å; E562-R564 PolarHBondContact O-N 3.27Å; E562-K565 WeakPolarHBondContact O-CA 3.38Å; E562-K565 PolarHBondContact O-N 2.87Å; E562-S566 PolarHBondContact O-N 3.41Å; E562-S566 PolarHBondContact O-OG 2.77Å
563	K	66.5	Low	60.4	Low	124 Å²	124	107.4 Å²	107.4	54%	0.539	56%	0.556	S	S	.	*	H	α-helix	trans	-59.9	-27.6	174.1	-75	179.3	177.4	-174.6	0	113.5	K559 S566 L569	K559-K563 WeakPolarHBondContact O-CB 3.38Å; K559-K563 WeakPolarHBondContact O-CG 3.16Å; K559-K563 PolarHBondContact O-N 2.64Å; K563-S566 PolarHBondContact O-OG 3.33Å; K563-L569 HydrophobicContact CB-CD1 4.38Å
564	R	58.8	Low	57.8	Low	212 Å²	212	113.5 Å²	113.5	80%	0.8	59%	0.589	S	S	*	*	H	α-helix	trans	-75	-38	169.4	-81.6	-176	173.8	179.3	-0.8	112.8	L560 R561 E562 S566	L560-R564 PolarHBondContact O-N 2.76Å; L560-R564 VanDerWaalsContact O-N 3.1Å; R561-R564 PolarHBondContact O-N 2.76Å; E562-R564 PolarHBondContact O-N 3.27Å; R564-S566 VanDerWaalsContact C-N 3.34Å
565	K	52.9	Low	55.6	Low	191 Å²	191	116.9 Å²	116.9	83%	0.83	61%	0.613	S	S	*	*	H	α-helix	trans	-70.6	-25.7	177	-75.7	-175.5	175.6	-177.3	0	113.4	R561 E562 G567	R561-K565 PolarHBondContact O-N 3.37Å; E562-K565 WeakPolarHBondContact O-CA 3.38Å; E562-K565 PolarHBondContact O-N 2.87Å; K565-G567 VanDerWaalsContact C-N 3.32Å
566	S	52.2	Low	53.3	Low	71 Å²	71	118.2 Å²	118.2	50%	0.497	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	3.3	177.8	64.4	0	0	0	0	115.1	E562 K563 R564 L568	E562-S566 PolarHBondContact O-N 3.41Å; E562-S566 PolarHBondContact O-OG 2.77Å; K563-S566 PolarHBondContact O-OG 3.33Å; R564-S566 VanDerWaalsContact C-N 3.34Å; S566-L568 PolarHBondContact O-N 2.95Å; S566-L568 VanDerWaalsContact O-N 3.15Å
567	G	48.6	Very low	51	Low	67 Å²	67	121.6 Å²	121.6	69%	0.691	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.8	2.2	172.6	0	0	0	0	0	116.4	K565 L569	K565-G567 VanDerWaalsContact C-N 3.32Å; G567-L569 VanDerWaalsContact C-N 3.29Å; G567-L569 PolarHBondContact O-N 2.76Å
568	L	50.2	Low	48.8	Very low	144 Å²	144	128.2 Å²	128.2	75%	0.754	68%	0.681	S	S	*	*			trans	-84.4	17.7	-170.9	-87.2	165.6	0	0	0	115.6	S566	S566-L568 PolarHBondContact O-N 2.95Å; S566-L568 VanDerWaalsContact O-N 3.15Å
569	L	40.7	Very low	46.7	Very low	118 Å²	118	134.1 Å²	134.1	62%	0.618	71%	0.705	S	S	*	*			trans	-136.2	85.5	179.6	-74.5	173.3	0	0	0	112.1	K563 G567	K563-L569 HydrophobicContact CB-CD1 4.38Å; G567-L569 VanDerWaalsContact C-N 3.29Å; G567-L569 PolarHBondContact O-N 2.76Å
570	S	38.1	Very low	44.6	Very low	112 Å²	112	132.2 Å²	132.2	78%	0.783	71%	0.709	S	S	*	*			trans	-99.7	143.9	150.4	71	0	0	0	0	108.6
571	S	42.9	Very low	42.8	Very low	93 Å²	93	138.5 Å²	138.5	65%	0.65	73%	0.734	S	S	*	*			trans	62	95.2	-176	-176.5	0	0	0	0	116.4
572	F	30.2	Very low	40.8	Very low	189 Å²	189	136 Å²	136	83%	0.829	74%	0.742	S	S	*	*				-153.6	83.6	124.9	-102.5	-68.4	0	0	0	109.7
573	S	36.3	Very low	39.5	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	75%	0.747	S	S	*	*			trans	-89.2	122.9	142.1	54.8	0	0	0	0	106.8
574	L	31.9	Very low	38.1	Very low	159 Å²	159	137.1 Å²	137.1	83%	0.832	76%	0.76	S	S	*	*			trans	-166.2	131.3	152.2	-108.2	166.2	0	0	0	109.5
575	S	31.8	Very low	37.2	Very low	96 Å²	96	133.1 Å²	133.1	67%	0.671	76%	0.755	S	S	*	*			trans	-110.9	161.4	172.6	58	0	0	0	0	109.7
576	M	28.2	Very low	36.1	Very low	161 Å²	161	131.6 Å²	131.6	79%	0.793	76%	0.755	S	S	*	*			trans	69.6	98.1	164.2	-57.9	-57.9	-68.6	0	0	117.1
577	T	33.6	Very low	35	Very low	126 Å²	126	133.7 Å²	133.7	77%	0.773	77%	0.769	S	S	*	*			trans	6	129.7	138.4	50.3	0	0	0	0	119.2
578	D	29.6	Very low	34.2	Very low	150 Å²	150	136.8 Å²	136.8	80%	0.802	78%	0.775	S	S	*	*			trans	-115.2	133.3	157.7	-147.9	-12.4	0	0	0	109.1
579	L	27.3	Very low	33.4	Very low	173 Å²	173	135.4 Å²	135.4	91%	0.906	77%	0.772	S	S	*	*			trans	-156.8	93.9	178.2	-157	89.4	0	0	0	112.3
580	S	30.5	Very low	33	Very low	99 Å²	99	137.3 Å²	137.3	69%	0.692	78%	0.78	S	S	*	*			trans	-143.2	112.5	168.2	60.5	0	0	0	0	113.4
581	K	33.4	Very low	32.6	Very low	208 Å²	208	140.2 Å²	140.2	90%	0.904	79%	0.786	S	S	*	*				21	145.9	127.4	-62.5	178.3	-176.7	-179.8	0	117.9
582	S	29.5	Very low	31.9	Very low	116 Å²	116	145.1 Å²	145.1	81%	0.811	79%	0.792	S	S	*	*			cis	-171.5	175.9	0.7	-178	0	0	0	0	108.8
583	C	36.6	Very low	31.8	Very low	113 Å²	113	142.4 Å²	142.4	76%	0.764	79%	0.786	S	S	*	*			trans	-81.3	160.4	-179.1	-43.8	0	0	0	0	115
584	E	36.6	Very low	32.2	Very low	174 Å²	174	142.7 Å²	142.7	81%	0.813	79%	0.785	S	S	*	*				165	136.7	124.1	-90.8	-174.2	-157.7	0	0	118.9
585	N	39.2	Very low	32.1	Very low	129 Å²	129	138.3 Å²	138.3	69%	0.69	78%	0.778	S	S	*	*			trans	68.6	113.2	134.6	-62.3	-28.2	0	0	0	128.7
586	L	30.9	Very low	32.1	Very low	158 Å²	158	142.3 Å²	142.3	83%	0.827	79%	0.791	S	S	*	*				56.9	131.9	118.5	-134.1	82.7	0	0	0	125.9
587	S	29.1	Very low	32.1	Very low	115 Å²	115	140.8 Å²	140.8	80%	0.804	78%	0.782	S	S	*	*				163.6	163.8	122.5	-72.8	0	0	0	0	117
588	T	31.8	Very low	32	Very low	133 Å²	133	142.5 Å²	142.5	82%	0.816	78%	0.779	S	S	*	*			trans	-136	163.5	-170.1	-55.5	0	0	0	0	112.2
589	V	32.6	Very low	32.5	Very low	114 Å²	114	143.1 Å²	143.1	69%	0.691	78%	0.777	S	S	*	*			trans	146.3	120.8	136.7	165.7	0	0	0	0	118.7
590	M	32.4	Very low	33.5	Very low	159 Å²	159	142 Å²	142	78%	0.783	76%	0.761	S	S	*	*			trans	44.1	148.1	143.1	-62.9	-165.3	-67.9	0	0	127
591	L	29.5	Very low	34.2	Very low	173 Å²	173	145.3 Å²	145.3	91%	0.906	77%	0.766	S	S	*	*				-169.1	-179.1	110.8	-99	167.8	0	0	0	114.5
592	Y	28.5	Very low	34.7	Very low	196 Å²	196	144.1 Å²	144.1	77%	0.769	76%	0.763	S	S	*	*			trans	-145.8	158.8	-140.1	-149	-117	0	0	0	115.3
593	N	29.3	Very low	35.5	Very low	131 Å²	131	143.2 Å²	143.2	70%	0.701	74%	0.742	S	S	*	*			trans	90.8	170	143	-112.5	15.8	0	0	0	123.7
594	P	44.4	Very low	36.2	Very low	114 Å²	114	142.6 Å²	142.6	74%	0.74	73%	0.728	S	S	*	*				-141.7	-161.3	-115.7	45.7	-23.4	0	0	0	116.4
595	G	28.8	Very low	36.9	Very low	67 Å²	67	141.9 Å²	141.9	69%	0.691	73%	0.725	S	S	*	*			trans	168.1	114.9	156.4	0	0	0	0	0	121.9
596	L	32.9	Very low	37.5	Very low	180 Å²	180	140.6 Å²	140.6	94%	0.942	72%	0.717	S	S	*	*			trans	76.7	130.9	143.2	-63.7	168.8	0	0	0	123.7
597	E	28.3	Very low	38.8	Very low	128 Å²	128	136.3 Å²	136.3	60%	0.598	69%	0.693	S	S	*	*			trans	-129.8	143	167.7	-61.6	-175.3	124.4	0	0	110.6	R603	E597-R603 IonicContact OE1-CZ 3.63Å; E597-R603 IonicContact OE1-NH1 3.73Å; E597-R603 PolarHBondContact OE1-NH1 3.37Å; E597-R603 IonicContact OE1-NH2 2.81Å
598	F	31.5	Very low	40.2	Very low	163 Å²	163	137.6 Å²	137.6	72%	0.715	68%	0.684	S	S	*	*			trans	-161.7	66.9	144.2	-143.6	-90.7	0	0	0	115.1	R600	F598-R600 HydrophobicContact CD1-CB 4.24Å; F598-R600 HydrophobicContact CD2-CB 4.23Å; F598-R600 HydrophobicContact CE1-CB 4.04Å; F598-R600 HydrophobicContact CE2-CB 4.04Å; F598-R600 HydrophobicContact CE2-CG 4.48Å; F598-R600 HydrophobicContact CG-CB 4.34Å; F598-R600 HydrophobicContact CZ-CB 3.94Å
599	E	40	Very low	41.4	Very low	162 Å²	162	136.8 Å²	136.8	76%	0.757	67%	0.674	S	S	*	*			trans	-109.1	45.1	157.3	-73.9	-170.8	141.2	0	0	110.2	Q601 R603	E599-Q601 VanDerWaalsContact C-N 3.29Å; E599-Q601 PolarHBondContact O-N 2.86Å; E599-R603 WeakPolarHBondContact O-CB 3.49Å; E599-R603 PolarHBondContact O-N 2.83Å
600	R	46.9	Very low	42.9	Very low	151 Å²	151	134.9 Å²	134.9	57%	0.57	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-2.4	-152.4	-155.4	176.1	179.1	-173.8	1.7	116.4	F598	F598-R600 HydrophobicContact CD1-CB 4.24Å; F598-R600 HydrophobicContact CD2-CB 4.23Å; F598-R600 HydrophobicContact CE1-CB 4.04Å; F598-R600 HydrophobicContact CE2-CB 4.04Å; F598-R600 HydrophobicContact CE2-CG 4.48Å; F598-R600 HydrophobicContact CG-CB 4.34Å; F598-R600 HydrophobicContact CZ-CB 3.94Å
601	Q	46.3	Very low	44.4	Very low	168 Å²	168	133.8 Å²	133.8	79%	0.785	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	-9.6	-173	-74.5	-175.1	-36.7	0	0	116.6	E599	E599-Q601 VanDerWaalsContact C-N 3.29Å; E599-Q601 PolarHBondContact O-N 2.86Å
602	Q	43.3	Very low	46.2	Very low	183 Å²	183	133.1 Å²	133.1	86%	0.855	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-21.1	153.5	-77.9	-175.7	-15.5	0	0	111.4
603	R	46.8	Very low	48.1	Very low	97 Å²	97	132.7 Å²	132.7	37%	0.366	64%	0.639	S	S	.	*	H	α-helix	trans	-62.8	-40.8	172.7	-96.3	174.2	169.3	-130.2	20.1	114.2	E597 E599 E605 L606 E607	E597-R603 IonicContact OE1-CZ 3.63Å; E597-R603 IonicContact OE1-NH1 3.73Å; E597-R603 PolarHBondContact OE1-NH1 3.37Å; E597-R603 IonicContact OE1-NH2 2.81Å; E599-R603 WeakPolarHBondContact O-CB 3.49Å; E599-R603 PolarHBondContact O-N 2.83Å; R603-E605 VanDerWaalsContact C-N 3.29Å; R603-E605 PolarHBondContact O-N 2.92Å; R603-E605 VanDerWaalsContact O-N 3.13Å; R603-L606 CarbonylContact O-C 3.58Å; R603-L606 PolarHBondContact O-N 2.86Å; R603-L606 VanDerWaalsContact O-N 3.17Å; R603-E607 HydrophobicContact CB-CG 4.08Å; R603-E607 VanDerWaalsContact CD-OE1 3.27Å; R603-E607 WeakPolarHBondContact CD-OE1 3.47Å; R603-E607 HydrophobicContact CG-CG 4.2Å; R603-E607 WeakPolarHBondContact CG-OE1 3.32Å; R603-E607 IonicContact CZ-OE1 3.4Å; R603-E607 IonicContact NE-OE1 2.71Å; R603-E607 IonicContact NH1-OE1 2.62Å; R603-E607 PolarHBondContact NH1-OE1 3.11Å; R603-E607 WeakPolarHBondContact O-CA 3.37Å; R603-E607 WeakPolarHBondContact O-CB 3.19Å; R603-E607 VanDerWaalsContact O-CG 3.27Å; R603-E607 WeakPolarHBondContact O-CG 3.37Å; R603-E607 PolarHBondContact O-N 2.8Å
604	E	50.9	Low	50	Low	100 Å²	100	133.3 Å²	133.3	47%	0.467	63%	0.631	S	S	.	*	H	α-helix	trans	-66	-22.9	-169.1	-71.1	-173.6	165.2	0	0	115.8	K608	E604-K608 VanDerWaalsContact O-CD 3.25Å; E604-K608 WeakPolarHBondContact O-CD 3.41Å; E604-K608 VanDerWaalsContact O-CG 3.26Å; E604-K608 WeakPolarHBondContact O-CG 3.26Å
605	E	51.1	Low	51.5	Low	159 Å²	159	132.9 Å²	132.9	74%	0.743	62%	0.622	S	S	*	*	H	α-helix	trans	-89.3	-40.5	169.8	-69	-151.5	138.5	0	0	112.5	R603 K608 L609	R603-E605 VanDerWaalsContact C-N 3.29Å; R603-E605 PolarHBondContact O-N 2.92Å; R603-E605 VanDerWaalsContact O-N 3.13Å; E605-K608 PolarHBondContact O-N 3.23Å; E605-L609 PolarHBondContact O-N 3.09Å; E605-L609 VanDerWaalsContact O-N 3.14Å
606	L	53.3	Low	53.7	Low	101 Å²	101	134.2 Å²	134.2	53%	0.529	61%	0.613	S	S	.	*	H	α-helix	trans	-63.1	-43.4	175.9	-161.8	78.2	0	0	0	110.9	R603 K608 L609 E610	R603-L606 CarbonylContact O-C 3.58Å; R603-L606 PolarHBondContact O-N 2.86Å; R603-L606 VanDerWaalsContact O-N 3.17Å; L606-K608 PolarHBondContact O-N 2.96Å; L606-L609 CarbonylContact O-C 3.57Å; L606-L609 PolarHBondContact O-N 3.34Å; L606-E610 HydrophobicContact CG-CG 4.38Å; L606-E610 VanDerWaalsContact O-CB 3.26Å; L606-E610 WeakPolarHBondContact O-CB 3.4Å; L606-E610 WeakPolarHBondContact O-CG 3.48Å; L606-E610 PolarHBondContact O-N 2.93Å
607	E	56.2	Low	55.7	Low	69 Å²	69	131.3 Å²	131.3	32%	0.322	59%	0.592	S	S	.	*	H	α-helix	trans	-64.6	-32.2	174.4	-72.8	177.2	171.8	0	0	112.1	R603 M611	R603-E607 HydrophobicContact CB-CG 4.08Å; R603-E607 VanDerWaalsContact CD-OE1 3.27Å; R603-E607 WeakPolarHBondContact CD-OE1 3.47Å; R603-E607 HydrophobicContact CG-CG 4.2Å; R603-E607 WeakPolarHBondContact CG-OE1 3.32Å; R603-E607 IonicContact CZ-OE1 3.4Å; R603-E607 IonicContact NE-OE1 2.71Å; R603-E607 IonicContact NH1-OE1 2.62Å; R603-E607 PolarHBondContact NH1-OE1 3.11Å; R603-E607 WeakPolarHBondContact O-CA 3.37Å; R603-E607 WeakPolarHBondContact O-CB 3.19Å; R603-E607 VanDerWaalsContact O-CG 3.27Å; R603-E607 WeakPolarHBondContact O-CG 3.37Å; R603-E607 PolarHBondContact O-N 2.8Å; E607-M611 WeakPolarHBondContact O-CA 3.41Å; E607-M611 WeakPolarHBondContact O-CB 3.48Å; E607-M611 PolarHBondContact O-N 3.36Å
608	K	59.1	Low	58.1	Low	141 Å²	141	131 Å²	131	61%	0.613	59%	0.591	S	S	*	*	H	α-helix	trans	-69.9	-35.4	172.8	-78.6	169	-170.8	155	0	112.2	E604 E605 L606 K612	E604-K608 VanDerWaalsContact O-CD 3.25Å; E604-K608 WeakPolarHBondContact O-CD 3.41Å; E604-K608 VanDerWaalsContact O-CG 3.26Å; E604-K608 WeakPolarHBondContact O-CG 3.26Å; E605-K608 PolarHBondContact O-N 3.23Å; L606-K608 PolarHBondContact O-N 2.96Å; K608-K612 WeakPolarHBondContact O-CG 3.26Å; K608-K612 PolarHBondContact O-N 3.02Å
609	L	58.3	Low	60.1	Low	117 Å²	117	128.7 Å²	128.7	61%	0.613	58%	0.584	S	S	*	*	H	α-helix	trans	-77.3	-39	176.1	-112.4	149.3	0	0	0	112.1	E605 L606 R613	E605-L609 PolarHBondContact O-N 3.09Å; E605-L609 VanDerWaalsContact O-N 3.14Å; L606-L609 CarbonylContact O-C 3.57Å; L606-L609 PolarHBondContact O-N 3.34Å; L609-R613 WeakPolarHBondContact O-CB 3.38Å; L609-R613 PolarHBondContact O-N 3.41Å
610	E	63.4	Low	61.9	Low	73 Å²	73	126.9 Å²	126.9	34%	0.341	58%	0.576	S	S	.	*	H	α-helix	trans	-70.9	-38.3	173.1	-78.7	-170.4	-171.2	0	0	112.3	L606 K612 R613 R614	L606-E610 HydrophobicContact CG-CG 4.38Å; L606-E610 VanDerWaalsContact O-CB 3.26Å; L606-E610 WeakPolarHBondContact O-CB 3.4Å; L606-E610 WeakPolarHBondContact O-CG 3.48Å; L606-E610 PolarHBondContact O-N 2.93Å; E610-K612 VanDerWaalsContact C-N 3.33Å; E610-R613 CarbonylContact O-C 3.6Å; E610-R613 PolarHBondContact O-N 3.17Å; E610-R614 VanDerWaalsContact O-CB 3.28Å; E610-R614 WeakPolarHBondContact O-CB 3.36Å; E610-R614 VanDerWaalsContact O-CG 3.24Å; E610-R614 WeakPolarHBondContact O-CG 3.24Å; E610-R614 PolarHBondContact O-N 2.81Å; E610-R614 IonicContact OE2-CZ 3.46Å; E610-R614 IonicContact OE2-NE 2.76Å; E610-R614 IonicContact OE2-NH2 3.62Å; E610-R614 PolarHBondContact OE2-NH2 3.14Å
611	M	64.3	Low	63.5	Low	137 Å²	137	124.5 Å²	124.5	68%	0.675	57%	0.571	S	S	*	*	H	α-helix	trans	-66.3	-39.3	175.8	-172.7	-174.8	-154.6	0	0	109.8	E607 R614 L615	E607-M611 WeakPolarHBondContact O-CA 3.41Å; E607-M611 WeakPolarHBondContact O-CB 3.48Å; E607-M611 PolarHBondContact O-N 3.36Å; M611-R614 PolarHBondContact O-N 3.47Å; M611-L615 VanDerWaalsContact O-CB 3.27Å; M611-L615 WeakPolarHBondContact O-CB 3.42Å; M611-L615 PolarHBondContact O-N 3.33Å
612	K	65.9	Low	65	Low	158 Å²	158	122.4 Å²	122.4	69%	0.687	56%	0.559	S	S	*	*	H	α-helix	trans	-63.1	-43.4	169.1	-79.6	-175.7	174.6	-177.7	0	112.4	K608 E610 L615 I616	K608-K612 WeakPolarHBondContact O-CG 3.26Å; K608-K612 PolarHBondContact O-N 3.02Å; E610-K612 VanDerWaalsContact C-N 3.33Å; K612-L615 PolarHBondContact O-N 2.91Å; K612-I616 WeakPolarHBondContact O-CD1 3.32Å; K612-I616 VanDerWaalsContact O-CG1 3.24Å; K612-I616 WeakPolarHBondContact O-CG1 3.34Å; K612-I616 PolarHBondContact O-N 3.07Å
613	R	68.1	Low	66.5	Low	188 Å²	188	119.7 Å²	119.7	71%	0.709	55%	0.546	S	S	*	.	H	α-helix	trans	-66.3	-37.4	175.5	-82.7	-176.2	166.4	-162.4	-3.8	113.4	L609 E610 K617	L609-R613 WeakPolarHBondContact O-CB 3.38Å; L609-R613 PolarHBondContact O-N 3.41Å; E610-R613 CarbonylContact O-C 3.6Å; E610-R613 PolarHBondContact O-N 3.17Å; R613-K617 VanDerWaalsContact O-CB 3.25Å; R613-K617 WeakPolarHBondContact O-CB 3.35Å; R613-K617 PolarHBondContact O-N 3.25Å
614	R	71	Confident	68.2	Low	143 Å²	143	120.8 Å²	120.8	54%	0.54	56%	0.559	S	S	.	*	H	α-helix	trans	-67.7	-44.6	175.1	-74.7	-179.8	-143.3	-176.6	7.6	110.2	E610 M611 I616 K617 E618	E610-R614 VanDerWaalsContact O-CB 3.28Å; E610-R614 WeakPolarHBondContact O-CB 3.36Å; E610-R614 VanDerWaalsContact O-CG 3.24Å; E610-R614 WeakPolarHBondContact O-CG 3.24Å; E610-R614 PolarHBondContact O-N 2.81Å; E610-R614 IonicContact OE2-CZ 3.46Å; E610-R614 IonicContact OE2-NE 2.76Å; E610-R614 IonicContact OE2-NH2 3.62Å; E610-R614 PolarHBondContact OE2-NH2 3.14Å; M611-R614 PolarHBondContact O-N 3.47Å; R614-I616 VanDerWaalsContact C-N 3.32Å; R614-I616 PolarHBondContact O-N 3.41Å; R614-K617 CarbonylContact O-C 3.58Å; R614-K617 PolarHBondContact O-N 2.83Å; R614-K617 VanDerWaalsContact O-N 3.17Å; R614-E618 WeakPolarHBondContact O-CB 3.39Å; R614-E618 WeakPolarHBondContact O-CG 3.42Å; R614-E618 PolarHBondContact O-N 2.95Å
615	L	74.3	Confident	69.6	Low	105 Å²	105	118.9 Å²	118.9	55%	0.55	56%	0.556	S	S	.	*	H	α-helix	trans	-63.9	-37.6	177.2	-153.5	79.6	0	0	0	112	M611 K612 M619	M611-L615 VanDerWaalsContact O-CB 3.27Å; M611-L615 WeakPolarHBondContact O-CB 3.42Å; M611-L615 PolarHBondContact O-N 3.33Å; K612-L615 PolarHBondContact O-N 2.91Å; L615-M619 WeakPolarHBondContact O-CB 3.39Å; L615-M619 WeakPolarHBondContact O-CG 3.45Å; L615-M619 PolarHBondContact O-N 3.1Å
616	I	74.8	Confident	71	Confident	96 Å²	96	115.2 Å²	115.2	49%	0.492	54%	0.54	S	S	.	.	H	α-helix	trans	-65.2	-48.1	171.7	-69.3	164.5	0	0	0	110.3	K612 R614 E618 M619 E620	K612-I616 WeakPolarHBondContact O-CD1 3.32Å; K612-I616 VanDerWaalsContact O-CG1 3.24Å; K612-I616 WeakPolarHBondContact O-CG1 3.34Å; K612-I616 PolarHBondContact O-N 3.07Å; R614-I616 VanDerWaalsContact C-N 3.32Å; R614-I616 PolarHBondContact O-N 3.41Å; I616-E618 PolarHBondContact O-N 2.94Å; I616-M619 CarbonylContact O-C 3.56Å; I616-M619 WeakPolarHBondContact O-CB 3.33Å; I616-M619 PolarHBondContact O-N 3.03Å; I616-E620 HydrophobicContact CG2-CG 4.39Å; I616-E620 WeakPolarHBondContact O-CB 3.43Å; I616-E620 WeakPolarHBondContact O-CG 3.49Å; I616-E620 PolarHBondContact O-N 2.83Å
617	K	76.9	Confident	72.2	Confident	118 Å²	118	116 Å²	116	51%	0.513	54%	0.538	S	S	.	.	H	α-helix	trans	-66.4	-36.8	-179.3	-170	171	-174.3	-83.1	0	112.9	R613 R614 E620 E621	R613-K617 VanDerWaalsContact O-CB 3.25Å; R613-K617 WeakPolarHBondContact O-CB 3.35Å; R613-K617 PolarHBondContact O-N 3.25Å; R614-K617 CarbonylContact O-C 3.58Å; R614-K617 PolarHBondContact O-N 2.83Å; R614-K617 VanDerWaalsContact O-N 3.17Å; K617-E620 PolarHBondContact O-N 3.47Å; K617-E621 WeakPolarHBondContact CE-OE1 3.29Å; K617-E621 HydrophobicContact CG-CG 4.48Å; K617-E621 IonicContact NZ-OE1 3.72Å; K617-E621 PolarHBondContact NZ-OE1 3.04Å; K617-E621 VanDerWaalsContact O-CB 3.27Å; K617-E621 WeakPolarHBondContact O-CB 3.4Å; K617-E621 VanDerWaalsContact O-CG 3.3Å; K617-E621 WeakPolarHBondContact O-CG 3.49Å; K617-E621 PolarHBondContact O-N 2.84Å
618	E	77.3	Confident	73.5	Confident	121 Å²	121	114.9 Å²	114.9	57%	0.565	54%	0.541	S	S	*	.	H	α-helix	trans	-67.2	-39.1	171.5	-76.9	179	153.9	0	0	110.9	R614 I616 K622	R614-E618 WeakPolarHBondContact O-CB 3.39Å; R614-E618 WeakPolarHBondContact O-CG 3.42Å; R614-E618 PolarHBondContact O-N 2.95Å; I616-E618 PolarHBondContact O-N 2.94Å; E618-K622 WeakPolarHBondContact O-CB 3.45Å; E618-K622 PolarHBondContact O-N 3.1Å
619	M	73.6	Confident	74.6	Confident	116 Å²	116	114.5 Å²	114.5	57%	0.571	54%	0.542	S	S	*	.	H	α-helix	trans	-64.7	-40.7	171.5	-83.7	-168.2	63.1	0	0	112.4	L615 I616 Q623	L615-M619 WeakPolarHBondContact O-CB 3.39Å; L615-M619 WeakPolarHBondContact O-CG 3.45Å; L615-M619 PolarHBondContact O-N 3.1Å; I616-M619 CarbonylContact O-C 3.56Å; I616-M619 WeakPolarHBondContact O-CB 3.33Å; I616-M619 PolarHBondContact O-N 3.03Å; M619-Q623 WeakPolarHBondContact O-CB 3.46Å; M619-Q623 WeakPolarHBondContact O-CG 3.12Å; M619-Q623 PolarHBondContact O-N 2.94Å
620	E	78.3	Confident	75.6	Confident	124 Å²	124	114 Å²	114	58%	0.579	54%	0.539	S	S	*	.	H	α-helix	trans	-68.6	-45.5	177.4	-73.8	173.4	167.1	0	0	111.7	I616 K617 Q623 L624	I616-E620 HydrophobicContact CG2-CG 4.39Å; I616-E620 WeakPolarHBondContact O-CB 3.43Å; I616-E620 WeakPolarHBondContact O-CG 3.49Å; I616-E620 PolarHBondContact O-N 2.83Å; K617-E620 PolarHBondContact O-N 3.47Å; E620-Q623 PolarHBondContact O-N 3.5Å; E620-L624 VanDerWaalsContact O-CB 3.31Å; E620-L624 WeakPolarHBondContact O-CB 3.22Å; E620-L624 PolarHBondContact O-N 3.45Å
621	E	80	Confident	76.5	Confident	101 Å²	101	114.7 Å²	114.7	47%	0.472	54%	0.542	S	S	.	.	H	α-helix	trans	-64.7	-39.2	175.3	-75.9	173.9	-175.2	0	0	111.5	K617 L624 S625	K617-E621 WeakPolarHBondContact CE-OE1 3.29Å; K617-E621 HydrophobicContact CG-CG 4.48Å; K617-E621 IonicContact NZ-OE1 3.72Å; K617-E621 PolarHBondContact NZ-OE1 3.04Å; K617-E621 VanDerWaalsContact O-CB 3.27Å; K617-E621 WeakPolarHBondContact O-CB 3.4Å; K617-E621 VanDerWaalsContact O-CG 3.3Å; K617-E621 WeakPolarHBondContact O-CG 3.49Å; K617-E621 PolarHBondContact O-N 2.84Å; E621-L624 PolarHBondContact O-N 3.24Å; E621-S625 PolarHBondContact O-N 3.26Å; E621-S625 PolarHBondContact O-OG 3.33Å
622	K	78.4	Confident	77.4	Confident	123 Å²	123	117 Å²	117	54%	0.535	54%	0.544	S	S	.	.	H	α-helix	trans	-67.9	-42.8	174.9	-166.9	-177.4	-172.5	-132.5	0	112.1	E618 L624 S625 E626	E618-K622 WeakPolarHBondContact O-CB 3.45Å; E618-K622 PolarHBondContact O-N 3.1Å; K622-L624 VanDerWaalsContact C-N 3.28Å; K622-L624 PolarHBondContact O-N 2.96Å; K622-S625 WeakPolarHBondContact CA-OG 3.46Å; K622-S625 PolarHBondContact O-N 3.02Å; K622-S625 PolarHBondContact O-OG 3.18Å; K622-E626 WeakPolarHBondContact CE-OE1 3.47Å; K622-E626 HydrophobicContact CG-CG 4.37Å; K622-E626 IonicContact NZ-OE1 3.89Å; K622-E626 PolarHBondContact NZ-OE1 3.07Å; K622-E626 WeakPolarHBondContact O-CB 3.27Å; K622-E626 VanDerWaalsContact O-CG 3.31Å; K622-E626 WeakPolarHBondContact O-CG 3.3Å; K622-E626 PolarHBondContact O-N 3.18Å
623	Q	75.6	Confident	78.2	Confident	126 Å²	126	114.7 Å²	114.7	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-63.1	-35.8	172.3	-80.6	-167.5	-3.3	0	0	111.7	M619 E620 K627	M619-Q623 WeakPolarHBondContact O-CB 3.46Å; M619-Q623 WeakPolarHBondContact O-CG 3.12Å; M619-Q623 PolarHBondContact O-N 2.94Å; E620-Q623 PolarHBondContact O-N 3.5Å; Q623-K627 WeakPolarHBondContact O-CB 3.49Å; Q623-K627 PolarHBondContact O-N 3.43Å
624	L	80.9	Confident	78.6	Confident	121 Å²	121	111.6 Å²	111.6	63%	0.634	53%	0.532	S	S	*	.	H	α-helix	trans	-67.9	-39.1	175.8	-162.1	74.1	0	0	0	111.6	E620 E621 K622 A628	E620-L624 VanDerWaalsContact O-CB 3.31Å; E620-L624 WeakPolarHBondContact O-CB 3.22Å; E620-L624 PolarHBondContact O-N 3.45Å; E621-L624 PolarHBondContact O-N 3.24Å; K622-L624 VanDerWaalsContact C-N 3.28Å; K622-L624 PolarHBondContact O-N 2.96Å; L624-A628 WeakPolarHBondContact O-CB 3.19Å; L624-A628 PolarHBondContact O-N 2.99Å
625	S	79.8	Confident	79.1	Confident	59 Å²	59	111.3 Å²	111.3	41%	0.413	54%	0.536	S	S	.	.	H	α-helix	trans	-70.4	-45.1	175	64.7	0	0	0	0	112.5	E621 K622 K627 A628 E629	E621-S625 PolarHBondContact O-N 3.26Å; E621-S625 PolarHBondContact O-OG 3.33Å; K622-S625 WeakPolarHBondContact CA-OG 3.46Å; K622-S625 PolarHBondContact O-N 3.02Å; K622-S625 PolarHBondContact O-OG 3.18Å; S625-K627 VanDerWaalsContact C-N 3.28Å; S625-K627 PolarHBondContact O-N 3.22Å; S625-A628 PolarHBondContact O-N 2.76Å; S625-A628 VanDerWaalsContact O-N 3.14Å; S625-E629 PolarHBondContact O-N 3.44Å
626	E	81.6	Confident	79.4	Confident	83 Å²	83	112 Å²	112	39%	0.388	54%	0.537	S	S	.	.	H	α-helix	trans	-61.5	-37.9	176	-72.7	172.7	-178.8	0	0	110.4	K622 L630	K622-E626 WeakPolarHBondContact CE-OE1 3.47Å; K622-E626 HydrophobicContact CG-CG 4.37Å; K622-E626 IonicContact NZ-OE1 3.89Å; K622-E626 PolarHBondContact NZ-OE1 3.07Å; K622-E626 WeakPolarHBondContact O-CB 3.27Å; K622-E626 VanDerWaalsContact O-CG 3.31Å; K622-E626 WeakPolarHBondContact O-CG 3.3Å; K622-E626 PolarHBondContact O-N 3.18Å; E626-L630 WeakPolarHBondContact O-CB 3.44Å; E626-L630 WeakPolarHBondContact O-CG 3.24Å; E626-L630 PolarHBondContact O-N 3.27Å
627	K	78.8	Confident	79.8	Confident	116 Å²	116	111.7 Å²	111.7	50%	0.504	54%	0.539	S	S	.	.	H	α-helix	trans	-65.7	-42.5	172.3	-172.3	175.8	-172.9	-87.4	0	112.6	Q623 S625 L630 E631	Q623-K627 WeakPolarHBondContact O-CB 3.49Å; Q623-K627 PolarHBondContact O-N 3.43Å; S625-K627 VanDerWaalsContact C-N 3.28Å; S625-K627 PolarHBondContact O-N 3.22Å; K627-L630 PolarHBondContact O-N 2.97Å; K627-E631 WeakPolarHBondContact CE-OE1 3.46Å; K627-E631 IonicContact NZ-OE1 3.92Å; K627-E631 PolarHBondContact NZ-OE1 3.33Å; K627-E631 WeakPolarHBondContact O-CG 3.23Å; K627-E631 PolarHBondContact O-N 3.39Å
628	A	83.5	Confident	79.9	Confident	47 Å²	47	111.8 Å²	111.8	39%	0.388	54%	0.542	S	S	.	.	H	α-helix	trans	-67.9	-34.9	178.4	0	0	0	0	0	112.6	L624 S625 R632	L624-A628 WeakPolarHBondContact O-CB 3.19Å; L624-A628 PolarHBondContact O-N 2.99Å; S625-A628 PolarHBondContact O-N 2.76Å; S625-A628 VanDerWaalsContact O-N 3.14Å; A628-R632 WeakPolarHBondContact O-CG 3.22Å; A628-R632 PolarHBondContact O-N 3.18Å; A628-R632 VanDerWaalsContact O-N 3.12Å
629	E	82.5	Confident	80.1	Confident	132 Å²	132	108.9 Å²	108.9	62%	0.617	54%	0.535	S	S	*	.	H	α-helix	trans	-68	-42.4	171.1	-73.3	-168.8	149.7	0	0	111.9	S625 E631 R632 L633	S625-E629 PolarHBondContact O-N 3.44Å; E629-E631 PolarHBondContact O-N 2.82Å; E629-R632 PolarHBondContact O-N 3Å; E629-L633 WeakPolarHBondContact O-CB 3.45Å; E629-L633 PolarHBondContact O-N 3.02Å
630	L	79.6	Confident	80.4	Confident	106 Å²	106	108.8 Å²	108.8	56%	0.555	53%	0.533	S	S	*	.	H	α-helix	trans	-60.1	-43.4	173.7	-84.2	162.7	0	0	0	112.4	E626 K627 R632 L633 Q634	E626-L630 WeakPolarHBondContact O-CB 3.44Å; E626-L630 WeakPolarHBondContact O-CG 3.24Å; E626-L630 PolarHBondContact O-N 3.27Å; K627-L630 PolarHBondContact O-N 2.97Å; L630-R632 PolarHBondContact O-N 3.34Å; L630-L633 PolarHBondContact O-N 2.93Å; L630-Q634 WeakPolarHBondContact O-CG 3.3Å; L630-Q634 PolarHBondContact O-N 2.87Å
631	E	81.7	Confident	80.3	Confident	89 Å²	89	111.4 Å²	111.4	42%	0.416	54%	0.537	S	S	.	.	H	α-helix	trans	-64.1	-38.3	176.4	-76.1	176.2	-170.8	0	0	112	K627 E629 Q634 Q635	K627-E631 WeakPolarHBondContact CE-OE1 3.46Å; K627-E631 IonicContact NZ-OE1 3.92Å; K627-E631 PolarHBondContact NZ-OE1 3.33Å; K627-E631 WeakPolarHBondContact O-CG 3.23Å; K627-E631 PolarHBondContact O-N 3.39Å; E629-E631 PolarHBondContact O-N 2.82Å; E631-Q634 PolarHBondContact O-N 3.04Å; E631-Q635 WeakPolarHBondContact O-CG 3.24Å; E631-Q635 PolarHBondContact O-N 2.76Å; E631-Q635 VanDerWaalsContact O-N 3.07Å
632	R	83.6	Confident	80.4	Confident	186 Å²	186	112.8 Å²	112.8	70%	0.702	54%	0.542	S	S	*	.	H	α-helix	trans	-66	-46.1	173.1	-76	-177.9	179	-163.2	1.2	112.4	A628 E629 L630 Q634 Q635 E636	A628-R632 WeakPolarHBondContact O-CG 3.22Å; A628-R632 PolarHBondContact O-N 3.18Å; A628-R632 VanDerWaalsContact O-N 3.12Å; E629-R632 PolarHBondContact O-N 3Å; L630-R632 PolarHBondContact O-N 3.34Å; R632-Q634 VanDerWaalsContact C-N 3.27Å; R632-Q634 PolarHBondContact O-N 3.42Å; R632-Q635 PolarHBondContact O-N 3.06Å; R632-Q635 VanDerWaalsContact O-N 3.14Å; R632-E636 PolarHBondContact O-N 2.89Å
633	L	81.9	Confident	80.5	Confident	109 Å²	109	112.8 Å²	112.8	57%	0.571	54%	0.544	S	S	*	.	H	α-helix	trans	-61	-36.1	175.8	-83.1	158.1	0	0	0	111.8	E629 L630 V637	E629-L633 WeakPolarHBondContact O-CB 3.45Å; E629-L633 PolarHBondContact O-N 3.02Å; L630-L633 PolarHBondContact O-N 2.93Å; L633-V637 WeakPolarHBondContact O-CB 3.5Å; L633-V637 VanDerWaalsContact O-CG2 3.29Å; L633-V637 WeakPolarHBondContact O-CG2 2.82Å; L633-V637 PolarHBondContact O-N 3.46Å
634	Q	76.7	Confident	80.7	Confident	123 Å²	123	110.2 Å²	110.2	58%	0.575	54%	0.539	S	S	*	.	H	α-helix	trans	-65.2	-42.7	172.4	-80	-179.6	-62.8	0	0	112.4	L630 E631 R632 V637 E638	L630-Q634 WeakPolarHBondContact O-CG 3.3Å; L630-Q634 PolarHBondContact O-N 2.87Å; E631-Q634 PolarHBondContact O-N 3.04Å; R632-Q634 VanDerWaalsContact C-N 3.27Å; R632-Q634 PolarHBondContact O-N 3.42Å; Q634-V637 PolarHBondContact O-N 2.82Å; Q634-E638 WeakPolarHBondContact O-CB 3.3Å; Q634-E638 WeakPolarHBondContact O-CG 3.17Å; Q634-E638 PolarHBondContact O-N 2.88Å
635	Q	80.4	Confident	80.7	Confident	136 Å²	136	110.2 Å²	110.2	64%	0.636	54%	0.536	S	S	*	.	H	α-helix	trans	-64.2	-40.7	176.3	-72	177.7	3.8	0	0	112.7	E631 R632 E638 S639	E631-Q635 WeakPolarHBondContact O-CG 3.24Å; E631-Q635 PolarHBondContact O-N 2.76Å; E631-Q635 VanDerWaalsContact O-N 3.07Å; R632-Q635 PolarHBondContact O-N 3.06Å; R632-Q635 VanDerWaalsContact O-N 3.14Å; Q635-E638 PolarHBondContact O-N 2.74Å; Q635-S639 WeakPolarHBondContact O-CB 3.24Å; Q635-S639 PolarHBondContact O-N 2.9Å
636	E	82.4	Confident	80.8	Confident	121 Å²	121	114.2 Å²	114.2	57%	0.565	55%	0.548	S	S	*	.	H	α-helix	trans	-59.5	-48.9	175	-166.7	85.2	-138.8	0	0	111.1	R632 S639 Q640	R632-E636 PolarHBondContact O-N 2.89Å; E636-S639 WeakPolarHBondContact O-CB 3.31Å; E636-S639 PolarHBondContact O-N 3.33Å; E636-Q640 WeakPolarHBondContact O-CG 3.31Å; E636-Q640 PolarHBondContact O-N 2.82Å
637	V	83.3	Confident	80.9	Confident	89 Å²	89	114.3 Å²	114.3	54%	0.539	55%	0.554	S	S	.	*	H	α-helix	trans	-65.1	-39.1	178.1	170.4	0	0	0	0	111.7	L633 Q634 S639 R641	L633-V637 WeakPolarHBondContact O-CB 3.5Å; L633-V637 VanDerWaalsContact O-CG2 3.29Å; L633-V637 WeakPolarHBondContact O-CG2 2.82Å; L633-V637 PolarHBondContact O-N 3.46Å; Q634-V637 PolarHBondContact O-N 2.82Å; V637-S639 VanDerWaalsContact C-N 3.34Å; V637-R641 WeakPolarHBondContact O-CB 3.37Å; V637-R641 PolarHBondContact O-N 3.35Å
638	E	77.8	Confident	80.8	Confident	120 Å²	120	114.4 Å²	114.4	56%	0.561	56%	0.557	S	S	*	*	H	α-helix	trans	-65.6	-35.1	174.1	-77.2	-169.5	176	0	0	112.8	Q634 Q635 K642	Q634-E638 WeakPolarHBondContact O-CB 3.3Å; Q634-E638 WeakPolarHBondContact O-CG 3.17Å; Q634-E638 PolarHBondContact O-N 2.88Å; Q635-E638 PolarHBondContact O-N 2.74Å; E638-K642 WeakPolarHBondContact O-CG 3.48Å; E638-K642 PolarHBondContact O-N 2.95Å; E638-K642 VanDerWaalsContact O-N 3.12Å
639	S	82.3	Confident	80.7	Confident	60 Å²	60	117.5 Å²	117.5	42%	0.42	56%	0.563	S	S	.	*	H	α-helix	trans	-65.5	-52.8	174.8	-163.8	0	0	0	0	111.3	Q635 E636 V637 R641 K642 E643	Q635-S639 WeakPolarHBondContact O-CB 3.24Å; Q635-S639 PolarHBondContact O-N 2.9Å; E636-S639 WeakPolarHBondContact O-CB 3.31Å; E636-S639 PolarHBondContact O-N 3.33Å; V637-S639 VanDerWaalsContact C-N 3.34Å; S639-R641 PolarHBondContact O-N 3.16Å; S639-K642 WeakPolarHBondContact O-CB 3.41Å; S639-K642 PolarHBondContact O-N 3.35Å; S639-E643 PolarHBondContact O-N 2.81Å
640	Q	78.5	Confident	80.7	Confident	113 Å²	113	120.5 Å²	120.5	53%	0.528	57%	0.569	S	S	.	*	H	α-helix	trans	-59.1	-35.1	177.1	-68.7	-179.3	10.4	0	0	112.2	E636 S644	E636-Q640 WeakPolarHBondContact O-CG 3.31Å; E636-Q640 PolarHBondContact O-N 2.82Å; Q640-S644 VanDerWaalsContact O-CB 3.32Å; Q640-S644 WeakPolarHBondContact O-CB 3.41Å; Q640-S644 PolarHBondContact O-N 3.45Å
641	R	77	Confident	80.7	Confident	180 Å²	180	119 Å²	119	68%	0.679	56%	0.561	S	S	*	*	H	α-helix	trans	-68.8	-33.5	177.1	-163.1	175.6	-168.6	-172.2	3.7	112.7	V637 S639 Q645	V637-R641 WeakPolarHBondContact O-CB 3.37Å; V637-R641 PolarHBondContact O-N 3.35Å; S639-R641 PolarHBondContact O-N 3.16Å; R641-Q645 WeakPolarHBondContact O-CG 3.37Å; R641-Q645 PolarHBondContact O-N 3.28Å
642	K	81.4	Confident	80.8	Confident	130 Å²	130	119.7 Å²	119.7	57%	0.565	57%	0.566	S	S	*	*	H	α-helix	trans	-69.4	-48.6	172.2	-76.1	173	-179.2	167.4	0	111.6	E638 S639 S644 Q645 E646	E638-K642 WeakPolarHBondContact O-CG 3.48Å; E638-K642 PolarHBondContact O-N 2.95Å; E638-K642 VanDerWaalsContact O-N 3.12Å; S639-K642 WeakPolarHBondContact O-CB 3.41Å; S639-K642 PolarHBondContact O-N 3.35Å; K642-S644 VanDerWaalsContact C-N 3.32Å; K642-S644 PolarHBondContact O-N 3.29Å; K642-Q645 WeakPolarHBondContact O-CB 3.06Å; K642-Q645 PolarHBondContact O-N 2.89Å; K642-Q645 VanDerWaalsContact O-N 3.08Å; K642-E646 PolarHBondContact O-N 2.85Å
643	E	81.9	Confident	80.7	Confident	123 Å²	123	118.9 Å²	118.9	58%	0.575	56%	0.563	S	S	*	*	H	α-helix	trans	-58.4	-43.9	178.1	-69.2	-174.7	162.7	0	0	111.9	S639 Q645 E646 V647	S639-E643 PolarHBondContact O-N 2.81Å; E643-Q645 VanDerWaalsContact C-N 3.35Å; E643-Q645 PolarHBondContact O-N 2.88Å; E643-E646 PolarHBondContact O-N 3.03Å; E643-V647 WeakPolarHBondContact O-CG2 3.2Å; E643-V647 PolarHBondContact O-N 2.99Å
644	S	78.5	Confident	80.6	Confident	71 Å²	71	120 Å²	120	50%	0.497	57%	0.566	S	S	.	*	H	α-helix	trans	-61.5	-38.6	175	-177.3	0	0	0	0	112.6	Q640 K642 V647 Q648	Q640-S644 VanDerWaalsContact O-CB 3.32Å; Q640-S644 WeakPolarHBondContact O-CB 3.41Å; Q640-S644 PolarHBondContact O-N 3.45Å; K642-S644 VanDerWaalsContact C-N 3.32Å; K642-S644 PolarHBondContact O-N 3.29Å; S644-V647 PolarHBondContact O-N 3.39Å; S644-Q648 WeakPolarHBondContact O-CB 3.34Å; S644-Q648 PolarHBondContact O-N 2.63Å
645	Q	81.9	Confident	80.7	Confident	122 Å²	122	119.2 Å²	119.2	57%	0.57	56%	0.562	S	S	*	*	H	α-helix	trans	-64.7	-38.9	173.3	-78.7	-178	-22.6	0	0	113.2	R641 K642 E643 Q648 Q649	R641-Q645 WeakPolarHBondContact O-CG 3.37Å; R641-Q645 PolarHBondContact O-N 3.28Å; K642-Q645 WeakPolarHBondContact O-CB 3.06Å; K642-Q645 PolarHBondContact O-N 2.89Å; K642-Q645 VanDerWaalsContact O-N 3.08Å; E643-Q645 VanDerWaalsContact C-N 3.35Å; E643-Q645 PolarHBondContact O-N 2.88Å; Q645-Q648 PolarHBondContact O-N 3.17Å; Q645-Q649 WeakPolarHBondContact O-CG 3.34Å; Q645-Q649 PolarHBondContact O-N 2.9Å
646	E	82.1	Confident	80.7	Confident	142 Å²	142	118 Å²	118	66%	0.664	56%	0.556	S	S	*	*	H	α-helix	trans	-67.1	-40.2	176.8	-68.9	-170.7	176.2	0	0	112.3	K642 E643 Q649 R650	K642-E646 PolarHBondContact O-N 2.85Å; E643-E646 PolarHBondContact O-N 3.03Å; E646-Q649 PolarHBondContact O-N 2.91Å; E646-R650 PolarHBondContact O-N 3.14Å; E646-R650 VanDerWaalsContact O-N 3.07Å
647	V	82.8	Confident	80.8	Confident	85 Å²	85	115.1 Å²	115.1	52%	0.515	55%	0.549	S	S	.	.	H	α-helix	trans	-62.2	-45	172.7	174.3	0	0	0	0	110.7	E643 S644 Q649 R650 I651	E643-V647 WeakPolarHBondContact O-CG2 3.2Å; E643-V647 PolarHBondContact O-N 2.99Å; S644-V647 PolarHBondContact O-N 3.39Å; V647-Q649 VanDerWaalsContact C-N 3.32Å; V647-Q649 PolarHBondContact O-N 3.03Å; V647-R650 WeakPolarHBondContact O-CB 3.33Å; V647-R650 PolarHBondContact O-N 2.96Å; V647-R650 VanDerWaalsContact O-N 3.11Å; V647-I651 HydrophobicContact CG1-CD1 4.03Å; V647-I651 WeakPolarHBondContact O-CG1 3.21Å; V647-I651 PolarHBondContact O-N 3.4Å; V647-I651 VanDerWaalsContact O-N 3.08Å
648	Q	76.7	Confident	80.8	Confident	119 Å²	119	116.4 Å²	116.4	56%	0.556	55%	0.553	S	S	*	*	H	α-helix	trans	-57.8	-42.8	176.9	-149.9	83.1	12.9	0	0	111.9	S644 Q645 I651 L652	S644-Q648 WeakPolarHBondContact O-CB 3.34Å; S644-Q648 PolarHBondContact O-N 2.63Å; Q645-Q648 PolarHBondContact O-N 3.17Å; Q648-I651 PolarHBondContact O-N 2.86Å; Q648-L652 PolarHBondContact O-N 2.88Å; Q648-L652 VanDerWaalsContact O-N 3.17Å
649	Q	80.6	Confident	80.9	Confident	111 Å²	111	119.9 Å²	119.9	52%	0.519	56%	0.561	S	S	.	*	H	α-helix	trans	-67	-34.1	176.5	-73.2	-165.4	21.5	0	0	113.2	Q645 E646 V647 R653	Q645-Q649 WeakPolarHBondContact O-CG 3.34Å; Q645-Q649 PolarHBondContact O-N 2.9Å; E646-Q649 PolarHBondContact O-N 2.91Å; V647-Q649 VanDerWaalsContact C-N 3.32Å; V647-Q649 PolarHBondContact O-N 3.03Å; Q649-R653 WeakPolarHBondContact O-CG 3.42Å; Q649-R653 PolarHBondContact O-N 3.29Å
650	R	82.8	Confident	80.9	Confident	196 Å²	196	125.1 Å²	125.1	74%	0.74	57%	0.571	S	S	*	*	H	α-helix	trans	-65.2	-42.9	175.4	-103.9	177.9	171.5	162.1	-1	112	E646 V647 R653 Q654	E646-R650 PolarHBondContact O-N 3.14Å; E646-R650 VanDerWaalsContact O-N 3.07Å; V647-R650 WeakPolarHBondContact O-CB 3.33Å; V647-R650 PolarHBondContact O-N 2.96Å; V647-R650 VanDerWaalsContact O-N 3.11Å; R650-R653 PolarHBondContact O-N 3.3Å; R650-Q654 PolarHBondContact O-N 3.06Å
651	I	81.4	Confident	81	Confident	75 Å²	75	127.9 Å²	127.9	39%	0.385	58%	0.577	S	S	.	*	H	α-helix	trans	-62.6	-49	178.2	-65.8	167.5	0	0	0	110.3	V647 Q648 R653 Q654 E655	V647-I651 HydrophobicContact CG1-CD1 4.03Å; V647-I651 WeakPolarHBondContact O-CG1 3.21Å; V647-I651 PolarHBondContact O-N 3.4Å; V647-I651 VanDerWaalsContact O-N 3.08Å; Q648-I651 PolarHBondContact O-N 2.86Å; I651-R653 VanDerWaalsContact C-N 3.3Å; I651-R653 PolarHBondContact O-N 2.66Å; I651-Q654 WeakPolarHBondContact O-CA 3.43Å; I651-Q654 WeakPolarHBondContact O-CB 3.44Å; I651-Q654 PolarHBondContact O-N 3.3Å; I651-E655 HydrophobicContact CG2-CG 4.38Å; I651-E655 PolarHBondContact O-N 2.88Å
652	L	82.6	Confident	80.8	Confident	102 Å²	102	122.2 Å²	122.2	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-55.5	-40.8	178.4	-81.2	163.2	0	0	0	113.3	Q648 Q654 E655 E656	Q648-L652 PolarHBondContact O-N 2.88Å; Q648-L652 VanDerWaalsContact O-N 3.17Å; L652-Q654 VanDerWaalsContact C-N 3.34Å; L652-Q654 PolarHBondContact O-N 3.48Å; L652-E655 PolarHBondContact O-N 3.3Å; L652-E656 PolarHBondContact O-N 3.39Å
653	R	82	Confident	80.6	Confident	169 Å²	169	121.9 Å²	121.9	64%	0.638	57%	0.565	S	S	*	*	H	α-helix	trans	-66.9	-33	176.2	-68.4	179.4	-164.4	179.4	8.9	112.9	Q649 R650 I651 S657	Q649-R653 WeakPolarHBondContact O-CG 3.42Å; Q649-R653 PolarHBondContact O-N 3.29Å; R650-R653 PolarHBondContact O-N 3.3Å; I651-R653 VanDerWaalsContact C-N 3.3Å; I651-R653 PolarHBondContact O-N 2.66Å; R653-S657 PolarHBondContact O-N 3.13Å
654	Q	78.8	Confident	80.6	Confident	133 Å²	133	119.5 Å²	119.5	62%	0.621	56%	0.557	S	S	*	*	H	α-helix	trans	-71.7	-41.7	174.7	-72	-176.7	-33	0	0	111.4	R650 I651 L652 S657 L658	R650-Q654 PolarHBondContact O-N 3.06Å; I651-Q654 WeakPolarHBondContact O-CA 3.43Å; I651-Q654 WeakPolarHBondContact O-CB 3.44Å; I651-Q654 PolarHBondContact O-N 3.3Å; L652-Q654 VanDerWaalsContact C-N 3.34Å; L652-Q654 PolarHBondContact O-N 3.48Å; Q654-S657 WeakPolarHBondContact O-CB 3.26Å; Q654-S657 PolarHBondContact O-N 3.14Å; Q654-L658 WeakPolarHBondContact O-CG 3.46Å; Q654-L658 PolarHBondContact O-N 3.2Å
655	E	78.8	Confident	80.7	Confident	106 Å²	106	121 Å²	121	50%	0.495	56%	0.558	S	S	.	*	H	α-helix	trans	-61.9	-42.2	175.8	-69.5	-172.1	154	0	0	112.7	I651 L652 S657 L658 R659	I651-E655 HydrophobicContact CG2-CG 4.38Å; I651-E655 PolarHBondContact O-N 2.88Å; L652-E655 PolarHBondContact O-N 3.3Å; E655-S657 VanDerWaalsContact C-N 3.34Å; E655-S657 PolarHBondContact O-N 3Å; E655-L658 PolarHBondContact O-N 3.04Å; E655-R659 PolarHBondContact O-N 3.09Å
656	E	82.2	Confident	80.4	Confident	111 Å²	111	119.5 Å²	119.5	52%	0.519	55%	0.551	S	S	.	*	H	α-helix	trans	-61.2	-41.4	173.2	-80.1	-158.7	118.4	0	0	112.5	L652 L658 R659 R660	L652-E656 PolarHBondContact O-N 3.39Å; E656-L658 VanDerWaalsContact C-N 3.33Å; E656-L658 PolarHBondContact O-N 3.47Å; E656-R659 PolarHBondContact O-N 3.18Å; E656-R660 WeakPolarHBondContact O-CG 3.47Å; E656-R660 PolarHBondContact O-N 2.88Å; E656-R660 VanDerWaalsContact O-N 3.08Å
657	S	84.5	Confident	80.3	Confident	60 Å²	60	115.1 Å²	115.1	42%	0.42	54%	0.536	S	S	.	.	H	α-helix	trans	-63.5	-39.8	177.8	-170.3	0	0	0	0	112	R653 Q654 E655 R661	R653-S657 PolarHBondContact O-N 3.13Å; Q654-S657 WeakPolarHBondContact O-CB 3.26Å; Q654-S657 PolarHBondContact O-N 3.14Å; E655-S657 VanDerWaalsContact C-N 3.34Å; E655-S657 PolarHBondContact O-N 3Å; S657-R661 PolarHBondContact O-N 3.4Å
658	L	81.6	Confident	80.2	Confident	116 Å²	116	117.8 Å²	117.8	61%	0.607	54%	0.537	S	S	*	.	H	α-helix	trans	-69.4	-42.7	176.3	-69.9	170.8	0	0	0	111.9	Q654 E655 E656 R660 R661 S662	Q654-L658 WeakPolarHBondContact O-CG 3.46Å; Q654-L658 PolarHBondContact O-N 3.2Å; E655-L658 PolarHBondContact O-N 3.04Å; E656-L658 VanDerWaalsContact C-N 3.33Å; E656-L658 PolarHBondContact O-N 3.47Å; L658-R660 PolarHBondContact O-N 2.9Å; L658-R661 PolarHBondContact O-N 2.85Å; L658-S662 PolarHBondContact O-N 3.41Å
659	R	80.4	Confident	80	Confident	194 Å²	194	117 Å²	117	73%	0.732	54%	0.536	S	S	*	.	H	α-helix	trans	-57.7	-44.3	174.9	-83.4	-176.8	168.4	-179.8	-1.5	112.5	E655 E656 R661 S662 Q663	E655-R659 PolarHBondContact O-N 3.09Å; E656-R659 PolarHBondContact O-N 3.18Å; R659-R661 VanDerWaalsContact C-N 3.33Å; R659-R661 PolarHBondContact O-N 3.47Å; R659-S662 WeakPolarHBondContact O-CB 3.43Å; R659-S662 PolarHBondContact O-N 3.13Å; R659-Q663 WeakPolarHBondContact O-CG 3.49Å; R659-Q663 PolarHBondContact O-N 3.4Å; R659-Q663 VanDerWaalsContact O-N 3.07Å
660	R	82.8	Confident	79.9	Confident	170 Å²	170	118.5 Å²	118.5	64%	0.642	54%	0.537	S	S	*	.	H	α-helix	trans	-62.3	-38.6	177.3	-69.7	179.8	-167.9	-167.3	6	112.5	E656 L658 Q663 D664	E656-R660 WeakPolarHBondContact O-CG 3.47Å; E656-R660 PolarHBondContact O-N 2.88Å; E656-R660 VanDerWaalsContact O-N 3.08Å; L658-R660 PolarHBondContact O-N 2.9Å; R660-Q663 PolarHBondContact O-N 2.9Å; R660-D664 PolarHBondContact O-N 3.33Å
661	R	79.7	Confident	79.6	Confident	170 Å²	170	114.1 Å²	114.1	64%	0.642	53%	0.528	S	S	*	.	H	α-helix	trans	-67.2	-39	174.3	-74.1	-179.5	173.1	-177	-1.5	112.6	S657 L658 R659 Q663 D664 I665	S657-R661 PolarHBondContact O-N 3.4Å; L658-R661 PolarHBondContact O-N 2.85Å; R659-R661 VanDerWaalsContact C-N 3.33Å; R659-R661 PolarHBondContact O-N 3.47Å; R661-Q663 VanDerWaalsContact C-N 3.33Å; R661-Q663 PolarHBondContact O-N 3.26Å; R661-D664 PolarHBondContact O-N 3.29Å; R661-I665 WeakPolarHBondContact O-CG1 3.26Å; R661-I665 PolarHBondContact O-N 2.83Å
662	S	72.4	Confident	79	Confident	61 Å²	61	117.2 Å²	117.2	43%	0.427	54%	0.539	S	S	.	.	H	α-helix	trans	-59.9	-43.8	175	-160.5	0	0	0	0	111.7	L658 R659 D664 I665 E666	L658-S662 PolarHBondContact O-N 3.41Å; R659-S662 WeakPolarHBondContact O-CB 3.43Å; R659-S662 PolarHBondContact O-N 3.13Å; S662-D664 PolarHBondContact O-N 3.42Å; S662-I665 PolarHBondContact O-N 3.15Å; S662-E666 WeakPolarHBondContact O-CG 3.28Å; S662-E666 PolarHBondContact O-N 2.89Å
663	Q	78.5	Confident	78.3	Confident	124 Å²	124	117.5 Å²	117.5	58%	0.579	54%	0.541	S	S	*	.	H	α-helix	trans	-66.4	-35.9	-179.6	-71.9	174.7	-23.5	0	0	113.5	R659 R660 R661 S667	R659-Q663 WeakPolarHBondContact O-CG 3.49Å; R659-Q663 PolarHBondContact O-N 3.4Å; R659-Q663 VanDerWaalsContact O-N 3.07Å; R660-Q663 PolarHBondContact O-N 2.9Å; R661-Q663 VanDerWaalsContact C-N 3.33Å; R661-Q663 PolarHBondContact O-N 3.26Å; Q663-S667 PolarHBondContact O-N 3.27Å
664	D	81.7	Confident	77.9	Confident	73 Å²	73	111.3 Å²	111.3	39%	0.39	53%	0.526	S	S	.	.	H	α-helix	trans	-66	-42.7	173.5	179.7	31.7	0	0	0	111.5	R660 R661 S662 E666 S667 R668	R660-D664 PolarHBondContact O-N 3.33Å; R661-D664 PolarHBondContact O-N 3.29Å; S662-D664 PolarHBondContact O-N 3.42Å; D664-E666 PolarHBondContact O-N 3.26Å; D664-S667 WeakPolarHBondContact O-CB 3.35Å; D664-S667 PolarHBondContact O-N 2.68Å; D664-R668 WeakPolarHBondContact O-CG 3.33Å; D664-R668 PolarHBondContact O-N 2.98Å; D664-R668 VanDerWaalsContact O-N 3.13Å; D664-R668 IonicContact OD1-CZ 3.27Å; D664-R668 IonicContact OD1-NE 3.59Å; D664-R668 PolarHBondContact OD1-NE 2.75Å; D664-R668 IonicContact OD1-NH2 2.95Å; D664-R668 PolarHBondContact OD1-NH2 2.9Å; D664-R668 IonicContact OD2-CZ 2.77Å; D664-R668 IonicContact OD2-NE 3.83Å; D664-R668 PolarHBondContact OD2-NE 3.37Å; D664-R668 IonicContact OD2-NH2 2.73Å; D664-R668 PolarHBondContact OD2-NH2 3.19Å
665	I	80.1	Confident	77.5	Confident	101 Å²	101	111.1 Å²	111.1	52%	0.518	53%	0.525	S	S	.	.	H	α-helix	trans	-61.5	-45.6	175.7	-67.2	165.2	0	0	0	111.1	R661 S662 S667 R668 L669	R661-I665 WeakPolarHBondContact O-CG1 3.26Å; R661-I665 PolarHBondContact O-N 2.83Å; S662-I665 PolarHBondContact O-N 3.15Å; I665-S667 VanDerWaalsContact C-N 3.3Å; I665-S667 PolarHBondContact O-N 3.49Å; I665-R668 PolarHBondContact O-N 3.25Å; I665-L669 HydrophobicContact CG2-CD1 4.13Å; I665-L669 PolarHBondContact O-N 2.76Å; I665-L669 VanDerWaalsContact O-N 3.09Å
666	E	75.5	Confident	76.9	Confident	92 Å²	92	111.9 Å²	111.9	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-62.5	-33.5	175.4	-75.2	174.7	-152.8	0	0	113.2	S662 D664 R670	S662-E666 WeakPolarHBondContact O-CG 3.28Å; S662-E666 PolarHBondContact O-N 2.89Å; D664-E666 PolarHBondContact O-N 3.26Å; E666-R670 PolarHBondContact O-N 2.93Å; E666-R670 IonicContact OE2-NH1 3.39Å
667	S	81.3	Confident	76.1	Confident	50 Å²	50	113.6 Å²	113.6	35%	0.35	53%	0.534	S	S	.	.	H	α-helix	trans	-65.2	-50.9	176.1	-158.8	0	0	0	0	111.1	Q663 D664 I665 L669 R670 D671	Q663-S667 PolarHBondContact O-N 3.27Å; D664-S667 WeakPolarHBondContact O-CB 3.35Å; D664-S667 PolarHBondContact O-N 2.68Å; I665-S667 VanDerWaalsContact C-N 3.3Å; I665-S667 PolarHBondContact O-N 3.49Å; S667-L669 VanDerWaalsContact C-N 3.27Å; S667-L669 PolarHBondContact O-N 3.27Å; S667-R670 WeakPolarHBondContact O-CB 3.4Å; S667-R670 PolarHBondContact O-N 3.14Å; S667-D671 PolarHBondContact O-N 2.74Å; S667-D671 VanDerWaalsContact O-N 3.14Å
668	R	79.9	Confident	75.2	Confident	140 Å²	140	119.4 Å²	119.4	53%	0.528	55%	0.547	S	S	.	.	H	α-helix	trans	-61.2	-36.6	-179.9	-62.4	171.6	-166.1	-148.4	7	112.2	D664 I665 R670 D671 F672	D664-R668 WeakPolarHBondContact O-CG 3.33Å; D664-R668 PolarHBondContact O-N 2.98Å; D664-R668 VanDerWaalsContact O-N 3.13Å; D664-R668 IonicContact OD1-CZ 3.27Å; D664-R668 IonicContact OD1-NE 3.59Å; D664-R668 PolarHBondContact OD1-NE 2.75Å; D664-R668 IonicContact OD1-NH2 2.95Å; D664-R668 PolarHBondContact OD1-NH2 2.9Å; D664-R668 IonicContact OD2-CZ 2.77Å; D664-R668 IonicContact OD2-NE 3.83Å; D664-R668 PolarHBondContact OD2-NE 3.37Å; D664-R668 IonicContact OD2-NH2 2.73Å; D664-R668 PolarHBondContact OD2-NH2 3.19Å; I665-R668 PolarHBondContact O-N 3.25Å; R668-R670 VanDerWaalsContact C-N 3.33Å; R668-R670 PolarHBondContact O-N 3.47Å; R668-D671 PolarHBondContact O-N 3.32Å; R668-F672 WeakPolarHBondContact O-CD2 3.29Å; R668-F672 PolarHBondContact O-N 2.77Å
669	L	73.4	Confident	74.2	Confident	104 Å²	104	120.2 Å²	120.2	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-61.5	-37.6	173.5	-96.3	155.2	0	0	0	112.9	I665 S667 L673	I665-L669 HydrophobicContact CG2-CD1 4.13Å; I665-L669 PolarHBondContact O-N 2.76Å; I665-L669 VanDerWaalsContact O-N 3.09Å; S667-L669 VanDerWaalsContact C-N 3.27Å; S667-L669 PolarHBondContact O-N 3.27Å; L669-L673 VanDerWaalsContact O-CG 3.3Å; L669-L673 WeakPolarHBondContact O-CG 3.32Å; L669-L673 PolarHBondContact O-N 3.05Å
670	R	78.4	Confident	73.1	Confident	142 Å²	142	114.7 Å²	114.7	54%	0.536	53%	0.528	S	S	.	.	H	α-helix	trans	-68.1	-40.2	174.6	-73.6	-178.7	-74.2	-102.9	-2.3	111.9	E666 S667 R668 L673 A674	E666-R670 PolarHBondContact O-N 2.93Å; E666-R670 IonicContact OE2-NH1 3.39Å; S667-R670 WeakPolarHBondContact O-CB 3.4Å; S667-R670 PolarHBondContact O-N 3.14Å; R668-R670 VanDerWaalsContact C-N 3.33Å; R668-R670 PolarHBondContact O-N 3.47Å; R670-L673 PolarHBondContact O-N 3.36Å; R670-A674 PolarHBondContact O-N 2.71Å; R670-A674 VanDerWaalsContact O-N 3.1Å
671	D	75.6	Confident	72	Confident	103 Å²	103	113.1 Å²	113.1	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-64.1	-44.4	179	-60.9	-37.1	0	0	0	111.5	S667 R668 L673 A674 E675	S667-D671 PolarHBondContact O-N 2.74Å; S667-D671 VanDerWaalsContact O-N 3.14Å; R668-D671 PolarHBondContact O-N 3.32Å; D671-L673 VanDerWaalsContact C-N 3.32Å; D671-L673 PolarHBondContact O-N 2.65Å; D671-A674 PolarHBondContact O-N 3.03Å; D671-E675 PolarHBondContact O-N 2.86Å
672	F	69.4	Low	71.2	Confident	141 Å²	141	111 Å²	111	62%	0.618	53%	0.526	S	S	*	.	H	α-helix	trans	-62.2	-34.3	174.6	-76.4	-57.4	0	0	0	113.7	R668 K676	R668-F672 WeakPolarHBondContact O-CD2 3.29Å; R668-F672 PolarHBondContact O-N 2.77Å; F672-K676 WeakPolarHBondContact O-CB 3.37Å; F672-K676 PolarHBondContact O-N 2.7Å
673	L	68	Low	70.4	Confident	108 Å²	108	114.7 Å²	114.7	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-68	-40.2	175.3	-72.5	168.9	0	0	0	111.6	L669 R670 D671 E675 K676 E677	L669-L673 VanDerWaalsContact O-CG 3.3Å; L669-L673 WeakPolarHBondContact O-CG 3.32Å; L669-L673 PolarHBondContact O-N 3.05Å; R670-L673 PolarHBondContact O-N 3.36Å; D671-L673 VanDerWaalsContact C-N 3.32Å; D671-L673 PolarHBondContact O-N 2.65Å; L673-E675 VanDerWaalsContact C-N 3.34Å; L673-K676 PolarHBondContact O-N 2.92Å; L673-E677 PolarHBondContact O-N 3.49Å; L673-E677 VanDerWaalsContact O-N 3.09Å
674	A	72	Confident	69.3	Low	39 Å²	39	115.6 Å²	115.6	32%	0.322	53%	0.528	S	S	.	.	H	α-helix	trans	-72	-25	177.2	0	0	0	0	0	113.6	R670 D671 R678	R670-A674 PolarHBondContact O-N 2.71Å; R670-A674 VanDerWaalsContact O-N 3.1Å; D671-A674 PolarHBondContact O-N 3.03Å; A674-R678 WeakPolarHBondContact O-CG 3.38Å; A674-R678 PolarHBondContact O-NE 2.93Å
675	E	70.8	Confident	68.2	Low	129 Å²	129	116 Å²	116	60%	0.603	54%	0.537	S	S	*	.	H	α-helix	trans	-75.4	-43.9	171.5	-172.1	170.3	-147.6	0	0	111.3	D671 L673 E677 R678 F679	D671-E675 PolarHBondContact O-N 2.86Å; L673-E675 VanDerWaalsContact C-N 3.34Å; E675-E677 VanDerWaalsContact C-N 3.29Å; E675-E677 PolarHBondContact O-N 2.83Å; E675-R678 PolarHBondContact O-N 2.87Å; E675-F679 PolarHBondContact O-N 2.81Å
676	K	66.9	Low	67.2	Low	122 Å²	122	116.6 Å²	116.6	53%	0.53	54%	0.537	S	S	.	.	H	α-helix	trans	-55.8	-42.5	173.5	-180	-173.2	167.5	-167.8	0	112.2	F672 L673 R678 F679 E680	F672-K676 WeakPolarHBondContact O-CB 3.37Å; F672-K676 PolarHBondContact O-N 2.7Å; L673-K676 PolarHBondContact O-N 2.92Å; K676-R678 PolarHBondContact O-N 2.74Å; K676-F679 PolarHBondContact O-N 3.41Å; K676-E680 WeakPolarHBondContact CE-OE1 3.44Å; K676-E680 IonicContact NZ-OE1 3.4Å; K676-E680 PolarHBondContact O-N 2.76Å
677	E	64.9	Low	66.5	Low	146 Å²	146	116.9 Å²	116.9	68%	0.682	54%	0.541	S	S	*	.	H	α-helix	trans	-63.9	-39.8	-177	-159.9	166.6	-144.7	0	0	112.3	L673 E675 E680 E681	L673-E677 PolarHBondContact O-N 3.49Å; L673-E677 VanDerWaalsContact O-N 3.09Å; E675-E677 VanDerWaalsContact C-N 3.29Å; E675-E677 PolarHBondContact O-N 2.83Å; E677-E680 PolarHBondContact O-N 3.26Å; E677-E681 PolarHBondContact O-N 2.82Å; E677-E681 VanDerWaalsContact O-N 3.13Å
678	R	66	Low	65.3	Low	182 Å²	182	121 Å²	121	69%	0.687	56%	0.555	S	S	*	*	H	α-helix	trans	-63.8	-42.2	174.2	-62.3	174.4	-147.9	-128	6.9	112.2	A674 E675 K676 E680 E681 E682	A674-R678 WeakPolarHBondContact O-CG 3.38Å; A674-R678 PolarHBondContact O-NE 2.93Å; E675-R678 PolarHBondContact O-N 2.87Å; K676-R678 PolarHBondContact O-N 2.74Å; R678-E680 VanDerWaalsContact C-N 3.31Å; R678-E680 PolarHBondContact O-N 2.75Å; R678-E681 PolarHBondContact O-N 3.01Å; R678-E681 VanDerWaalsContact O-N 3.14Å; R678-E682 PolarHBondContact O-N 2.99Å
679	F	60.3	Low	64.5	Low	134 Å²	134	121.1 Å²	121.1	59%	0.588	56%	0.561	S	S	*	*	H	α-helix	trans	-67.3	-31.5	179.5	-160.8	-91.5	0	0	0	112.4	E675 K676 R683	E675-F679 PolarHBondContact O-N 2.81Å; K676-F679 PolarHBondContact O-N 3.41Å; F679-R683 HydrophobicContact CE1-CG 4.42Å; F679-R683 WeakPolarHBondContact O-CB 3.47Å; F679-R683 WeakPolarHBondContact O-CG 3.34Å; F679-R683 PolarHBondContact O-N 2.96Å
680	E	57	Low	63.9	Low	77 Å²	77	119.9 Å²	119.9	36%	0.36	56%	0.558	S	S	.	*	H	α-helix	trans	-70.4	-33.2	171	-74	-170.3	-168.1	0	0	112.7	K676 E677 R678 R684	K676-E680 WeakPolarHBondContact CE-OE1 3.44Å; K676-E680 IonicContact NZ-OE1 3.4Å; K676-E680 PolarHBondContact O-N 2.76Å; E677-E680 PolarHBondContact O-N 3.26Å; R678-E680 VanDerWaalsContact C-N 3.31Å; R678-E680 PolarHBondContact O-N 2.75Å; E680-R684 WeakPolarHBondContact O-CG 3.38Å; E680-R684 PolarHBondContact O-N 3.31Å
681	E	60.9	Low	63.1	Low	137 Å²	137	114.5 Å²	114.5	64%	0.64	54%	0.543	S	S	*	.	H	α-helix	trans	-74.5	-40.4	179.4	-160.5	158	-129.4	0	0	112.2	E677 R678 R684 S685	E677-E681 PolarHBondContact O-N 2.82Å; E677-E681 VanDerWaalsContact O-N 3.13Å; R678-E681 PolarHBondContact O-N 3.01Å; R678-E681 VanDerWaalsContact O-N 3.14Å; E681-R684 WeakPolarHBondContact O-CB 3.49Å; E681-R684 PolarHBondContact O-N 3.23Å; E681-S685 PolarHBondContact O-N 2.96Å
682	E	62.3	Low	62.7	Low	127 Å²	127	114.2 Å²	114.2	59%	0.593	54%	0.542	S	S	*	.	H	α-helix	trans	-60.9	-48.2	172.9	-167.3	163.7	-145.5	0	0	111.3	R678 R684 S685 E686	R678-E682 PolarHBondContact O-N 2.99Å; E682-R684 PolarHBondContact O-N 2.96Å; E682-S685 WeakPolarHBondContact O-CB 3.31Å; E682-S685 PolarHBondContact O-N 3.13Å; E682-E686 PolarHBondContact O-N 2.95Å
683	R	55.1	Low	62.5	Low	137 Å²	137	113.1 Å²	113.1	52%	0.517	54%	0.538	S	S	.	.	H	α-helix	trans	-56.4	-32.6	173.3	-85.9	-177.8	62	-167.9	-3	114	F679 I687	F679-R683 HydrophobicContact CE1-CG 4.42Å; F679-R683 WeakPolarHBondContact O-CB 3.47Å; F679-R683 WeakPolarHBondContact O-CG 3.34Å; F679-R683 PolarHBondContact O-N 2.96Å; R683-I687 WeakPolarHBondContact O-CD1 2.88Å; R683-I687 WeakPolarHBondContact O-CG1 3.44Å; R683-I687 PolarHBondContact O-N 2.78Å; R683-I687 VanDerWaalsContact O-N 3.15Å
684	R	55.8	Low	62.3	Low	143 Å²	143	109.9 Å²	109.9	54%	0.54	52%	0.521	S	S	.	.	H	α-helix	trans	-68.8	-37.5	177.7	-76.3	171.7	-170.1	177.6	7.4	111.6	E680 E681 E682 Q688	E680-R684 WeakPolarHBondContact O-CG 3.38Å; E680-R684 PolarHBondContact O-N 3.31Å; E681-R684 WeakPolarHBondContact O-CB 3.49Å; E681-R684 PolarHBondContact O-N 3.23Å; E682-R684 PolarHBondContact O-N 2.96Å; R684-Q688 PolarHBondContact O-N 3.42Å
685	S	58.9	Low	61.9	Low	81 Å²	81	110.2 Å²	110.2	57%	0.566	52%	0.521	S	S	*	.	H	α-helix	trans	-64.6	-46.8	176.5	-162.5	0	0	0	0	111	E681 E682 I687 Q688 E689	E681-S685 PolarHBondContact O-N 2.96Å; E682-S685 WeakPolarHBondContact O-CB 3.31Å; E682-S685 PolarHBondContact O-N 3.13Å; S685-I687 PolarHBondContact O-N 3.21Å; S685-Q688 PolarHBondContact O-N 3.05Å; S685-E689 PolarHBondContact O-N 3.38Å
686	E	59	Low	61.9	Low	114 Å²	114	112.6 Å²	112.6	53%	0.533	52%	0.524	S	S	.	.	H	α-helix	trans	-58.5	-45.5	176.7	-64.1	-179.1	145.5	0	0	112.6	E682 Q688 E689 V690	E682-E686 PolarHBondContact O-N 2.95Å; E686-Q688 VanDerWaalsContact C-N 3.27Å; E686-Q688 PolarHBondContact O-N 2.61Å; E686-E689 PolarHBondContact O-N 2.88Å; E686-V690 WeakPolarHBondContact O-CG2 3.39Å; E686-V690 PolarHBondContact O-N 2.89Å
687	I	61.2	Low	61.7	Low	98 Å²	98	112.2 Å²	112.2	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-60.6	-38.2	179.5	-71.1	164.7	0	0	0	111.4	R683 S685 A691	R683-I687 WeakPolarHBondContact O-CD1 2.88Å; R683-I687 WeakPolarHBondContact O-CG1 3.44Å; R683-I687 PolarHBondContact O-N 2.78Å; R683-I687 VanDerWaalsContact O-N 3.15Å; S685-I687 PolarHBondContact O-N 3.21Å; I687-A691 WeakPolarHBondContact O-CB 3.36Å; I687-A691 PolarHBondContact O-N 2.93Å
688	Q	55.4	Low	61.6	Low	137 Å²	137	107 Å²	107	64%	0.64	50%	0.501	S	S	*	.	H	α-helix	trans	-70.2	-35.5	179.8	-170.1	164.9	13.3	0	0	112.3	R684 S685 E686 L692	R684-Q688 PolarHBondContact O-N 3.42Å; S685-Q688 PolarHBondContact O-N 3.05Å; E686-Q688 VanDerWaalsContact C-N 3.27Å; E686-Q688 PolarHBondContact O-N 2.61Å; Q688-L692 PolarHBondContact O-N 2.95Å
689	E	63	Low	61.7	Low	143 Å²	143	103.1 Å²	103.1	67%	0.668	49%	0.491	S	S	*	.	H	α-helix	trans	-70.2	-42.1	175.9	-156.2	169.2	-150.6	0	0	111.7	S685 E686 A691 L692 Q693	S685-E689 PolarHBondContact O-N 3.38Å; E686-E689 PolarHBondContact O-N 2.88Å; E689-A691 PolarHBondContact O-N 2.76Å; E689-L692 PolarHBondContact O-N 3.27Å; E689-Q693 PolarHBondContact O-N 3.09Å
690	V	61.5	Low	62.2	Low	78 Å²	78	104.6 Å²	104.6	47%	0.473	49%	0.492	S	S	.	.	H	α-helix	trans	-61.3	-40.1	174	171.4	0	0	0	0	112	E686 Q693 I694	E686-V690 WeakPolarHBondContact O-CG2 3.39Å; E686-V690 PolarHBondContact O-N 2.89Å; V690-Q693 PolarHBondContact O-N 3.39Å; V690-I694 HydrophobicContact CG1-CD1 3.94Å; V690-I694 WeakPolarHBondContact O-CG1 3.39Å; V690-I694 PolarHBondContact O-N 2.98Å
691	A	61.8	Low	62.5	Low	28 Å²	28	105 Å²	105	23%	0.231	50%	0.496	C	S	.	.	H	α-helix	trans	-62.9	-42.5	176.3	0	0	0	0	0	112.3	I687 E689 Q693 I694 C695 L963	I687-A691 WeakPolarHBondContact O-CB 3.36Å; I687-A691 PolarHBondContact O-N 2.93Å; E689-A691 PolarHBondContact O-N 2.76Å; A691-Q693 VanDerWaalsContact C-N 3.3Å; A691-Q693 PolarHBondContact O-N 3.03Å; A691-I694 PolarHBondContact O-N 3.43Å; A691-C695 PolarHBondContact O-N 3.49Å; A691-L963 HydrophobicContact CB-CD1 4.46Å
692	L	66.1	Low	62.7	Low	98 Å²	98	101.5 Å²	101.5	51%	0.513	48%	0.48	S	S	.	.	H	α-helix	trans	-63.3	-35.4	174.5	-79.8	163.3	0	0	0	112.4	Q688 E689 R696	Q688-L692 PolarHBondContact O-N 2.95Å; E689-L692 PolarHBondContact O-N 3.27Å; L692-R696 WeakPolarHBondContact O-CG 3.39Å; L692-R696 PolarHBondContact O-N 3.45Å
693	Q	65.4	Low	63.1	Low	117 Å²	117	103.5 Å²	103.5	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-68.6	-43.9	176.4	-171.2	167.8	-13.4	0	0	112.1	E689 V690 A691 C695 R696 E697	E689-Q693 PolarHBondContact O-N 3.09Å; V690-Q693 PolarHBondContact O-N 3.39Å; A691-Q693 VanDerWaalsContact C-N 3.3Å; A691-Q693 PolarHBondContact O-N 3.03Å; Q693-C695 VanDerWaalsContact C-N 3.32Å; Q693-C695 PolarHBondContact O-N 2.71Å; Q693-R696 PolarHBondContact O-N 2.96Å; Q693-R696 VanDerWaalsContact O-N 3.15Å; Q693-E697 PolarHBondContact O-N 2.96Å; Q693-E697 VanDerWaalsContact O-N 3.08Å
694	I	64.6	Low	63.6	Low	41 Å²	41	100.4 Å²	100.4	21%	0.21	47%	0.473	C	S	.	.	H	α-helix	trans	-59	-41.4	176.1	-69.7	165.9	0	0	0	111.4	V690 A691 R696 E697 L698	V690-I694 HydrophobicContact CG1-CD1 3.94Å; V690-I694 WeakPolarHBondContact O-CG1 3.39Å; V690-I694 PolarHBondContact O-N 2.98Å; A691-I694 PolarHBondContact O-N 3.43Å; I694-R696 VanDerWaalsContact C-N 3.34Å; I694-R696 PolarHBondContact O-N 3.31Å; I694-E697 PolarHBondContact O-N 2.66Å; I694-L698 WeakPolarHBondContact O-CB 3.38Å; I694-L698 PolarHBondContact O-N 3.4Å
695	C	63.6	Low	63.9	Low	46 Å²	46	95.5 Å²	95.5	31%	0.311	46%	0.46	S	S	.	.	H	α-helix	trans	-64.9	-34.4	177.7	-71.9	0	0	0	0	113.2	A691 Q693 L698 Q699	A691-C695 PolarHBondContact O-N 3.49Å; Q693-C695 VanDerWaalsContact C-N 3.32Å; Q693-C695 PolarHBondContact O-N 2.71Å; C695-L698 WeakPolarHBondContact O-CB 3.34Å; C695-Q699 PolarHBondContact O-N 3.31Å
696	R	69.5	Low	64.4	Low	179 Å²	179	96.9 Å²	96.9	68%	0.675	46%	0.458	S	S	*	.	H	α-helix	trans	-70.8	-40.2	175.4	-68.1	175.4	-171.3	168.5	5.7	112.1	L692 Q693 I694 L698 R700	L692-R696 WeakPolarHBondContact O-CG 3.39Å; L692-R696 PolarHBondContact O-N 3.45Å; Q693-R696 PolarHBondContact O-N 2.96Å; Q693-R696 VanDerWaalsContact O-N 3.15Å; I694-R696 VanDerWaalsContact C-N 3.34Å; I694-R696 PolarHBondContact O-N 3.31Å; R696-L698 VanDerWaalsContact C-N 3.34Å; R696-R700 PolarHBondContact O-N 3.36Å; R696-R700 VanDerWaalsContact O-N 3.11Å
697	E	63.5	Low	65	Low	114 Å²	114	95.7 Å²	95.7	53%	0.533	46%	0.455	S	S	.	.	H	α-helix	trans	-63.7	-40	173.9	-72.6	-171.3	147	0	0	111.9	Q693 I694 R700 L701	Q693-E697 PolarHBondContact O-N 2.96Å; Q693-E697 VanDerWaalsContact O-N 3.08Å; I694-E697 PolarHBondContact O-N 2.66Å; E697-R700 PolarHBondContact O-N 2.98Å; E697-L701 WeakPolarHBondContact O-CG 3.29Å; E697-L701 PolarHBondContact O-N 3.36Å
698	L	62.9	Low	65.1	Low	35 Å²	35	96.1 Å²	96.1	18%	0.183	46%	0.455	C	S	.	.	H	α-helix	trans	-56	-53.7	174.6	-106.5	166.9	0	0	0	112.1	I694 C695 R696 R700 L701 Q702 L956	I694-L698 WeakPolarHBondContact O-CB 3.38Å; I694-L698 PolarHBondContact O-N 3.4Å; C695-L698 WeakPolarHBondContact O-CB 3.34Å; R696-L698 VanDerWaalsContact C-N 3.34Å; L698-R700 VanDerWaalsContact C-N 3.26Å; L698-R700 PolarHBondContact O-N 3.4Å; L698-L701 PolarHBondContact O-N 3.07Å; L698-Q702 PolarHBondContact O-N 3.29Å; L698-L956 HydrophobicContact CD1-CB 4.17Å; L698-L956 HydrophobicContact CD2-CB 3.71Å; L698-L956 HydrophobicContact CD2-CD1 3.79Å; L698-L956 HydrophobicContact CD2-CG 4.3Å; L698-L956 HydrophobicContact CG-CB 4.06Å; L698-L956 HydrophobicContact CG-CD1 4.14Å; L698-L956 HydrophobicContact CG-CD2 4.48Å; L698-L956 HydrophobicContact CG-CG 4.46Å
699	Q	68.1	Low	65.5	Low	102 Å²	102	94.7 Å²	94.7	48%	0.477	45%	0.449	S	S	.	.	H	α-helix	trans	-61.8	-33.2	178.5	-72.8	-177	-16.9	0	0	112.8	C695 R703	C695-Q699 PolarHBondContact O-N 3.31Å; Q699-R703 WeakPolarHBondContact O-CG 3.27Å; Q699-R703 PolarHBondContact O-N 3.37Å
700	R	71.3	Confident	66	Low	165 Å²	165	92.6 Å²	92.6	62%	0.623	45%	0.445	S	S	*	.	H	α-helix	trans	-67.9	-51.4	175.9	179.3	-177.5	168.4	-178.8	-3.9	111.5	R696 E697 L698 Q702 R703 E704	R696-R700 PolarHBondContact O-N 3.36Å; R696-R700 VanDerWaalsContact O-N 3.11Å; E697-R700 PolarHBondContact O-N 2.98Å; L698-R700 VanDerWaalsContact C-N 3.26Å; L698-R700 PolarHBondContact O-N 3.4Å; R700-Q702 PolarHBondContact O-N 2.81Å; R700-R703 PolarHBondContact O-N 2.65Å; R700-E704 IonicContact CZ-OE1 2.66Å; R700-E704 IonicContact NE-OE1 3.31Å; R700-E704 PolarHBondContact NE-OE1 3.21Å; R700-E704 IonicContact NH2-OE1 3.57Å; R700-E704 PolarHBondContact NH2-OE1 3.15Å; R700-E704 PolarHBondContact O-N 3.17Å
701	L	62.7	Low	66.4	Low	84 Å²	84	96.6 Å²	96.6	44%	0.44	45%	0.452	S	S	.	.	H	α-helix	trans	-59.2	-36.5	179.3	-72.4	169.2	0	0	0	111.4	E697 L698 E704 C705 L956	E697-L701 WeakPolarHBondContact O-CG 3.29Å; E697-L701 PolarHBondContact O-N 3.36Å; L698-L701 PolarHBondContact O-N 3.07Å; L701-E704 PolarHBondContact O-N 2.91Å; L701-C705 PolarHBondContact O-N 3.38Å; L701-C705 PolarHBondContact O-SG 3.03Å; L701-L956 HydrophobicContact CD1-CD1 4.19Å
702	Q	65.4	Low	66.5	Low	64 Å²	64	98.2 Å²	98.2	30%	0.299	46%	0.456	S	S	.	.	H	α-helix	trans	-61.6	-47.5	177.8	-138.2	167.7	-5.7	0	0	112.4	L698 R700 E704 C705 E706	L698-Q702 PolarHBondContact O-N 3.29Å; R700-Q702 PolarHBondContact O-N 2.81Å; Q702-E704 PolarHBondContact O-N 3.01Å; Q702-C705 WeakPolarHBondContact O-CB 3.27Å; Q702-C705 PolarHBondContact O-N 2.74Å; Q702-C705 VanDerWaalsContact O-N 3.15Å; Q702-E706 PolarHBondContact O-N 2.97Å
703	R	70.3	Confident	66.7	Low	170 Å²	170	97.3 Å²	97.3	64%	0.642	45%	0.449	S	S	*	.	H	α-helix	trans	-63.9	-40.3	175.5	-67.2	176.3	-174.3	-177.1	2.4	112.4	Q699 R700 C705 E706 D707	Q699-R703 WeakPolarHBondContact O-CG 3.27Å; Q699-R703 PolarHBondContact O-N 3.37Å; R700-R703 PolarHBondContact O-N 2.65Å; R703-C705 PolarHBondContact O-N 2.94Å; R703-E706 PolarHBondContact O-N 2.89Å; R703-D707 WeakPolarHBondContact O-CB 3.44Å; R703-D707 PolarHBondContact O-N 3.1Å
704	E	66.4	Low	66.9	Low	72 Å²	72	94 Å²	94	34%	0.336	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-28.4	175.9	-71.2	177.6	-174.9	0	0	111.9	R700 L701 Q702 Q708	R700-E704 IonicContact CZ-OE1 2.66Å; R700-E704 IonicContact NE-OE1 3.31Å; R700-E704 PolarHBondContact NE-OE1 3.21Å; R700-E704 IonicContact NH2-OE1 3.57Å; R700-E704 PolarHBondContact NH2-OE1 3.15Å; R700-E704 PolarHBondContact O-N 3.17Å; L701-E704 PolarHBondContact O-N 2.91Å; Q702-E704 PolarHBondContact O-N 3.01Å; E704-Q708 WeakPolarHBondContact O-CB 3.42Å; E704-Q708 WeakPolarHBondContact O-CG 3.42Å; E704-Q708 PolarHBondContact O-N 2.91Å; E704-Q708 PolarHBondContact O-NE2 2.9Å
705	C	61.9	Low	66.9	Low	39 Å²	39	97.7 Å²	97.7	26%	0.264	46%	0.458	S	S	.	.	H	α-helix	trans	-77.1	-45	173.6	-63	0	0	0	0	112.9	L701 Q702 R703 D707 Q708 Q709 L949	L701-C705 PolarHBondContact O-N 3.38Å; L701-C705 PolarHBondContact O-SG 3.03Å; Q702-C705 WeakPolarHBondContact O-CB 3.27Å; Q702-C705 PolarHBondContact O-N 2.74Å; Q702-C705 VanDerWaalsContact O-N 3.15Å; R703-C705 PolarHBondContact O-N 2.94Å; C705-D707 VanDerWaalsContact C-N 3.34Å; C705-D707 PolarHBondContact O-N 3.3Å; C705-Q708 PolarHBondContact O-N 3.46Å; C705-Q709 PolarHBondContact O-N 3.24Å; C705-L949 WeakPolarHBondContact SG-CD2 3.46Å
706	E	68.4	Low	66.9	Low	110 Å²	110	101.1 Å²	101.1	51%	0.514	47%	0.465	S	S	.	.	H	α-helix	trans	-58.8	-45.9	176.4	-70.3	172.4	171	0	0	110.8	Q702 R703 Q708 Q709 V710	Q702-E706 PolarHBondContact O-N 2.97Å; R703-E706 PolarHBondContact O-N 2.89Å; E706-Q708 VanDerWaalsContact C-N 3.33Å; E706-Q708 PolarHBondContact O-N 3.45Å; E706-Q709 PolarHBondContact O-N 3.28Å; E706-V710 WeakPolarHBondContact O-CG2 2.95Å; E706-V710 PolarHBondContact O-N 3.1Å
707	D	73.2	Confident	66.9	Low	90 Å²	90	100.3 Å²	100.3	48%	0.481	46%	0.462	S	S	.	.	H	α-helix	trans	-60.5	-38.3	174.4	-98.8	21.1	0	0	0	113	R703 C705 R711	R703-D707 WeakPolarHBondContact O-CB 3.44Å; R703-D707 PolarHBondContact O-N 3.1Å; C705-D707 VanDerWaalsContact C-N 3.34Å; C705-D707 PolarHBondContact O-N 3.3Å; D707-R711 WeakPolarHBondContact O-CD 3.35Å; D707-R711 WeakPolarHBondContact O-CG 3.38Å; D707-R711 PolarHBondContact O-N 3.39Å; D707-R711 PolarHBondContact O-NE 3.08Å; D707-R711 IonicContact OD2-NH2 3.69Å; D707-R711 PolarHBondContact OD2-NH2 2.94Å
708	Q	62.8	Low	67.3	Low	106 Å²	106	103.2 Å²	103.2	50%	0.495	47%	0.468	S	S	.	.	H	α-helix	trans	-70.4	-41.7	177.6	-79	172.6	32.4	0	0	111.6	E704 C705 E706 R711 L712	E704-Q708 WeakPolarHBondContact O-CB 3.42Å; E704-Q708 WeakPolarHBondContact O-CG 3.42Å; E704-Q708 PolarHBondContact O-N 2.91Å; E704-Q708 PolarHBondContact O-NE2 2.9Å; C705-Q708 PolarHBondContact O-N 3.46Å; E706-Q708 VanDerWaalsContact C-N 3.33Å; E706-Q708 PolarHBondContact O-N 3.45Å; Q708-R711 PolarHBondContact O-N 2.93Å; Q708-L712 WeakPolarHBondContact O-CG 3.42Å; Q708-L712 PolarHBondContact O-N 2.8Å
709	Q	63.5	Low	67.2	Low	108 Å²	108	105.3 Å²	105.3	51%	0.505	48%	0.479	S	S	.	.	H	α-helix	trans	-63.6	-45.3	177.8	-174.3	176.2	-20.5	0	0	111.4	C705 E706 R711 L712 E713	C705-Q709 PolarHBondContact O-N 3.24Å; E706-Q709 PolarHBondContact O-N 3.28Å; Q709-R711 VanDerWaalsContact C-N 3.28Å; Q709-R711 PolarHBondContact O-N 3.39Å; Q709-L712 PolarHBondContact O-N 2.92Å; Q709-E713 PolarHBondContact NE2-OE1 3.04Å; Q709-E713 WeakPolarHBondContact O-CG 3.3Å; Q709-E713 PolarHBondContact O-N 3.43Å
710	V	73.9	Confident	67	Low	98 Å²	98	103.2 Å²	103.2	59%	0.594	47%	0.469	S	S	*	.	H	α-helix	trans	-61.1	-36.5	176.5	171.9	0	0	0	0	111.9	E706 A714	E706-V710 WeakPolarHBondContact O-CG2 2.95Å; E706-V710 PolarHBondContact O-N 3.1Å; V710-A714 VanDerWaalsContact O-CB 3.3Å; V710-A714 WeakPolarHBondContact O-CB 3.41Å; V710-A714 PolarHBondContact O-N 3.45Å
711	R	70.3	Confident	66.9	Low	163 Å²	163	101 Å²	101	62%	0.615	47%	0.465	S	S	*	.	H	α-helix	trans	-67.2	-45.4	175.9	-72.1	167.6	-160.4	-159.9	8.5	112.2	D707 Q708 Q709 A714 E715	D707-R711 WeakPolarHBondContact O-CD 3.35Å; D707-R711 WeakPolarHBondContact O-CG 3.38Å; D707-R711 PolarHBondContact O-N 3.39Å; D707-R711 PolarHBondContact O-NE 3.08Å; D707-R711 IonicContact OD2-NH2 3.69Å; D707-R711 PolarHBondContact OD2-NH2 2.94Å; Q708-R711 PolarHBondContact O-N 2.93Å; Q709-R711 VanDerWaalsContact C-N 3.28Å; Q709-R711 PolarHBondContact O-N 3.39Å; R711-A714 PolarHBondContact O-N 2.94Å; R711-E715 WeakPolarHBondContact O-CB 3.32Å; R711-E715 PolarHBondContact O-N 3.42Å
712	L	63.3	Low	66.9	Low	61 Å²	61	102.1 Å²	102.1	32%	0.319	47%	0.469	S	S	.	.	H	α-helix	trans	-64.1	-44.2	177.7	-71.5	169.4	0	0	0	111.5	Q708 Q709 A714 E715 R716	Q708-L712 WeakPolarHBondContact O-CG 3.42Å; Q708-L712 PolarHBondContact O-N 2.8Å; Q709-L712 PolarHBondContact O-N 2.92Å; L712-A714 VanDerWaalsContact C-N 3.34Å; L712-A714 PolarHBondContact O-N 2.8Å; L712-E715 PolarHBondContact O-N 3.34Å; L712-R716 WeakPolarHBondContact O-CB 3.31Å; L712-R716 PolarHBondContact O-N 2.68Å
713	E	68.9	Low	66.5	Low	79 Å²	79	100.1 Å²	100.1	37%	0.369	46%	0.459	S	S	.	.	H	α-helix	trans	-63.1	-38	176	-73	-178.4	-160.6	0	0	112.5	Q709 R717	Q709-E713 PolarHBondContact NE2-OE1 3.04Å; Q709-E713 WeakPolarHBondContact O-CG 3.3Å; Q709-E713 PolarHBondContact O-N 3.43Å; E713-R717 WeakPolarHBondContact O-CG 3.32Å; E713-R717 PolarHBondContact O-N 3.19Å
714	A	70.6	Confident	66.2	Low	48 Å²	48	100.5 Å²	100.5	40%	0.397	46%	0.461	S	S	.	.	H	α-helix	trans	-68.2	-38.2	174.8	0	0	0	0	0	112.7	V710 R711 L712 R718	V710-A714 VanDerWaalsContact O-CB 3.3Å; V710-A714 WeakPolarHBondContact O-CB 3.41Å; V710-A714 PolarHBondContact O-N 3.45Å; R711-A714 PolarHBondContact O-N 2.94Å; L712-A714 VanDerWaalsContact C-N 3.34Å; L712-A714 PolarHBondContact O-N 2.8Å; A714-R718 WeakPolarHBondContact O-CG 3.34Å; A714-R718 PolarHBondContact O-N 2.73Å
715	E	65.1	Low	66	Low	119 Å²	119	103.3 Å²	103.3	56%	0.556	47%	0.474	S	S	*	.	H	α-helix	trans	-68.1	-41	174.9	-170.1	165	-156.2	0	0	111.3	R711 L712 R717 R718 L719	R711-E715 WeakPolarHBondContact O-CB 3.32Å; R711-E715 PolarHBondContact O-N 3.42Å; L712-E715 PolarHBondContact O-N 3.34Å; E715-R717 PolarHBondContact O-N 3.17Å; E715-R718 PolarHBondContact O-N 2.71Å; E715-L719 WeakPolarHBondContact O-CG 3.44Å; E715-L719 PolarHBondContact O-N 3.4Å
716	R	63.4	Low	65.7	Low	118 Å²	118	105.3 Å²	105.3	45%	0.445	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-44.1	175.5	-151.4	-171.1	90.2	-149.1	0.5	112.1	L712 L719 E720	L712-R716 WeakPolarHBondContact O-CB 3.31Å; L712-R716 PolarHBondContact O-N 2.68Å; R716-L719 PolarHBondContact O-N 2.83Å; R716-E720 IonicContact CZ-OE1 2.8Å; R716-E720 IonicContact NE-OE1 3.35Å; R716-E720 PolarHBondContact NE-OE1 2.77Å; R716-E720 IonicContact NH2-OE1 3.36Å; R716-E720 PolarHBondContact NH2-OE1 2.72Å; R716-E720 VanDerWaalsContact NH2-OE1 3.09Å; R716-E720 WeakPolarHBondContact O-CG 3.3Å; R716-E720 PolarHBondContact O-N 3.38Å
717	R	69.8	Low	65.1	Low	161 Å²	161	103.5 Å²	103.5	61%	0.608	47%	0.473	S	S	*	.	H	α-helix	trans	-60.8	-43.7	175.6	-75.4	-177	-173.7	-162.9	3.9	112.4	E713 E715 L719 E720 E721	E713-R717 WeakPolarHBondContact O-CG 3.32Å; E713-R717 PolarHBondContact O-N 3.19Å; E715-R717 PolarHBondContact O-N 3.17Å; R717-L719 VanDerWaalsContact C-N 3.33Å; R717-L719 PolarHBondContact O-N 2.74Å; R717-E720 PolarHBondContact O-N 3.49Å; R717-E721 WeakPolarHBondContact O-CG 3.22Å; R717-E721 PolarHBondContact O-N 3.01Å
718	R	71.6	Confident	64.6	Low	176 Å²	176	101.8 Å²	101.8	66%	0.664	47%	0.468	S	S	*	.	H	α-helix	trans	-59.9	-41.6	175.7	-74.2	173.5	174.2	-178.2	-1.5	112.5	A714 E715 E721 Q722	A714-R718 WeakPolarHBondContact O-CG 3.34Å; A714-R718 PolarHBondContact O-N 2.73Å; E715-R718 PolarHBondContact O-N 2.71Å; R718-E721 PolarHBondContact O-N 3.33Å; R718-Q722 WeakPolarHBondContact O-CB 3.33Å; R718-Q722 WeakPolarHBondContact O-CG 3.21Å; R718-Q722 PolarHBondContact O-N 2.65Å
719	L	60.7	Low	64.3	Low	79 Å²	79	99.1 Å²	99.1	41%	0.414	46%	0.457	S	S	.	.	H	α-helix	trans	-69	-37	177	-67.9	171	0	0	0	112.2	E715 R716 R717 E723 L938	E715-L719 WeakPolarHBondContact O-CG 3.44Å; E715-L719 PolarHBondContact O-N 3.4Å; R716-L719 PolarHBondContact O-N 2.83Å; R717-L719 VanDerWaalsContact C-N 3.33Å; R717-L719 PolarHBondContact O-N 2.74Å; L719-E723 WeakPolarHBondContact O-CB 3.29Å; L719-E723 PolarHBondContact O-N 2.75Å; L719-L938 HydrophobicContact CD1-CD1 4.29Å
720	E	63.5	Low	63.9	Low	58 Å²	58	95.8 Å²	95.8	27%	0.271	44%	0.443	S	S	.	.	H	α-helix	trans	-66.1	-36.9	173.5	-73.2	174.6	-159.3	0	0	112.3	R716 R717 R724	R716-E720 IonicContact CZ-OE1 2.8Å; R716-E720 IonicContact NE-OE1 3.35Å; R716-E720 PolarHBondContact NE-OE1 2.77Å; R716-E720 IonicContact NH2-OE1 3.36Å; R716-E720 PolarHBondContact NH2-OE1 2.72Å; R716-E720 VanDerWaalsContact NH2-OE1 3.09Å; R716-E720 WeakPolarHBondContact O-CG 3.3Å; R716-E720 PolarHBondContact O-N 3.38Å; R717-E720 PolarHBondContact O-N 3.49Å; E720-R724 WeakPolarHBondContact O-CG 3.3Å; E720-R724 PolarHBondContact O-N 3.48Å
721	E	70.2	Confident	63.2	Low	117 Å²	117	93.7 Å²	93.7	55%	0.547	44%	0.437	S	S	.	.	H	α-helix	trans	-68.1	-51.6	174.5	-74.9	170.5	165.3	0	0	111.6	R717 R718 E723 R724 E725	R717-E721 WeakPolarHBondContact O-CG 3.22Å; R717-E721 PolarHBondContact O-N 3.01Å; R718-E721 PolarHBondContact O-N 3.33Å; E721-E723 PolarHBondContact O-N 3.25Å; E721-R724 PolarHBondContact O-N 3.2Å; E721-E725 WeakPolarHBondContact O-CG 3.5Å; E721-E725 PolarHBondContact O-N 2.96Å
722	Q	60.7	Low	62.7	Low	109 Å²	109	92.7 Å²	92.7	51%	0.509	43%	0.433	S	S	.	.	H	α-helix	trans	-57.7	-33.9	176.4	-75.2	-178.7	-21.5	0	0	113	R718 Q726	R718-Q722 WeakPolarHBondContact O-CB 3.33Å; R718-Q722 WeakPolarHBondContact O-CG 3.21Å; R718-Q722 PolarHBondContact O-N 2.65Å; Q722-Q726 WeakPolarHBondContact O-CG 3.47Å; Q722-Q726 PolarHBondContact O-N 2.79Å; Q722-Q726 VanDerWaalsContact O-N 3.14Å
723	E	57.3	Low	62.2	Low	21 Å²	21	93 Å²	93	10%	0.098	44%	0.435	C	S	.	.	H	α-helix	trans	-69.7	-42.1	175.1	-171.9	178.5	-111.1	0	0	112.3	L719 E721 E725 Q726 L727 R935	L719-E723 WeakPolarHBondContact O-CB 3.29Å; L719-E723 PolarHBondContact O-N 2.75Å; E721-E723 PolarHBondContact O-N 3.25Å; E723-E725 VanDerWaalsContact C-N 3.34Å; E723-E725 PolarHBondContact O-N 3.47Å; E723-Q726 PolarHBondContact O-N 2.89Å; E723-L727 HydrophobicContact CG-CD1 4.02Å; E723-L727 HydrophobicContact CG-CG 4.39Å; E723-L727 WeakPolarHBondContact O-CB 3.35Å; E723-L727 WeakPolarHBondContact O-CG 3.47Å; E723-L727 PolarHBondContact O-N 2.95Å; E723-R935 IonicContact OE1-CZ 3.03Å; E723-R935 IonicContact OE1-NE 3.41Å; E723-R935 PolarHBondContact OE1-NE 2.97Å; E723-R935 IonicContact OE1-NH1 2.98Å; E723-R935 IonicContact OE1-NH2 2.74Å; E723-R935 PolarHBondContact OE1-NH2 3.48Å; E723-R935 IonicContact OE2-CZ 2.77Å; E723-R935 IonicContact OE2-NE 3.61Å; E723-R935 IonicContact OE2-NH1 2.72Å; E723-R935 PolarHBondContact OE2-NH1 2.88Å; E723-R935 IonicContact OE2-NH2 3.55Å; E723-R935 PolarHBondContact OE2-NH2 2.72Å
724	R	64	Low	61.5	Low	179 Å²	179	92.9 Å²	92.9	68%	0.675	43%	0.434	S	S	*	.	H	α-helix	trans	-62.6	-41.6	176.4	-73.5	173.5	179.8	-168.8	2.3	111.9	E720 E721 L727 S728	E720-R724 WeakPolarHBondContact O-CG 3.3Å; E720-R724 PolarHBondContact O-N 3.48Å; E721-R724 PolarHBondContact O-N 3.2Å; R724-L727 PolarHBondContact O-N 2.99Å; R724-S728 WeakPolarHBondContact O-CB 3.35Å; R724-S728 PolarHBondContact O-N 2.87Å
725	E	63.1	Low	61.1	Low	131 Å²	131	95.5 Å²	95.5	61%	0.612	44%	0.438	S	S	*	.	H	α-helix	trans	-62.6	-43.8	176.9	-70.8	175.7	163.9	0	0	111.6	E721 E723 S728 L729	E721-E725 WeakPolarHBondContact O-CG 3.5Å; E721-E725 PolarHBondContact O-N 2.96Å; E723-E725 VanDerWaalsContact C-N 3.34Å; E723-E725 PolarHBondContact O-N 3.47Å; E725-S728 WeakPolarHBondContact O-CB 3.38Å; E725-S728 PolarHBondContact O-N 3.21Å; E725-L729 PolarHBondContact O-N 3.16Å
726	Q	54.5	Low	60.5	Low	81 Å²	81	93.6 Å²	93.6	38%	0.379	43%	0.429	S	S	.	.	H	α-helix	trans	-73.2	-35.1	178.3	-70.2	-167.5	0.7	0	0	113.4	Q722 E723 S728 L729 V730	Q722-Q726 WeakPolarHBondContact O-CG 3.47Å; Q722-Q726 PolarHBondContact O-N 2.79Å; Q722-Q726 VanDerWaalsContact O-N 3.14Å; E723-Q726 PolarHBondContact O-N 2.89Å; Q726-S728 VanDerWaalsContact C-N 3.32Å; Q726-S728 PolarHBondContact O-N 2.98Å; Q726-L729 WeakPolarHBondContact O-CB 3.36Å; Q726-L729 PolarHBondContact O-N 2.91Å; Q726-V730 VanDerWaalsContact O-CG2 3.29Å; Q726-V730 WeakPolarHBondContact O-CG2 3.47Å; Q726-V730 PolarHBondContact O-N 2.82Å
727	L	56.7	Low	60.1	Low	72 Å²	72	89.6 Å²	89.6	38%	0.377	42%	0.416	S	S	.	.	H	α-helix	trans	-63.2	-39.8	170.7	-73	170.8	0	0	0	111.5	E723 R724 L729 V730 A731 E928	E723-L727 HydrophobicContact CG-CD1 4.02Å; E723-L727 HydrophobicContact CG-CG 4.39Å; E723-L727 WeakPolarHBondContact O-CB 3.35Å; E723-L727 WeakPolarHBondContact O-CG 3.47Å; E723-L727 PolarHBondContact O-N 2.95Å; R724-L727 PolarHBondContact O-N 2.99Å; L727-L729 VanDerWaalsContact C-N 3.32Å; L727-L729 PolarHBondContact O-N 2.87Å; L727-V730 PolarHBondContact O-N 2.96Å; L727-A731 WeakPolarHBondContact O-CB 3.4Å; L727-A731 PolarHBondContact O-N 2.87Å; L727-E928 HydrophobicContact CD2-CG 4.18Å
728	S	63.2	Low	59.6	Low	54 Å²	54	87.5 Å²	87.5	38%	0.378	41%	0.408	S	S	.	.	H	α-helix	trans	-63.9	-34.7	172.4	175.5	0	0	0	0	112.9	R724 E725 Q726 R732	R724-S728 WeakPolarHBondContact O-CB 3.35Å; R724-S728 PolarHBondContact O-N 2.87Å; E725-S728 WeakPolarHBondContact O-CB 3.38Å; E725-S728 PolarHBondContact O-N 3.21Å; Q726-S728 VanDerWaalsContact C-N 3.32Å; Q726-S728 PolarHBondContact O-N 2.98Å; S728-R732 WeakPolarHBondContact O-CG 3.34Å; S728-R732 PolarHBondContact O-N 3.19Å; S728-R732 PolarHBondContact O-NE 2.89Å; S728-R732 PolarHBondContact OG-NE 3.14Å; S728-R732 PolarHBondContact OG-NH2 3.48Å
729	L	56.8	Low	59	Low	50 Å²	50	84.1 Å²	84.1	26%	0.262	40%	0.4	S	S	.	.	H	α-helix	trans	-68.8	-45.8	173.9	-177.1	65.4	0	0	0	111.4	E725 Q726 L727 R732 L733 L837	E725-L729 PolarHBondContact O-N 3.16Å; Q726-L729 WeakPolarHBondContact O-CB 3.36Å; Q726-L729 PolarHBondContact O-N 2.91Å; L727-L729 VanDerWaalsContact C-N 3.32Å; L727-L729 PolarHBondContact O-N 2.87Å; L729-R732 PolarHBondContact O-N 3.07Å; L729-L733 HydrophobicContact CD1-CD1 4.37Å; L729-L733 HydrophobicContact CG-CD1 4Å; L729-L733 VanDerWaalsContact O-CG 3.3Å; L729-L733 WeakPolarHBondContact O-CG 3.03Å; L729-L733 PolarHBondContact O-N 2.76Å; L729-L837 HydrophobicContact CD1-CD2 3.69Å; L729-L837 HydrophobicContact CD2-CD2 3.81Å; L729-L837 HydrophobicContact CG-CD2 4.38Å
730	V	54.7	Low	58.5	Low	37 Å²	37	82.3 Å²	82.3	22%	0.224	40%	0.397	C	S	.	.	H	α-helix	trans	-62.6	-45.4	179.4	172.9	0	0	0	0	111.1	Q726 L727 R732 L733 E734 A924	Q726-V730 VanDerWaalsContact O-CG2 3.29Å; Q726-V730 WeakPolarHBondContact O-CG2 3.47Å; Q726-V730 PolarHBondContact O-N 2.82Å; L727-V730 PolarHBondContact O-N 2.96Å; V730-R732 VanDerWaalsContact C-N 3.33Å; V730-R732 PolarHBondContact O-N 3.42Å; V730-L733 PolarHBondContact O-N 2.76Å; V730-L733 VanDerWaalsContact O-N 3.14Å; V730-E734 HydrophobicContact CG1-CG 4.34Å; V730-E734 PolarHBondContact O-N 3.19Å; V730-A924 HydrophobicContact CG1-CB 4.18Å; V730-A924 HydrophobicContact CG2-CB 3.66Å
731	A	57.8	Low	58	Low	55 Å²	55	83.1 Å²	83.1	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-58.6	-43.2	176.8	0	0	0	0	0	112.4	L727 E734 E735	L727-A731 WeakPolarHBondContact O-CB 3.4Å; L727-A731 PolarHBondContact O-N 2.87Å; A731-E734 PolarHBondContact O-N 3.26Å; A731-E735 PolarHBondContact O-N 3.34Å
732	R	59.8	Low	57.4	Low	142 Å²	142	82.3 Å²	82.3	54%	0.536	40%	0.397	S	S	.	.	H	α-helix	trans	-64.5	-38.9	175.3	-77.1	179.1	-78.3	179.3	-4.4	112.5	S728 L729 V730 Q736	S728-R732 WeakPolarHBondContact O-CG 3.34Å; S728-R732 PolarHBondContact O-N 3.19Å; S728-R732 PolarHBondContact O-NE 2.89Å; S728-R732 PolarHBondContact OG-NE 3.14Å; S728-R732 PolarHBondContact OG-NH2 3.48Å; L729-R732 PolarHBondContact O-N 3.07Å; V730-R732 VanDerWaalsContact C-N 3.33Å; V730-R732 PolarHBondContact O-N 3.42Å; R732-Q736 WeakPolarHBondContact O-CB 3.43Å; R732-Q736 VanDerWaalsContact O-CG 3.28Å; R732-Q736 WeakPolarHBondContact O-CG 3.22Å; R732-Q736 PolarHBondContact O-N 3.31Å
733	L	52.8	Low	57	Low	68 Å²	68	77.8 Å²	77.8	36%	0.356	38%	0.378	S	S	.	.	H	α-helix	trans	-70.3	-36.5	177	-70.7	170.6	0	0	0	112.8	L729 V730 L737 L844	L729-L733 HydrophobicContact CD1-CD1 4.37Å; L729-L733 HydrophobicContact CG-CD1 4Å; L729-L733 VanDerWaalsContact O-CG 3.3Å; L729-L733 WeakPolarHBondContact O-CG 3.03Å; L729-L733 PolarHBondContact O-N 2.76Å; V730-L733 PolarHBondContact O-N 2.76Å; V730-L733 VanDerWaalsContact O-N 3.14Å; L733-L737 VanDerWaalsContact O-CB 3.3Å; L733-L737 WeakPolarHBondContact O-CB 3.48Å; L733-L737 PolarHBondContact O-N 3.31Å; L733-L844 HydrophobicContact CD2-CD1 3.53Å
734	E	55.6	Low	56.8	Low	75 Å²	75	77.9 Å²	77.9	35%	0.35	38%	0.382	S	S	.	.	H	α-helix	trans	-68.2	-38.7	174.5	-72.8	-171.4	147.2	0	0	111.6	V730 A731 L737 R738 R925	V730-E734 HydrophobicContact CG1-CG 4.34Å; V730-E734 PolarHBondContact O-N 3.19Å; A731-E734 PolarHBondContact O-N 3.26Å; E734-L737 PolarHBondContact O-N 3.11Å; E734-R738 PolarHBondContact O-N 3.02Å; E734-R738 VanDerWaalsContact O-N 3.07Å; E734-R925 IonicContact OE1-CZ 3.58Å; E734-R925 IonicContact OE1-NH1 2.75Å; E734-R925 PolarHBondContact OE1-NH1 3.33Å
735	E	62.2	Low	56.5	Low	103 Å²	103	72.6 Å²	72.6	48%	0.481	38%	0.377	S	S	.	.	H	α-helix	trans	-66.3	-48.2	174	-172.8	122.7	-112.4	0	0	111.9	A731 L737 R738 E739	A731-E735 PolarHBondContact O-N 3.34Å; E735-L737 VanDerWaalsContact C-N 3.26Å; E735-L737 PolarHBondContact O-N 3.18Å; E735-R738 WeakPolarHBondContact O-CB 3.48Å; E735-R738 PolarHBondContact O-N 3.26Å; E735-R738 IonicContact OE1-CZ 4Å; E735-R738 IonicContact OE1-NH2 2.76Å; E735-R738 PolarHBondContact OE1-NH2 3.34Å; E735-E739 PolarHBondContact O-N 3.47Å
736	Q	51.7	Low	56.1	Low	80 Å²	80	69.9 Å²	69.9	37%	0.374	37%	0.369	S	S	.	.	H	α-helix	trans	-60.1	-34.9	175.3	-75.3	-180	-33.2	0	0	112.7	R732 A740	R732-Q736 WeakPolarHBondContact O-CB 3.43Å; R732-Q736 VanDerWaalsContact O-CG 3.28Å; R732-Q736 WeakPolarHBondContact O-CG 3.22Å; R732-Q736 PolarHBondContact O-N 3.31Å; Q736-A740 VanDerWaalsContact O-CB 3.29Å; Q736-A740 WeakPolarHBondContact O-CB 3.24Å; Q736-A740 PolarHBondContact O-N 2.93Å
737	L	55.1	Low	56	Low	33 Å²	33	68.2 Å²	68.2	17%	0.173	36%	0.363	C	S	.	.	H	α-helix	trans	-66.2	-41.2	173.9	179.1	57.1	0	0	0	111.7	L733 E734 E735 A740 Q741 C917	L733-L737 VanDerWaalsContact O-CB 3.3Å; L733-L737 WeakPolarHBondContact O-CB 3.48Å; L733-L737 PolarHBondContact O-N 3.31Å; E734-L737 PolarHBondContact O-N 3.11Å; E735-L737 VanDerWaalsContact C-N 3.26Å; E735-L737 PolarHBondContact O-N 3.18Å; L737-A740 PolarHBondContact O-N 3.43Å; L737-Q741 HydrophobicContact CD1-CG 4.22Å; L737-Q741 WeakPolarHBondContact O-CB 3.41Å; L737-Q741 VanDerWaalsContact O-CG 3.26Å; L737-Q741 WeakPolarHBondContact O-CG 3.31Å; L737-Q741 PolarHBondContact O-N 2.91Å; L737-C917 HydrophobicContact CD1-CB 3.35Å; L737-C917 HydrophobicContact CD2-CB 3.77Å; L737-C917 HydrophobicContact CG-CB 4.18Å
738	R	60.1	Low	56	Low	117 Å²	117	67 Å²	67	44%	0.442	36%	0.356	S	S	.	.	H	α-helix	trans	-63.4	-45.9	177.1	-172.6	174.7	65.7	87.1	-4.7	111.4	E734 E735 A740 Q741 E742	E734-R738 PolarHBondContact O-N 3.02Å; E734-R738 VanDerWaalsContact O-N 3.07Å; E735-R738 WeakPolarHBondContact O-CB 3.48Å; E735-R738 PolarHBondContact O-N 3.26Å; E735-R738 IonicContact OE1-CZ 4Å; E735-R738 IonicContact OE1-NH2 2.76Å; E735-R738 PolarHBondContact OE1-NH2 3.34Å; R738-A740 VanDerWaalsContact C-N 3.33Å; R738-A740 PolarHBondContact O-N 3.44Å; R738-Q741 PolarHBondContact O-N 2.86Å; R738-E742 WeakPolarHBondContact CG-OE1 3.47Å; R738-E742 IonicContact CZ-OE1 2.87Å; R738-E742 IonicContact NH1-OE1 3.91Å; R738-E742 PolarHBondContact NH1-OE1 3.35Å; R738-E742 WeakPolarHBondContact O-CG 3.48Å; R738-E742 PolarHBondContact O-N 2.98Å
739	E	57.7	Low	55.7	Low	105 Å²	105	65.3 Å²	65.3	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-63.2	-37.5	175.4	-66.7	-172	152.2	0	0	112.6	E735 A743	E735-E739 PolarHBondContact O-N 3.47Å; E739-A743 VanDerWaalsContact O-CB 3.23Å; E739-A743 WeakPolarHBondContact O-CB 3.27Å; E739-A743 PolarHBondContact O-N 2.75Å
740	A	51.6	Low	55.6	Low	42 Å²	42	73.9 Å²	73.9	35%	0.347	38%	0.375	S	S	.	.	H	α-helix	trans	-68.7	-35.8	174.9	0	0	0	0	0	112.7	Q736 L737 R738 A744	Q736-A740 VanDerWaalsContact O-CB 3.29Å; Q736-A740 WeakPolarHBondContact O-CB 3.24Å; Q736-A740 PolarHBondContact O-N 2.93Å; L737-A740 PolarHBondContact O-N 3.43Å; R738-A740 VanDerWaalsContact C-N 3.33Å; R738-A740 PolarHBondContact O-N 3.44Å; A740-A744 VanDerWaalsContact O-CB 3.29Å; A740-A744 WeakPolarHBondContact O-CB 2.9Å; A740-A744 PolarHBondContact O-N 3.09Å
741	Q	53.2	Low	55.8	Low	74 Å²	74	78.8 Å²	78.8	35%	0.346	40%	0.395	S	S	.	.	H	α-helix	trans	-68.2	-47.2	174.6	-76.3	171.3	-5.5	0	0	111.7	L737 R738 A743 A744 A745	L737-Q741 HydrophobicContact CD1-CG 4.22Å; L737-Q741 WeakPolarHBondContact O-CB 3.41Å; L737-Q741 VanDerWaalsContact O-CG 3.26Å; L737-Q741 WeakPolarHBondContact O-CG 3.31Å; L737-Q741 PolarHBondContact O-N 2.91Å; R738-Q741 PolarHBondContact O-N 2.86Å; Q741-A743 VanDerWaalsContact C-N 3.29Å; Q741-A743 PolarHBondContact O-N 3.39Å; Q741-A744 PolarHBondContact O-N 3.37Å; Q741-A745 WeakPolarHBondContact O-CB 3.4Å; Q741-A745 PolarHBondContact O-N 2.94Å
742	E	57.2	Low	56	Low	101 Å²	101	77.5 Å²	77.5	47%	0.472	38%	0.381	S	S	.	.	H	α-helix	trans	-58.2	-43.2	174.4	-72.2	173.3	-159.8	0	0	110.6	R738 A745 V746	R738-E742 WeakPolarHBondContact CG-OE1 3.47Å; R738-E742 IonicContact CZ-OE1 2.87Å; R738-E742 IonicContact NH1-OE1 3.91Å; R738-E742 PolarHBondContact NH1-OE1 3.35Å; R738-E742 WeakPolarHBondContact O-CG 3.48Å; R738-E742 PolarHBondContact O-N 2.98Å; E742-A745 PolarHBondContact O-N 3.45Å; E742-V746 WeakPolarHBondContact O-CG2 3.33Å; E742-V746 PolarHBondContact O-N 3.47Å
743	A	52.8	Low	56.3	Low	13 Å²	13	72 Å²	72	11%	0.107	36%	0.364	C	S	.	.	H	α-helix	trans	-68	-38	176.4	0	0	0	0	0	114.8	E739 Q741 V746 L747 R821	E739-A743 VanDerWaalsContact O-CB 3.23Å; E739-A743 WeakPolarHBondContact O-CB 3.27Å; E739-A743 PolarHBondContact O-N 2.75Å; Q741-A743 VanDerWaalsContact C-N 3.29Å; Q741-A743 PolarHBondContact O-N 3.39Å; A743-V746 PolarHBondContact O-N 3.26Å; A743-L747 WeakPolarHBondContact O-CB 3.27Å; A743-L747 WeakPolarHBondContact O-CG 3.3Å; A743-L747 PolarHBondContact O-N 3.04Å; A743-R821 VanDerWaalsContact CB-CZ 3.44Å
744	A	52.2	Low	57.1	Low	23 Å²	23	75.8 Å²	75.8	19%	0.19	37%	0.373	C	S	.	.	H	α-helix	trans	-68.8	-36.4	177	0	0	0	0	0	111.5	A740 Q741 V746 L747 L748 L910	A740-A744 VanDerWaalsContact O-CB 3.29Å; A740-A744 WeakPolarHBondContact O-CB 2.9Å; A740-A744 PolarHBondContact O-N 3.09Å; Q741-A744 PolarHBondContact O-N 3.37Å; A744-V746 VanDerWaalsContact C-N 3.3Å; A744-V746 PolarHBondContact O-N 2.96Å; A744-L747 PolarHBondContact O-N 3.26Å; A744-L748 PolarHBondContact O-N 2.83Å; A744-L910 HydrophobicContact CB-CD1 4.34Å; A744-L910 HydrophobicContact CB-CD2 3.92Å
745	A	57.1	Low	57.9	Low	69 Å²	69	73.4 Å²	73.4	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-65.6	-30.8	174.7	0	0	0	0	0	113.1	Q741 E742	Q741-A745 WeakPolarHBondContact O-CB 3.4Å; Q741-A745 PolarHBondContact O-N 2.94Å; E742-A745 PolarHBondContact O-N 3.45Å
746	V	55.5	Low	58.5	Low	74 Å²	74	69.1 Å²	69.1	45%	0.448	34%	0.341	S	S	.	.	H	α-helix	trans	-78.4	-35.7	173.9	172.7	0	0	0	0	112.3	E742 A743 A744	E742-V746 WeakPolarHBondContact O-CG2 3.33Å; E742-V746 PolarHBondContact O-N 3.47Å; A743-V746 PolarHBondContact O-N 3.26Å; A744-V746 VanDerWaalsContact C-N 3.3Å; A744-V746 PolarHBondContact O-N 2.96Å
747	L	52.8	Low	59.8	Low	46 Å²	46	69.9 Å²	69.9	24%	0.241	35%	0.345	C	S	.	.	H	α-helix	trans	-83.5	-27.9	-178.4	-73.9	168.8	0	0	0	114.3	A743 A744 A855	A743-L747 WeakPolarHBondContact O-CB 3.27Å; A743-L747 WeakPolarHBondContact O-CG 3.3Å; A743-L747 PolarHBondContact O-N 3.04Å; A744-L747 PolarHBondContact O-N 3.26Å; L747-A855 HydrophobicContact CD1-CB 3.88Å; L747-A855 HydrophobicContact CD2-CB 3.79Å
748	L	56.9	Low	61	Low	46 Å²	46	72.9 Å²	72.9	24%	0.241	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	61.8	165.6	-67.7	-179.4	0	0	0	108.8	A744 R750 A907 L910	A744-L748 PolarHBondContact O-N 2.83Å; L748-R750 PolarHBondContact O-N 2.8Å; L748-A907 HydrophobicContact CD1-CB 3.94Å; L748-L910 HydrophobicContact CD1-CB 4.11Å; L748-L910 HydrophobicContact CD1-CD1 3.4Å; L748-L910 HydrophobicContact CD1-CG 4.36Å; L748-L910 HydrophobicContact CG-CD1 3.8Å
749	A	56.5	Low	62	Low	19 Å²	19	67.8 Å²	67.8	16%	0.157	34%	0.339	C	S	.	.			trans	-53.1	120.4	175.7	0	0	0	0	0	108.7	E751 D752	A749-E751 PolarHBondContact O-N 2.87Å; A749-D752 HydrophobicContact CB-CB 4.5Å; A749-D752 PolarHBondContact O-N 3.07Å
750	R	55.3	Low	63.2	Low	230 Å²	230	67.1 Å²	67.1	87%	0.868	33%	0.332	S	S	*	.	H	α-helix	trans	-58.3	-20.1	178.9	-143.7	173.4	-173.3	168.6	1.6	111.6	L748 R754	L748-R750 PolarHBondContact O-N 2.8Å; R750-R754 VanDerWaalsContact O-CB 3.31Å; R750-R754 WeakPolarHBondContact O-CB 3.06Å; R750-R754 PolarHBondContact O-N 2.97Å
751	E	57.4	Low	64.7	Low	139 Å²	139	73 Å²	73	65%	0.65	35%	0.346	S	S	*	.	H	α-helix	trans	-74.6	-33.5	173.3	-73.2	151.8	150.5	0	0	113.8	A749 R754 R755	A749-E751 PolarHBondContact O-N 2.87Å; E751-R754 PolarHBondContact O-N 3.06Å; E751-R755 VanDerWaalsContact O-CB 3.24Å; E751-R755 WeakPolarHBondContact O-CB 3.46Å; E751-R755 PolarHBondContact O-N 3Å
752	D	63.6	Low	66.2	Low	29 Å²	29	72 Å²	72	16%	0.155	34%	0.344	C	S	.	.	H	α-helix	trans	-68.6	-46.5	178.4	-88.9	-43.9	0	0	0	112.1	A749 R754 R755 L756	A749-D752 HydrophobicContact CB-CB 4.5Å; A749-D752 PolarHBondContact O-N 3.07Å; D752-R754 VanDerWaalsContact C-N 3.28Å; D752-R754 PolarHBondContact O-N 3.35Å; D752-R755 PolarHBondContact O-N 3.23Å; D752-R755 IonicContact OD1-CZ 2.61Å; D752-R755 IonicContact OD1-NH1 2.67Å; D752-R755 PolarHBondContact OD1-NH1 3.27Å; D752-L756 WeakPolarHBondContact O-CG 3.47Å; D752-L756 PolarHBondContact O-N 2.72Å
753	S	65.3	Low	67.4	Low	26 Å²	26	67.2 Å²	67.2	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-61.5	-40.5	175.5	-158.6	0	0	0	0	111.4	L756 E757 H903	S753-L756 PolarHBondContact O-N 3.4Å; S753-E757 WeakPolarHBondContact O-CG 3.47Å; S753-E757 PolarHBondContact O-N 3.17Å; S753-H903 WeakPolarHBondContact CB-ND1 3.41Å
754	R	68.7	Low	68.8	Low	147 Å²	147	68.3 Å²	68.3	56%	0.555	33%	0.331	S	S	*	.	H	α-helix	trans	-69.9	-38.6	178.1	-178.6	178.9	163.3	-154.8	-18.1	111.7	R750 E751 D752 E757 E758	R750-R754 VanDerWaalsContact O-CB 3.31Å; R750-R754 WeakPolarHBondContact O-CB 3.06Å; R750-R754 PolarHBondContact O-N 2.97Å; E751-R754 PolarHBondContact O-N 3.06Å; D752-R754 VanDerWaalsContact C-N 3.28Å; D752-R754 PolarHBondContact O-N 3.35Å; R754-E757 PolarHBondContact O-N 2.67Å; R754-E758 HydrophobicContact CG-CG 4.48Å; R754-E758 IonicContact CZ-OE1 3.74Å; R754-E758 VanDerWaalsContact CZ-OE1 3.24Å; R754-E758 IonicContact NE-OE1 3.71Å; R754-E758 PolarHBondContact NE-OE1 3Å; R754-E758 IonicContact NH2-OE1 2.65Å; R754-E758 PolarHBondContact NH2-OE1 3.2Å; R754-E758 WeakPolarHBondContact O-CB 3.41Å; R754-E758 WeakPolarHBondContact O-CG 3.33Å; R754-E758 PolarHBondContact O-N 3.14Å
755	R	73.5	Confident	70.4	Confident	26 Å²	26	71.6 Å²	71.6	10%	0.098	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-47.6	173.6	-167.4	-165.1	76.7	-124	-10	110.1	E751 D752 E757 E758 E759	E751-R755 VanDerWaalsContact O-CB 3.24Å; E751-R755 WeakPolarHBondContact O-CB 3.46Å; E751-R755 PolarHBondContact O-N 3Å; D752-R755 PolarHBondContact O-N 3.23Å; D752-R755 IonicContact OD1-CZ 2.61Å; D752-R755 IonicContact OD1-NH1 2.67Å; D752-R755 PolarHBondContact OD1-NH1 3.27Å; R755-E757 VanDerWaalsContact C-N 3.33Å; R755-E757 PolarHBondContact O-N 2.77Å; R755-E758 PolarHBondContact O-N 2.81Å; R755-E759 VanDerWaalsContact CD-OE1 3.28Å; R755-E759 WeakPolarHBondContact CD-OE1 3.45Å; R755-E759 HydrophobicContact CG-CG 4.43Å; R755-E759 WeakPolarHBondContact CG-OE1 3.39Å; R755-E759 IonicContact CZ-OE1 2.67Å; R755-E759 IonicContact NE-OE1 2.74Å; R755-E759 PolarHBondContact NE-OE1 3.22Å; R755-E759 WeakPolarHBondContact O-CB 3.44Å; R755-E759 VanDerWaalsContact O-CG 3.3Å; R755-E759 WeakPolarHBondContact O-CG 3.46Å; R755-E759 PolarHBondContact O-N 3.05Å
756	L	74.7	Confident	71.6	Confident	12 Å²	12	68.8 Å²	68.8	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-64.2	-34.6	176.8	-69	171	0	0	0	112.7	D752 S753 R760 K899 L900	D752-L756 WeakPolarHBondContact O-CG 3.47Å; D752-L756 PolarHBondContact O-N 2.72Å; S753-L756 PolarHBondContact O-N 3.4Å; L756-R760 VanDerWaalsContact O-CB 3.29Å; L756-R760 WeakPolarHBondContact O-CB 3.44Å; L756-R760 PolarHBondContact O-N 2.98Å; L756-K899 HydrophobicContact CD1-CB 4.17Å; L756-K899 HydrophobicContact CD2-CD 4.49Å; L756-L900 HydrophobicContact CB-CD1 3.93Å; L756-L900 HydrophobicContact CB-CG 4.33Å
757	E	77.8	Confident	72.9	Confident	97 Å²	97	69.8 Å²	69.8	45%	0.453	31%	0.314	S	S	.	.	H	α-helix	trans	-66.5	-43.3	172.3	-76.3	173	179.3	0	0	112.4	S753 R754 R755 R761 L900	S753-E757 WeakPolarHBondContact O-CG 3.47Å; S753-E757 PolarHBondContact O-N 3.17Å; R754-E757 PolarHBondContact O-N 2.67Å; R755-E757 VanDerWaalsContact C-N 3.33Å; R755-E757 PolarHBondContact O-N 2.77Å; E757-R761 WeakPolarHBondContact O-CB 3.47Å; E757-R761 PolarHBondContact O-N 2.91Å; E757-R761 VanDerWaalsContact O-N 3.08Å; E757-L900 HydrophobicContact CB-CD1 4.45Å; E757-L900 HydrophobicContact CG-CD1 3.73Å; E757-L900 HydrophobicContact CG-CD2 4.02Å; E757-L900 HydrophobicContact CG-CG 4.34Å
758	E	80.5	Confident	74.3	Confident	95 Å²	95	73.2 Å²	73.2	44%	0.444	33%	0.328	S	S	.	.	H	α-helix	trans	-67.8	-42.2	176.8	-72	176.4	-172.9	0	0	111.3	R754 R755 R761 V762	R754-E758 HydrophobicContact CG-CG 4.48Å; R754-E758 IonicContact CZ-OE1 3.74Å; R754-E758 VanDerWaalsContact CZ-OE1 3.24Å; R754-E758 IonicContact NE-OE1 3.71Å; R754-E758 PolarHBondContact NE-OE1 3Å; R754-E758 IonicContact NH2-OE1 2.65Å; R754-E758 PolarHBondContact NH2-OE1 3.2Å; R754-E758 WeakPolarHBondContact O-CB 3.41Å; R754-E758 WeakPolarHBondContact O-CG 3.33Å; R754-E758 PolarHBondContact O-N 3.14Å; R755-E758 PolarHBondContact O-N 2.81Å; E758-R761 WeakPolarHBondContact O-CB 3.35Å; E758-R761 PolarHBondContact O-N 3.26Å; E758-V762 WeakPolarHBondContact O-CG2 3.42Å; E758-V762 PolarHBondContact O-N 3.13Å
759	E	81.6	Confident	75.5	Confident	11 Å²	11	71.8 Å²	71.8	5%	0.051	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-49	173.1	-75.9	177.6	-154.1	0	0	112	R755 R761 V762 L763 F799 Q803	R755-E759 VanDerWaalsContact CD-OE1 3.28Å; R755-E759 WeakPolarHBondContact CD-OE1 3.45Å; R755-E759 HydrophobicContact CG-CG 4.43Å; R755-E759 WeakPolarHBondContact CG-OE1 3.39Å; R755-E759 IonicContact CZ-OE1 2.67Å; R755-E759 IonicContact NE-OE1 2.74Å; R755-E759 PolarHBondContact NE-OE1 3.22Å; R755-E759 WeakPolarHBondContact O-CB 3.44Å; R755-E759 VanDerWaalsContact O-CG 3.3Å; R755-E759 WeakPolarHBondContact O-CG 3.46Å; R755-E759 PolarHBondContact O-N 3.05Å; E759-R761 PolarHBondContact O-N 3.14Å; E759-V762 PolarHBondContact O-N 3.32Å; E759-L763 WeakPolarHBondContact O-CB 3.5Å; E759-L763 WeakPolarHBondContact O-CG 3.49Å; E759-L763 PolarHBondContact O-N 3.45Å; E759-F799 HydrophobicContact CB-CE2 4.36Å; E759-F799 HydrophobicContact CB-CZ 4.02Å; E759-F799 HydrophobicContact CG-CE2 4.11Å; E759-F799 HydrophobicContact CG-CZ 3.95Å; E759-Q803 PolarHBondContact OE2-NE2 3.44Å
760	R	83	Confident	76.5	Confident	91 Å²	91	70.9 Å²	70.9	34%	0.343	32%	0.316	S	S	.	.	H	α-helix	trans	-59.3	-37.4	177.1	-167.4	-169.9	72	-173	-1.7	111.5	L756 A764 L893	L756-R760 VanDerWaalsContact O-CB 3.29Å; L756-R760 WeakPolarHBondContact O-CB 3.44Å; L756-R760 PolarHBondContact O-N 2.98Å; R760-A764 WeakPolarHBondContact O-CB 3.35Å; R760-A764 PolarHBondContact O-N 3.24Å; R760-L893 HydrophobicContact CG-CG 4.2Å
761	R	83.7	Confident	77.6	Confident	165 Å²	165	62.8 Å²	62.8	62%	0.623	29%	0.289	S	S	*	.	H	α-helix	trans	-65.6	-48.7	176	-179.9	-175.8	165.4	-173	-6.3	111.6	E757 E758 E759 L763 A764 E765	E757-R761 WeakPolarHBondContact O-CB 3.47Å; E757-R761 PolarHBondContact O-N 2.91Å; E757-R761 VanDerWaalsContact O-N 3.08Å; E758-R761 WeakPolarHBondContact O-CB 3.35Å; E758-R761 PolarHBondContact O-N 3.26Å; E759-R761 PolarHBondContact O-N 3.14Å; R761-L763 VanDerWaalsContact C-N 3.34Å; R761-L763 PolarHBondContact O-N 3.35Å; R761-A764 WeakPolarHBondContact O-CB 3.34Å; R761-A764 PolarHBondContact O-N 2.83Å; R761-E765 IonicContact CZ-OE1 3.86Å; R761-E765 IonicContact NE-OE1 2.67Å; R761-E765 PolarHBondContact NE-OE1 3.31Å; R761-E765 IonicContact NH2-OE1 2.79Å; R761-E765 PolarHBondContact NH2-OE1 3.23Å; R761-E765 WeakPolarHBondContact O-CG 3.46Å; R761-E765 PolarHBondContact O-N 3.16Å
762	V	83.5	Confident	78.6	Confident	53 Å²	53	63.2 Å²	63.2	32%	0.321	29%	0.285	S	S	.	.	H	α-helix	trans	-65.3	-39	179.9	175.1	0	0	0	0	111.2	E758 E759 A764 E765 I766 F799	E758-V762 WeakPolarHBondContact O-CG2 3.42Å; E758-V762 PolarHBondContact O-N 3.13Å; E759-V762 PolarHBondContact O-N 3.32Å; V762-A764 VanDerWaalsContact C-N 3.32Å; V762-A764 PolarHBondContact O-N 3.02Å; V762-E765 PolarHBondContact O-N 3.25Å; V762-I766 HydrophobicContact CG1-CD1 3.83Å; V762-I766 HydrophobicContact CG1-CG1 4.46Å; V762-I766 VanDerWaalsContact O-CG1 3.3Å; V762-I766 WeakPolarHBondContact O-CG1 3.49Å; V762-I766 PolarHBondContact O-N 3.05Å; V762-F799 HydrophobicContact CB-CD2 4.09Å; V762-F799 HydrophobicContact CB-CE2 3.99Å; V762-F799 HydrophobicContact CG1-CD2 3.48Å; V762-F799 VanDerWaalsContact CG1-CD2 3.48Å; V762-F799 HydrophobicContact CG1-CE2 3.91Å; V762-F799 HydrophobicContact CG1-CG 4.11Å
763	L	83.9	Confident	79	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-37.4	172.7	-74	171	0	0	0	112.4	E759 R761 I766 R767 Y796 F799 V889 E892 L893 T896	E759-L763 WeakPolarHBondContact O-CB 3.5Å; E759-L763 WeakPolarHBondContact O-CG 3.49Å; E759-L763 PolarHBondContact O-N 3.45Å; R761-L763 VanDerWaalsContact C-N 3.34Å; R761-L763 PolarHBondContact O-N 3.35Å; L763-I766 PolarHBondContact O-N 2.99Å; L763-R767 WeakPolarHBondContact O-CB 3.28Å; L763-R767 PolarHBondContact O-N 3.09Å; L763-Y796 HydrophobicContact CD2-CD2 4.46Å; L763-Y796 HydrophobicContact CD2-CE2 4.02Å; L763-F799 HydrophobicContact CD1-CE1 4.31Å; L763-F799 HydrophobicContact CD1-CZ 4.37Å; L763-F799 HydrophobicContact CD2-CD1 4.1Å; L763-F799 HydrophobicContact CD2-CE1 3.59Å; L763-F799 HydrophobicContact CD2-CZ 4.25Å; L763-F799 HydrophobicContact CG-CE1 3.81Å; L763-F799 HydrophobicContact CG-CZ 3.94Å; L763-V889 HydrophobicContact CD2-CG1 4.32Å; L763-E892 HydrophobicContact CD1-CB 4.27Å; L763-L893 HydrophobicContact CB-CD1 4.08Å; L763-T896 HydrophobicContact CD1-CG2 4.27Å
764	A	82.5	Confident	79.4	Confident	36 Å²	36	63.6 Å²	63.6	30%	0.298	28%	0.282	S	S	.	.	H	α-helix	trans	-65.7	-45.2	174.7	0	0	0	0	0	112	R760 R761 V762 I766 R767 E768 L893	R760-A764 WeakPolarHBondContact O-CB 3.35Å; R760-A764 PolarHBondContact O-N 3.24Å; R761-A764 WeakPolarHBondContact O-CB 3.34Å; R761-A764 PolarHBondContact O-N 2.83Å; V762-A764 VanDerWaalsContact C-N 3.32Å; V762-A764 PolarHBondContact O-N 3.02Å; A764-I766 VanDerWaalsContact C-N 3.32Å; A764-I766 PolarHBondContact O-N 2.74Å; A764-R767 WeakPolarHBondContact O-CB 3.39Å; A764-R767 PolarHBondContact O-N 3.45Å; A764-E768 PolarHBondContact O-N 3.09Å; A764-L893 HydrophobicContact CB-CD1 3.86Å
765	E	83.8	Confident	79.5	Confident	93 Å²	93	60.8 Å²	60.8	44%	0.435	28%	0.275	S	S	.	.	H	α-helix	trans	-61.8	-38.9	177.1	-68.5	175.9	-168.2	0	0	111.2	R761 V762 A769	R761-E765 IonicContact CZ-OE1 3.86Å; R761-E765 IonicContact NE-OE1 2.67Å; R761-E765 PolarHBondContact NE-OE1 3.31Å; R761-E765 IonicContact NH2-OE1 2.79Å; R761-E765 PolarHBondContact NH2-OE1 3.23Å; R761-E765 WeakPolarHBondContact O-CG 3.46Å; R761-E765 PolarHBondContact O-N 3.16Å; V762-E765 PolarHBondContact O-N 3.25Å; E765-A769 PolarHBondContact O-N 3.02Å; E765-A769 VanDerWaalsContact O-N 3.13Å
766	I	83.4	Confident	79.3	Confident	9 Å²	9	60.7 Å²	60.7	5%	0.046	28%	0.28	C	S	.	.	H	α-helix	trans	-67	-42.8	173.2	-68.3	165.3	0	0	0	111.6	V762 L763 A764 E768 A769 L770 V792 Y796 F799 V889	V762-I766 HydrophobicContact CG1-CD1 3.83Å; V762-I766 HydrophobicContact CG1-CG1 4.46Å; V762-I766 VanDerWaalsContact O-CG1 3.3Å; V762-I766 WeakPolarHBondContact O-CG1 3.49Å; V762-I766 PolarHBondContact O-N 3.05Å; L763-I766 PolarHBondContact O-N 2.99Å; A764-I766 VanDerWaalsContact C-N 3.32Å; A764-I766 PolarHBondContact O-N 2.74Å; I766-E768 PolarHBondContact O-N 3.15Å; I766-A769 WeakPolarHBondContact O-CB 3.27Å; I766-A769 PolarHBondContact O-N 2.73Å; I766-A769 VanDerWaalsContact O-N 3.16Å; I766-L770 HydrophobicContact CG2-CD1 4.11Å; I766-L770 HydrophobicContact CG2-CG 4.37Å; I766-L770 WeakPolarHBondContact O-CG 3.41Å; I766-L770 PolarHBondContact O-N 3.25Å; I766-V792 HydrophobicContact CG2-CG1 4.22Å; I766-Y796 HydrophobicContact CD1-CD2 4.38Å; I766-Y796 HydrophobicContact CG2-CD2 4.29Å; I766-F799 HydrophobicContact CD1-CB 4.05Å; I766-F799 HydrophobicContact CD1-CG 4.26Å; I766-V889 HydrophobicContact CG2-CG2 4.24Å
767	R	83.5	Confident	78.9	Confident	96 Å²	96	62.4 Å²	62.4	36%	0.362	30%	0.296	S	S	.	.	H	α-helix	trans	-58.9	-45.8	176.6	-174.6	-169.7	174.4	-135.6	3.9	111.4	L763 A764 A769 L770 L771 L886 V889 E890	L763-R767 WeakPolarHBondContact O-CB 3.28Å; L763-R767 PolarHBondContact O-N 3.09Å; A764-R767 WeakPolarHBondContact O-CB 3.39Å; A764-R767 PolarHBondContact O-N 3.45Å; R767-A769 VanDerWaalsContact C-N 3.3Å; R767-A769 PolarHBondContact O-N 3.47Å; R767-L770 PolarHBondContact O-N 3.47Å; R767-L771 HydrophobicContact CG-CD1 4.16Å; R767-L771 WeakPolarHBondContact O-CB 3.48Å; R767-L771 WeakPolarHBondContact O-CG 3.21Å; R767-L771 PolarHBondContact O-N 2.99Å; R767-L886 HydrophobicContact CG-CD1 3.8Å; R767-V889 HydrophobicContact CB-CG1 3.91Å; R767-E890 HydrophobicContact CG-CG 4.19Å; R767-E890 IonicContact CZ-OE1 3.62Å; R767-E890 IonicContact NE-OE1 2.89Å; R767-E890 PolarHBondContact NE-OE1 3.27Å; R767-E890 IonicContact NH2-OE1 2.64Å; R767-E890 PolarHBondContact NH2-OE1 3.23Å
768	E	82.3	Confident	78.3	Confident	118 Å²	118	64.4 Å²	64.4	55%	0.551	31%	0.305	S	S	*	.	H	α-helix	trans	-64.6	-33.2	176	-72.9	-173.5	179.5	0	0	112.7	A764 I766 R772	A764-E768 PolarHBondContact O-N 3.09Å; I766-E768 PolarHBondContact O-N 3.15Å; E768-R772 WeakPolarHBondContact O-CB 3.35Å; E768-R772 WeakPolarHBondContact O-CG 3.37Å; E768-R772 PolarHBondContact O-N 3.48Å; E768-R772 VanDerWaalsContact O-N 3.14Å; E768-R772 PolarHBondContact O-NE 3.4Å
769	A	80.2	Confident	77.5	Confident	16 Å²	16	67.9 Å²	67.9	13%	0.132	31%	0.314	C	S	.	.	H	α-helix	trans	-70.5	-40.5	173.5	0	0	0	0	0	112.1	E765 I766 R767 R772 A773 V792	E765-A769 PolarHBondContact O-N 3.02Å; E765-A769 VanDerWaalsContact O-N 3.13Å; I766-A769 WeakPolarHBondContact O-CB 3.27Å; I766-A769 PolarHBondContact O-N 2.73Å; I766-A769 VanDerWaalsContact O-N 3.16Å; R767-A769 VanDerWaalsContact C-N 3.3Å; R767-A769 PolarHBondContact O-N 3.47Å; A769-R772 PolarHBondContact O-N 3.08Å; A769-A773 WeakPolarHBondContact O-CB 3.5Å; A769-A773 PolarHBondContact O-N 3.28Å; A769-V792 HydrophobicContact CB-CB 4.45Å; A769-V792 HydrophobicContact CB-CG1 3.71Å; A769-V792 HydrophobicContact CB-CG2 3.77Å
770	L	78.6	Confident	76.4	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-65	-41.9	175.1	-72.5	173.5	0	0	0	112.2	I766 R767 A773 K774 V792 L882 T885 L886 V889	I766-L770 HydrophobicContact CG2-CD1 4.11Å; I766-L770 HydrophobicContact CG2-CG 4.37Å; I766-L770 WeakPolarHBondContact O-CG 3.41Å; I766-L770 PolarHBondContact O-N 3.25Å; R767-L770 PolarHBondContact O-N 3.47Å; L770-A773 PolarHBondContact O-N 3.46Å; L770-K774 WeakPolarHBondContact O-CB 3.31Å; L770-K774 PolarHBondContact O-N 3.46Å; L770-V792 HydrophobicContact CD2-CB 4.02Å; L770-V792 HydrophobicContact CD2-CG1 3.56Å; L770-V792 HydrophobicContact CG-CG1 3.62Å; L770-L882 HydrophobicContact CD2-CD2 3.94Å; L770-T885 HydrophobicContact CD1-CG2 3.93Å; L770-T885 HydrophobicContact CD2-CG2 4.25Å; L770-L886 HydrophobicContact CB-CD1 4.05Å; L770-L886 HydrophobicContact CD1-CB 4.5Å; L770-L886 HydrophobicContact CD1-CD1 4.48Å; L770-V889 HydrophobicContact CD1-CB 4.33Å; L770-V889 HydrophobicContact CD1-CG2 3.89Å
771	L	78.6	Confident	75.1	Confident	60 Å²	60	74.6 Å²	74.6	31%	0.314	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-45	175.6	-75.8	167.1	0	0	0	111.6	R767 K774 E775 L886	R767-L771 HydrophobicContact CG-CD1 4.16Å; R767-L771 WeakPolarHBondContact O-CB 3.48Å; R767-L771 WeakPolarHBondContact O-CG 3.21Å; R767-L771 PolarHBondContact O-N 2.99Å; L771-K774 PolarHBondContact O-N 3.48Å; L771-E775 WeakPolarHBondContact O-CB 3.43Å; L771-E775 PolarHBondContact O-N 3.43Å; L771-L886 HydrophobicContact CD2-CD1 4.27Å; L771-L886 HydrophobicContact CD2-CD2 3.65Å; L771-L886 HydrophobicContact CG-CD1 4.03Å; L771-L886 HydrophobicContact CG-CD2 4.28Å
772	R	77.3	Confident	73.9	Confident	147 Å²	147	69.4 Å²	69.4	56%	0.555	36%	0.358	S	S	*	.	H	α-helix	trans	-61.8	-43.8	174.6	-77.4	177.6	-73.8	174.5	-5.4	112.6	E768 A769 K774 E775 A776	E768-R772 WeakPolarHBondContact O-CB 3.35Å; E768-R772 WeakPolarHBondContact O-CG 3.37Å; E768-R772 PolarHBondContact O-N 3.48Å; E768-R772 VanDerWaalsContact O-N 3.14Å; E768-R772 PolarHBondContact O-NE 3.4Å; A769-R772 PolarHBondContact O-N 3.08Å; R772-K774 VanDerWaalsContact C-N 3.34Å; R772-K774 PolarHBondContact O-N 3.14Å; R772-E775 PolarHBondContact O-N 3.14Å; R772-A776 WeakPolarHBondContact O-CB 3.42Å; R772-A776 PolarHBondContact O-N 2.98Å
773	A	73.2	Confident	72.8	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-64.5	-36.4	176.7	0	0	0	0	0	112.5	A769 L770 A776 A777 E788 L882	A769-A773 WeakPolarHBondContact O-CB 3.5Å; A769-A773 PolarHBondContact O-N 3.28Å; L770-A773 PolarHBondContact O-N 3.46Å; A773-A776 PolarHBondContact O-N 3.13Å; A773-A777 WeakPolarHBondContact O-CB 3.49Å; A773-A777 PolarHBondContact O-N 3.16Å; A773-E788 HydrophobicContact CB-CG 4.22Å; A773-L882 HydrophobicContact CB-CD2 4.35Å
774	K	72.9	Confident	71.7	Confident	63 Å²	63	78.6 Å²	78.6	27%	0.274	40%	0.401	S	S	.	.	H	α-helix	trans	-65	-49.8	172.9	178.4	176.5	175.6	171	0	111.7	L770 L771 R772 A776 A777 E778 D883	L770-K774 WeakPolarHBondContact O-CB 3.31Å; L770-K774 PolarHBondContact O-N 3.46Å; L771-K774 PolarHBondContact O-N 3.48Å; R772-K774 VanDerWaalsContact C-N 3.34Å; R772-K774 PolarHBondContact O-N 3.14Å; K774-A776 PolarHBondContact O-N 2.97Å; K774-A777 WeakPolarHBondContact O-CB 3.36Å; K774-A777 PolarHBondContact O-N 2.98Å; K774-A777 VanDerWaalsContact O-N 3.11Å; K774-E778 WeakPolarHBondContact CE-OE1 3.46Å; K774-E778 PolarHBondContact O-N 3Å; K774-D883 WeakPolarHBondContact CE-OD1 3.35Å; K774-D883 IonicContact NZ-OD1 3.48Å; K774-D883 PolarHBondContact NZ-OD1 3.47Å
775	E	72.2	Confident	70.7	Confident	88 Å²	88	77 Å²	77	41%	0.411	39%	0.388	S	S	.	.	H	α-helix	trans	-59.7	-32.1	175.8	-84.1	-166.6	-142.5	0	0	113.4	L771 R772 R779	L771-E775 WeakPolarHBondContact O-CB 3.43Å; L771-E775 PolarHBondContact O-N 3.43Å; R772-E775 PolarHBondContact O-N 3.14Å; E775-R779 WeakPolarHBondContact O-CD 3.47Å; E775-R779 VanDerWaalsContact O-CG 3.32Å; E775-R779 WeakPolarHBondContact O-CG 3.25Å; E775-R779 PolarHBondContact O-NE 3.21Å; E775-R779 IonicContact OE2-CZ 2.67Å; E775-R779 VanDerWaalsContact OE2-CZ 3.31Å; E775-R779 IonicContact OE2-NH1 2.71Å; E775-R779 PolarHBondContact OE2-NH1 3.06Å; E775-R779 IonicContact OE2-NH2 3.35Å; E775-R779 PolarHBondContact OE2-NH2 3.35Å
776	A	68.7	Low	69.7	Low	24 Å²	24	74.2 Å²	74.2	20%	0.198	38%	0.38	C	S	.	.	H	α-helix	trans	-71.2	-41.5	173.6	0	0	0	0	0	111.7	R772 A773 K774 E778 R779 T780 A785	R772-A776 WeakPolarHBondContact O-CB 3.42Å; R772-A776 PolarHBondContact O-N 2.98Å; A773-A776 PolarHBondContact O-N 3.13Å; K774-A776 PolarHBondContact O-N 2.97Å; A776-E778 PolarHBondContact O-N 3.24Å; A776-R779 PolarHBondContact O-N 3.34Å; A776-T780 PolarHBondContact O-N 3.2Å; A776-T780 PolarHBondContact O-OG1 3.49Å; A776-A785 HydrophobicContact CB-CB 4.42Å
777	A	65	Low	69	Low	48 Å²	48	79 Å²	79	40%	0.397	40%	0.401	S	S	.	.	H	α-helix	trans	-62.6	-24.2	177.6	0	0	0	0	0	113.9	A773 K774 R779 A785 L882	A773-A777 WeakPolarHBondContact O-CB 3.49Å; A773-A777 PolarHBondContact O-N 3.16Å; K774-A777 WeakPolarHBondContact O-CB 3.36Å; K774-A777 PolarHBondContact O-N 2.98Å; K774-A777 VanDerWaalsContact O-N 3.11Å; A777-R779 VanDerWaalsContact C-N 3.32Å; A777-A785 VanDerWaalsContact CA-CB 3.47Å; A777-A785 HydrophobicContact CB-CB 3.82Å; A777-L882 HydrophobicContact CB-CD1 4.47Å
778	E	65.9	Low	68.3	Low	140 Å²	140	79.1 Å²	79.1	65%	0.654	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-5.7	174.2	-68.5	175.6	-173.7	0	0	113.5	K774 A776	K774-E778 WeakPolarHBondContact CE-OE1 3.46Å; K774-E778 PolarHBondContact O-N 3Å; A776-E778 PolarHBondContact O-N 3.24Å
779	R	63.6	Low	67.6	Low	167 Å²	167	74 Å²	74	63%	0.63	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-16.3	-169.5	-65.3	175.4	-169.6	138	5.4	116.2	E775 A776 A777	E775-R779 WeakPolarHBondContact O-CD 3.47Å; E775-R779 VanDerWaalsContact O-CG 3.32Å; E775-R779 WeakPolarHBondContact O-CG 3.25Å; E775-R779 PolarHBondContact O-NE 3.21Å; E775-R779 IonicContact OE2-CZ 2.67Å; E775-R779 VanDerWaalsContact OE2-CZ 3.31Å; E775-R779 IonicContact OE2-NH1 2.71Å; E775-R779 PolarHBondContact OE2-NH1 3.06Å; E775-R779 IonicContact OE2-NH2 3.35Å; E775-R779 PolarHBondContact OE2-NH2 3.35Å; A776-R779 PolarHBondContact O-N 3.34Å; A777-R779 VanDerWaalsContact C-N 3.32Å
780	T	59.1	Low	67.2	Low	85 Å²	85	80.4 Å²	80.4	52%	0.521	40%	0.404	S	S	.	.	S	Bend	trans	-138	160.4	-174	54.6	0	0	0	0	113.7	A776 G782	A776-T780 PolarHBondContact O-N 3.2Å; A776-T780 PolarHBondContact O-OG1 3.49Å; T780-G782 PolarHBondContact O-N 3.19Å
781	D	55.8	Low	67.2	Low	159 Å²	159	83.5 Å²	83.5	85%	0.85	43%	0.425	S	S	*	.			trans	-58.3	127.2	175.2	-74.4	-45	0	0	0	111.1	E783	D781-E783 PolarHBondContact O-N 3.15Å
782	G	58.6	Low	67.2	Low	55 Å²	55	81 Å²	81	57%	0.567	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	9.9	-149.7	0	0	0	0	0	119.3	T780 A786	T780-G782 PolarHBondContact O-N 3.19Å; G782-A786 WeakPolarHBondContact O-CB 3.44Å; G782-A786 PolarHBondContact O-N 3.04Å
783	E	60.3	Low	67	Low	141 Å²	141	75.5 Å²	75.5	66%	0.659	39%	0.393	S	S	*	.	H	α-helix	trans	-76.8	-46.5	178.1	-78	-151.1	148.1	0	0	113.6	D781 A786 K787	D781-E783 PolarHBondContact O-N 3.15Å; E783-A786 PolarHBondContact O-N 3.13Å; E783-K787 WeakPolarHBondContact O-CG 3.25Å; E783-K787 PolarHBondContact O-N 3.27Å
784	D	60.1	Low	67.4	Low	106 Å²	106	83.1 Å²	83.1	57%	0.567	43%	0.426	S	S	*	.	H	α-helix	trans	-76.5	-40.9	-173.9	-76.3	-23.8	0	0	0	112.1	A786 K787 E788	D784-A786 PolarHBondContact O-N 3.03Å; D784-K787 WeakPolarHBondContact O-CB 3.38Å; D784-K787 PolarHBondContact O-N 3.16Å; D784-K787 WeakPolarHBondContact OD1-CD 3.34Å; D784-K787 WeakPolarHBondContact OD1-CE 3.29Å; D784-K787 IonicContact OD1-NZ 3.7Å; D784-K787 PolarHBondContact OD1-NZ 3.04Å; D784-E788 PolarHBondContact O-N 2.89Å
785	A	61.2	Low	67.7	Low	3 Å²	3	85 Å²	85	3%	0.025	44%	0.436	C	S	.	.	H	α-helix	trans	-60.2	-35.3	170.5	0	0	0	0	0	112	A776 A777 E788 A789	A776-A785 HydrophobicContact CB-CB 4.42Å; A777-A785 VanDerWaalsContact CA-CB 3.47Å; A777-A785 HydrophobicContact CB-CB 3.82Å; A785-E788 PolarHBondContact O-N 2.87Å; A785-A789 VanDerWaalsContact O-CB 3.29Å; A785-A789 WeakPolarHBondContact O-CB 3.37Å; A785-A789 PolarHBondContact O-N 3.35Å
786	A	63.9	Low	68.2	Low	33 Å²	33	81.3 Å²	81.3	27%	0.273	42%	0.418	S	S	.	.	H	α-helix	trans	-72.2	-24.7	173.5	0	0	0	0	0	113.3	G782 E783 D784 R790	G782-A786 WeakPolarHBondContact O-CB 3.44Å; G782-A786 PolarHBondContact O-N 3.04Å; E783-A786 PolarHBondContact O-N 3.13Å; D784-A786 PolarHBondContact O-N 3.03Å; A786-R790 WeakPolarHBondContact O-CB 3.17Å; A786-R790 WeakPolarHBondContact O-CG 3.18Å; A786-R790 PolarHBondContact O-N 3.04Å; A786-R790 PolarHBondContact O-NE 3.1Å; A786-R790 PolarHBondContact O-NH2 3.48Å
787	K	68.3	Low	68.7	Low	111 Å²	111	82.1 Å²	82.1	48%	0.483	42%	0.419	S	S	.	.	H	α-helix	trans	-71.7	-44.1	170.1	-69.3	164	-158.4	157.3	0	110.5	E783 D784 R790 S791	E783-K787 WeakPolarHBondContact O-CG 3.25Å; E783-K787 PolarHBondContact O-N 3.27Å; D784-K787 WeakPolarHBondContact O-CB 3.38Å; D784-K787 PolarHBondContact O-N 3.16Å; D784-K787 WeakPolarHBondContact OD1-CD 3.34Å; D784-K787 WeakPolarHBondContact OD1-CE 3.29Å; D784-K787 IonicContact OD1-NZ 3.7Å; D784-K787 PolarHBondContact OD1-NZ 3.04Å; K787-R790 PolarHBondContact O-N 3.41Å; K787-S791 PolarHBondContact O-N 2.94Å
788	E	68.7	Low	69.5	Low	98 Å²	98	82.4 Å²	82.4	46%	0.458	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-47.2	178.1	-167.9	168	-157.9	0	0	111.4	A773 D784 A785 R790 S791 V792	A773-E788 HydrophobicContact CB-CG 4.22Å; D784-E788 PolarHBondContact O-N 2.89Å; A785-E788 PolarHBondContact O-N 2.87Å; E788-R790 VanDerWaalsContact C-N 3.35Å; E788-R790 PolarHBondContact O-N 3.19Å; E788-S791 WeakPolarHBondContact O-CA 3.48Å; E788-S791 WeakPolarHBondContact O-CB 3.49Å; E788-S791 PolarHBondContact O-N 3.07Å; E788-V792 PolarHBondContact O-N 3.09Å
789	A	67.9	Low	70.5	Confident	9 Å²	9	77.1 Å²	77.1	7%	0.074	40%	0.397	C	S	.	.	H	α-helix	trans	-53.6	-46.5	173.2	0	0	0	0	0	113.3	A785 S791 V792 Q793 L882	A785-A789 VanDerWaalsContact O-CB 3.29Å; A785-A789 WeakPolarHBondContact O-CB 3.37Å; A785-A789 PolarHBondContact O-N 3.35Å; A789-S791 VanDerWaalsContact C-N 3.3Å; A789-S791 PolarHBondContact O-N 3.2Å; A789-V792 PolarHBondContact O-N 3.2Å; A789-Q793 WeakPolarHBondContact O-CB 3.42Å; A789-Q793 WeakPolarHBondContact O-CG 3.41Å; A789-Q793 PolarHBondContact O-N 2.98Å; A789-L882 HydrophobicContact CB-CD1 3.91Å; A789-L882 HydrophobicContact CB-CD2 3.81Å; A789-L882 HydrophobicContact CB-CG 3.98Å
790	R	71.6	Confident	71.3	Confident	152 Å²	152	69.5 Å²	69.5	57%	0.574	37%	0.368	S	S	*	.	H	α-helix	trans	-66.9	-30.2	177	-78.9	177.7	-76.4	-149.7	-1	112.5	A786 K787 E788 K794	A786-R790 WeakPolarHBondContact O-CB 3.17Å; A786-R790 WeakPolarHBondContact O-CG 3.18Å; A786-R790 PolarHBondContact O-N 3.04Å; A786-R790 PolarHBondContact O-NE 3.1Å; A786-R790 PolarHBondContact O-NH2 3.48Å; K787-R790 PolarHBondContact O-N 3.41Å; E788-R790 VanDerWaalsContact C-N 3.35Å; E788-R790 PolarHBondContact O-N 3.19Å; R790-K794 WeakPolarHBondContact O-CB 3.35Å; R790-K794 PolarHBondContact O-N 3.38Å; R790-K794 VanDerWaalsContact O-N 3.1Å
791	S	78.8	Confident	72.4	Confident	64 Å²	64	71.4 Å²	71.4	45%	0.448	37%	0.371	S	S	.	.	H	α-helix	trans	-69.1	-46.2	174.6	-165.9	0	0	0	0	111.7	K787 E788 A789 K794 Q795	K787-S791 PolarHBondContact O-N 2.94Å; E788-S791 WeakPolarHBondContact O-CA 3.48Å; E788-S791 WeakPolarHBondContact O-CB 3.49Å; E788-S791 PolarHBondContact O-N 3.07Å; A789-S791 VanDerWaalsContact C-N 3.3Å; A789-S791 PolarHBondContact O-N 3.2Å; S791-K794 WeakPolarHBondContact O-CB 3.26Å; S791-K794 PolarHBondContact O-N 2.81Å; S791-Q795 WeakPolarHBondContact O-CG 3.42Å; S791-Q795 PolarHBondContact O-N 3.07Å
792	V	77.3	Confident	73.7	Confident	7 Å²	7	66.7 Å²	66.7	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-68.9	-38.2	178.5	-174.3	0	0	0	0	111.6	I766 A769 L770 E788 A789 K794 Q795 Y796	I766-V792 HydrophobicContact CG2-CG1 4.22Å; A769-V792 HydrophobicContact CB-CB 4.45Å; A769-V792 HydrophobicContact CB-CG1 3.71Å; A769-V792 HydrophobicContact CB-CG2 3.77Å; L770-V792 HydrophobicContact CD2-CB 4.02Å; L770-V792 HydrophobicContact CD2-CG1 3.56Å; L770-V792 HydrophobicContact CG-CG1 3.62Å; E788-V792 PolarHBondContact O-N 3.09Å; A789-V792 PolarHBondContact O-N 3.2Å; V792-K794 VanDerWaalsContact C-N 3.27Å; V792-K794 PolarHBondContact O-N 3Å; V792-Q795 WeakPolarHBondContact O-CB 3.42Å; V792-Q795 PolarHBondContact O-N 2.79Å; V792-Q795 VanDerWaalsContact O-N 3.16Å; V792-Y796 PolarHBondContact O-N 3.42Å
793	Q	74.9	Confident	74.7	Confident	32 Å²	32	64.7 Å²	64.7	15%	0.15	33%	0.33	C	S	.	.	H	α-helix	trans	-59.4	-37.3	170.6	-77.3	179.6	-26.9	0	0	112.3	A789 Y796 L797 T885	A789-Q793 WeakPolarHBondContact O-CB 3.42Å; A789-Q793 WeakPolarHBondContact O-CG 3.41Å; A789-Q793 PolarHBondContact O-N 2.98Å; Q793-Y796 PolarHBondContact O-N 2.97Å; Q793-L797 WeakPolarHBondContact O-CG 3.43Å; Q793-L797 PolarHBondContact O-N 3.02Å; Q793-L797 VanDerWaalsContact O-N 3.08Å; Q793-T885 HydrophobicContact CG-CG2 4.17Å; Q793-T885 PolarHBondContact NE2-OG1 2.71Å
794	K	80	Confident	75.8	Confident	160 Å²	160	58.2 Å²	58.2	70%	0.696	30%	0.301	S	S	*	.	H	α-helix	trans	-68.9	-36.9	174.9	-171.3	179.8	179.9	-177.1	0	112.4	R790 S791 V792 L797 A798	R790-K794 WeakPolarHBondContact O-CB 3.35Å; R790-K794 PolarHBondContact O-N 3.38Å; R790-K794 VanDerWaalsContact O-N 3.1Å; S791-K794 WeakPolarHBondContact O-CB 3.26Å; S791-K794 PolarHBondContact O-N 2.81Å; V792-K794 VanDerWaalsContact C-N 3.27Å; V792-K794 PolarHBondContact O-N 3Å; K794-L797 PolarHBondContact O-N 3.24Å; K794-A798 WeakPolarHBondContact O-CB 3.45Å; K794-A798 PolarHBondContact O-N 2.98Å
795	Q	80.5	Confident	76.6	Confident	102 Å²	102	56.6 Å²	56.6	48%	0.477	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-41.4	173.5	-70.6	172.8	-18.1	0	0	111.7	S791 V792 A798 F799	S791-Q795 WeakPolarHBondContact O-CG 3.42Å; S791-Q795 PolarHBondContact O-N 3.07Å; V792-Q795 WeakPolarHBondContact O-CB 3.42Å; V792-Q795 PolarHBondContact O-N 2.79Å; V792-Q795 VanDerWaalsContact O-N 3.16Å; Q795-A798 PolarHBondContact O-N 3.3Å; Q795-F799 PolarHBondContact O-N 2.92Å
796	Y	81.3	Confident	77.4	Confident	11 Å²	11	59.9 Å²	59.9	4%	0.043	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-41.8	175.2	178.8	-115.9	0	0	0	113	L763 I766 V792 Q793 F799 K800 V872 T885 V889 E892	L763-Y796 HydrophobicContact CD2-CD2 4.46Å; L763-Y796 HydrophobicContact CD2-CE2 4.02Å; I766-Y796 HydrophobicContact CD1-CD2 4.38Å; I766-Y796 HydrophobicContact CG2-CD2 4.29Å; V792-Y796 PolarHBondContact O-N 3.42Å; Q793-Y796 PolarHBondContact O-N 2.97Å; Y796-F799 WeakPolarHBondContact O-CB 3.42Å; Y796-F799 PolarHBondContact O-N 3.18Å; Y796-K800 HydrophobicContact CE2-CG 4.35Å; Y796-K800 WeakPolarHBondContact O-CG 3.46Å; Y796-K800 PolarHBondContact O-N 3.23Å; Y796-K800 WeakPolarHBondContact OH-CE 3.5Å; Y796-V872 HydrophobicContact CE1-CG1 4.27Å; Y796-T885 HydrophobicContact CD1-CG2 4.18Å; Y796-V889 HydrophobicContact CD2-CG2 3.7Å; Y796-V889 HydrophobicContact CE1-CG2 4.49Å; Y796-V889 HydrophobicContact CE2-CG2 3.53Å; Y796-V889 HydrophobicContact CG-CG2 4.26Å; Y796-E892 VanDerWaalsContact OH-CD 3.24Å; Y796-E892 PolarHBondContact OH-OE1 3.22Å; Y796-E892 PolarHBondContact OH-OE2 3.44Å; Y796-E892 VanDerWaalsContact OH-OE2 3.1Å
797	L	80.8	Confident	78.1	Confident	41 Å²	41	58.4 Å²	58.4	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-40.8	174	-71.1	171.9	0	0	0	112.3	Q793 K794 F799 K800 E801 L873 A877	Q793-L797 WeakPolarHBondContact O-CG 3.43Å; Q793-L797 PolarHBondContact O-N 3.02Å; Q793-L797 VanDerWaalsContact O-N 3.08Å; K794-L797 PolarHBondContact O-N 3.24Å; L797-F799 VanDerWaalsContact C-N 3.33Å; L797-F799 PolarHBondContact O-N 3.39Å; L797-K800 PolarHBondContact O-N 3.24Å; L797-E801 PolarHBondContact O-N 2.68Å; L797-L873 HydrophobicContact CD2-CD2 4.2Å; L797-L873 WeakPolarHBondContact O-CD2 3.43Å; L797-A877 HydrophobicContact CD1-CB 4.04Å
798	A	82	Confident	78.5	Confident	55 Å²	55	57.8 Å²	57.8	46%	0.455	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-36.9	175.4	0	0	0	0	0	112.5	K794 Q795 E801 A802	K794-A798 WeakPolarHBondContact O-CB 3.45Å; K794-A798 PolarHBondContact O-N 2.98Å; Q795-A798 PolarHBondContact O-N 3.3Å; A798-E801 PolarHBondContact O-N 2.72Å; A798-A802 PolarHBondContact O-N 2.99Å; A798-A802 VanDerWaalsContact O-N 3.11Å
799	F	85.1	Confident	78.9	Confident	28 Å²	28	60.2 Å²	60.2	12%	0.123	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-44.6	170.9	168.5	-101.9	0	0	0	111.7	E759 V762 L763 I766 Q795 Y796 L797 E801 A802 Q803	E759-F799 HydrophobicContact CB-CE2 4.36Å; E759-F799 HydrophobicContact CB-CZ 4.02Å; E759-F799 HydrophobicContact CG-CE2 4.11Å; E759-F799 HydrophobicContact CG-CZ 3.95Å; V762-F799 HydrophobicContact CB-CD2 4.09Å; V762-F799 HydrophobicContact CB-CE2 3.99Å; V762-F799 HydrophobicContact CG1-CD2 3.48Å; V762-F799 VanDerWaalsContact CG1-CD2 3.48Å; V762-F799 HydrophobicContact CG1-CE2 3.91Å; V762-F799 HydrophobicContact CG1-CG 4.11Å; L763-F799 HydrophobicContact CD1-CE1 4.31Å; L763-F799 HydrophobicContact CD1-CZ 4.37Å; L763-F799 HydrophobicContact CD2-CD1 4.1Å; L763-F799 HydrophobicContact CD2-CE1 3.59Å; L763-F799 HydrophobicContact CD2-CZ 4.25Å; L763-F799 HydrophobicContact CG-CE1 3.81Å; L763-F799 HydrophobicContact CG-CZ 3.94Å; I766-F799 HydrophobicContact CD1-CB 4.05Å; I766-F799 HydrophobicContact CD1-CG 4.26Å; Q795-F799 PolarHBondContact O-N 2.92Å; Y796-F799 WeakPolarHBondContact O-CB 3.42Å; Y796-F799 PolarHBondContact O-N 3.18Å; L797-F799 VanDerWaalsContact C-N 3.33Å; L797-F799 PolarHBondContact O-N 3.39Å; F799-E801 VanDerWaalsContact C-N 3.33Å; F799-E801 PolarHBondContact O-N 3.26Å; F799-A802 PolarHBondContact O-N 3.25Å; F799-Q803 WeakPolarHBondContact O-CB 3.44Å; F799-Q803 PolarHBondContact O-N 3.43Å
800	K	82.3	Confident	79	Confident	8 Å²	8	61.4 Å²	61.4	4%	0.035	30%	0.298	C	S	.	.	H	α-helix	trans	-63.7	-36.4	176.9	-73.5	-74.7	160.3	-166.5	0	113.1	Y796 L797 Q803 V804 A869 V872 L873 E892	Y796-K800 HydrophobicContact CE2-CG 4.35Å; Y796-K800 WeakPolarHBondContact O-CG 3.46Å; Y796-K800 PolarHBondContact O-N 3.23Å; Y796-K800 WeakPolarHBondContact OH-CE 3.5Å; L797-K800 PolarHBondContact O-N 3.24Å; K800-Q803 PolarHBondContact O-N 2.93Å; K800-V804 WeakPolarHBondContact O-CG2 3.4Å; K800-V804 PolarHBondContact O-N 3.02Å; K800-V804 VanDerWaalsContact O-N 3.12Å; K800-A869 HydrophobicContact CD-CB 4.3Å; K800-V872 HydrophobicContact CD-CG1 4.35Å; K800-V872 HydrophobicContact CG-CG1 4.17Å; K800-L873 HydrophobicContact CB-CD2 3.72Å; K800-L873 HydrophobicContact CB-CG 4.01Å; K800-E892 WeakPolarHBondContact CE-OE2 3.43Å; K800-E892 VanDerWaalsContact NZ-CD 3.31Å; K800-E892 IonicContact NZ-OE1 3.85Å; K800-E892 PolarHBondContact NZ-OE1 3.47Å; K800-E892 IonicContact NZ-OE2 3.49Å; K800-E892 PolarHBondContact NZ-OE2 3.3Å
801	E	81.8	Confident	79.1	Confident	124 Å²	124	56.7 Å²	56.7	58%	0.579	28%	0.283	S	S	*	.	H	α-helix	trans	-64	-47.5	175.6	-167.3	167.7	-156.5	0	0	111.1	L797 A798 F799 Q803 V804 D805 L873	L797-E801 PolarHBondContact O-N 2.68Å; A798-E801 PolarHBondContact O-N 2.72Å; F799-E801 VanDerWaalsContact C-N 3.33Å; F799-E801 PolarHBondContact O-N 3.26Å; E801-Q803 PolarHBondContact O-N 3.43Å; E801-V804 PolarHBondContact O-N 3.3Å; E801-D805 PolarHBondContact O-N 3.04Å; E801-L873 HydrophobicContact CB-CD1 4.32Å; E801-L873 HydrophobicContact CB-CD2 4.26Å
802	A	82.1	Confident	78.8	Confident	61 Å²	61	59.5 Å²	59.5	50%	0.504	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-40.2	173.8	0	0	0	0	0	113	A798 F799 V804 D805 E806	A798-A802 PolarHBondContact O-N 2.99Å; A798-A802 VanDerWaalsContact O-N 3.11Å; F799-A802 PolarHBondContact O-N 3.25Å; A802-V804 VanDerWaalsContact C-N 3.34Å; A802-V804 PolarHBondContact O-N 2.95Å; A802-D805 PolarHBondContact O-N 3.44Å; A802-E806 PolarHBondContact O-N 3.18Å; A802-E806 VanDerWaalsContact O-N 3.13Å
803	Q	80.2	Confident	78.3	Confident	12 Å²	12	63.6 Å²	63.6	6%	0.056	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-40.8	177.8	-165.6	-177.8	34	0	0	111.6	E759 F799 K800 E801 L807	E759-Q803 PolarHBondContact OE2-NE2 3.44Å; F799-Q803 WeakPolarHBondContact O-CB 3.44Å; F799-Q803 PolarHBondContact O-N 3.43Å; K800-Q803 PolarHBondContact O-N 2.93Å; E801-Q803 PolarHBondContact O-N 3.43Å; Q803-L807 HydrophobicContact CG-CD1 4.02Å; Q803-L807 WeakPolarHBondContact O-CB 3.47Å; Q803-L807 WeakPolarHBondContact O-CD1 3.23Å; Q803-L807 WeakPolarHBondContact O-CG 3.29Å; Q803-L807 PolarHBondContact O-N 3.22Å
804	V	82.4	Confident	77.9	Confident	6 Å²	6	63.1 Å²	63.1	4%	0.036	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-43.3	178.9	167.2	0	0	0	0	112.6	K800 E801 A802 R808 Q866 A869 Q870 L873	K800-V804 WeakPolarHBondContact O-CG2 3.4Å; K800-V804 PolarHBondContact O-N 3.02Å; K800-V804 VanDerWaalsContact O-N 3.12Å; E801-V804 PolarHBondContact O-N 3.3Å; A802-V804 VanDerWaalsContact C-N 3.34Å; A802-V804 PolarHBondContact O-N 2.95Å; V804-R808 PolarHBondContact O-N 2.74Å; V804-Q866 HydrophobicContact CG1-CG 4.32Å; V804-A869 HydrophobicContact CG2-CB 3.51Å; V804-Q870 HydrophobicContact CB-CG 4.36Å; V804-Q870 HydrophobicContact CG1-CG 3.59Å; V804-Q870 HydrophobicContact CG2-CG 3.73Å; V804-L873 HydrophobicContact CG2-CD1 3.92Å
805	D	78.8	Confident	77.3	Confident	71 Å²	71	57.3 Å²	57.3	38%	0.38	29%	0.29	S	S	.	.	H	α-helix	trans	-70.3	-36.7	-178.7	-84.3	-14.6	0	0	0	112.1	E801 A802 R808 R809	E801-D805 PolarHBondContact O-N 3.04Å; A802-D805 PolarHBondContact O-N 3.44Å; D805-R808 WeakPolarHBondContact O-CB 3.48Å; D805-R808 PolarHBondContact O-N 3.43Å; D805-R808 IonicContact OD1-CZ 2.8Å; D805-R808 IonicContact OD1-NH1 2.76Å; D805-R808 PolarHBondContact OD1-NH1 3.35Å; D805-R809 PolarHBondContact O-N 2.82Å
806	E	76	Confident	76.6	Confident	73 Å²	73	57.8 Å²	57.8	34%	0.341	29%	0.292	S	S	.	.	H	α-helix	trans	-71.1	-41.8	176.8	-163.8	58.9	-158.4	0	0	112	A802 R808 R809 L810	A802-E806 PolarHBondContact O-N 3.18Å; A802-E806 VanDerWaalsContact O-N 3.13Å; E806-R808 PolarHBondContact O-N 2.82Å; E806-R809 PolarHBondContact O-N 3.08Å; E806-R809 WeakPolarHBondContact OE2-CD 3.38Å; E806-R809 IonicContact OE2-CZ 3.35Å; E806-R809 IonicContact OE2-NE 2.84Å; E806-R809 IonicContact OE2-NH1 3.39Å; E806-R809 PolarHBondContact OE2-NH1 3.43Å; E806-L810 HydrophobicContact CG-CD1 4.46Å; E806-L810 PolarHBondContact O-N 2.94Å; E806-L810 VanDerWaalsContact O-N 3.13Å
807	L	78.7	Confident	75.4	Confident	1 Å²	1	59 Å²	59	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-60.3	-32.6	171.6	-72	169.5	0	0	0	112.4	Q803 Q811 L862 E865 Q866	Q803-L807 HydrophobicContact CG-CD1 4.02Å; Q803-L807 WeakPolarHBondContact O-CB 3.47Å; Q803-L807 WeakPolarHBondContact O-CD1 3.23Å; Q803-L807 WeakPolarHBondContact O-CG 3.29Å; Q803-L807 PolarHBondContact O-N 3.22Å; L807-Q811 WeakPolarHBondContact O-CB 3.49Å; L807-Q811 PolarHBondContact O-N 3.36Å; L807-Q811 VanDerWaalsContact O-N 3.07Å; L807-L862 HydrophobicContact CD2-CD2 3.86Å; L807-E865 HydrophobicContact CD1-CG 3.92Å; L807-Q866 HydrophobicContact CB-CB 4.16Å; L807-Q866 HydrophobicContact CB-CG 4.24Å; L807-Q866 HydrophobicContact CD1-CB 4.34Å
808	R	77.8	Confident	74.6	Confident	99 Å²	99	60 Å²	60	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-64.5	-47.1	174.5	-167.8	-178.5	-67.7	130.5	4.3	111.9	V804 D805 E806 L810 Q811 E812 Q866	V804-R808 PolarHBondContact O-N 2.74Å; D805-R808 WeakPolarHBondContact O-CB 3.48Å; D805-R808 PolarHBondContact O-N 3.43Å; D805-R808 IonicContact OD1-CZ 2.8Å; D805-R808 IonicContact OD1-NH1 2.76Å; D805-R808 PolarHBondContact OD1-NH1 3.35Å; E806-R808 PolarHBondContact O-N 2.82Å; R808-L810 VanDerWaalsContact C-N 3.34Å; R808-L810 PolarHBondContact O-N 3.13Å; R808-Q811 WeakPolarHBondContact O-CB 3.47Å; R808-Q811 PolarHBondContact O-N 2.92Å; R808-E812 WeakPolarHBondContact O-CG 3.13Å; R808-E812 PolarHBondContact O-N 3.4Å; R808-E812 VanDerWaalsContact O-N 3.14Å; R808-Q866 VanDerWaalsContact CB-NE2 3.3Å
809	R	76.9	Confident	73.5	Confident	148 Å²	148	65.3 Å²	65.3	56%	0.558	32%	0.316	S	S	*	.	H	α-helix	trans	-59.8	-44.8	178.4	-68.1	168.7	-179.9	163.4	-0.5	111.8	D805 E806 E812 V813	D805-R809 PolarHBondContact O-N 2.82Å; E806-R809 PolarHBondContact O-N 3.08Å; E806-R809 WeakPolarHBondContact OE2-CD 3.38Å; E806-R809 IonicContact OE2-CZ 3.35Å; E806-R809 IonicContact OE2-NE 2.84Å; E806-R809 IonicContact OE2-NH1 3.39Å; E806-R809 PolarHBondContact OE2-NH1 3.43Å; R809-E812 WeakPolarHBondContact O-CB 3.16Å; R809-E812 PolarHBondContact O-N 3.22Å; R809-V813 WeakPolarHBondContact O-CG2 3.46Å; R809-V813 PolarHBondContact O-N 3.32Å
810	L	70.3	Confident	72.1	Confident	34 Å²	34	68.9 Å²	68.9	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-36.1	-178.8	-67.2	169.7	0	0	0	112.2	E806 R808 E812 V813 L814	E806-L810 HydrophobicContact CG-CD1 4.46Å; E806-L810 PolarHBondContact O-N 2.94Å; E806-L810 VanDerWaalsContact O-N 3.13Å; R808-L810 VanDerWaalsContact C-N 3.34Å; R808-L810 PolarHBondContact O-N 3.13Å; L810-E812 VanDerWaalsContact C-N 3.32Å; L810-E812 PolarHBondContact O-N 3.48Å; L810-V813 PolarHBondContact O-N 3.44Å; L810-L814 WeakPolarHBondContact O-CB 3.49Å; L810-L814 PolarHBondContact O-N 3.49Å
811	Q	72.5	Confident	70.9	Confident	54 Å²	54	75 Å²	75	25%	0.252	36%	0.356	S	S	.	.	H	α-helix	trans	-59.3	-42.1	170.8	-173.1	-168.4	-9.5	0	0	111.9	L807 R808 T815 L859 V863	L807-Q811 WeakPolarHBondContact O-CB 3.49Å; L807-Q811 PolarHBondContact O-N 3.36Å; L807-Q811 VanDerWaalsContact O-N 3.07Å; R808-Q811 WeakPolarHBondContact O-CB 3.47Å; R808-Q811 PolarHBondContact O-N 2.92Å; Q811-T815 VanDerWaalsContact O-CB 3.3Å; Q811-T815 WeakPolarHBondContact O-CB 3.41Å; Q811-T815 PolarHBondContact O-N 2.84Å; Q811-T815 PolarHBondContact O-OG1 2.75Å; Q811-L859 HydrophobicContact CG-CD1 4.05Å; Q811-V863 HydrophobicContact CG-CG2 4.24Å
812	E	72.4	Confident	69.5	Low	122 Å²	122	77.1 Å²	77.1	57%	0.57	37%	0.366	S	S	*	.	H	α-helix	trans	-65.4	-46.1	178.4	-71	170.3	-172.6	0	0	111.9	R808 R809 L810 T815 H816	R808-E812 WeakPolarHBondContact O-CG 3.13Å; R808-E812 PolarHBondContact O-N 3.4Å; R808-E812 VanDerWaalsContact O-N 3.14Å; R809-E812 WeakPolarHBondContact O-CB 3.16Å; R809-E812 PolarHBondContact O-N 3.22Å; L810-E812 VanDerWaalsContact C-N 3.32Å; L810-E812 PolarHBondContact O-N 3.48Å; E812-T815 PolarHBondContact O-N 2.82Å; E812-H816 PolarHBondContact O-N 2.99Å
813	V	68.5	Low	68	Low	93 Å²	93	82.1 Å²	82.1	56%	0.564	38%	0.378	S	S	*	.	H	α-helix	trans	-60.4	-48.8	176.6	173.3	0	0	0	0	111.5	R809 L810 T815 H816 S817	R809-V813 WeakPolarHBondContact O-CG2 3.46Å; R809-V813 PolarHBondContact O-N 3.32Å; L810-V813 PolarHBondContact O-N 3.44Å; V813-T815 VanDerWaalsContact C-N 3.3Å; V813-T815 PolarHBondContact O-N 2.72Å; V813-H816 WeakPolarHBondContact O-CB 3.46Å; V813-H816 PolarHBondContact O-N 3.04Å; V813-H816 VanDerWaalsContact O-N 3.14Å; V813-S817 PolarHBondContact O-N 2.93Å; V813-S817 VanDerWaalsContact O-N 3.1Å
814	L	66.1	Low	66.5	Low	23 Å²	23	91 Å²	91	12%	0.12	41%	0.412	C	S	.	.	H	α-helix	trans	-64.4	-36.7	-179.6	-160.5	71.8	0	0	0	111.7	L810 H816 L818 V858 L859 L862	L810-L814 WeakPolarHBondContact O-CB 3.49Å; L810-L814 PolarHBondContact O-N 3.49Å; L814-H816 VanDerWaalsContact C-N 3.34Å; L814-L818 WeakPolarHBondContact O-CG 3.42Å; L814-L818 PolarHBondContact O-N 3.37Å; L814-L818 VanDerWaalsContact O-N 3.13Å; L814-V858 HydrophobicContact CD2-CG1 4.17Å; L814-L859 HydrophobicContact CB-CD1 4.4Å; L814-L859 HydrophobicContact CD2-CB 4.27Å; L814-L859 HydrophobicContact CD2-CD1 4.02Å; L814-L862 HydrophobicContact CD2-CD1 3.92Å
815	T	66.4	Low	64.4	Low	38 Å²	38	94.6 Å²	94.6	23%	0.233	44%	0.442	C	S	.	.	H	α-helix	trans	-67.2	-33.7	175.6	-56.6	0	0	0	0	112.1	Q811 E812 V813 R819	Q811-T815 VanDerWaalsContact O-CB 3.3Å; Q811-T815 WeakPolarHBondContact O-CB 3.41Å; Q811-T815 PolarHBondContact O-N 2.84Å; Q811-T815 PolarHBondContact O-OG1 2.75Å; E812-T815 PolarHBondContact O-N 2.82Å; V813-T815 VanDerWaalsContact C-N 3.3Å; V813-T815 PolarHBondContact O-N 2.72Å; T815-R819 WeakPolarHBondContact O-CG 3.45Å; T815-R819 PolarHBondContact O-N 3.15Å
816	H	65.4	Low	62.6	Low	112 Å²	112	97.1 Å²	97.1	52%	0.519	46%	0.462	S	S	.	.	H	α-helix	trans	-66.3	-52.6	174.4	-166.2	-82	0	0	0	111.4	E812 V813 L814 L818 R819 E820	E812-H816 PolarHBondContact O-N 2.99Å; V813-H816 WeakPolarHBondContact O-CB 3.46Å; V813-H816 PolarHBondContact O-N 3.04Å; V813-H816 VanDerWaalsContact O-N 3.14Å; L814-H816 VanDerWaalsContact C-N 3.34Å; H816-L818 VanDerWaalsContact C-N 3.29Å; H816-L818 PolarHBondContact O-N 3.11Å; H816-R819 PolarHBondContact O-N 3.44Å; H816-E820 VanDerWaalsContact CE1-CD 3.49Å; H816-E820 IonicContact CE1-OE1 2.7Å; H816-E820 PolarHBondContact CE1-OE1 3.08Å; H816-E820 IonicContact CE1-OE2 3.8Å; H816-E820 IonicContact ND1-OE1 3.34Å; H816-E820 IonicContact ND1-OE2 3.21Å; H816-E820 PolarHBondContact ND1-OE2 3.38Å; H816-E820 PolarHBondContact O-N 2.79Å
817	S	57.8	Low	60.7	Low	37 Å²	37	102.8 Å²	102.8	26%	0.259	49%	0.489	S	S	.	.	H	α-helix	trans	-60.9	-34.9	-179.3	-61.9	0	0	0	0	113.3	V813 R819 R821	V813-S817 PolarHBondContact O-N 2.93Å; V813-S817 VanDerWaalsContact O-N 3.1Å; S817-R819 VanDerWaalsContact C-N 3.34Å; S817-R819 PolarHBondContact O-N 3.36Å; S817-R821 WeakPolarHBondContact O-CB 3.45Å; S817-R821 PolarHBondContact O-N 3.44Å
818	L	62.1	Low	59.1	Low	60 Å²	60	110.9 Å²	110.9	31%	0.314	53%	0.532	S	S	.	.	H	α-helix	trans	-67	-32.4	175.4	-73.7	169.8	0	0	0	112.9	L814 H816 Q822 L859	L814-L818 WeakPolarHBondContact O-CG 3.42Å; L814-L818 PolarHBondContact O-N 3.37Å; L814-L818 VanDerWaalsContact O-N 3.13Å; H816-L818 VanDerWaalsContact C-N 3.29Å; H816-L818 PolarHBondContact O-N 3.11Å; L818-Q822 PolarHBondContact O-N 2.92Å; L818-L859 HydrophobicContact CD1-CD2 4.25Å
819	R	60.2	Low	56.9	Low	168 Å²	168	109.7 Å²	109.7	63%	0.634	55%	0.551	S	S	*	*	H	α-helix	trans	-73.9	-42.8	178.1	-74.9	175.4	177.6	169.4	1.9	112.6	T815 H816 S817 R821 Q822	T815-R819 WeakPolarHBondContact O-CG 3.45Å; T815-R819 PolarHBondContact O-N 3.15Å; H816-R819 PolarHBondContact O-N 3.44Å; S817-R819 VanDerWaalsContact C-N 3.34Å; S817-R819 PolarHBondContact O-N 3.36Å; R819-R821 PolarHBondContact O-N 3.32Å; R819-Q822 PolarHBondContact O-N 3.05Å
820	E	56.4	Low	55.2	Low	102 Å²	102	106.6 Å²	106.6	48%	0.477	57%	0.565	S	S	.	*	H	α-helix	trans	-60.4	-34.9	175.9	-68	-178.5	131.3	0	0	111.6	H816 Q823	H816-E820 VanDerWaalsContact CE1-CD 3.49Å; H816-E820 IonicContact CE1-OE1 2.7Å; H816-E820 PolarHBondContact CE1-OE1 3.08Å; H816-E820 IonicContact CE1-OE2 3.8Å; H816-E820 IonicContact ND1-OE1 3.34Å; H816-E820 IonicContact ND1-OE2 3.21Å; H816-E820 PolarHBondContact ND1-OE2 3.38Å; H816-E820 PolarHBondContact O-N 2.79Å; E820-Q823 PolarHBondContact O-N 3.32Å
821	R	55.4	Low	53.6	Low	138 Å²	138	108.6 Å²	108.6	52%	0.521	59%	0.594	S	S	.	*	H	α-helix	trans	-71.7	-32.8	-178	-150.1	169	-179.6	-167.1	-5.8	113.6	A743 S817 R819 Q823	A743-R821 VanDerWaalsContact CB-CZ 3.44Å; S817-R821 WeakPolarHBondContact O-CB 3.45Å; S817-R821 PolarHBondContact O-N 3.44Å; R819-R821 PolarHBondContact O-N 3.32Å; R821-Q823 PolarHBondContact O-N 3.25Å
822	Q	53.4	Low	52.1	Low	168 Å²	168	115.3 Å²	115.3	79%	0.785	63%	0.625	S	S	*	*	H	α-helix	trans	-68.9	-16.5	175.1	-74.5	-177.7	-14.1	0	0	113.5	L818 R819	L818-Q822 PolarHBondContact O-N 2.92Å; R819-Q822 PolarHBondContact O-N 3.05Å
823	Q	50.8	Low	50.5	Low	165 Å²	165	118.4 Å²	118.4	77%	0.771	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-5.3	-177.9	-63.3	179.6	5.2	0	0	114	E820 R821	E820-Q823 PolarHBondContact O-N 3.32Å; R821-Q823 PolarHBondContact O-N 3.25Å
824	R	47.8	Very low	49	Very low	199 Å²	199	119.5 Å²	119.5	75%	0.751	64%	0.638	S	S	*	*			trans	-107.8	19.6	-174.8	-69	-168.8	-179.6	-179.4	3.9	115.5	P826	R824-P826 WeakPolarHBondContact O-CD 3.27Å
825	A	38.4	Very low	47.9	Very low	82 Å²	82	124.8 Å²	124.8	68%	0.678	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-72.4	124.7	178.3	0	0	0	0	0	112.2
826	P	41.2	Very low	46.8	Very low	123 Å²	123	128.6 Å²	128.6	80%	0.799	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-72.4	149.6	173.4	-12.3	27.7	0	0	0	111.9	R824	R824-P826 WeakPolarHBondContact O-CD 3.27Å
827	Q	36.1	Very low	45.7	Very low	193 Å²	193	125.6 Å²	125.6	90%	0.902	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-86.8	135	171.7	-67.8	-178.4	-0.7	0	0	110.8
828	D	44.2	Very low	45.4	Very low	171 Å²	171	131.9 Å²	131.9	91%	0.914	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-77.1	131.7	-173.6	-138	-8	0	0	0	111.9
829	G	33.2	Very low	44.6	Very low	74 Å²	74	135.3 Å²	135.3	76%	0.763	71%	0.71	S	S	*	*			trans	-123.5	99.7	179.8	0	0	0	0	0	110.6
830	G	40.7	Very low	43.7	Very low	83 Å²	83	130.6 Å²	130.6	86%	0.856	70%	0.7	S	S	*	*			trans	-81.4	151.5	-166.9	0	0	0	0	0	116.3
831	G	36.2	Very low	43.4	Very low	76 Å²	76	131 Å²	131	78%	0.784	70%	0.702	S	S	*	*			trans	-167.1	133	167.7	0	0	0	0	0	109.6
832	Q	41.2	Very low	43.1	Very low	195 Å²	195	130.1 Å²	130.1	91%	0.911	70%	0.703	S	S	*	*			trans	-73.7	139.2	171.8	-62.9	157.9	-24.5	0	0	107.1
833	E	39.2	Very low	42.9	Very low	186 Å²	186	130.4 Å²	130.4	87%	0.869	70%	0.697	S	S	*	*			cis	-150.8	151.8	46	-63.4	171.4	116.7	0	0	111
834	E	37.3	Very low	42.8	Very low	116 Å²	116	125.2 Å²	125.2	54%	0.542	68%	0.675	S	S	.	*			trans	169.6	123.2	131.2	-161.6	178.7	-147.7	0	0	110	L836 L837 R838	E834-L836 HydrophobicContact CG-CB 4.35Å; E834-L836 PolarHBondContact O-N 3.2Å; E834-L837 HydrophobicContact CB-CB 4.17Å; E834-L837 HydrophobicContact CB-CD1 3.94Å; E834-L837 HydrophobicContact CB-CG 4.25Å; E834-L837 PolarHBondContact O-N 3.14Å; E834-L837 WeakPolarHBondContact OE2-CD1 3.39Å; E834-L837 VanDerWaalsContact OE2-CG 3.3Å; E834-L837 WeakPolarHBondContact OE2-CG 3.41Å; E834-R838 PolarHBondContact O-N 3.32Å
835	T	42.9	Very low	43	Very low	135 Å²	135	121.1 Å²	121.1	83%	0.828	66%	0.664	S	S	*	*	H	α-helix	trans	-69	-19.4	-175.7	-30.8	0	0	0	0	113.1
836	L	43.8	Very low	43.5	Very low	117 Å²	117	123.4 Å²	123.4	61%	0.613	66%	0.659	S	S	*	*	H	α-helix	trans	-85.2	-42.5	179.7	-150.3	73.8	0	0	0	112.1	E834 R838 Q839 T840	E834-L836 HydrophobicContact CG-CB 4.35Å; E834-L836 PolarHBondContact O-N 3.2Å; L836-R838 VanDerWaalsContact C-N 3.26Å; L836-R838 PolarHBondContact O-N 2.97Å; L836-Q839 PolarHBondContact O-N 3.48Å; L836-T840 PolarHBondContact O-N 2.85Å
837	L	41.9	Very low	43.8	Very low	50 Å²	50	121.3 Å²	121.3	26%	0.262	64%	0.637	S	S	.	*	H	α-helix	trans	-55.7	-39.8	172	-85	168.8	0	0	0	112.4	L729 E834 Q839 T840 Q841	L729-L837 HydrophobicContact CD1-CD2 3.69Å; L729-L837 HydrophobicContact CD2-CD2 3.81Å; L729-L837 HydrophobicContact CG-CD2 4.38Å; E834-L837 HydrophobicContact CB-CB 4.17Å; E834-L837 HydrophobicContact CB-CD1 3.94Å; E834-L837 HydrophobicContact CB-CG 4.25Å; E834-L837 PolarHBondContact O-N 3.14Å; E834-L837 WeakPolarHBondContact OE2-CD1 3.39Å; E834-L837 VanDerWaalsContact OE2-CG 3.3Å; E834-L837 WeakPolarHBondContact OE2-CG 3.41Å; L837-Q839 PolarHBondContact O-N 3.05Å; L837-T840 PolarHBondContact O-N 3.45Å; L837-T840 PolarHBondContact O-OG1 3.13Å; L837-Q841 WeakPolarHBondContact O-CB 3.49Å; L837-Q841 WeakPolarHBondContact O-CG 3.5Å; L837-Q841 PolarHBondContact O-N 3.01Å
838	R	50.4	Low	44.5	Very low	169 Å²	169	116 Å²	116	64%	0.638	61%	0.612	S	S	*	*	H	α-helix	trans	-60	-34.9	176.8	-118.7	-177.8	179.1	-165.4	-0.8	112.8	E834 L836 H842	E834-R838 PolarHBondContact O-N 3.32Å; L836-R838 VanDerWaalsContact C-N 3.26Å; L836-R838 PolarHBondContact O-N 2.97Å; R838-H842 VanDerWaalsContact O-CB 3.24Å; R838-H842 WeakPolarHBondContact O-CB 3.3Å; R838-H842 PolarHBondContact O-CD2 3.37Å; R838-H842 PolarHBondContact O-N 2.86Å
839	Q	46.3	Very low	44.9	Very low	131 Å²	131	116 Å²	116	61%	0.612	60%	0.599	S	S	*	*	H	α-helix	trans	-76.5	-34	-177.6	-158.4	-180	34.3	0	0	112.4	L836 L837 R843	L836-Q839 PolarHBondContact O-N 3.48Å; L837-Q839 PolarHBondContact O-N 3.05Å; Q839-R843 WeakPolarHBondContact O-CG 3.45Å; Q839-R843 PolarHBondContact O-N 3.43Å
840	T	42	Very low	45.7	Very low	70 Å²	70	117.3 Å²	117.3	43%	0.429	59%	0.585	S	S	.	*	H	α-helix	trans	-74.3	-44.4	173.1	50.2	0	0	0	0	111.3	L836 L837 H842 R843 L844	L836-T840 PolarHBondContact O-N 2.85Å; L837-T840 PolarHBondContact O-N 3.45Å; L837-T840 PolarHBondContact O-OG1 3.13Å; T840-H842 PolarHBondContact O-N 3.48Å; T840-R843 PolarHBondContact O-N 3.04Å; T840-L844 PolarHBondContact O-N 3.22Å
841	Q	48.8	Very low	46.2	Very low	109 Å²	109	115.9 Å²	115.9	51%	0.509	56%	0.558	S	S	.	*	H	α-helix	trans	-58.8	-46.7	173.6	-74.4	176.9	-29.6	0	0	112.2	L837 R843 L844 H845	L837-Q841 WeakPolarHBondContact O-CB 3.49Å; L837-Q841 WeakPolarHBondContact O-CG 3.5Å; L837-Q841 PolarHBondContact O-N 3.01Å; Q841-R843 VanDerWaalsContact C-N 3.3Å; Q841-R843 PolarHBondContact O-N 3.25Å; Q841-L844 PolarHBondContact O-N 3.15Å; Q841-L844 VanDerWaalsContact O-N 3.13Å; Q841-H845 WeakPolarHBondContact O-CB 3.31Å; Q841-H845 PolarHBondContact O-N 3.48Å
842	H	49.3	Very low	47	Very low	120 Å²	120	115 Å²	115	56%	0.556	54%	0.543	S	S	*	.	H	α-helix	trans	-61.1	-37.1	176.8	-74.9	-165.8	0	0	0	112.5	R838 T840 F846	R838-H842 VanDerWaalsContact O-CB 3.24Å; R838-H842 WeakPolarHBondContact O-CB 3.3Å; R838-H842 PolarHBondContact O-CD2 3.37Å; R838-H842 PolarHBondContact O-N 2.86Å; T840-H842 PolarHBondContact O-N 3.48Å; H842-F846 VanDerWaalsContact O-CB 3.24Å; H842-F846 WeakPolarHBondContact O-CB 3.17Å; H842-F846 PolarHBondContact O-N 2.97Å
843	R	48.8	Very low	47.7	Very low	174 Å²	174	111.6 Å²	111.6	66%	0.657	53%	0.531	S	S	*	.	H	α-helix	trans	-67.2	-35.6	174.4	-83.6	173.9	57.2	-165.9	-5.2	112.8	Q839 T840 Q841 K847	Q839-R843 WeakPolarHBondContact O-CG 3.45Å; Q839-R843 PolarHBondContact O-N 3.43Å; T840-R843 PolarHBondContact O-N 3.04Å; Q841-R843 VanDerWaalsContact C-N 3.3Å; Q841-R843 PolarHBondContact O-N 3.25Å; R843-K847 PolarHBondContact O-N 2.7Å
844	L	48.9	Very low	48.3	Very low	56 Å²	56	107.9 Å²	107.9	29%	0.293	52%	0.516	S	S	.	.	H	α-helix	trans	-72.5	-49.1	179.3	-141.1	162.7	0	0	0	110.1	L733 T840 Q841 F846 K847 E848	L733-L844 HydrophobicContact CD2-CD1 3.53Å; T840-L844 PolarHBondContact O-N 3.22Å; Q841-L844 PolarHBondContact O-N 3.15Å; Q841-L844 VanDerWaalsContact O-N 3.13Å; L844-F846 VanDerWaalsContact C-N 3.26Å; L844-F846 PolarHBondContact O-N 2.95Å; L844-K847 WeakPolarHBondContact O-CA 3.45Å; L844-K847 WeakPolarHBondContact O-CB 3.41Å; L844-K847 PolarHBondContact O-N 3.29Å; L844-E848 HydrophobicContact CD2-CG 4.18Å; L844-E848 PolarHBondContact O-N 2.92Å
845	H	51.6	Low	49	Very low	114 Å²	114	103 Å²	103	53%	0.528	50%	0.495	S	S	.	.	H	α-helix	trans	-64.7	-28.4	178.8	-152.8	15.1	0	0	0	113.1	Q841 E848 R849	Q841-H845 WeakPolarHBondContact O-CB 3.31Å; Q841-H845 PolarHBondContact O-N 3.48Å; H845-E848 WeakPolarHBondContact CA-OE2 3.43Å; H845-E848 IonicContact CE1-OE2 3.38Å; H845-E848 IonicContact CG-OE2 3.62Å; H845-E848 IonicContact ND1-OE2 3.17Å; H845-E848 PolarHBondContact ND1-OE2 2.9Å; H845-R849 PolarHBondContact O-N 2.82Å; H845-R849 VanDerWaalsContact O-N 3.14Å
846	F	49.8	Very low	49.7	Very low	129 Å²	129	99.8 Å²	99.8	57%	0.566	48%	0.482	S	S	*	.	H	α-helix	trans	-66	-44.2	168.3	-178.8	-94.8	0	0	0	112.3	H842 L844 R849 Q850	H842-F846 VanDerWaalsContact O-CB 3.24Å; H842-F846 WeakPolarHBondContact O-CB 3.17Å; H842-F846 PolarHBondContact O-N 2.97Å; L844-F846 VanDerWaalsContact C-N 3.26Å; L844-F846 PolarHBondContact O-N 2.95Å; F846-R849 PolarHBondContact O-N 3.1Å; F846-Q850 VanDerWaalsContact CE1-CD 3.48Å; F846-Q850 HydrophobicContact CE1-CG 4.24Å; F846-Q850 WeakPolarHBondContact O-CG 3.49Å; F846-Q850 PolarHBondContact O-N 3.5Å
847	K	46.8	Very low	50.3	Low	79 Å²	79	96.3 Å²	96.3	34%	0.343	48%	0.475	S	S	.	.	H	α-helix	trans	-67.5	-37	176.2	-76.3	-172.5	170.5	-166.9	0	112.6	R843 L844 Q850 L851 L913	R843-K847 PolarHBondContact O-N 2.7Å; L844-K847 WeakPolarHBondContact O-CA 3.45Å; L844-K847 WeakPolarHBondContact O-CB 3.41Å; L844-K847 PolarHBondContact O-N 3.29Å; K847-Q850 PolarHBondContact O-N 3.26Å; K847-L851 PolarHBondContact O-N 3.12Å; K847-L913 HydrophobicContact CD-CD1 4.3Å; K847-L913 VanDerWaalsContact NZ-CD1 3.34Å
848	E	50.4	Low	51.4	Low	81 Å²	81	96.7 Å²	96.7	38%	0.379	48%	0.479	S	S	.	.	H	α-helix	trans	-60.3	-45.6	172.6	-70.8	171.6	166.9	0	0	111.8	L844 H845 Q850 L851 A852	L844-E848 HydrophobicContact CD2-CG 4.18Å; L844-E848 PolarHBondContact O-N 2.92Å; H845-E848 WeakPolarHBondContact CA-OE2 3.43Å; H845-E848 IonicContact CE1-OE2 3.38Å; H845-E848 IonicContact CG-OE2 3.62Å; H845-E848 IonicContact ND1-OE2 3.17Å; H845-E848 PolarHBondContact ND1-OE2 2.9Å; E848-Q850 VanDerWaalsContact C-N 3.31Å; E848-Q850 PolarHBondContact O-N 3.23Å; E848-L851 PolarHBondContact O-N 3.13Å; E848-A852 WeakPolarHBondContact O-CB 3.4Å; E848-A852 PolarHBondContact O-N 2.97Å
849	R	54.1	Low	52	Low	173 Å²	173	90.8 Å²	90.8	65%	0.653	46%	0.46	S	S	*	.	H	α-helix	trans	-62.1	-36.6	173.9	-83.2	-176.8	170.1	173.1	-1	112.7	H845 F846 N853	H845-R849 PolarHBondContact O-N 2.82Å; H845-R849 VanDerWaalsContact O-N 3.14Å; F846-R849 PolarHBondContact O-N 3.1Å; R849-N853 VanDerWaalsContact O-CB 3.31Å; R849-N853 WeakPolarHBondContact O-CB 3.43Å; R849-N853 PolarHBondContact O-N 2.98Å; R849-N853 PolarHBondContact O-ND2 3.41Å
850	Q	50.2	Low	53	Low	100 Å²	100	87.8 Å²	87.8	47%	0.467	45%	0.452	S	S	.	.	H	α-helix	trans	-64.3	-45.9	173.9	-73.2	-173.9	-40.1	0	0	111.7	F846 K847 E848 N853 M854	F846-Q850 VanDerWaalsContact CE1-CD 3.48Å; F846-Q850 HydrophobicContact CE1-CG 4.24Å; F846-Q850 WeakPolarHBondContact O-CG 3.49Å; F846-Q850 PolarHBondContact O-N 3.5Å; K847-Q850 PolarHBondContact O-N 3.26Å; E848-Q850 VanDerWaalsContact C-N 3.31Å; E848-Q850 PolarHBondContact O-N 3.23Å; Q850-N853 PolarHBondContact O-N 3.43Å; Q850-M854 WeakPolarHBondContact O-CG 3.47Å; Q850-M854 PolarHBondContact O-N 3.17Å
851	L	50.2	Low	54.1	Low	53 Å²	53	86.6 Å²	86.6	28%	0.277	45%	0.449	S	S	.	.	H	α-helix	trans	-64.2	-41	176.7	-77.2	164.3	0	0	0	112.9	K847 E848 M854 A855 L910	K847-L851 PolarHBondContact O-N 3.12Å; E848-L851 PolarHBondContact O-N 3.13Å; L851-M854 PolarHBondContact O-N 3.28Å; L851-A855 PolarHBondContact O-N 3.15Å; L851-L910 HydrophobicContact CD2-CD2 4.2Å
852	A	53.7	Low	55	Low	58 Å²	58	82.1 Å²	82.1	48%	0.479	43%	0.428	S	S	.	.	H	α-helix	trans	-64.7	-41.8	176.1	0	0	0	0	0	112.2	E848 A855 A856	E848-A852 WeakPolarHBondContact O-CB 3.4Å; E848-A852 PolarHBondContact O-N 2.97Å; A852-A855 PolarHBondContact O-N 3.35Å; A852-A856 WeakPolarHBondContact O-CB 3.44Å; A852-A856 PolarHBondContact O-N 2.76Å
853	N	54.6	Low	56.1	Low	123 Å²	123	78.1 Å²	78.1	66%	0.658	41%	0.412	S	S	*	.	H	α-helix	trans	-66.8	-35.8	175.8	-74.5	-8.4	0	0	0	112.4	R849 Q850	R849-N853 VanDerWaalsContact O-CB 3.31Å; R849-N853 WeakPolarHBondContact O-CB 3.43Å; R849-N853 PolarHBondContact O-N 2.98Å; R849-N853 PolarHBondContact O-ND2 3.41Å; Q850-N853 PolarHBondContact O-N 3.43Å
854	M	52.5	Low	57.3	Low	109 Å²	109	74.9 Å²	74.9	54%	0.537	40%	0.404	S	S	.	.	H	α-helix	trans	-65.3	-45.5	173.4	-73.7	174.3	66.2	0	0	111.5	Q850 L851 A856 G857	Q850-M854 WeakPolarHBondContact O-CG 3.47Å; Q850-M854 PolarHBondContact O-N 3.17Å; L851-M854 PolarHBondContact O-N 3.28Å; M854-A856 VanDerWaalsContact C-N 3.32Å; M854-A856 PolarHBondContact O-N 3.32Å; M854-G857 PolarHBondContact O-N 3.02Å
855	A	53.1	Low	58.4	Low	13 Å²	13	73.5 Å²	73.5	11%	0.107	40%	0.396	C	S	.	.	H	α-helix	trans	-62.8	-36.5	177.8	0	0	0	0	0	113	L747 L851 A852 G857 V858	L747-A855 HydrophobicContact CD1-CB 3.88Å; L747-A855 HydrophobicContact CD2-CB 3.79Å; L851-A855 PolarHBondContact O-N 3.15Å; A852-A855 PolarHBondContact O-N 3.35Å; A855-G857 PolarHBondContact O-N 3.5Å; A855-V858 PolarHBondContact O-N 3.06Å
856	A	55.8	Low	59.6	Low	67 Å²	67	69 Å²	69	55%	0.554	38%	0.376	S	S	*	.	H	α-helix	trans	-63.8	-22.3	179.2	0	0	0	0	0	114	A852 M854 P860	A852-A856 WeakPolarHBondContact O-CB 3.44Å; A852-A856 PolarHBondContact O-N 2.76Å; M854-A856 VanDerWaalsContact C-N 3.32Å; M854-A856 PolarHBondContact O-N 3.32Å; A856-P860 VanDerWaalsContact O-CD 3.24Å; A856-P860 WeakPolarHBondContact O-CD 3.43Å
857	G	58.2	Low	60.9	Low	45 Å²	45	68 Å²	68	46%	0.464	37%	0.373	S	S	.	.	H	α-helix	trans	-83	-19.2	178	0	0	0	0	0	115.2	M854 A855	M854-G857 PolarHBondContact O-N 3.02Å; A855-G857 PolarHBondContact O-N 3.5Å
858	V	63.3	Low	62.3	Low	57 Å²	57	70.2 Å²	70.2	35%	0.345	38%	0.379	S	S	.	.	H	α-helix	trans	-77.1	-42.8	-172.7	-178.3	0	0	0	0	112.1	L814 A855 A861 L862	L814-V858 HydrophobicContact CD2-CG1 4.17Å; A855-V858 PolarHBondContact O-N 3.06Å; V858-A861 PolarHBondContact O-N 3.34Å; V858-L862 HydrophobicContact CG1-CD1 4.06Å; V858-L862 HydrophobicContact CG1-CG 4.49Å; V858-L862 PolarHBondContact O-N 3.3Å; V858-L862 VanDerWaalsContact O-N 3.08Å
859	L	64.2	Low	63.4	Low	45 Å²	45	66.5 Å²	66.5	24%	0.236	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-43.5	-177.4	-172.3	72.9	0	0	0	113.1	Q811 L814 L818 A861 V863	Q811-L859 HydrophobicContact CG-CD1 4.05Å; L814-L859 HydrophobicContact CB-CD1 4.4Å; L814-L859 HydrophobicContact CD2-CB 4.27Å; L814-L859 HydrophobicContact CD2-CD1 4.02Å; L818-L859 HydrophobicContact CD1-CD2 4.25Å; L859-A861 PolarHBondContact O-N 3.08Å; L859-V863 WeakPolarHBondContact O-CG2 3.47Å; L859-V863 PolarHBondContact O-N 3.32Å
860	P	66.3	Low	64.6	Low	69 Å²	69	60.2 Å²	60.2	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-61.4	-40.8	172.9	-23.9	35.1	0	0	0	113.1	A856 L862 V863 E864	A856-P860 VanDerWaalsContact O-CD 3.24Å; A856-P860 WeakPolarHBondContact O-CD 3.43Å; P860-L862 PolarHBondContact O-N 2.91Å; P860-V863 PolarHBondContact O-N 3.01Å; P860-E864 WeakPolarHBondContact O-CG 3.46Å; P860-E864 PolarHBondContact O-N 2.98Å
861	A	65.9	Low	65.8	Low	45 Å²	45	59 Å²	59	37%	0.372	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-42.2	-179.7	0	0	0	0	0	112.5	V858 L859 V863 E864 E865	V858-A861 PolarHBondContact O-N 3.34Å; L859-A861 PolarHBondContact O-N 3.08Å; A861-V863 VanDerWaalsContact C-N 3.33Å; A861-V863 PolarHBondContact O-N 3.25Å; A861-E864 PolarHBondContact O-N 3.38Å; A861-E865 WeakPolarHBondContact O-CB 3.27Å; A861-E865 PolarHBondContact O-N 3.26Å
862	L	68.1	Low	67	Low	15 Å²	15	58.2 Å²	58.2	8%	0.079	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-40	173.6	-75.4	168	0	0	0	112.3	L807 L814 V858 P860 E865 Q866	L807-L862 HydrophobicContact CD2-CD2 3.86Å; L814-L862 HydrophobicContact CD2-CD1 3.92Å; V858-L862 HydrophobicContact CG1-CD1 4.06Å; V858-L862 HydrophobicContact CG1-CG 4.49Å; V858-L862 PolarHBondContact O-N 3.3Å; V858-L862 VanDerWaalsContact O-N 3.08Å; P860-L862 PolarHBondContact O-N 2.91Å; L862-E865 PolarHBondContact O-N 3.24Å; L862-Q866 WeakPolarHBondContact O-CB 3.44Å; L862-Q866 PolarHBondContact O-N 3.33Å
863	V	71.5	Confident	68	Low	35 Å²	35	57.9 Å²	57.9	21%	0.212	32%	0.322	C	S	.	.	H	α-helix	trans	-66.7	-43.9	177	172.1	0	0	0	0	111.4	Q811 L859 P860 A861 E865 Q866 Q867	Q811-V863 HydrophobicContact CG-CG2 4.24Å; L859-V863 WeakPolarHBondContact O-CG2 3.47Å; L859-V863 PolarHBondContact O-N 3.32Å; P860-V863 PolarHBondContact O-N 3.01Å; A861-V863 VanDerWaalsContact C-N 3.33Å; A861-V863 PolarHBondContact O-N 3.25Å; V863-E865 VanDerWaalsContact C-N 3.3Å; V863-E865 PolarHBondContact O-N 3.46Å; V863-Q866 PolarHBondContact O-N 3.28Å; V863-Q867 WeakPolarHBondContact O-CB 3.45Å; V863-Q867 VanDerWaalsContact O-CG 3.25Å; V863-Q867 WeakPolarHBondContact O-CG 3.46Å; V863-Q867 PolarHBondContact O-N 3.03Å
864	E	74.6	Confident	68.9	Low	106 Å²	106	60.9 Å²	60.9	50%	0.495	32%	0.324	S	S	.	.	H	α-helix	trans	-64.9	-32.8	175.1	-72	-178.6	-177.8	0	0	112.9	P860 A861 R868	P860-E864 WeakPolarHBondContact O-CG 3.46Å; P860-E864 PolarHBondContact O-N 2.98Å; A861-E864 PolarHBondContact O-N 3.38Å; E864-R868 WeakPolarHBondContact O-CB 3.44Å; E864-R868 WeakPolarHBondContact O-CG 3.39Å; E864-R868 PolarHBondContact O-N 3.44Å; E864-R868 PolarHBondContact O-NE 3.02Å; E864-R868 IonicContact OE2-NH2 3.6Å; E864-R868 PolarHBondContact OE2-NH2 3.46Å
865	E	71.6	Confident	69.6	Low	27 Å²	27	64.1 Å²	64.1	13%	0.126	33%	0.33	C	S	.	.	H	α-helix	trans	-71.7	-44.9	176.3	-176.8	154.1	-163	0	0	111.6	L807 A861 L862 V863 Q867 R868 A869 K899	L807-E865 HydrophobicContact CD1-CG 3.92Å; A861-E865 WeakPolarHBondContact O-CB 3.27Å; A861-E865 PolarHBondContact O-N 3.26Å; L862-E865 PolarHBondContact O-N 3.24Å; V863-E865 VanDerWaalsContact C-N 3.3Å; V863-E865 PolarHBondContact O-N 3.46Å; E865-Q867 VanDerWaalsContact C-N 3.32Å; E865-Q867 PolarHBondContact O-N 3.25Å; E865-R868 PolarHBondContact O-N 3Å; E865-A869 PolarHBondContact O-N 3.31Å; E865-K899 IonicContact OE1-NZ 3.64Å; E865-K899 PolarHBondContact OE1-NZ 3.43Å; E865-K899 IonicContact OE2-NZ 2.74Å; E865-K899 PolarHBondContact OE2-NZ 3.11Å
866	Q	77.4	Confident	70	Confident	19 Å²	19	65.2 Å²	65.2	9%	0.089	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-42.5	172.7	-170.6	-160.5	66.4	0	0	111.6	V804 L807 R808 L862 V863 A869 Q870	V804-Q866 HydrophobicContact CG1-CG 4.32Å; L807-Q866 HydrophobicContact CB-CB 4.16Å; L807-Q866 HydrophobicContact CB-CG 4.24Å; L807-Q866 HydrophobicContact CD1-CB 4.34Å; R808-Q866 VanDerWaalsContact CB-NE2 3.3Å; L862-Q866 WeakPolarHBondContact O-CB 3.44Å; L862-Q866 PolarHBondContact O-N 3.33Å; V863-Q866 PolarHBondContact O-N 3.28Å; Q866-A869 PolarHBondContact O-N 2.96Å; Q866-Q870 WeakPolarHBondContact O-CB 3.43Å; Q866-Q870 WeakPolarHBondContact O-CG 3.38Å; Q866-Q870 PolarHBondContact O-N 3.08Å
867	Q	77.1	Confident	70	Confident	110 Å²	110	65.4 Å²	65.4	51%	0.514	34%	0.344	S	S	.	.	H	α-helix	trans	-64.7	-40.8	176.6	-74.9	176.7	13.5	0	0	112.2	V863 E865 Q870 E871	V863-Q867 WeakPolarHBondContact O-CB 3.45Å; V863-Q867 VanDerWaalsContact O-CG 3.25Å; V863-Q867 WeakPolarHBondContact O-CG 3.46Å; V863-Q867 PolarHBondContact O-N 3.03Å; E865-Q867 VanDerWaalsContact C-N 3.32Å; E865-Q867 PolarHBondContact O-N 3.25Å; Q867-Q870 PolarHBondContact O-N 3.34Å; Q867-E871 WeakPolarHBondContact O-CB 3.47Å; Q867-E871 PolarHBondContact O-N 3.48Å
868	R	75.1	Confident	69.8	Low	125 Å²	125	66.1 Å²	66.1	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-45.4	174.5	-82.9	176.9	-84.9	-164.9	-12.5	112.1	E864 E865 E871 V872	E864-R868 WeakPolarHBondContact O-CB 3.44Å; E864-R868 WeakPolarHBondContact O-CG 3.39Å; E864-R868 PolarHBondContact O-N 3.44Å; E864-R868 PolarHBondContact O-NE 3.02Å; E864-R868 IonicContact OE2-NH2 3.6Å; E864-R868 PolarHBondContact OE2-NH2 3.46Å; E865-R868 PolarHBondContact O-N 3Å; R868-E871 PolarHBondContact O-N 3.22Å; R868-V872 PolarHBondContact O-N 3.14Å; R868-V872 VanDerWaalsContact O-N 3.13Å
869	A	74.4	Confident	69.2	Low	3 Å²	3	70 Å²	70	3%	0.025	37%	0.372	C	S	.	.	H	α-helix	trans	-65.2	-39.4	177	0	0	0	0	0	112.3	K800 V804 E865 Q866 E871 V872 L873	K800-A869 HydrophobicContact CD-CB 4.3Å; V804-A869 HydrophobicContact CG2-CB 3.51Å; E865-A869 PolarHBondContact O-N 3.31Å; Q866-A869 PolarHBondContact O-N 2.96Å; A869-E871 VanDerWaalsContact C-N 3.35Å; A869-E871 PolarHBondContact O-N 2.9Å; A869-V872 PolarHBondContact O-N 3.41Å; A869-L873 WeakPolarHBondContact O-CG 3.41Å; A869-L873 PolarHBondContact O-N 3.16Å
870	Q	78.3	Confident	68.7	Low	41 Å²	41	69.9 Å²	69.9	19%	0.192	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-36.4	172.6	-75.4	176.8	19	0	0	113.2	V804 Q866 Q867 L873 R874	V804-Q870 HydrophobicContact CB-CG 4.36Å; V804-Q870 HydrophobicContact CG1-CG 3.59Å; V804-Q870 HydrophobicContact CG2-CG 3.73Å; Q866-Q870 WeakPolarHBondContact O-CB 3.43Å; Q866-Q870 WeakPolarHBondContact O-CG 3.38Å; Q866-Q870 PolarHBondContact O-N 3.08Å; Q867-Q870 PolarHBondContact O-N 3.34Å; Q870-L873 PolarHBondContact O-N 2.93Å; Q870-R874 WeakPolarHBondContact O-CG 3.39Å; Q870-R874 PolarHBondContact O-N 3.03Å
871	E	76.3	Confident	68.4	Low	74 Å²	74	69 Å²	69	35%	0.346	38%	0.38	S	S	.	.	H	α-helix	trans	-67.8	-38.1	177.3	178.3	62	-172	0	0	112	Q867 R868 A869 L873 R874 R875	Q867-E871 WeakPolarHBondContact O-CB 3.47Å; Q867-E871 PolarHBondContact O-N 3.48Å; R868-E871 PolarHBondContact O-N 3.22Å; A869-E871 VanDerWaalsContact C-N 3.35Å; A869-E871 PolarHBondContact O-N 2.9Å; E871-L873 VanDerWaalsContact C-N 3.33Å; E871-L873 PolarHBondContact O-N 3.39Å; E871-R874 PolarHBondContact O-N 2.9Å; E871-R875 WeakPolarHBondContact O-CG 3.39Å; E871-R875 PolarHBondContact O-N 2.98Å; E871-R875 IonicContact OE1-CZ 3.42Å; E871-R875 IonicContact OE1-NE 3.48Å; E871-R875 PolarHBondContact OE1-NE 3.42Å; E871-R875 IonicContact OE1-NH2 2.97Å; E871-R875 PolarHBondContact OE1-NH2 3.47Å
872	V	74.3	Confident	68.5	Low	36 Å²	36	68.4 Å²	68.4	22%	0.218	37%	0.371	C	S	.	.	H	α-helix	trans	-60.9	-42.3	172.2	173.8	0	0	0	0	111.1	Y796 K800 R868 A869 G876	Y796-V872 HydrophobicContact CE1-CG1 4.27Å; K800-V872 HydrophobicContact CD-CG1 4.35Å; K800-V872 HydrophobicContact CG-CG1 4.17Å; R868-V872 PolarHBondContact O-N 3.14Å; R868-V872 VanDerWaalsContact O-N 3.13Å; A869-V872 PolarHBondContact O-N 3.41Å; V872-G876 PolarHBondContact O-N 3.5Å
873	L	75.6	Confident	68.5	Low	52 Å²	52	72.1 Å²	72.1	27%	0.272	39%	0.391	S	S	.	.	H	α-helix	trans	-65.6	-42.2	175.1	-67	169.6	0	0	0	112.7	L797 K800 E801 V804 A869 Q870 E871 R875 G876	L797-L873 HydrophobicContact CD2-CD2 4.2Å; L797-L873 WeakPolarHBondContact O-CD2 3.43Å; K800-L873 HydrophobicContact CB-CD2 3.72Å; K800-L873 HydrophobicContact CB-CG 4.01Å; E801-L873 HydrophobicContact CB-CD1 4.32Å; E801-L873 HydrophobicContact CB-CD2 4.26Å; V804-L873 HydrophobicContact CG2-CD1 3.92Å; A869-L873 WeakPolarHBondContact O-CG 3.41Å; A869-L873 PolarHBondContact O-N 3.16Å; Q870-L873 PolarHBondContact O-N 2.93Å; E871-L873 VanDerWaalsContact C-N 3.33Å; E871-L873 PolarHBondContact O-N 3.39Å; L873-R875 VanDerWaalsContact C-N 3.34Å; L873-R875 PolarHBondContact O-N 3.17Å; L873-G876 PolarHBondContact O-N 3.13Å; L873-G876 VanDerWaalsContact O-N 3.15Å
874	R	73.5	Confident	68.6	Low	186 Å²	186	74.9 Å²	74.9	70%	0.702	41%	0.405	S	S	*	.	H	α-helix	trans	-64.3	-34.3	179.1	-80	-174.4	-176.5	128.8	6.2	113.6	Q870 E871 G876	Q870-R874 WeakPolarHBondContact O-CG 3.39Å; Q870-R874 PolarHBondContact O-N 3.03Å; E871-R874 PolarHBondContact O-N 2.9Å; R874-G876 PolarHBondContact O-N 3.17Å
875	R	68.2	Low	68.5	Low	177 Å²	177	70.8 Å²	70.8	67%	0.668	39%	0.387	S	S	*	.	H	α-helix	trans	-68.9	-25.9	175.5	-71.4	175.4	-173.7	-161.9	1.9	112.4	E871 L873	E871-R875 WeakPolarHBondContact O-CG 3.39Å; E871-R875 PolarHBondContact O-N 2.98Å; E871-R875 IonicContact OE1-CZ 3.42Å; E871-R875 IonicContact OE1-NE 3.48Å; E871-R875 PolarHBondContact OE1-NE 3.42Å; E871-R875 IonicContact OE1-NH2 2.97Å; E871-R875 PolarHBondContact OE1-NH2 3.47Å; L873-R875 VanDerWaalsContact C-N 3.34Å; L873-R875 PolarHBondContact O-N 3.17Å
876	G	59.7	Low	68.7	Low	35 Å²	35	70.2 Å²	70.2	36%	0.361	38%	0.384	S	S	.	.			trans	63	-176.5	178.3	0	0	0	0	0	113.7	V872 L873 R874 A878	V872-G876 PolarHBondContact O-N 3.5Å; L873-G876 PolarHBondContact O-N 3.13Å; L873-G876 VanDerWaalsContact O-N 3.15Å; R874-G876 PolarHBondContact O-N 3.17Å; G876-A878 PolarHBondContact O-N 3.32Å
877	A	56.4	Low	68.8	Low	71 Å²	71	75.3 Å²	75.3	59%	0.587	41%	0.406	S	S	*	.	S	Bend	trans	-76.3	66.1	170.1	0	0	0	0	0	111	L797	L797-A877 HydrophobicContact CD1-CB 4.04Å
878	A	53.3	Low	68.8	Low	60 Å²	60	73 Å²	73	50%	0.496	40%	0.396	S	S	.	.			trans	-58.4	149.4	160.5	0	0	0	0	0	109.2	G876 A880	G876-A878 PolarHBondContact O-N 3.32Å; A878-A880 PolarHBondContact O-N 2.95Å
879	P	51.1	Low	69	Low	140 Å²	140	67 Å²	67	91%	0.909	37%	0.373	S	S	*	.	S	Bend	trans	-76.7	55.8	-174.9	33.2	-37.2	0	0	0	112.5
880	A	53.9	Low	69.2	Low	41 Å²	41	69.9 Å²	69.9	34%	0.339	39%	0.386	S	S	.	.			trans	-77.5	132.9	159.2	0	0	0	0	0	108.3	A878 N884	A878-A880 PolarHBondContact O-N 2.95Å; A880-N884 HydrophobicContact CB-CB 4.05Å
881	G	60.9	Low	69.3	Low	50 Å²	50	72.1 Å²	72.1	52%	0.515	40%	0.395	S	S	.	.			trans	-60.9	161.9	-176.5	0	0	0	0	0	113.7	D883 N884	G881-D883 PolarHBondContact O-N 3.17Å; G881-N884 PolarHBondContact O-N 3.24Å
882	L	67.8	Low	69.5	Low	34 Å²	34	69.5 Å²	69.5	18%	0.178	38%	0.383	C	S	.	.	H	α-helix	trans	-42	-42	178.1	-88.3	156.5	0	0	0	113.4	L770 A773 A777 A789 N884 T885 L886	L770-L882 HydrophobicContact CD2-CD2 3.94Å; A773-L882 HydrophobicContact CB-CD2 4.35Å; A777-L882 HydrophobicContact CB-CD1 4.47Å; A789-L882 HydrophobicContact CB-CD1 3.91Å; A789-L882 HydrophobicContact CB-CD2 3.81Å; A789-L882 HydrophobicContact CB-CG 3.98Å; L882-N884 VanDerWaalsContact C-N 3.29Å; L882-N884 PolarHBondContact O-N 2.81Å; L882-T885 PolarHBondContact O-N 3.09Å; L882-L886 WeakPolarHBondContact O-CB 3.43Å; L882-L886 PolarHBondContact O-N 3.42Å
883	D	68.2	Low	69.8	Low	92 Å²	92	69.4 Å²	69.4	49%	0.492	38%	0.381	S	S	.	.	H	α-helix	trans	-58.5	-35.5	179.8	-66.7	-44.1	0	0	0	113.9	K774 G881 F887	K774-D883 WeakPolarHBondContact CE-OD1 3.35Å; K774-D883 IonicContact NZ-OD1 3.48Å; K774-D883 PolarHBondContact NZ-OD1 3.47Å; G881-D883 PolarHBondContact O-N 3.17Å; D883-F887 VanDerWaalsContact O-CB 3.27Å; D883-F887 WeakPolarHBondContact O-CB 3.17Å; D883-F887 PolarHBondContact O-N 3.07Å
884	N	73.1	Confident	70	Confident	94 Å²	94	73.2 Å²	73.2	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-75.3	-38	179.2	-163.1	-7.3	0	0	0	110.9	A880 G881 L882 Q888	A880-N884 HydrophobicContact CB-CB 4.05Å; G881-N884 PolarHBondContact O-N 3.24Å; L882-N884 VanDerWaalsContact C-N 3.29Å; L882-N884 PolarHBondContact O-N 2.81Å; N884-Q888 WeakPolarHBondContact O-CB 3.49Å; N884-Q888 PolarHBondContact O-N 3.49Å
885	T	72	Confident	70.3	Confident	20 Å²	20	67.4 Å²	67.4	12%	0.123	38%	0.378	C	S	.	.	H	α-helix	trans	-64.4	-43.5	171.6	-46.2	0	0	0	0	111.2	L770 Q793 Y796 L882 Q888 V889	L770-T885 HydrophobicContact CD1-CG2 3.93Å; L770-T885 HydrophobicContact CD2-CG2 4.25Å; Q793-T885 HydrophobicContact CG-CG2 4.17Å; Q793-T885 PolarHBondContact NE2-OG1 2.71Å; Y796-T885 HydrophobicContact CD1-CG2 4.18Å; L882-T885 PolarHBondContact O-N 3.09Å; T885-Q888 PolarHBondContact O-N 2.94Å; T885-V889 WeakPolarHBondContact O-CG2 3.34Å; T885-V889 PolarHBondContact O-N 3.43Å
886	L	75.8	Confident	70.8	Confident	14 Å²	14	59.3 Å²	59.3	7%	0.073	35%	0.348	C	S	.	.	H	α-helix	trans	-62.9	-48.2	178.4	179.4	63.2	0	0	0	111.4	R767 L770 L771 L882 Q888 V889 E890	R767-L886 HydrophobicContact CG-CD1 3.8Å; L770-L886 HydrophobicContact CB-CD1 4.05Å; L770-L886 HydrophobicContact CD1-CB 4.5Å; L770-L886 HydrophobicContact CD1-CD1 4.48Å; L771-L886 HydrophobicContact CD2-CD1 4.27Å; L771-L886 HydrophobicContact CD2-CD2 3.65Å; L771-L886 HydrophobicContact CG-CD1 4.03Å; L771-L886 HydrophobicContact CG-CD2 4.28Å; L882-L886 WeakPolarHBondContact O-CB 3.43Å; L882-L886 PolarHBondContact O-N 3.42Å; L886-Q888 VanDerWaalsContact C-N 3.31Å; L886-Q888 PolarHBondContact O-N 3.35Å; L886-V889 PolarHBondContact O-N 3.11Å; L886-E890 HydrophobicContact CD1-CG 4.29Å; L886-E890 WeakPolarHBondContact O-CG 3.34Å; L886-E890 PolarHBondContact O-N 3.31Å
887	F	78.9	Confident	71.7	Confident	126 Å²	126	61.2 Å²	61.2	55%	0.553	35%	0.348	S	S	*	.	H	α-helix	trans	-58.3	-41.8	176.3	177.3	-101.6	0	0	0	112.4	D883 E890 K891	D883-F887 VanDerWaalsContact O-CB 3.27Å; D883-F887 WeakPolarHBondContact O-CB 3.17Å; D883-F887 PolarHBondContact O-N 3.07Å; F887-E890 PolarHBondContact O-N 3.25Å; F887-K891 WeakPolarHBondContact O-CB 3.3Å; F887-K891 PolarHBondContact O-N 3.4Å
888	Q	77.1	Confident	72.7	Confident	61 Å²	61	62.9 Å²	62.9	29%	0.285	35%	0.347	S	S	.	.	H	α-helix	trans	-64.7	-41.7	176.6	-174.9	63.3	31.7	0	0	111.9	N884 T885 L886 E892	N884-Q888 WeakPolarHBondContact O-CB 3.49Å; N884-Q888 PolarHBondContact O-N 3.49Å; T885-Q888 PolarHBondContact O-N 2.94Å; L886-Q888 VanDerWaalsContact C-N 3.31Å; L886-Q888 PolarHBondContact O-N 3.35Å; Q888-E892 PolarHBondContact NE2-OE1 2.84Å; Q888-E892 WeakPolarHBondContact O-CB 3.42Å; Q888-E892 VanDerWaalsContact O-CG 3.32Å; Q888-E892 WeakPolarHBondContact O-CG 3.45Å; Q888-E892 PolarHBondContact O-N 2.86Å
889	V	80.3	Confident	73.7	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.1	-41.3	176	169.8	0	0	0	0	111.7	L763 I766 R767 L770 Y796 T885 L886 E892 L893	L763-V889 HydrophobicContact CD2-CG1 4.32Å; I766-V889 HydrophobicContact CG2-CG2 4.24Å; R767-V889 HydrophobicContact CB-CG1 3.91Å; L770-V889 HydrophobicContact CD1-CB 4.33Å; L770-V889 HydrophobicContact CD1-CG2 3.89Å; Y796-V889 HydrophobicContact CD2-CG2 3.7Å; Y796-V889 HydrophobicContact CE1-CG2 4.49Å; Y796-V889 HydrophobicContact CE2-CG2 3.53Å; Y796-V889 HydrophobicContact CG-CG2 4.26Å; T885-V889 WeakPolarHBondContact O-CG2 3.34Å; T885-V889 PolarHBondContact O-N 3.43Å; L886-V889 PolarHBondContact O-N 3.11Å; V889-E892 PolarHBondContact O-N 3.13Å; V889-L893 WeakPolarHBondContact O-CB 3.41Å; V889-L893 PolarHBondContact O-N 3.4Å
890	E	78.8	Confident	74.7	Confident	64 Å²	64	57 Å²	57	30%	0.299	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-44.8	177	-73.6	-174.6	147.2	0	0	111.9	R767 L886 F887 E892 L893 E894	R767-E890 HydrophobicContact CG-CG 4.19Å; R767-E890 IonicContact CZ-OE1 3.62Å; R767-E890 IonicContact NE-OE1 2.89Å; R767-E890 PolarHBondContact NE-OE1 3.27Å; R767-E890 IonicContact NH2-OE1 2.64Å; R767-E890 PolarHBondContact NH2-OE1 3.23Å; L886-E890 HydrophobicContact CD1-CG 4.29Å; L886-E890 WeakPolarHBondContact O-CG 3.34Å; L886-E890 PolarHBondContact O-N 3.31Å; F887-E890 PolarHBondContact O-N 3.25Å; E890-E892 PolarHBondContact O-N 3.06Å; E890-L893 PolarHBondContact O-N 3.32Å; E890-E894 PolarHBondContact O-N 3.32Å
891	K	81	Confident	75.5	Confident	87 Å²	87	60.7 Å²	60.7	38%	0.378	31%	0.307	S	S	.	.	H	α-helix	trans	-61.7	-42.3	176	-171.7	175.8	-173.4	-92	0	112.3	F887 L893 E894 E895	F887-K891 WeakPolarHBondContact O-CB 3.3Å; F887-K891 PolarHBondContact O-N 3.4Å; K891-L893 VanDerWaalsContact C-N 3.33Å; K891-E894 PolarHBondContact O-N 3.4Å; K891-E895 WeakPolarHBondContact CE-OE1 3.47Å; K891-E895 IonicContact NZ-OE1 3.73Å; K891-E895 PolarHBondContact NZ-OE1 3.04Å; K891-E895 WeakPolarHBondContact O-CB 3.48Å; K891-E895 WeakPolarHBondContact O-CG 3.39Å; K891-E895 PolarHBondContact O-N 3.42Å
892	E	80.6	Confident	76	Confident	19 Å²	19	65 Å²	65	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-70.5	-29.5	177.5	-72.9	-178.3	-170.4	0	0	113	L763 Y796 K800 Q888 V889 E890 T896	L763-E892 HydrophobicContact CD1-CB 4.27Å; Y796-E892 VanDerWaalsContact OH-CD 3.24Å; Y796-E892 PolarHBondContact OH-OE1 3.22Å; Y796-E892 PolarHBondContact OH-OE2 3.44Å; Y796-E892 VanDerWaalsContact OH-OE2 3.1Å; K800-E892 WeakPolarHBondContact CE-OE2 3.43Å; K800-E892 VanDerWaalsContact NZ-CD 3.31Å; K800-E892 IonicContact NZ-OE1 3.85Å; K800-E892 PolarHBondContact NZ-OE1 3.47Å; K800-E892 IonicContact NZ-OE2 3.49Å; K800-E892 PolarHBondContact NZ-OE2 3.3Å; Q888-E892 PolarHBondContact NE2-OE1 2.84Å; Q888-E892 WeakPolarHBondContact O-CB 3.42Å; Q888-E892 VanDerWaalsContact O-CG 3.32Å; Q888-E892 WeakPolarHBondContact O-CG 3.45Å; Q888-E892 PolarHBondContact O-N 2.86Å; V889-E892 PolarHBondContact O-N 3.13Å; E890-E892 PolarHBondContact O-N 3.06Å; E892-T896 WeakPolarHBondContact O-CB 3.48Å; E892-T896 WeakPolarHBondContact O-CG2 3.36Å; E892-T896 PolarHBondContact O-N 3.36Å; E892-T896 PolarHBondContact O-OG1 3.44Å
893	L	79.6	Confident	76.1	Confident	35 Å²	35	65.4 Å²	65.4	18%	0.183	32%	0.318	C	S	.	.	H	α-helix	trans	-70	-36.1	173.6	-169.1	139.6	0	0	0	111.9	R760 L763 A764 V889 E890 K891 T896 Q897	R760-L893 HydrophobicContact CG-CG 4.2Å; L763-L893 HydrophobicContact CB-CD1 4.08Å; A764-L893 HydrophobicContact CB-CD1 3.86Å; V889-L893 WeakPolarHBondContact O-CB 3.41Å; V889-L893 PolarHBondContact O-N 3.4Å; E890-L893 PolarHBondContact O-N 3.32Å; K891-L893 VanDerWaalsContact C-N 3.33Å; L893-T896 WeakPolarHBondContact CA-OG1 3.38Å; L893-T896 PolarHBondContact O-OG1 3.48Å; L893-Q897 WeakPolarHBondContact O-CB 3.38Å; L893-Q897 PolarHBondContact O-N 3.06Å; L893-Q897 VanDerWaalsContact O-N 3.15Å
894	E	79.4	Confident	76	Confident	132 Å²	132	68.3 Å²	68.3	62%	0.617	32%	0.322	S	S	*	.	H	α-helix	trans	-67.6	-50	170.2	-168.9	169.7	-144.9	0	0	111.2	E890 K891 T896 Q897 D898	E890-E894 PolarHBondContact O-N 3.32Å; K891-E894 PolarHBondContact O-N 3.4Å; E894-T896 VanDerWaalsContact C-N 3.34Å; E894-T896 PolarHBondContact O-N 3.25Å; E894-Q897 PolarHBondContact O-N 2.94Å; E894-Q897 VanDerWaalsContact O-N 3.11Å; E894-D898 PolarHBondContact O-N 3.34Å
895	E	80.2	Confident	75.6	Confident	64 Å²	64	68.4 Å²	68.4	30%	0.299	32%	0.32	S	S	.	.	H	α-helix	trans	-59.2	-39.3	178.1	-73.9	-179.3	-160	0	0	112.5	K891 K899	K891-E895 WeakPolarHBondContact CE-OE1 3.47Å; K891-E895 IonicContact NZ-OE1 3.73Å; K891-E895 PolarHBondContact NZ-OE1 3.04Å; K891-E895 WeakPolarHBondContact O-CB 3.48Å; K891-E895 WeakPolarHBondContact O-CG 3.39Å; K891-E895 PolarHBondContact O-N 3.42Å; E895-K899 VanDerWaalsContact O-CG 3.29Å; E895-K899 WeakPolarHBondContact O-CG 3.41Å; E895-K899 PolarHBondContact O-N 3.36Å
896	T	79.1	Confident	75.3	Confident	6 Å²	6	68.3 Å²	68.3	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-71	-34.7	175.6	47.8	0	0	0	0	112.6	L763 E892 L893 E894 L900	L763-T896 HydrophobicContact CD1-CG2 4.27Å; E892-T896 WeakPolarHBondContact O-CB 3.48Å; E892-T896 WeakPolarHBondContact O-CG2 3.36Å; E892-T896 PolarHBondContact O-N 3.36Å; E892-T896 PolarHBondContact O-OG1 3.44Å; L893-T896 WeakPolarHBondContact CA-OG1 3.38Å; L893-T896 PolarHBondContact O-OG1 3.48Å; E894-T896 VanDerWaalsContact C-N 3.34Å; E894-T896 PolarHBondContact O-N 3.25Å; T896-L900 WeakPolarHBondContact O-CB 3.48Å; T896-L900 PolarHBondContact O-N 3.41Å; T896-L900 VanDerWaalsContact O-N 3.11Å
897	Q	77.6	Confident	74.7	Confident	75 Å²	75	69.5 Å²	69.5	35%	0.35	33%	0.334	S	S	.	.	H	α-helix	trans	-68.1	-40	175.6	-178.8	160.8	-41.7	0	0	112.3	L893 E894 L900 H901	L893-Q897 WeakPolarHBondContact O-CB 3.38Å; L893-Q897 PolarHBondContact O-N 3.06Å; L893-Q897 VanDerWaalsContact O-N 3.15Å; E894-Q897 PolarHBondContact O-N 2.94Å; E894-Q897 VanDerWaalsContact O-N 3.11Å; Q897-L900 WeakPolarHBondContact O-CB 3.42Å; Q897-L900 PolarHBondContact O-N 2.92Å; Q897-H901 PolarHBondContact O-N 3.26Å
898	D	77.1	Confident	74	Confident	106 Å²	106	67.1 Å²	67.1	57%	0.567	33%	0.325	S	S	*	.	H	α-helix	trans	-63.7	-43	174.7	-82.7	-9.2	0	0	0	112.1	E894 L900 H901 L902	E894-D898 PolarHBondContact O-N 3.34Å; D898-L900 VanDerWaalsContact C-N 3.26Å; D898-L900 PolarHBondContact O-N 3.02Å; D898-H901 PolarHBondContact O-N 3.49Å; D898-L902 PolarHBondContact O-N 3.1Å
899	K	74.3	Confident	73.3	Confident	58 Å²	58	69 Å²	69	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-39.6	173.1	-70.9	172.7	-164.9	-172.2	0	112	L756 E865 E895 L902 H903	L756-K899 HydrophobicContact CD1-CB 4.17Å; L756-K899 HydrophobicContact CD2-CD 4.49Å; E865-K899 IonicContact OE1-NZ 3.64Å; E865-K899 PolarHBondContact OE1-NZ 3.43Å; E865-K899 IonicContact OE2-NZ 2.74Å; E865-K899 PolarHBondContact OE2-NZ 3.11Å; E895-K899 VanDerWaalsContact O-CG 3.29Å; E895-K899 WeakPolarHBondContact O-CG 3.41Å; E895-K899 PolarHBondContact O-N 3.36Å; K899-L902 WeakPolarHBondContact O-CB 3.35Å; K899-L902 PolarHBondContact O-N 3.36Å; K899-H903 WeakPolarHBondContact O-CB 3.46Å; K899-H903 PolarHBondContact O-N 3.41Å
900	L	73.8	Confident	72.4	Confident	19 Å²	19	70.7 Å²	70.7	10%	0.099	34%	0.342	C	S	.	.	H	α-helix	trans	-66.3	-42.1	178.9	-135.4	146.3	0	0	0	111.8	L756 E757 T896 Q897 D898 L902 H903 W904	L756-L900 HydrophobicContact CB-CD1 3.93Å; L756-L900 HydrophobicContact CB-CG 4.33Å; E757-L900 HydrophobicContact CB-CD1 4.45Å; E757-L900 HydrophobicContact CG-CD1 3.73Å; E757-L900 HydrophobicContact CG-CD2 4.02Å; E757-L900 HydrophobicContact CG-CG 4.34Å; T896-L900 WeakPolarHBondContact O-CB 3.48Å; T896-L900 PolarHBondContact O-N 3.41Å; T896-L900 VanDerWaalsContact O-N 3.11Å; Q897-L900 WeakPolarHBondContact O-CB 3.42Å; Q897-L900 PolarHBondContact O-N 2.92Å; D898-L900 VanDerWaalsContact C-N 3.26Å; D898-L900 PolarHBondContact O-N 3.02Å; L900-L902 VanDerWaalsContact C-N 3.35Å; L900-H903 PolarHBondContact O-N 3.47Å; L900-W904 WeakPolarHBondContact O-CB 3.42Å; L900-W904 PolarHBondContact O-N 3.43Å
901	H	70.8	Confident	71.6	Confident	119 Å²	119	73 Å²	73	55%	0.551	35%	0.353	S	S	*	.	H	α-helix	trans	-62.2	-40.8	171.7	-91.4	-74.4	0	0	0	112.4	Q897 D898 W904 H905	Q897-H901 PolarHBondContact O-N 3.26Å; D898-H901 PolarHBondContact O-N 3.49Å; H901-W904 PolarHBondContact O-N 2.97Å; H901-H905 WeakPolarHBondContact O-CB 3.32Å; H901-H905 PolarHBondContact O-N 2.95Å
902	L	70.8	Confident	70.6	Confident	140 Å²	140	74.6 Å²	74.6	73%	0.733	36%	0.362	S	S	*	.	H	α-helix	trans	-64.1	-43.2	177.1	-148	74.8	0	0	0	111.5	D898 K899 L900 H905 G906	D898-L902 PolarHBondContact O-N 3.1Å; K899-L902 WeakPolarHBondContact O-CB 3.35Å; K899-L902 PolarHBondContact O-N 3.36Å; L900-L902 VanDerWaalsContact C-N 3.35Å; L902-H905 PolarHBondContact O-N 3.48Å; L902-G906 PolarHBondContact O-N 3.42Å
903	H	69.1	Low	69.6	Low	42 Å²	42	76.3 Å²	76.3	19%	0.194	37%	0.371	C	S	.	.	H	α-helix	trans	-65.4	-41.8	176.7	-164.5	-91.5	0	0	0	112	S753 K899 L900 H905 G906 A907	S753-H903 WeakPolarHBondContact CB-ND1 3.41Å; K899-H903 WeakPolarHBondContact O-CB 3.46Å; K899-H903 PolarHBondContact O-N 3.41Å; L900-H903 PolarHBondContact O-N 3.47Å; H903-H905 PolarHBondContact O-N 3.21Å; H903-G906 PolarHBondContact O-N 3.05Å; H903-A907 PolarHBondContact O-N 3.36Å
904	W	66.1	Low	68.5	Low	154 Å²	154	79.2 Å²	79.2	58%	0.583	38%	0.384	S	S	*	.	H	α-helix	trans	-61.2	-43.7	175.1	-173.1	90.1	0	0	0	112.2	L900 H901 G906 A907 Q908	L900-W904 WeakPolarHBondContact O-CB 3.42Å; L900-W904 PolarHBondContact O-N 3.43Å; H901-W904 PolarHBondContact O-N 2.97Å; W904-G906 VanDerWaalsContact C-N 3.35Å; W904-G906 PolarHBondContact O-N 3.01Å; W904-A907 PolarHBondContact O-N 3Å; W904-Q908 VanDerWaalsContact CZ3-OE1 3.3Å; W904-Q908 PolarHBondContact O-N 3.36Å
905	H	64.8	Low	67.6	Low	96 Å²	96	78 Å²	78	44%	0.444	38%	0.378	S	S	.	.	H	α-helix	trans	-68.2	-34	177.8	-159.3	-66.1	0	0	0	112.2	H901 L902 H903 Q909	H901-H905 WeakPolarHBondContact O-CB 3.32Å; H901-H905 PolarHBondContact O-N 2.95Å; L902-H905 PolarHBondContact O-N 3.48Å; H903-H905 PolarHBondContact O-N 3.21Å; H905-Q909 PolarHBondContact CE1-NE2 3.22Å; H905-Q909 PolarHBondContact ND1-NE2 3.27Å; H905-Q909 WeakPolarHBondContact O-CG 3.39Å; H905-Q909 PolarHBondContact O-N 2.94Å; H905-Q909 VanDerWaalsContact O-N 3.14Å
906	G	65.8	Low	66.7	Low	17 Å²	17	77.8 Å²	77.8	18%	0.175	38%	0.384	C	S	.	.	H	α-helix	trans	-64.9	-43.2	171.1	0	0	0	0	0	112.8	L902 H903 W904 Q908 Q909 L910	L902-G906 PolarHBondContact O-N 3.42Å; H903-G906 PolarHBondContact O-N 3.05Å; W904-G906 VanDerWaalsContact C-N 3.35Å; W904-G906 PolarHBondContact O-N 3.01Å; G906-Q908 PolarHBondContact O-N 2.93Å; G906-Q909 PolarHBondContact O-N 2.93Å; G906-L910 PolarHBondContact O-N 3.04Å
907	A	64.4	Low	65.5	Low	39 Å²	39	79.5 Å²	79.5	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-61.6	-42.4	174.7	0	0	0	0	0	112.5	L748 H903 W904 Q909 L910 Q911	L748-A907 HydrophobicContact CD1-CB 3.94Å; H903-A907 PolarHBondContact O-N 3.36Å; W904-A907 PolarHBondContact O-N 3Å; A907-Q909 PolarHBondContact O-N 3.07Å; A907-L910 PolarHBondContact O-N 2.89Å; A907-Q911 PolarHBondContact O-N 2.76Å
908	Q	64.3	Low	64.7	Low	76 Å²	76	80.9 Å²	80.9	36%	0.355	40%	0.402	S	S	.	.	H	α-helix	trans	-63.9	-39.6	177	-166	178.9	26.7	0	0	112.4	W904 G906 Q911 Q912	W904-Q908 VanDerWaalsContact CZ3-OE1 3.3Å; W904-Q908 PolarHBondContact O-N 3.36Å; G906-Q908 PolarHBondContact O-N 2.93Å; Q908-Q911 PolarHBondContact O-N 3.02Å; Q908-Q912 WeakPolarHBondContact O-CG 3.45Å; Q908-Q912 PolarHBondContact O-N 2.85Å; Q908-Q912 VanDerWaalsContact O-N 3.09Å
909	Q	61	Low	63.9	Low	102 Å²	102	82.7 Å²	82.7	48%	0.477	41%	0.405	S	S	.	.	H	α-helix	trans	-66	-39.5	175.3	-75.5	178.4	-10.2	0	0	112.5	H905 G906 A907 Q912 L913	H905-Q909 PolarHBondContact CE1-NE2 3.22Å; H905-Q909 PolarHBondContact ND1-NE2 3.27Å; H905-Q909 WeakPolarHBondContact O-CG 3.39Å; H905-Q909 PolarHBondContact O-N 2.94Å; H905-Q909 VanDerWaalsContact O-N 3.14Å; G906-Q909 PolarHBondContact O-N 2.93Å; A907-Q909 PolarHBondContact O-N 3.07Å; Q909-Q912 PolarHBondContact O-N 2.67Å; Q909-L913 PolarHBondContact O-N 3.09Å
910	L	61	Low	63.1	Low	35 Å²	35	83.7 Å²	83.7	18%	0.183	42%	0.416	C	S	.	.	H	α-helix	trans	-69	-36.2	176.5	-89.8	163.4	0	0	0	112.5	A744 L748 L851 G906 A907 L913 Q914	A744-L910 HydrophobicContact CB-CD1 4.34Å; A744-L910 HydrophobicContact CB-CD2 3.92Å; L748-L910 HydrophobicContact CD1-CB 4.11Å; L748-L910 HydrophobicContact CD1-CD1 3.4Å; L748-L910 HydrophobicContact CD1-CG 4.36Å; L748-L910 HydrophobicContact CG-CD1 3.8Å; L851-L910 HydrophobicContact CD2-CD2 4.2Å; G906-L910 PolarHBondContact O-N 3.04Å; A907-L910 PolarHBondContact O-N 2.89Å; L910-L913 HydrophobicContact CD2-CD2 4.37Å; L910-L913 WeakPolarHBondContact O-CB 3.29Å; L910-L913 PolarHBondContact O-N 2.97Å; L910-Q914 PolarHBondContact O-N 2.91Å
911	Q	62.3	Low	62.2	Low	112 Å²	112	83.4 Å²	83.4	52%	0.523	42%	0.417	S	S	.	.	H	α-helix	trans	-62.1	-46	171.7	-175.5	-179.4	-22	0	0	112	A907 Q908 L913 Q914 E915	A907-Q911 PolarHBondContact O-N 2.76Å; Q908-Q911 PolarHBondContact O-N 3.02Å; Q911-L913 PolarHBondContact O-N 3.38Å; Q911-Q914 WeakPolarHBondContact O-CB 3.41Å; Q911-Q914 PolarHBondContact O-N 2.65Å; Q911-Q914 VanDerWaalsContact O-N 3.11Å; Q911-E915 WeakPolarHBondContact CG-OE1 3.33Å; Q911-E915 PolarHBondContact NE2-OE1 3.22Å; Q911-E915 WeakPolarHBondContact O-CG 3.45Å; Q911-E915 PolarHBondContact O-N 2.87Å
912	Q	61.3	Low	61.7	Low	120 Å²	120	81.1 Å²	81.1	56%	0.561	41%	0.408	S	S	*	.	H	α-helix	trans	-60.8	-34.6	175.3	-72.1	176.5	0.2	0	0	112.4	Q908 Q909 S916	Q908-Q912 WeakPolarHBondContact O-CG 3.45Å; Q908-Q912 PolarHBondContact O-N 2.85Å; Q908-Q912 VanDerWaalsContact O-N 3.09Å; Q909-Q912 PolarHBondContact O-N 2.67Å; Q912-S916 WeakPolarHBondContact O-CB 3.44Å; Q912-S916 PolarHBondContact O-N 3.18Å; Q912-S916 VanDerWaalsContact O-N 3.11Å
913	L	58.3	Low	61.3	Low	56 Å²	56	77.2 Å²	77.2	29%	0.293	39%	0.391	S	S	.	.	H	α-helix	trans	-66.4	-42.2	174.4	-150.9	78.9	0	0	0	111.4	K847 Q909 L910 Q911 S916 C917	K847-L913 HydrophobicContact CD-CD1 4.3Å; K847-L913 VanDerWaalsContact NZ-CD1 3.34Å; Q909-L913 PolarHBondContact O-N 3.09Å; L910-L913 HydrophobicContact CD2-CD2 4.37Å; L910-L913 WeakPolarHBondContact O-CB 3.29Å; L910-L913 PolarHBondContact O-N 2.97Å; Q911-L913 PolarHBondContact O-N 3.38Å; L913-S916 PolarHBondContact O-N 3.27Å; L913-C917 PolarHBondContact O-N 3.15Å; L913-C917 VanDerWaalsContact O-N 3.1Å; L913-C917 PolarHBondContact O-SG 2.83Å
914	Q	56.4	Low	60.6	Low	95 Å²	95	76.3 Å²	76.3	44%	0.444	39%	0.39	S	S	.	.	H	α-helix	trans	-64	-47.9	178.1	-175.6	174	-2.9	0	0	111.9	L910 Q911 S916 C917 E918	L910-Q914 PolarHBondContact O-N 2.91Å; Q911-Q914 WeakPolarHBondContact O-CB 3.41Å; Q911-Q914 PolarHBondContact O-N 2.65Å; Q911-Q914 VanDerWaalsContact O-N 3.11Å; Q914-S916 VanDerWaalsContact C-N 3.32Å; Q914-S916 PolarHBondContact O-N 2.69Å; Q914-C917 PolarHBondContact O-N 3.14Å; Q914-C917 VanDerWaalsContact O-N 3.13Å; Q914-E918 PolarHBondContact O-N 3.14Å
915	E	61.7	Low	60.3	Low	106 Å²	106	73.4 Å²	73.4	50%	0.495	38%	0.379	S	S	.	.	H	α-helix	trans	-59.9	-40.7	176.2	-70.3	172.3	-168.1	0	0	111.6	Q911 C917 E918 F919	Q911-E915 WeakPolarHBondContact CG-OE1 3.33Å; Q911-E915 PolarHBondContact NE2-OE1 3.22Å; Q911-E915 WeakPolarHBondContact O-CG 3.45Å; Q911-E915 PolarHBondContact O-N 2.87Å; E915-C917 VanDerWaalsContact C-N 3.32Å; E915-C917 PolarHBondContact O-N 3.49Å; E915-E918 PolarHBondContact O-N 3.3Å; E915-F919 WeakPolarHBondContact O-CB 3.43Å; E915-F919 PolarHBondContact O-N 3.19Å
916	S	60.9	Low	59.8	Low	60 Å²	60	74.1 Å²	74.1	42%	0.42	38%	0.383	S	S	.	.	H	α-helix	trans	-64.2	-34.1	175.4	-179.9	0	0	0	0	113.2	Q912 L913 Q914 T920	Q912-S916 WeakPolarHBondContact O-CB 3.44Å; Q912-S916 PolarHBondContact O-N 3.18Å; Q912-S916 VanDerWaalsContact O-N 3.11Å; L913-S916 PolarHBondContact O-N 3.27Å; Q914-S916 VanDerWaalsContact C-N 3.32Å; Q914-S916 PolarHBondContact O-N 2.69Å; S916-T920 PolarHBondContact O-N 2.97Å; S916-T920 PolarHBondContact O-OG1 2.99Å
917	C	54.4	Low	59.3	Low	42 Å²	42	78 Å²	78	28%	0.284	40%	0.396	S	S	.	.	H	α-helix	trans	-78.2	-40.9	178.2	-70.3	0	0	0	0	111.8	L737 L913 Q914 E915 F919 T920 A921	L737-C917 HydrophobicContact CD1-CB 3.35Å; L737-C917 HydrophobicContact CD2-CB 3.77Å; L737-C917 HydrophobicContact CG-CB 4.18Å; L913-C917 PolarHBondContact O-N 3.15Å; L913-C917 VanDerWaalsContact O-N 3.1Å; L913-C917 PolarHBondContact O-SG 2.83Å; Q914-C917 PolarHBondContact O-N 3.14Å; Q914-C917 VanDerWaalsContact O-N 3.13Å; E915-C917 VanDerWaalsContact C-N 3.32Å; E915-C917 PolarHBondContact O-N 3.49Å; C917-F919 VanDerWaalsContact C-N 3.34Å; C917-F919 PolarHBondContact O-N 3.42Å; C917-T920 WeakPolarHBondContact O-CB 3.49Å; C917-T920 PolarHBondContact O-N 3.43Å; C917-T920 VanDerWaalsContact O-N 3.1Å; C917-A921 PolarHBondContact O-N 3.33Å
918	E	61.2	Low	58.8	Low	104 Å²	104	80.1 Å²	80.1	49%	0.486	40%	0.399	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175	-176.6	173.4	-174.5	0	0	112	Q914 E915 T920 A921 N922	Q914-E918 PolarHBondContact O-N 3.14Å; E915-E918 PolarHBondContact O-N 3.3Å; E918-T920 VanDerWaalsContact C-N 3.29Å; E918-T920 PolarHBondContact O-N 3.21Å; E918-A921 PolarHBondContact O-N 3.14Å; E918-N922 WeakPolarHBondContact O-CB 3.44Å; E918-N922 PolarHBondContact O-N 3.46Å; E918-N922 PolarHBondContact O-ND2 3.09Å
919	F	59.2	Low	58.6	Low	145 Å²	145	82.2 Å²	82.2	64%	0.636	41%	0.407	S	S	*	.	H	α-helix	trans	-56.3	-44.5	170.2	179.4	-97.3	0	0	0	111.7	E915 C917 N922 V923	E915-F919 WeakPolarHBondContact O-CB 3.43Å; E915-F919 PolarHBondContact O-N 3.19Å; C917-F919 VanDerWaalsContact C-N 3.34Å; C917-F919 PolarHBondContact O-N 3.42Å; F919-N922 PolarHBondContact O-N 3.28Å; F919-V923 HydrophobicContact CD1-CG2 4.37Å; F919-V923 HydrophobicContact CE1-CG2 3.96Å; F919-V923 HydrophobicContact CZ-CG2 4.07Å; F919-V923 WeakPolarHBondContact O-CG2 3.46Å; F919-V923 PolarHBondContact O-N 3.05Å
920	T	57.3	Low	58.5	Low	79 Å²	79	81 Å²	81	49%	0.485	41%	0.406	S	S	.	.	H	α-helix	trans	-64.7	-43.2	179.9	-53.9	0	0	0	0	111.7	S916 C917 E918 N922 V923 A924	S916-T920 PolarHBondContact O-N 2.97Å; S916-T920 PolarHBondContact O-OG1 2.99Å; C917-T920 WeakPolarHBondContact O-CB 3.49Å; C917-T920 PolarHBondContact O-N 3.43Å; C917-T920 VanDerWaalsContact O-N 3.1Å; E918-T920 VanDerWaalsContact C-N 3.29Å; E918-T920 PolarHBondContact O-N 3.21Å; T920-N922 VanDerWaalsContact C-N 3.35Å; T920-N922 PolarHBondContact O-N 3.5Å; T920-V923 PolarHBondContact O-N 3.25Å; T920-A924 PolarHBondContact O-N 3.31Å
921	A	54.4	Low	58.3	Low	13 Å²	13	82.6 Å²	82.6	11%	0.107	41%	0.41	C	S	.	.	H	α-helix	trans	-64.5	-36.8	174.7	0	0	0	0	0	112.7	C917 E918 A924 R925	C917-A921 PolarHBondContact O-N 3.33Å; E918-A921 PolarHBondContact O-N 3.14Å; A921-A924 PolarHBondContact O-N 2.95Å; A921-R925 WeakPolarHBondContact O-CG 3.36Å; A921-R925 PolarHBondContact O-N 3.47Å; A921-R925 VanDerWaalsContact O-N 3.07Å
922	N	60.5	Low	58.3	Low	70 Å²	70	84.8 Å²	84.8	37%	0.374	41%	0.413	S	S	.	.	H	α-helix	trans	-71.1	-30.4	177.5	-76	-32.2	0	0	0	113.5	E918 F919 T920 R925 Q926	E918-N922 WeakPolarHBondContact O-CB 3.44Å; E918-N922 PolarHBondContact O-N 3.46Å; E918-N922 PolarHBondContact O-ND2 3.09Å; F919-N922 PolarHBondContact O-N 3.28Å; T920-N922 VanDerWaalsContact C-N 3.35Å; T920-N922 PolarHBondContact O-N 3.5Å; N922-R925 PolarHBondContact OD1-NE 3.5Å; N922-R925 PolarHBondContact OD1-NH2 3.32Å; N922-Q926 WeakPolarHBondContact O-CG 3.39Å; N922-Q926 PolarHBondContact O-N 3.46Å
923	V	63.3	Low	58.1	Low	59 Å²	59	84.9 Å²	84.9	36%	0.358	41%	0.412	S	S	.	.	H	α-helix	trans	-64.3	-50.6	169.9	170.8	0	0	0	0	110.2	F919 T920 R925 Q926 E927	F919-V923 HydrophobicContact CD1-CG2 4.37Å; F919-V923 HydrophobicContact CE1-CG2 3.96Å; F919-V923 HydrophobicContact CZ-CG2 4.07Å; F919-V923 WeakPolarHBondContact O-CG2 3.46Å; F919-V923 PolarHBondContact O-N 3.05Å; T920-V923 PolarHBondContact O-N 3.25Å; V923-R925 VanDerWaalsContact C-N 3.33Å; V923-R925 PolarHBondContact O-N 3.43Å; V923-Q926 PolarHBondContact O-N 3.11Å; V923-E927 HydrophobicContact CG1-CG 4.46Å; V923-E927 PolarHBondContact O-N 3.19Å
924	A	53.6	Low	58	Low	22 Å²	22	86.9 Å²	86.9	18%	0.182	42%	0.42	C	S	.	.	H	α-helix	trans	-55.8	-44.6	178.1	0	0	0	0	0	112.8	V730 T920 A921 Q926 E927 E928	V730-A924 HydrophobicContact CG1-CB 4.18Å; V730-A924 HydrophobicContact CG2-CB 3.66Å; T920-A924 PolarHBondContact O-N 3.31Å; A921-A924 PolarHBondContact O-N 2.95Å; A924-Q926 PolarHBondContact O-N 3.31Å; A924-E927 PolarHBondContact O-N 3.49Å; A924-E928 PolarHBondContact O-N 3.35Å; A924-E928 VanDerWaalsContact O-N 3.08Å
925	R	60.6	Low	58.1	Low	94 Å²	94	87.1 Å²	87.1	36%	0.355	42%	0.417	S	S	.	.	H	α-helix	trans	-67.9	-12.4	176.6	-70.8	-172.1	-71.1	-126.5	10.6	114.9	E734 A921 N922 V923 K929	E734-R925 IonicContact OE1-CZ 3.58Å; E734-R925 IonicContact OE1-NH1 2.75Å; E734-R925 PolarHBondContact OE1-NH1 3.33Å; A921-R925 WeakPolarHBondContact O-CG 3.36Å; A921-R925 PolarHBondContact O-N 3.47Å; A921-R925 VanDerWaalsContact O-N 3.07Å; N922-R925 PolarHBondContact OD1-NE 3.5Å; N922-R925 PolarHBondContact OD1-NH2 3.32Å; V923-R925 VanDerWaalsContact C-N 3.33Å; V923-R925 PolarHBondContact O-N 3.43Å; R925-K929 WeakPolarHBondContact O-CD 3.38Å; R925-K929 WeakPolarHBondContact O-CE 3.47Å; R925-K929 WeakPolarHBondContact O-CG 3.45Å
926	Q	53.8	Low	58.2	Low	111 Å²	111	86.9 Å²	86.9	52%	0.519	42%	0.416	S	S	.	.	H	α-helix	trans	-93.6	-37.4	170.1	-70.9	-67.8	-5.5	0	0	111.7	N922 V923 A924 E928 K929 V930	N922-Q926 WeakPolarHBondContact O-CG 3.39Å; N922-Q926 PolarHBondContact O-N 3.46Å; V923-Q926 PolarHBondContact O-N 3.11Å; A924-Q926 PolarHBondContact O-N 3.31Å; Q926-E928 VanDerWaalsContact C-N 3.33Å; Q926-E928 PolarHBondContact O-N 3.1Å; Q926-K929 WeakPolarHBondContact O-CB 3.42Å; Q926-K929 PolarHBondContact O-N 2.83Å; Q926-K929 VanDerWaalsContact O-N 3.14Å; Q926-V930 WeakPolarHBondContact O-CG2 3.4Å; Q926-V930 PolarHBondContact O-N 3.13Å
927	E	55.9	Low	58.1	Low	98 Å²	98	87.6 Å²	87.6	46%	0.458	41%	0.414	S	S	.	.	H	α-helix	trans	-61.3	-40.5	174.8	-68.8	-176.3	168.8	0	0	111.9	V923 A924 K929 V930 R931	V923-E927 HydrophobicContact CG1-CG 4.46Å; V923-E927 PolarHBondContact O-N 3.19Å; A924-E927 PolarHBondContact O-N 3.49Å; E927-K929 VanDerWaalsContact C-N 3.3Å; E927-K929 PolarHBondContact O-N 2.89Å; E927-V930 PolarHBondContact O-N 3.22Å; E927-V930 VanDerWaalsContact O-N 3.16Å; E927-R931 PolarHBondContact O-N 3.22Å
928	E	53.5	Low	58.3	Low	83 Å²	83	89.4 Å²	89.4	39%	0.388	42%	0.42	S	S	.	.	H	α-helix	trans	-58.3	-40.2	173	-167	-162.2	162.3	0	0	112.3	L727 A924 Q926 R931 R932	L727-E928 HydrophobicContact CD2-CG 4.18Å; A924-E928 PolarHBondContact O-N 3.35Å; A924-E928 VanDerWaalsContact O-N 3.08Å; Q926-E928 VanDerWaalsContact C-N 3.33Å; Q926-E928 PolarHBondContact O-N 3.1Å; E928-R931 PolarHBondContact O-N 3.01Å; E928-R932 WeakPolarHBondContact O-CB 3.45Å; E928-R932 PolarHBondContact O-N 3.14Å
929	K	60.7	Low	58.3	Low	121 Å²	121	87.2 Å²	87.2	53%	0.526	42%	0.42	S	S	.	.	H	α-helix	trans	-68.9	-35	177.7	-70	171.7	-174.1	163.9	0	112.2	R925 Q926 E927 K933	R925-K929 WeakPolarHBondContact O-CD 3.38Å; R925-K929 WeakPolarHBondContact O-CE 3.47Å; R925-K929 WeakPolarHBondContact O-CG 3.45Å; Q926-K929 WeakPolarHBondContact O-CB 3.42Å; Q926-K929 PolarHBondContact O-N 2.83Å; Q926-K929 VanDerWaalsContact O-N 3.14Å; E927-K929 VanDerWaalsContact C-N 3.3Å; E927-K929 PolarHBondContact O-N 2.89Å; K929-K933 WeakPolarHBondContact O-CG 3.3Å; K929-K933 PolarHBondContact O-N 3.05Å
930	V	58.3	Low	58.6	Low	75 Å²	75	83.1 Å²	83.1	46%	0.455	40%	0.4	S	S	.	.	H	α-helix	trans	-67.1	-47.2	173.5	173.7	0	0	0	0	110	Q926 E927 R932 K933 E934	Q926-V930 WeakPolarHBondContact O-CG2 3.4Å; Q926-V930 PolarHBondContact O-N 3.13Å; E927-V930 PolarHBondContact O-N 3.22Å; E927-V930 VanDerWaalsContact O-N 3.16Å; V930-R932 PolarHBondContact O-N 3.49Å; V930-K933 CarbonylContact O-C 3.55Å; V930-K933 WeakPolarHBondContact O-CA 3.39Å; V930-K933 VanDerWaalsContact O-CB 3.27Å; V930-K933 WeakPolarHBondContact O-CB 3.33Å; V930-K933 PolarHBondContact O-N 2.88Å; V930-E934 HydrophobicContact CG1-CG 4.38Å; V930-E934 WeakPolarHBondContact O-CG 3.47Å; V930-E934 PolarHBondContact O-N 3.39Å
931	R	57.7	Low	58.6	Low	70 Å²	70	83.2 Å²	83.2	26%	0.264	39%	0.392	S	S	.	.	H	α-helix	trans	-66.2	-33.7	178.7	-69.8	-168.1	-170.7	152.1	16.6	114.2	E927 E928 K933 E934 R935	E927-R931 PolarHBondContact O-N 3.22Å; E928-R931 PolarHBondContact O-N 3.01Å; R931-K933 VanDerWaalsContact C-N 3.3Å; R931-K933 PolarHBondContact O-N 2.9Å; R931-E934 PolarHBondContact O-N 2.86Å; R931-R935 WeakPolarHBondContact O-CG 3.3Å; R931-R935 PolarHBondContact O-N 3.23Å
932	R	60.6	Low	58.8	Low	157 Å²	157	85.4 Å²	85.4	59%	0.592	40%	0.4	S	S	*	.	H	α-helix	trans	-61.5	-40.6	170.3	-166.2	175.8	-169.1	146	3.9	111.5	E928 V930 E936	E928-R932 WeakPolarHBondContact O-CB 3.45Å; E928-R932 PolarHBondContact O-N 3.14Å; V930-R932 PolarHBondContact O-N 3.49Å; R932-E936 WeakPolarHBondContact O-CG 3.45Å; R932-E936 PolarHBondContact O-N 2.95Å; R932-E936 VanDerWaalsContact O-N 3.12Å
933	K	57.5	Low	59	Low	122 Å²	122	85 Å²	85	53%	0.53	41%	0.406	S	S	.	.	H	α-helix	trans	-66.8	-39.6	174	-80.3	-79.8	164.1	-144.7	0	112.6	K929 V930 R931 E936 I937	K929-K933 WeakPolarHBondContact O-CG 3.3Å; K929-K933 PolarHBondContact O-N 3.05Å; V930-K933 CarbonylContact O-C 3.55Å; V930-K933 WeakPolarHBondContact O-CA 3.39Å; V930-K933 VanDerWaalsContact O-CB 3.27Å; V930-K933 WeakPolarHBondContact O-CB 3.33Å; V930-K933 PolarHBondContact O-N 2.88Å; R931-K933 VanDerWaalsContact C-N 3.3Å; R931-K933 PolarHBondContact O-N 2.9Å; K933-E936 IonicContact NZ-OE2 3.71Å; K933-E936 PolarHBondContact NZ-OE2 3.14Å; K933-E936 PolarHBondContact O-N 2.95Å; K933-I937 WeakPolarHBondContact O-CD1 3.29Å; K933-I937 VanDerWaalsContact O-CG1 3.29Å; K933-I937 WeakPolarHBondContact O-CG1 3.45Å; K933-I937 PolarHBondContact O-N 2.7Å
934	E	57.4	Low	58.9	Low	98 Å²	98	85 Å²	85	46%	0.458	40%	0.402	S	S	.	.	H	α-helix	trans	-65.8	-42.1	177	-70.6	166.9	161.3	0	0	111.4	V930 R931 E936 I937 L938	V930-E934 HydrophobicContact CG1-CG 4.38Å; V930-E934 WeakPolarHBondContact O-CG 3.47Å; V930-E934 PolarHBondContact O-N 3.39Å; R931-E934 PolarHBondContact O-N 2.86Å; E934-E936 PolarHBondContact O-N 3.37Å; E934-I937 PolarHBondContact O-N 2.98Å; E934-I937 VanDerWaalsContact O-N 3.13Å; E934-L938 WeakPolarHBondContact O-CG 3.29Å; E934-L938 PolarHBondContact O-N 3.02Å
935	R	58.5	Low	59	Low	101 Å²	101	89.3 Å²	89.3	38%	0.381	42%	0.418	S	S	.	.	H	α-helix	trans	-62.2	-40.1	172.8	-73.9	-177.1	-67.6	170.4	-5.5	113.2	E723 R931 I937 L938 A939	E723-R935 IonicContact OE1-CZ 3.03Å; E723-R935 IonicContact OE1-NE 3.41Å; E723-R935 PolarHBondContact OE1-NE 2.97Å; E723-R935 IonicContact OE1-NH1 2.98Å; E723-R935 IonicContact OE1-NH2 2.74Å; E723-R935 PolarHBondContact OE1-NH2 3.48Å; E723-R935 IonicContact OE2-CZ 2.77Å; E723-R935 IonicContact OE2-NE 3.61Å; E723-R935 IonicContact OE2-NH1 2.72Å; E723-R935 PolarHBondContact OE2-NH1 2.88Å; E723-R935 IonicContact OE2-NH2 3.55Å; E723-R935 PolarHBondContact OE2-NH2 2.72Å; R931-R935 WeakPolarHBondContact O-CG 3.3Å; R931-R935 PolarHBondContact O-N 3.23Å; R935-I937 VanDerWaalsContact C-N 3.3Å; R935-I937 PolarHBondContact O-N 2.8Å; R935-L938 PolarHBondContact O-N 2.89Å; R935-A939 WeakPolarHBondContact O-CB 3.5Å; R935-A939 PolarHBondContact O-N 3.48Å
936	E	62.3	Low	58.9	Low	101 Å²	101	89.9 Å²	89.9	47%	0.472	42%	0.42	S	S	.	.	H	α-helix	trans	-59.5	-40	171.9	-75.4	173.7	-178	0	0	111.7	R932 K933 E934 W940	R932-E936 WeakPolarHBondContact O-CG 3.45Å; R932-E936 PolarHBondContact O-N 2.95Å; R932-E936 VanDerWaalsContact O-N 3.12Å; K933-E936 IonicContact NZ-OE2 3.71Å; K933-E936 PolarHBondContact NZ-OE2 3.14Å; K933-E936 PolarHBondContact O-N 2.95Å; E934-E936 PolarHBondContact O-N 3.37Å; E936-W940 VanDerWaalsContact O-CB 3.23Å; E936-W940 WeakPolarHBondContact O-CB 3.43Å; E936-W940 PolarHBondContact O-N 3.28Å
937	I	60.3	Low	59.4	Low	75 Å²	75	89.5 Å²	89.5	39%	0.385	42%	0.419	S	S	.	.	H	α-helix	trans	-72.7	-40.1	179.3	-68.4	163.3	0	0	0	111.8	K933 E934 R935 R941	K933-I937 WeakPolarHBondContact O-CD1 3.29Å; K933-I937 VanDerWaalsContact O-CG1 3.29Å; K933-I937 WeakPolarHBondContact O-CG1 3.45Å; K933-I937 PolarHBondContact O-N 2.7Å; E934-I937 PolarHBondContact O-N 2.98Å; E934-I937 VanDerWaalsContact O-N 3.13Å; R935-I937 VanDerWaalsContact C-N 3.3Å; R935-I937 PolarHBondContact O-N 2.8Å; I937-R941 VanDerWaalsContact O-CG 3.26Å; I937-R941 WeakPolarHBondContact O-CG 3.28Å; I937-R941 PolarHBondContact O-N 3.23Å
938	L	58.8	Low	59.4	Low	79 Å²	79	87.1 Å²	87.1	41%	0.414	42%	0.416	S	S	.	.	H	α-helix	trans	-66.7	-50.4	178.2	-72.3	170.9	0	0	0	111.6	L719 E934 R935 W940 R941 E942	L719-L938 HydrophobicContact CD1-CD1 4.29Å; E934-L938 WeakPolarHBondContact O-CG 3.29Å; E934-L938 PolarHBondContact O-N 3.02Å; R935-L938 PolarHBondContact O-N 2.89Å; L938-W940 PolarHBondContact O-N 3.49Å; L938-R941 WeakPolarHBondContact O-CB 3.3Å; L938-R941 PolarHBondContact O-N 3.5Å; L938-E942 PolarHBondContact O-N 3.33Å
939	A	60.9	Low	59.4	Low	58 Å²	58	86.5 Å²	86.5	48%	0.479	42%	0.415	S	S	.	.	H	α-helix	trans	-60	-34.8	177.2	0	0	0	0	0	112.3	R935 A943	R935-A939 WeakPolarHBondContact O-CB 3.5Å; R935-A939 PolarHBondContact O-N 3.48Å; A939-A943 WeakPolarHBondContact O-CB 3.26Å; A939-A943 PolarHBondContact O-N 3.33Å; A939-A943 VanDerWaalsContact O-N 3.15Å
940	W	65.8	Low	59.4	Low	59 Å²	59	85.4 Å²	85.4	22%	0.223	41%	0.412	C	S	.	.	H	α-helix	trans	-65.1	-42.5	173.2	-171.5	105.6	0	0	0	111.4	E936 L938 A943 Q944 I1051 Y1054 I1055	E936-W940 VanDerWaalsContact O-CB 3.23Å; E936-W940 WeakPolarHBondContact O-CB 3.43Å; E936-W940 PolarHBondContact O-N 3.28Å; L938-W940 PolarHBondContact O-N 3.49Å; W940-A943 PolarHBondContact O-N 3.06Å; W940-Q944 HydrophobicContact CE3-CB 4.37Å; W940-Q944 HydrophobicContact CH2-CB 3.88Å; W940-Q944 HydrophobicContact CH2-CG 3.86Å; W940-Q944 HydrophobicContact CZ3-CB 3.55Å; W940-Q944 HydrophobicContact CZ3-CG 4.03Å; W940-Q944 PolarHBondContact O-N 3.33Å; W940-Q944 VanDerWaalsContact O-N 3.13Å; W940-I1051 HydrophobicContact CD2-CG2 3.86Å; W940-I1051 HydrophobicContact CE3-CB 4.13Å; W940-I1051 HydrophobicContact CE3-CD1 4.19Å; W940-I1051 HydrophobicContact CE3-CG1 4.21Å; W940-I1051 HydrophobicContact CE3-CG2 3.26Å; W940-I1051 HydrophobicContact CH2-CB 3.56Å; W940-I1051 HydrophobicContact CH2-CD1 4.3Å; W940-I1051 HydrophobicContact CH2-CG1 3.54Å; W940-I1051 HydrophobicContact CH2-CG2 3.52Å; W940-I1051 HydrophobicContact CZ2-CB 4.28Å; W940-I1051 HydrophobicContact CZ2-CG2 3.96Å; W940-I1051 HydrophobicContact CZ3-CB 3.49Å; W940-I1051 VanDerWaalsContact CZ3-CB 3.49Å; W940-I1051 HydrophobicContact CZ3-CD1 3.51Å; W940-I1051 HydrophobicContact CZ3-CG1 3.26Å; W940-I1051 HydrophobicContact CZ3-CG2 3.17Å; W940-Y1054 HydrophobicContact CZ2-CD1 4.2Å; W940-I1055 HydrophobicContact CD2-CD1 3.98Å; W940-I1055 HydrophobicContact CD2-CG1 4.36Å; W940-I1055 HydrophobicContact CG-CD1 4.08Å; W940-I1055 HydrophobicContact CG-CG1 4.43Å; W940-I1055 HydrophobicContact CZ2-CG1 4.46Å
941	R	55.5	Low	59.4	Low	82 Å²	82	85.8 Å²	85.8	31%	0.309	41%	0.408	S	S	.	.	H	α-helix	trans	-67.7	-42.6	179.5	-74.1	166.4	-178.6	-132.8	-5.9	112.1	I937 L938 A943 Q944 Q945 E1048 I1051	I937-R941 VanDerWaalsContact O-CG 3.26Å; I937-R941 WeakPolarHBondContact O-CG 3.28Å; I937-R941 PolarHBondContact O-N 3.23Å; L938-R941 WeakPolarHBondContact O-CB 3.3Å; L938-R941 PolarHBondContact O-N 3.5Å; R941-A943 VanDerWaalsContact C-N 3.33Å; R941-A943 PolarHBondContact O-N 2.97Å; R941-Q944 PolarHBondContact O-N 2.95Å; R941-Q945 WeakPolarHBondContact O-CG 3.33Å; R941-Q945 PolarHBondContact O-N 3.42Å; R941-E1048 IonicContact CZ-OE1 3.39Å; R941-E1048 IonicContact NH1-OE1 3.73Å; R941-E1048 PolarHBondContact NH1-OE1 3.05Å; R941-E1048 VanDerWaalsContact NH2-CD 3.26Å; R941-E1048 IonicContact NH2-OE1 3.09Å; R941-E1048 PolarHBondContact NH2-OE1 3.39Å; R941-E1048 IonicContact NH2-OE2 2.67Å; R941-I1051 HydrophobicContact CG-CD1 4.19Å
942	E	59.4	Low	59.2	Low	59 Å²	59	84.3 Å²	84.3	28%	0.276	41%	0.411	S	S	.	.	H	α-helix	trans	-57.5	-46.1	173.9	-72	179.5	156.9	0	0	111	L938 Q944 Q945 R946	L938-E942 PolarHBondContact O-N 3.33Å; E942-Q944 VanDerWaalsContact C-N 3.34Å; E942-Q944 PolarHBondContact O-N 3.29Å; E942-Q945 PolarHBondContact O-N 3Å; E942-R946 VanDerWaalsContact O-CB 3.31Å; E942-R946 WeakPolarHBondContact O-CB 3.41Å; E942-R946 PolarHBondContact O-N 2.96Å
943	A	65.1	Low	58.8	Low	60 Å²	60	79.7 Å²	79.7	50%	0.496	40%	0.4	S	S	.	.	H	α-helix	trans	-59.6	-42.1	176.4	0	0	0	0	0	112.5	A939 W940 R941 R946 E947	A939-A943 WeakPolarHBondContact O-CB 3.26Å; A939-A943 PolarHBondContact O-N 3.33Å; A939-A943 VanDerWaalsContact O-N 3.15Å; W940-A943 PolarHBondContact O-N 3.06Å; R941-A943 VanDerWaalsContact C-N 3.33Å; R941-A943 PolarHBondContact O-N 2.97Å; A943-R946 PolarHBondContact O-N 3.24Å; A943-E947 PolarHBondContact O-N 3.02Å
944	Q	60.2	Low	58.8	Low	61 Å²	61	75.4 Å²	75.4	29%	0.285	39%	0.388	S	S	.	.	H	α-helix	trans	-74.2	-33.6	180	-149.3	-162.9	35.3	0	0	113.3	W940 R941 E942 A948	W940-Q944 HydrophobicContact CE3-CB 4.37Å; W940-Q944 HydrophobicContact CH2-CB 3.88Å; W940-Q944 HydrophobicContact CH2-CG 3.86Å; W940-Q944 HydrophobicContact CZ3-CB 3.55Å; W940-Q944 HydrophobicContact CZ3-CG 4.03Å; W940-Q944 PolarHBondContact O-N 3.33Å; W940-Q944 VanDerWaalsContact O-N 3.13Å; R941-Q944 PolarHBondContact O-N 2.95Å; E942-Q944 VanDerWaalsContact C-N 3.34Å; E942-Q944 PolarHBondContact O-N 3.29Å; Q944-A948 WeakPolarHBondContact O-CB 3.49Å; Q944-A948 PolarHBondContact O-N 3.5Å
945	Q	56.3	Low	58.7	Low	112 Å²	112	77.7 Å²	77.7	52%	0.523	39%	0.392	S	S	.	.	H	α-helix	trans	-66.8	-41	172.3	-75.3	-177.7	-24.5	0	0	111.3	R941 E942 A948 L949	R941-Q945 WeakPolarHBondContact O-CG 3.33Å; R941-Q945 PolarHBondContact O-N 3.42Å; E942-Q945 PolarHBondContact O-N 3Å; Q945-A948 PolarHBondContact O-N 3.27Å; Q945-L949 WeakPolarHBondContact O-CB 3.42Å; Q945-L949 WeakPolarHBondContact O-CG 3.33Å; Q945-L949 PolarHBondContact O-N 3.4Å
946	R	58.9	Low	58.3	Low	105 Å²	105	74.8 Å²	74.8	40%	0.396	38%	0.384	S	S	.	.	H	α-helix	trans	-61.1	-46	174.1	-176.2	172.9	175.3	159.1	-1.2	112.1	E942 A943 A948 L949 E950	E942-R946 VanDerWaalsContact O-CB 3.31Å; E942-R946 WeakPolarHBondContact O-CB 3.41Å; E942-R946 PolarHBondContact O-N 2.96Å; A943-R946 PolarHBondContact O-N 3.24Å; R946-A948 VanDerWaalsContact C-N 3.35Å; R946-A948 PolarHBondContact O-N 2.9Å; R946-L949 PolarHBondContact O-N 3.04Å; R946-E950 WeakPolarHBondContact CG-OE1 3.49Å; R946-E950 IonicContact NE-OE1 2.64Å; R946-E950 PolarHBondContact NE-OE1 2.99Å; R946-E950 VanDerWaalsContact NE-OE1 3.13Å; R946-E950 IonicContact NH2-OE1 3.14Å; R946-E950 WeakPolarHBondContact O-CG 3.32Å; R946-E950 PolarHBondContact O-N 3.36Å
947	E	63.1	Low	57.8	Low	104 Å²	104	72.6 Å²	72.6	49%	0.486	37%	0.374	S	S	.	.	H	α-helix	trans	-61.1	-42.6	175.3	-165.9	-162.8	159.2	0	0	111.7	A943 L949 E950 Q951	A943-E947 PolarHBondContact O-N 3.02Å; E947-L949 VanDerWaalsContact C-N 3.31Å; E947-L949 PolarHBondContact O-N 3.3Å; E947-E950 PolarHBondContact O-N 3.29Å; E947-Q951 WeakPolarHBondContact O-CB 3.38Å; E947-Q951 VanDerWaalsContact O-CG 3.25Å; E947-Q951 WeakPolarHBondContact O-CG 3.29Å; E947-Q951 PolarHBondContact O-N 3.41Å; E947-Q951 PolarHBondContact OE1-NE2 3.15Å
948	A	55.7	Low	57.5	Low	47 Å²	47	77.1 Å²	77.1	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-63.6	-36.9	177.1	0	0	0	0	0	112.5	Q944 Q945 R946 A952	Q944-A948 WeakPolarHBondContact O-CB 3.49Å; Q944-A948 PolarHBondContact O-N 3.5Å; Q945-A948 PolarHBondContact O-N 3.27Å; R946-A948 VanDerWaalsContact C-N 3.35Å; R946-A948 PolarHBondContact O-N 2.9Å; A948-A952 WeakPolarHBondContact O-CB 3.38Å; A948-A952 PolarHBondContact O-N 3.15Å
949	L	55.1	Low	57.1	Low	70 Å²	70	81.1 Å²	81.1	37%	0.366	40%	0.396	S	S	.	.	H	α-helix	trans	-72.7	-44.9	176.5	-80.1	168.4	0	0	0	112.5	C705 Q945 R946 E947 Q951 A952 V953	C705-L949 WeakPolarHBondContact SG-CD2 3.46Å; Q945-L949 WeakPolarHBondContact O-CB 3.42Å; Q945-L949 WeakPolarHBondContact O-CG 3.33Å; Q945-L949 PolarHBondContact O-N 3.4Å; R946-L949 PolarHBondContact O-N 3.04Å; E947-L949 VanDerWaalsContact C-N 3.31Å; E947-L949 PolarHBondContact O-N 3.3Å; L949-Q951 VanDerWaalsContact C-N 3.26Å; L949-Q951 PolarHBondContact O-N 2.93Å; L949-A952 CarbonylContact O-C 3.51Å; L949-A952 WeakPolarHBondContact O-CA 3.44Å; L949-A952 WeakPolarHBondContact O-CB 3.44Å; L949-A952 PolarHBondContact O-N 2.93Å; L949-V953 WeakPolarHBondContact O-CG2 3.33Å; L949-V953 PolarHBondContact O-N 3.38Å
950	E	60	Low	56.4	Low	99 Å²	99	79.9 Å²	79.9	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-59	-38.8	172.1	-75	173.2	-168	0	0	110.9	R946 E947 A952 A954	R946-E950 WeakPolarHBondContact CG-OE1 3.49Å; R946-E950 IonicContact NE-OE1 2.64Å; R946-E950 PolarHBondContact NE-OE1 2.99Å; R946-E950 VanDerWaalsContact NE-OE1 3.13Å; R946-E950 IonicContact NH2-OE1 3.14Å; R946-E950 WeakPolarHBondContact O-CG 3.32Å; R946-E950 PolarHBondContact O-N 3.36Å; E947-E950 PolarHBondContact O-N 3.29Å; E950-A952 VanDerWaalsContact C-N 3.32Å; E950-A952 PolarHBondContact O-N 3.11Å; E950-A954 WeakPolarHBondContact O-CB 3.46Å; E950-A954 PolarHBondContact O-N 2.69Å
951	Q	58.7	Low	55.4	Low	83 Å²	83	80 Å²	80	39%	0.388	39%	0.394	S	S	.	.	H	α-helix	trans	-70.2	-22.6	172.5	-71.2	-179.1	23	0	0	114.2	E947 L949 R955	E947-Q951 WeakPolarHBondContact O-CB 3.38Å; E947-Q951 VanDerWaalsContact O-CG 3.25Å; E947-Q951 WeakPolarHBondContact O-CG 3.29Å; E947-Q951 PolarHBondContact O-N 3.41Å; E947-Q951 PolarHBondContact OE1-NE2 3.15Å; L949-Q951 VanDerWaalsContact C-N 3.26Å; L949-Q951 PolarHBondContact O-N 2.93Å; Q951-R955 WeakPolarHBondContact O-CB 3.42Å; Q951-R955 WeakPolarHBondContact O-CG 3.47Å; Q951-R955 PolarHBondContact O-N 2.77Å; Q951-R955 PolarHBondContact O-NE 3.46Å
952	A	53.3	Low	55	Low	39 Å²	39	79 Å²	79	32%	0.322	40%	0.403	S	S	.	.	H	α-helix	trans	-81	-46.7	174.4	0	0	0	0	0	110.9	A948 L949 E950 R955 L956	A948-A952 WeakPolarHBondContact O-CB 3.38Å; A948-A952 PolarHBondContact O-N 3.15Å; L949-A952 CarbonylContact O-C 3.51Å; L949-A952 WeakPolarHBondContact O-CA 3.44Å; L949-A952 WeakPolarHBondContact O-CB 3.44Å; L949-A952 PolarHBondContact O-N 2.93Å; E950-A952 VanDerWaalsContact C-N 3.32Å; E950-A952 PolarHBondContact O-N 3.11Å; A952-R955 WeakPolarHBondContact O-CA 3.42Å; A952-R955 WeakPolarHBondContact O-CB 3.49Å; A952-R955 PolarHBondContact O-N 3.35Å; A952-L956 PolarHBondContact O-N 2.98Å
953	V	52.5	Low	54.3	Low	59 Å²	59	80.2 Å²	80.2	36%	0.358	41%	0.411	S	S	.	.	H	α-helix	trans	-57.9	-49.1	171.6	174.7	0	0	0	0	109.9	L949 R955 L956 E957	L949-V953 WeakPolarHBondContact O-CG2 3.33Å; L949-V953 PolarHBondContact O-N 3.38Å; V953-R955 PolarHBondContact O-N 2.89Å; V953-R955 VanDerWaalsContact O-N 3.13Å; V953-L956 CarbonylContact O-C 3.44Å; V953-L956 PolarHBondContact O-N 2.98Å; V953-L956 VanDerWaalsContact O-N 3.08Å; V953-E957 HydrophobicContact CG1-CG 4.13Å; V953-E957 WeakPolarHBondContact O-CB 3.44Å; V953-E957 PolarHBondContact O-N 2.92Å
954	A	57.9	Low	52.9	Low	33 Å²	33	80 Å²	80	27%	0.273	40%	0.397	S	S	.	.	H	α-helix	trans	-65.7	-15.6	176	0	0	0	0	0	114.1	E950 R958	E950-A954 WeakPolarHBondContact O-CB 3.46Å; E950-A954 PolarHBondContact O-N 2.69Å; A954-R958 WeakPolarHBondContact O-CB 3.41Å; A954-R958 WeakPolarHBondContact O-CG 3.42Å; A954-R958 PolarHBondContact O-N 2.91Å; A954-R958 PolarHBondContact O-NE 2.96Å
955	R	54.8	Low	52	Low	146 Å²	146	80.9 Å²	80.9	55%	0.551	41%	0.408	S	S	*	.	H	α-helix	trans	-84.9	-37.7	170.7	-90.3	178.8	-91.1	-154.8	-6.9	111.8	Q951 A952 V953 R958 R959	Q951-R955 WeakPolarHBondContact O-CB 3.42Å; Q951-R955 WeakPolarHBondContact O-CG 3.47Å; Q951-R955 PolarHBondContact O-N 2.77Å; Q951-R955 PolarHBondContact O-NE 3.46Å; A952-R955 WeakPolarHBondContact O-CA 3.42Å; A952-R955 WeakPolarHBondContact O-CB 3.49Å; A952-R955 PolarHBondContact O-N 3.35Å; V953-R955 PolarHBondContact O-N 2.89Å; V953-R955 VanDerWaalsContact O-N 3.13Å; R955-R958 PolarHBondContact O-N 3.3Å; R955-R959 PolarHBondContact O-N 2.95Å
956	L	51	Low	51.2	Low	39 Å²	39	81.9 Å²	81.9	20%	0.204	42%	0.417	C	S	.	.	H	α-helix	trans	-76.2	-39.2	176	-71.7	164.4	0	0	0	112.2	L698 L701 A952 V953 R958 R959 H960	L698-L956 HydrophobicContact CD1-CB 4.17Å; L698-L956 HydrophobicContact CD2-CB 3.71Å; L698-L956 HydrophobicContact CD2-CD1 3.79Å; L698-L956 HydrophobicContact CD2-CG 4.3Å; L698-L956 HydrophobicContact CG-CB 4.06Å; L698-L956 HydrophobicContact CG-CD1 4.14Å; L698-L956 HydrophobicContact CG-CD2 4.48Å; L698-L956 HydrophobicContact CG-CG 4.46Å; L701-L956 HydrophobicContact CD1-CD1 4.19Å; A952-L956 PolarHBondContact O-N 2.98Å; V953-L956 CarbonylContact O-C 3.44Å; V953-L956 PolarHBondContact O-N 2.98Å; V953-L956 VanDerWaalsContact O-N 3.08Å; L956-R958 VanDerWaalsContact C-N 3.29Å; L956-R958 PolarHBondContact O-N 2.97Å; L956-R959 CarbonylContact O-C 3.6Å; L956-R959 WeakPolarHBondContact O-CA 3.48Å; L956-R959 WeakPolarHBondContact O-CB 3.37Å; L956-R959 PolarHBondContact O-N 3.44Å; L956-R959 VanDerWaalsContact O-N 3.1Å; L956-H960 PolarHBondContact O-N 3.43Å
957	E	50.9	Low	50.3	Low	56 Å²	56	86.5 Å²	86.5	26%	0.262	43%	0.434	S	S	.	.	H	α-helix	trans	-60.5	-37	167.9	-75.9	-165.9	141.5	0	0	111.3	V953 H960 A961 R1006	V953-E957 HydrophobicContact CG1-CG 4.13Å; V953-E957 WeakPolarHBondContact O-CB 3.44Å; V953-E957 PolarHBondContact O-N 2.92Å; E957-H960 PolarHBondContact O-N 2.99Å; E957-A961 WeakPolarHBondContact O-CB 3.31Å; E957-A961 PolarHBondContact O-N 2.97Å; E957-R1006 IonicContact OE1-CZ 2.87Å; E957-R1006 IonicContact OE1-NE 3.88Å; E957-R1006 PolarHBondContact OE1-NE 3.32Å; E957-R1006 IonicContact OE1-NH2 4Å; E957-R1006 PolarHBondContact OE1-NH2 3.32Å; E957-R1006 VanDerWaalsContact OE1-NH2 3.1Å; E957-R1006 IonicContact OE2-CZ 2.83Å; E957-R1006 IonicContact OE2-NE 2.91Å; E957-R1006 IonicContact OE2-NH2 3.28Å; E957-R1006 PolarHBondContact OE2-NH2 3.03Å
958	R	53.6	Low	48.7	Very low	170 Å²	170	92.7 Å²	92.7	64%	0.642	45%	0.453	S	S	*	.	H	α-helix	trans	-68.3	-32.9	172.3	-86.6	-178.8	-78.7	-167.9	-7.6	113	A954 R955 L956 A962	A954-R958 WeakPolarHBondContact O-CB 3.41Å; A954-R958 WeakPolarHBondContact O-CG 3.42Å; A954-R958 PolarHBondContact O-N 2.91Å; A954-R958 PolarHBondContact O-NE 2.96Å; R955-R958 PolarHBondContact O-N 3.3Å; L956-R958 VanDerWaalsContact C-N 3.29Å; L956-R958 PolarHBondContact O-N 2.97Å; R958-A962 VanDerWaalsContact O-CB 3.25Å; R958-A962 WeakPolarHBondContact O-CB 3.24Å; R958-A962 PolarHBondContact O-N 3.49Å
959	R	49.5	Very low	47.7	Very low	163 Å²	163	102 Å²	102	62%	0.615	48%	0.478	S	S	*	.	H	α-helix	trans	-66.1	-41.8	168.6	-93.5	179	162.7	-176	-6.6	112.2	R955 L956 L963	R955-R959 PolarHBondContact O-N 2.95Å; L956-R959 CarbonylContact O-C 3.6Å; L956-R959 WeakPolarHBondContact O-CA 3.48Å; L956-R959 WeakPolarHBondContact O-CB 3.37Å; L956-R959 PolarHBondContact O-N 3.44Å; L956-R959 VanDerWaalsContact O-N 3.1Å; R959-L963 WeakPolarHBondContact O-CG 3.42Å
960	H	46.4	Very low	46.8	Very low	31 Å²	31	101.9 Å²	101.9	14%	0.144	49%	0.488	C	S	.	.	H	α-helix	trans	-74.6	-35.3	179.9	-168.9	-62	0	0	0	112.5	L956 E957 L963	L956-H960 PolarHBondContact O-N 3.43Å; E957-H960 PolarHBondContact O-N 2.99Å; H960-L963 WeakPolarHBondContact O-CB 3.45Å; H960-L963 PolarHBondContact O-N 3.29Å
961	A	46.5	Very low	45.2	Very low	63 Å²	63	106.3 Å²	106.3	52%	0.521	51%	0.508	S	S	.	.	H	α-helix	trans	-72.1	-31.6	174.3	0	0	0	0	0	111.9	E957 L963 R964	E957-A961 WeakPolarHBondContact O-CB 3.31Å; E957-A961 PolarHBondContact O-N 2.97Å; A961-L963 PolarHBondContact O-N 3.47Å; A961-R964 PolarHBondContact O-N 2.92Å; A961-R964 VanDerWaalsContact O-N 3.09Å; A961-R964 VanDerWaalsContact O-O 3.14Å
962	A	46.4	Very low	44.6	Very low	60 Å²	60	108.1 Å²	108.1	50%	0.496	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-7.7	169.8	0	0	0	0	0	113.7	R958	R958-A962 VanDerWaalsContact O-CB 3.25Å; R958-A962 WeakPolarHBondContact O-CB 3.24Å; R958-A962 PolarHBondContact O-N 3.49Å
963	L	43.7	Very low	43.3	Very low	85 Å²	85	113.6 Å²	113.6	45%	0.445	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.8	-9	171.4	-65.3	168.4	0	0	0	113	A691 R959 H960 A961	A691-L963 HydrophobicContact CB-CD1 4.46Å; R959-L963 WeakPolarHBondContact O-CG 3.42Å; H960-L963 WeakPolarHBondContact O-CB 3.45Å; H960-L963 PolarHBondContact O-N 3.29Å; A961-L963 PolarHBondContact O-N 3.47Å
964	R	37	Very low	42.2	Very low	54 Å²	54	115.9 Å²	115.9	20%	0.204	57%	0.568	C	S	.	*			trans	-105.1	127.2	174.6	-89.1	-159.1	-169.4	113	8.7	112.4	A961 E995 E999	A961-R964 PolarHBondContact O-N 2.92Å; A961-R964 VanDerWaalsContact O-N 3.09Å; A961-R964 VanDerWaalsContact O-O 3.14Å; R964-E995 PolarHBondContact NH2-O 2.92Å; R964-E999 WeakPolarHBondContact CD-OE1 3.24Å; R964-E999 IonicContact CZ-OE1 3.98Å; R964-E999 IonicContact CZ-OE2 3.27Å; R964-E999 IonicContact NE-OE1 2.7Å; R964-E999 PolarHBondContact NE-OE1 3.43Å; R964-E999 IonicContact NE-OE2 2.69Å; R964-E999 PolarHBondContact NE-OE2 3.17Å; R964-E999 IonicContact NH1-OE1 2.95Å; R964-E999 PolarHBondContact NH1-OE1 3.43Å; R964-E999 IonicContact NH1-OE2 3.64Å
965	P	41.2	Very low	40.9	Very low	81 Å²	81	122.7 Å²	122.7	53%	0.526	59%	0.594	S	S	.	*			trans	-94.3	126.5	168.7	34.1	-28	0	0	0	110.8	I393	I393-P965 HydrophobicContact CD1-CB 3.51Å
966	D	40	Very low	39.7	Very low	132 Å²	132	126.4 Å²	126.4	71%	0.706	61%	0.608	S	S	*	*			trans	-148.5	152.1	151.5	-146.9	13.8	0	0	0	117.3
967	R	38.4	Very low	38.8	Very low	202 Å²	202	129.6 Å²	129.6	76%	0.762	63%	0.634	S	S	*	*			trans	-46.1	139.6	179.1	-58.4	148.9	174.4	144.8	-10.1	114.3
968	R	31.1	Very low	37.9	Very low	234 Å²	234	131.3 Å²	131.3	88%	0.883	66%	0.658	S	S	*	*				-173.5	119.5	114.4	-97.3	149.9	-162.4	-125.6	4	114.6
969	R	34	Very low	36.9	Very low	242 Å²	242	129 Å²	129	91%	0.913	67%	0.667	S	S	*	*			trans	61.1	103.2	147	-71.4	-175.5	170.4	-178.8	-4.2	120.1
970	A	35.3	Very low	36	Very low	68 Å²	68	124.9 Å²	124.9	56%	0.562	68%	0.676	S	S	*	*			trans	-66.9	159.2	136.9	0	0	0	0	0	111.7
971	Q	27.6	Very low	35.2	Very low	192 Å²	192	129.6 Å²	129.6	90%	0.897	71%	0.712	S	S	*	*			trans	-133.6	122.3	154.9	-141.2	178.4	9.4	0	0	106.3
972	P	45.5	Very low	34.4	Very low	121 Å²	121	130 Å²	130	79%	0.786	72%	0.723	S	S	*	*			trans	-101.3	163.6	-171.3	38.3	-34.6	0	0	0	112.5
973	D	26.8	Very low	33.5	Very low	155 Å²	155	133 Å²	133	83%	0.829	74%	0.738	S	S	*	*			trans	-138.6	160.4	160.8	-138.7	-26.2	0	0	0	111.1
974	C	27.8	Very low	33	Very low	106 Å²	106	134.7 Å²	134.7	72%	0.716	76%	0.758	S	S	*	*			trans	75.6	81.5	173.5	-60.5	0	0	0	0	120.1
975	H	32	Very low	32.5	Very low	177 Å²	177	136 Å²	136	82%	0.819	79%	0.788	S	S	*	*				49.4	122.8	128.3	-71.1	-57.2	0	0	0	125.3
976	R	30.1	Very low	32	Very low	224 Å²	224	144.2 Å²	144.2	85%	0.845	81%	0.808	S	S	*	*			trans	84.3	87.5	132.5	-86.1	-170.4	172.6	-173.4	-1.4	121.9
977	S	31.1	Very low	32.1	Very low	105 Å²	105	143.7 Å²	143.7	73%	0.734	81%	0.812	S	S	*	*				80.2	133.9	107.1	63.8	0	0	0	0	122.9
978	A	31.8	Very low	31.5	Very low	93 Å²	93	137.9 Å²	137.9	77%	0.769	82%	0.815	S	S	*	*			trans	92.8	133.7	157.1	0	0	0	0	0	117.2
979	S	33.2	Very low	32.1	Very low	120 Å²	120	138.8 Å²	138.8	84%	0.839	82%	0.818	S	S	*	*			cis	173.4	136.6	-21.2	43.4	0	0	0	0	108.1
980	G	29.3	Very low	31.9	Very low	77 Å²	77	132.8 Å²	132.8	79%	0.794	81%	0.814	S	S	*	*			trans	102.4	147.1	167	0	0	0	0	0	114.9
981	S	31	Very low	32.1	Very low	131 Å²	131	135.4 Å²	135.4	92%	0.916	82%	0.818	S	S	*	*			cis	158	122.7	-3.4	165.2	0	0	0	0	105.7
982	G	29.6	Very low	32.8	Very low	71 Å²	71	130.3 Å²	130.3	73%	0.732	80%	0.801	S	S	*	*			trans	156.2	87.4	166	0	0	0	0	0	119.7
983	C	27.5	Very low	32.4	Very low	122 Å²	122	130.3 Å²	130.3	82%	0.824	80%	0.795	S	S	*	*			trans	58.2	94.3	139.4	-62.5	0	0	0	0	123.6
984	S	32.3	Very low	33.1	Very low	122 Å²	122	126.6 Å²	126.6	85%	0.853	78%	0.781	S	S	*	*				54.7	120	112.9	66.7	0	0	0	0	123.7
985	G	27	Very low	33.8	Very low	81 Å²	81	126.3 Å²	126.3	84%	0.835	77%	0.769	S	S	*	*			trans	-152.2	147	153.2	0	0	0	0	0	110.6
986	R	30.9	Very low	34.4	Very low	253 Å²	253	122.6 Å²	122.6	96%	0.955	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-95	161.8	-168.2	-102.7	-172.5	174.2	-172.2	0.1	114.7
987	P	42.3	Very low	35.1	Very low	121 Å²	121	120.7 Å²	120.7	79%	0.786	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-96.3	150.8	-164.7	37.2	-36	0	0	0	115.8
988	G	25.7	Very low	35.8	Very low	80 Å²	80	118.1 Å²	118.1	83%	0.825	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-94.6	139.3	164.8	0	0	0	0	0	112.3
989	R	42.5	Very low	36.7	Very low	254 Å²	254	117.2 Å²	117.2	96%	0.958	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-84.3	136.1	179.2	-74.1	172.6	163.6	178.5	-6.3	111.9
990	S	31.2	Very low	37.4	Very low	116 Å²	116	117.5 Å²	117.5	81%	0.811	70%	0.695	S	S	*	*			trans	-132.1	162.4	155.4	62	0	0	0	0	110.1	P992	S990-P992 WeakPolarHBondContact O-CD 3.48Å
991	N	38.5	Very low	38.4	Very low	123 Å²	123	118.9 Å²	118.9	66%	0.658	68%	0.681	S	S	*	*			trans	-103.8	107.2	-147.1	-163.1	2.1	0	0	0	113.8	N993 S994	N991-N993 VanDerWaalsContact C-N 3.26Å; N991-N993 PolarHBondContact O-N 3.36Å; N991-N993 VanDerWaalsContact O-N 3.14Å; N991-S994 PolarHBondContact O-OG 3.3Å
992	P	42.7	Very low	39.4	Very low	84 Å²	84	114.7 Å²	114.7	55%	0.545	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.9	-7.3	-168	29.1	-36.5	0	0	0	115.5	S990 S994	S990-P992 WeakPolarHBondContact O-CD 3.48Å; P992-S994 PolarHBondContact O-N 2.92Å
993	N	36.7	Very low	40.4	Very low	122 Å²	122	117.5 Å²	117.5	65%	0.652	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-5.3	-176.3	-78	-5.7	0	0	0	114.9	N991	N991-N993 VanDerWaalsContact C-N 3.26Å; N991-N993 PolarHBondContact O-N 3.36Å; N991-N993 VanDerWaalsContact O-N 3.14Å
994	S	41.2	Very low	41.4	Very low	77 Å²	77	114.6 Å²	114.6	54%	0.538	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.2	-48.6	-179.5	57	0	0	0	0	112.8	N991 P992 L996 R997 V998	N991-S994 PolarHBondContact O-OG 3.3Å; P992-S994 PolarHBondContact O-N 2.92Å; S994-L996 PolarHBondContact O-N 3.45Å; S994-R997 WeakPolarHBondContact O-CB 3.46Å; S994-R997 PolarHBondContact O-N 3.14Å; S994-V998 PolarHBondContact O-N 2.99Å
995	E	43.4	Very low	42.1	Very low	100 Å²	100	111.5 Å²	111.5	47%	0.467	59%	0.59	S	S	.	*	H	α-helix	trans	-62.4	-42.1	179.5	-76.7	-174	108.8	0	0	113.1	R964 R997 V998 E999	R964-E995 PolarHBondContact NH2-O 2.92Å; E995-R997 PolarHBondContact O-N 2.94Å; E995-V998 PolarHBondContact O-N 3.28Å; E995-E999 PolarHBondContact O-N 3.47Å
996	L	45	Very low	43.3	Very low	98 Å²	98	114.3 Å²	114.3	51%	0.513	58%	0.575	S	S	.	*	H	α-helix	trans	-58.3	-33.3	177.8	-94.6	156.8	0	0	0	112.8	S994 E999 Q1000	S994-L996 PolarHBondContact O-N 3.45Å; L996-E999 PolarHBondContact O-N 3.44Å; L996-Q1000 WeakPolarHBondContact O-CG 3.45Å; L996-Q1000 PolarHBondContact O-N 3.05Å
997	R	44.9	Very low	44.2	Very low	184 Å²	184	107.8 Å²	107.8	69%	0.694	55%	0.551	S	S	*	*	H	α-helix	trans	-71	-43.1	-179.4	-142.8	175	-170.9	179.9	1.7	111.4	S994 E995 E999 Q1000 E1001	S994-R997 WeakPolarHBondContact O-CB 3.46Å; S994-R997 PolarHBondContact O-N 3.14Å; E995-R997 PolarHBondContact O-N 2.94Å; R997-E999 VanDerWaalsContact C-N 3.33Å; R997-Q1000 PolarHBondContact O-N 3.3Å; R997-E1001 PolarHBondContact O-N 2.95Å; R997-E1001 VanDerWaalsContact O-N 3.17Å
998	V	46.1	Very low	44.5	Very low	52 Å²	52	109.4 Å²	109.4	32%	0.315	54%	0.541	S	S	.	.	H	α-helix	trans	-69	-31.9	175.7	-179.8	0	0	0	0	111.3	S994 E995 I1002	S994-V998 PolarHBondContact O-N 2.99Å; E995-V998 PolarHBondContact O-N 3.28Å; V998-I1002 HydrophobicContact CG1-CD1 3.98Å; V998-I1002 VanDerWaalsContact O-CG1 3.3Å; V998-I1002 WeakPolarHBondContact O-CG1 3.38Å; V998-I1002 PolarHBondContact O-N 3.43Å; V998-I1002 VanDerWaalsContact O-N 3.13Å
999	E	49	Very low	45.7	Very low	73 Å²	73	109.9 Å²	109.9	34%	0.341	52%	0.524	S	S	.	.	H	α-helix	trans	-66.1	-40.9	175.7	-156.3	132.8	-126.6	0	0	112.3	R964 E995 L996 R997 I1002 Q1003	R964-E999 WeakPolarHBondContact CD-OE1 3.24Å; R964-E999 IonicContact CZ-OE1 3.98Å; R964-E999 IonicContact CZ-OE2 3.27Å; R964-E999 IonicContact NE-OE1 2.7Å; R964-E999 PolarHBondContact NE-OE1 3.43Å; R964-E999 IonicContact NE-OE2 2.69Å; R964-E999 PolarHBondContact NE-OE2 3.17Å; R964-E999 IonicContact NH1-OE1 2.95Å; R964-E999 PolarHBondContact NH1-OE1 3.43Å; R964-E999 IonicContact NH1-OE2 3.64Å; E995-E999 PolarHBondContact O-N 3.47Å; L996-E999 PolarHBondContact O-N 3.44Å; R997-E999 VanDerWaalsContact C-N 3.33Å; E999-I1002 PolarHBondContact O-N 3.41Å; E999-Q1003 WeakPolarHBondContact O-CG 3.38Å; E999-Q1003 PolarHBondContact O-N 3.21Å; E999-Q1003 VanDerWaalsContact O-N 3.09Å
1000	Q	49.6	Very low	45.8	Very low	126 Å²	126	100.6 Å²	100.6	59%	0.589	50%	0.498	S	S	*	.	H	α-helix	trans	-68	-40.1	176	-72.7	175.6	-18.9	0	0	112.4	L996 R997 Q1003 E1004	L996-Q1000 WeakPolarHBondContact O-CG 3.45Å; L996-Q1000 PolarHBondContact O-N 3.05Å; R997-Q1000 PolarHBondContact O-N 3.3Å; Q1000-Q1003 PolarHBondContact O-N 3.31Å; Q1000-E1004 WeakPolarHBondContact O-CB 3.33Å; Q1000-E1004 PolarHBondContact O-N 3.08Å
1001	E	48.7	Very low	46.4	Very low	107 Å²	107	98.9 Å²	98.9	50%	0.5	48%	0.477	S	S	.	.	H	α-helix	trans	-62.3	-42.9	174.7	-74	178.7	170.5	0	0	112	R997 Q1003 E1004 L1005	R997-E1001 PolarHBondContact O-N 2.95Å; R997-E1001 VanDerWaalsContact O-N 3.17Å; E1001-Q1003 PolarHBondContact O-N 3.02Å; E1001-E1004 PolarHBondContact O-N 3.27Å; E1001-L1005 WeakPolarHBondContact O-CB 3.49Å; E1001-L1005 WeakPolarHBondContact O-CD1 3.49Å; E1001-L1005 VanDerWaalsContact O-CG 3.27Å; E1001-L1005 WeakPolarHBondContact O-CG 3.29Å; E1001-L1005 PolarHBondContact O-N 3.49Å
1002	I	51.9	Low	46.6	Very low	42 Å²	42	95 Å²	95	22%	0.215	46%	0.46	C	S	.	.	H	α-helix	trans	-65.2	-36.7	176.6	-67.4	167.1	0	0	0	111.7	V998 E999 R1006	V998-I1002 HydrophobicContact CG1-CD1 3.98Å; V998-I1002 VanDerWaalsContact O-CG1 3.3Å; V998-I1002 WeakPolarHBondContact O-CG1 3.38Å; V998-I1002 PolarHBondContact O-N 3.43Å; V998-I1002 VanDerWaalsContact O-N 3.13Å; E999-I1002 PolarHBondContact O-N 3.41Å; I1002-R1006 WeakPolarHBondContact O-CG 3.32Å; I1002-R1006 PolarHBondContact O-N 3.45Å; I1002-R1006 VanDerWaalsContact O-N 3.17Å
1003	Q	50.9	Low	46.7	Very low	130 Å²	130	96.6 Å²	96.6	61%	0.607	46%	0.46	S	S	*	.	H	α-helix	trans	-70.4	-41.3	176.1	-74.6	-176.8	-3	0	0	112.9	E999 Q1000 E1001 L1005 R1006 R1007	E999-Q1003 WeakPolarHBondContact O-CG 3.38Å; E999-Q1003 PolarHBondContact O-N 3.21Å; E999-Q1003 VanDerWaalsContact O-N 3.09Å; Q1000-Q1003 PolarHBondContact O-N 3.31Å; E1001-Q1003 PolarHBondContact O-N 3.02Å; Q1003-L1005 VanDerWaalsContact C-N 3.34Å; Q1003-R1006 PolarHBondContact O-N 2.99Å; Q1003-R1007 PolarHBondContact O-N 3.05Å
1004	E	49.6	Very low	46.6	Very low	62 Å²	62	95.9 Å²	95.9	29%	0.29	46%	0.456	S	S	.	.	H	α-helix	trans	-65.3	-36.7	175.9	175.1	62.8	-173.3	0	0	111.9	Q1000 E1001 R1007 R1008	Q1000-E1004 WeakPolarHBondContact O-CB 3.33Å; Q1000-E1004 PolarHBondContact O-N 3.08Å; E1001-E1004 PolarHBondContact O-N 3.27Å; E1004-R1007 VanDerWaalsContact CD-NH2 3.25Å; E1004-R1007 WeakPolarHBondContact O-CB 3.33Å; E1004-R1007 PolarHBondContact O-N 3.48Å; E1004-R1007 IonicContact OE1-CZ 2.69Å; E1004-R1007 IonicContact OE1-NH2 3.46Å; E1004-R1007 PolarHBondContact OE1-NH2 2.98Å; E1004-R1007 IonicContact OE2-CZ 3.02Å; E1004-R1007 VanDerWaalsContact OE2-CZ 3.28Å; E1004-R1007 IonicContact OE2-NE 3.15Å; E1004-R1007 PolarHBondContact OE2-NE 3.47Å; E1004-R1007 IonicContact OE2-NH2 3.47Å; E1004-R1007 PolarHBondContact OE2-NH2 3.35Å; E1004-R1008 WeakPolarHBondContact O-CG 3.38Å; E1004-R1008 PolarHBondContact O-N 3.45Å; E1004-R1008 VanDerWaalsContact O-N 3.13Å; E1004-R1008 IonicContact OE1-CZ 2.67Å; E1004-R1008 IonicContact OE1-NE 3.31Å; E1004-R1008 PolarHBondContact OE1-NE 3.28Å; E1004-R1008 IonicContact OE1-NH2 3.37Å; E1004-R1008 PolarHBondContact OE1-NH2 3.23Å
1005	L	46.4	Very low	46.5	Very low	56 Å²	56	98.5 Å²	98.5	29%	0.293	46%	0.46	S	S	.	.	H	α-helix	trans	-61.9	-45.3	172.6	-77.2	164.7	0	0	0	112.2	E1001 Q1003 R1007 R1008 I1009	E1001-L1005 WeakPolarHBondContact O-CB 3.49Å; E1001-L1005 WeakPolarHBondContact O-CD1 3.49Å; E1001-L1005 VanDerWaalsContact O-CG 3.27Å; E1001-L1005 WeakPolarHBondContact O-CG 3.29Å; E1001-L1005 PolarHBondContact O-N 3.49Å; Q1003-L1005 VanDerWaalsContact C-N 3.34Å; L1005-R1007 VanDerWaalsContact C-N 3.29Å; L1005-R1007 PolarHBondContact O-N 2.89Å; L1005-R1008 PolarHBondContact O-N 2.88Å; L1005-I1009 WeakPolarHBondContact O-CG1 3.41Å; L1005-I1009 PolarHBondContact O-N 2.98Å; L1005-I1009 VanDerWaalsContact O-N 3.07Å
1006	R	51.6	Low	46.3	Very low	140 Å²	140	99.9 Å²	99.9	53%	0.528	47%	0.471	S	S	.	.	H	α-helix	trans	-62	-36.8	176.1	-74.5	171.5	168.9	-147.8	-5.4	112.3	E957 I1002 Q1003 S1010	E957-R1006 IonicContact OE1-CZ 2.87Å; E957-R1006 IonicContact OE1-NE 3.88Å; E957-R1006 PolarHBondContact OE1-NE 3.32Å; E957-R1006 IonicContact OE1-NH2 4Å; E957-R1006 PolarHBondContact OE1-NH2 3.32Å; E957-R1006 VanDerWaalsContact OE1-NH2 3.1Å; E957-R1006 IonicContact OE2-CZ 2.83Å; E957-R1006 IonicContact OE2-NE 2.91Å; E957-R1006 IonicContact OE2-NH2 3.28Å; E957-R1006 PolarHBondContact OE2-NH2 3.03Å; I1002-R1006 WeakPolarHBondContact O-CG 3.32Å; I1002-R1006 PolarHBondContact O-N 3.45Å; I1002-R1006 VanDerWaalsContact O-N 3.17Å; Q1003-R1006 PolarHBondContact O-N 2.99Å; R1006-S1010 PolarHBondContact O-N 3.07Å; R1006-S1010 VanDerWaalsContact O-N 3.11Å
1007	R	49.8	Very low	45.9	Very low	117 Å²	117	105.4 Å²	105.4	44%	0.442	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-45	174.9	-170.2	175	69.4	90	-2.2	111.8	Q1003 E1004 L1005 S1010 E1011	Q1003-R1007 PolarHBondContact O-N 3.05Å; E1004-R1007 VanDerWaalsContact CD-NH2 3.25Å; E1004-R1007 WeakPolarHBondContact O-CB 3.33Å; E1004-R1007 PolarHBondContact O-N 3.48Å; E1004-R1007 IonicContact OE1-CZ 2.69Å; E1004-R1007 IonicContact OE1-NH2 3.46Å; E1004-R1007 PolarHBondContact OE1-NH2 2.98Å; E1004-R1007 IonicContact OE2-CZ 3.02Å; E1004-R1007 VanDerWaalsContact OE2-CZ 3.28Å; E1004-R1007 IonicContact OE2-NE 3.15Å; E1004-R1007 PolarHBondContact OE2-NE 3.47Å; E1004-R1007 IonicContact OE2-NH2 3.47Å; E1004-R1007 PolarHBondContact OE2-NH2 3.35Å; L1005-R1007 VanDerWaalsContact C-N 3.29Å; L1005-R1007 PolarHBondContact O-N 2.89Å; R1007-S1010 PolarHBondContact O-N 3.13Å; R1007-E1011 HydrophobicContact CG-CG 4.46Å; R1007-E1011 VanDerWaalsContact CG-OE1 3.32Å; R1007-E1011 WeakPolarHBondContact CG-OE1 3.36Å; R1007-E1011 IonicContact CZ-OE1 3.85Å; R1007-E1011 IonicContact CZ-OE2 2.77Å; R1007-E1011 IonicContact NE-OE1 2.84Å; R1007-E1011 IonicContact NH1-OE1 3.24Å; R1007-E1011 PolarHBondContact NH1-OE1 3.03Å; R1007-E1011 IonicContact NH1-OE2 2.83Å; R1007-E1011 PolarHBondContact NH1-OE2 2.99Å; R1007-E1011 WeakPolarHBondContact O-CB 3.44Å; R1007-E1011 WeakPolarHBondContact O-CG 3.35Å; R1007-E1011 PolarHBondContact O-N 3.3Å
1008	R	49.9	Very low	45.5	Very low	154 Å²	154	100.1 Å²	100.1	58%	0.581	48%	0.48	S	S	*	.	H	α-helix	trans	-66.7	-39.8	178.9	-68.3	176.9	-172.1	-161.5	0.8	113.5	E1004 L1005 S1010 E1011 S1012	E1004-R1008 WeakPolarHBondContact O-CG 3.38Å; E1004-R1008 PolarHBondContact O-N 3.45Å; E1004-R1008 VanDerWaalsContact O-N 3.13Å; E1004-R1008 IonicContact OE1-CZ 2.67Å; E1004-R1008 IonicContact OE1-NE 3.31Å; E1004-R1008 PolarHBondContact OE1-NE 3.28Å; E1004-R1008 IonicContact OE1-NH2 3.37Å; E1004-R1008 PolarHBondContact OE1-NH2 3.23Å; L1005-R1008 PolarHBondContact O-N 2.88Å; R1008-S1010 VanDerWaalsContact C-N 3.33Å; R1008-E1011 PolarHBondContact O-N 2.9Å; R1008-S1012 PolarHBondContact O-N 3.42Å; R1008-S1012 VanDerWaalsContact O-N 3.15Å
1009	I	49.2	Very low	45	Very low	90 Å²	90	105.8 Å²	105.8	46%	0.462	50%	0.503	S	S	.	.	H	α-helix	trans	-59.8	-46.8	174.1	-66.7	164.8	0	0	0	109.7	L1005 S1012	L1005-I1009 WeakPolarHBondContact O-CG1 3.41Å; L1005-I1009 PolarHBondContact O-N 2.98Å; L1005-I1009 VanDerWaalsContact O-N 3.07Å; I1009-S1012 PolarHBondContact O-N 3.06Å; I1009-S1012 PolarHBondContact O-OG 3.25Å
1010	S	46.6	Very low	44.4	Very low	59 Å²	59	107.2 Å²	107.2	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-68.3	-35.3	178.3	-169.1	0	0	0	0	113.8	R1006 R1007 R1008 S1012 E1013	R1006-S1010 PolarHBondContact O-N 3.07Å; R1006-S1010 VanDerWaalsContact O-N 3.11Å; R1007-S1010 PolarHBondContact O-N 3.13Å; R1008-S1010 VanDerWaalsContact C-N 3.33Å; S1010-S1012 VanDerWaalsContact C-N 3.28Å; S1010-S1012 PolarHBondContact O-N 2.95Å; S1010-E1013 PolarHBondContact O-N 2.88Å
1011	E	43.3	Very low	43.6	Very low	81 Å²	81	108 Å²	108	38%	0.379	53%	0.534	S	S	.	.	H	α-helix	trans	-65.9	-31	176.6	-78.4	170.1	-178	0	0	112	R1007 R1008 E1013 N1014 Q1015	R1007-E1011 HydrophobicContact CG-CG 4.46Å; R1007-E1011 VanDerWaalsContact CG-OE1 3.32Å; R1007-E1011 WeakPolarHBondContact CG-OE1 3.36Å; R1007-E1011 IonicContact CZ-OE1 3.85Å; R1007-E1011 IonicContact CZ-OE2 2.77Å; R1007-E1011 IonicContact NE-OE1 2.84Å; R1007-E1011 IonicContact NH1-OE1 3.24Å; R1007-E1011 PolarHBondContact NH1-OE1 3.03Å; R1007-E1011 IonicContact NH1-OE2 2.83Å; R1007-E1011 PolarHBondContact NH1-OE2 2.99Å; R1007-E1011 WeakPolarHBondContact O-CB 3.44Å; R1007-E1011 WeakPolarHBondContact O-CG 3.35Å; R1007-E1011 PolarHBondContact O-N 3.3Å; R1008-E1011 PolarHBondContact O-N 2.9Å; E1011-E1013 VanDerWaalsContact C-N 3.3Å; E1011-E1013 PolarHBondContact O-N 2.76Å; E1011-N1014 PolarHBondContact O-N 2.83Å; E1011-Q1015 PolarHBondContact O-N 2.84Å
1012	S	42	Very low	42.7	Very low	42 Å²	42	105.9 Å²	105.9	29%	0.294	54%	0.541	S	S	.	.	H	α-helix	trans	-65.7	-28.6	174.5	82.6	0	0	0	0	113.8	R1008 I1009 S1010 N1016	R1008-S1012 PolarHBondContact O-N 3.42Å; R1008-S1012 VanDerWaalsContact O-N 3.15Å; I1009-S1012 PolarHBondContact O-N 3.06Å; I1009-S1012 PolarHBondContact O-OG 3.25Å; S1010-S1012 VanDerWaalsContact C-N 3.28Å; S1010-S1012 PolarHBondContact O-N 2.95Å; S1012-N1016 PolarHBondContact O-ND2 3.15Å
1013	E	44.8	Very low	41.6	Very low	117 Å²	117	110.3 Å²	110.3	55%	0.547	57%	0.571	S	S	.	*	H	α-helix	trans	-72.5	-34.8	175.9	-61.3	-170.4	124.1	0	0	111.8	S1010 E1011	S1010-E1013 PolarHBondContact O-N 2.88Å; E1011-E1013 VanDerWaalsContact C-N 3.3Å; E1011-E1013 PolarHBondContact O-N 2.76Å
1014	N	34.8	Very low	40.8	Very low	106 Å²	106	112.6 Å²	112.6	57%	0.567	58%	0.581	S	S	*	*	H	α-helix	trans	-76.3	-32.8	178.7	-80.4	-40.4	0	0	0	112.9	E1011 N1016 R1017 A1018	E1011-N1014 PolarHBondContact O-N 2.83Å; N1014-N1016 VanDerWaalsContact C-N 3.35Å; N1014-N1016 PolarHBondContact O-N 3.21Å; N1014-R1017 PolarHBondContact O-N 2.93Å; N1014-R1017 VanDerWaalsContact O-N 3.14Å; N1014-A1018 PolarHBondContact O-N 3.28Å; N1014-A1018 VanDerWaalsContact O-N 3.14Å
1015	Q	38.8	Very low	39.8	Very low	132 Å²	132	116.5 Å²	116.5	62%	0.617	60%	0.599	S	S	*	*	H	α-helix	trans	-64.7	-38.2	175.7	-75	176.6	-17.9	0	0	112.3	E1011 R1017 A1018 Q1019	E1011-Q1015 PolarHBondContact O-N 2.84Å; Q1015-R1017 PolarHBondContact O-N 2.75Å; Q1015-A1018 PolarHBondContact O-N 3.03Å; Q1015-Q1019 PolarHBondContact O-N 3.35Å
1016	N	39.2	Very low	38.9	Very low	130 Å²	130	121.1 Å²	121.1	70%	0.695	62%	0.617	S	S	*	*	H	α-helix	trans	-67.3	-14.1	174.4	-78.3	-59.8	0	0	0	114.2	S1012 N1014	S1012-N1016 PolarHBondContact O-ND2 3.15Å; N1014-N1016 VanDerWaalsContact C-N 3.35Å; N1014-N1016 PolarHBondContact O-N 3.21Å
1017	R	36.7	Very low	37.8	Very low	213 Å²	213	123 Å²	123	80%	0.804	63%	0.634	S	S	*	*	H	α-helix	trans	-100.9	-13.1	174.7	-158.6	173.9	-177.2	-178	0.7	113.5	N1014 Q1015	N1014-R1017 PolarHBondContact O-N 2.93Å; N1014-R1017 VanDerWaalsContact O-N 3.14Å; Q1015-R1017 PolarHBondContact O-N 2.75Å
1018	A	35.9	Very low	36.6	Very low	73 Å²	73	120.3 Å²	120.3	60%	0.603	64%	0.643	S	S	*	*	H	α-helix	trans	-96.3	-21.7	-179.1	0	0	0	0	0	113.8	N1014 Q1015 S1020	N1014-A1018 PolarHBondContact O-N 3.28Å; N1014-A1018 VanDerWaalsContact O-N 3.14Å; Q1015-A1018 PolarHBondContact O-N 3.03Å; A1018-S1020 PolarHBondContact O-N 3.42Å
1019	Q	36.5	Very low	35.7	Very low	172 Å²	172	121 Å²	121	80%	0.804	65%	0.652	S	S	*	*			trans	-78.6	57	175.9	-70.9	-172.4	-12	0	0	112.9	Q1015	Q1015-Q1019 PolarHBondContact O-N 3.35Å
1020	S	35.3	Very low	34.6	Very low	102 Å²	102	122 Å²	122	71%	0.713	67%	0.668	S	S	*	*	S	Bend	trans	-137.3	30.2	168.9	77.9	0	0	0	0	113.8	A1018	A1018-S1020 PolarHBondContact O-N 3.42Å
1021	V	34.8	Very low	33.6	Very low	143 Å²	143	124.6 Å²	124.6	87%	0.867	69%	0.686	S	S	*	*	S	Bend	trans	-156.1	132.5	160.3	170.2	0	0	0	0	108.6
1022	G	29	Very low	32.8	Very low	63 Å²	63	125.9 Å²	125.9	65%	0.649	70%	0.704	S	S	*	*			trans	120.6	89.8	157.2	0	0	0	0	0	119
1023	T	28.8	Very low	32.9	Very low	135 Å²	135	129.2 Å²	129.2	83%	0.828	73%	0.725	S	S	*	*			trans	35.2	135.7	138.3	38.1	0	0	0	0	124.8
1024	E	33.2	Very low	32	Very low	177 Å²	177	130.2 Å²	130.2	83%	0.827	74%	0.738	S	S	*	*			trans	-8.1	138.3	149.3	-49.6	175.3	139.9	0	0	118
1025	E	29	Very low	31.6	Very low	145 Å²	145	128.2 Å²	128.2	68%	0.678	74%	0.742	S	S	*	*				179.8	159.6	74.2	-95.8	-149	124.1	0	0	113.9
1026	K	28.5	Very low	31.1	Very low	152 Å²	152	129.4 Å²	129.4	66%	0.661	75%	0.748	S	S	*	*			trans	63	127.8	147.3	-72.7	179.4	175.1	86.2	0	124.1
1027	M	27.1	Very low	30.5	Very low	179 Å²	179	132.5 Å²	132.5	88%	0.882	75%	0.749	S	S	*	*			trans	36.8	144.3	134.8	-63.5	175.6	170.8	0	0	121.7
1028	G	26.3	Very low	30	Very low	62 Å²	62	129.5 Å²	129.5	64%	0.639	75%	0.745	S	S	*	*			cis	163.4	173.9	0.3	0	0	0	0	0	112.8
1029	H	30.1	Very low	29.7	Very low	167 Å²	167	130.6 Å²	130.6	77%	0.773	75%	0.748	S	S	*	*			trans	68	114.1	165.1	-53.4	-67.8	0	0	0	119.6
1030	S	26.7	Very low	29.1	Very low	112 Å²	112	130 Å²	130	78%	0.783	75%	0.75	S	S	*	*				87	141.1	103.5	71.7	0	0	0	0	115.2
1031	S	25.5	Very low	28.7	Very low	113 Å²	113	132.1 Å²	132.1	79%	0.79	75%	0.753	S	S	*	*			cis	-164.4	159.9	-0.7	43.7	0	0	0	0	111.7
1032	S	26.9	Very low	28.6	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	75%	0.745	S	S	*	*			trans	-40.2	167.1	162.2	-58.1	0	0	0	0	115.7
1033	P	42.8	Very low	28.4	Very low	113 Å²	113	136.1 Å²	136.1	73%	0.734	76%	0.759	S	S	*	*			cis	-152.9	165.7	34	42	-19.5	0	0	0	121.7
1034	V	26.8	Very low	28.6	Very low	138 Å²	138	137.4 Å²	137.4	84%	0.836	76%	0.76	S	S	*	*			trans	27.5	136.5	132.2	-169.9	0	0	0	0	119.8
1035	G	26.1	Very low	28.6	Very low	63 Å²	63	134.3 Å²	134.3	65%	0.649	76%	0.756	S	S	*	*			cis	151.5	-178	-1.4	0	0	0	0	0	113.5
1036	H	28.8	Very low	28.7	Very low	157 Å²	157	135.6 Å²	135.6	73%	0.727	77%	0.766	S	S	*	*			trans	67.5	138.7	173.3	-70.8	18.2	0	0	0	115.4
1037	R	26	Very low	29	Very low	195 Å²	195	132.7 Å²	132.7	74%	0.736	77%	0.765	S	S	*	*			cis	-166.9	167.6	10.1	-110.1	166.6	-169.9	-160	10.3	106.6
1038	Q	25.7	Very low	29.5	Very low	151 Å²	151	128.6 Å²	128.6	71%	0.706	74%	0.744	S	S	*	*			cis	-161.2	161.1	4.2	-145.7	161.2	-95.8	0	0	110.4
1039	S	28.9	Very low	30.2	Very low	96 Å²	96	130 Å²	130	67%	0.671	74%	0.736	S	S	*	*			trans	37.7	118.9	152.9	-177.4	0	0	0	0	121.5
1040	L	24.6	Very low	30.7	Very low	160 Å²	160	131.8 Å²	131.8	84%	0.838	74%	0.737	S	S	*	*				-166.5	167.2	121.2	-103.1	163.9	0	0	0	112.4
1041	N	27.3	Very low	31.4	Very low	146 Å²	146	127.1 Å²	127.1	78%	0.781	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-75.9	159.6	-153.5	-77.3	-48	0	0	0	117.8
1042	P	31.7	Very low	32	Very low	108 Å²	108	125.5 Å²	125.5	70%	0.701	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-92.6	146.6	-176.5	36.3	-33.7	0	0	0	114
1043	L	26.4	Very low	32.9	Very low	182 Å²	182	123.2 Å²	123.2	95%	0.953	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-95.4	137	162.2	-80.2	168.2	0	0	0	110.2
1044	L	31.6	Very low	32.8	Very low	161 Å²	161	124.2 Å²	124.2	84%	0.843	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-85.9	163.2	-169	-78.8	168.7	0	0	0	113.6
1045	P	33.8	Very low	33.5	Very low	113 Å²	113	120.2 Å²	120.2	73%	0.734	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-96.7	162	-155	32.1	-26.2	0	0	0	115.5	S1047	P1045-S1047 PolarHBondContact O-N 2.96Å
1046	L	30.3	Very low	34.3	Very low	171 Å²	171	124 Å²	124	90%	0.895	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-63.6	128.1	167.7	-67.5	165	0	0	0	110
1047	S	36.3	Very low	35.1	Very low	91 Å²	91	123 Å²	123	64%	0.636	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-82	143.7	-161.7	56.2	0	0	0	0	115.5	P1045 D1049	P1045-S1047 PolarHBondContact O-N 2.96Å; S1047-D1049 PolarHBondContact O-N 3.29Å
1048	E	36.5	Very low	36	Very low	94 Å²	94	115.8 Å²	115.8	44%	0.439	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	10.8	-174.9	-54.3	163.9	141.3	0	0	115.2	R941 I1051 N1052	R941-E1048 IonicContact CZ-OE1 3.39Å; R941-E1048 IonicContact NH1-OE1 3.73Å; R941-E1048 PolarHBondContact NH1-OE1 3.05Å; R941-E1048 VanDerWaalsContact NH2-CD 3.26Å; R941-E1048 IonicContact NH2-OE1 3.09Å; R941-E1048 PolarHBondContact NH2-OE1 3.39Å; R941-E1048 IonicContact NH2-OE2 2.67Å; E1048-I1051 HydrophobicContact CB-CD1 4.21Å; E1048-I1051 VanDerWaalsContact O-CB 3.31Å; E1048-I1051 WeakPolarHBondContact O-CB 3.43Å; E1048-N1052 PolarHBondContact O-ND2 3.49Å
1049	D	40.3	Very low	36.8	Very low	90 Å²	90	112.2 Å²	112.2	48%	0.481	60%	0.596	S	S	.	*	H	α-helix	trans	-89.1	-23.7	-170.8	-79	-34.3	0	0	0	113.9	K303 S1047 I1051	K303-D1049 VanDerWaalsContact NZ-CG 3.29Å; K303-D1049 IonicContact NZ-OD1 2.73Å; K303-D1049 PolarHBondContact NZ-OD1 2.79Å; K303-D1049 IonicContact NZ-OD2 3.7Å; K303-D1049 PolarHBondContact NZ-OD2 2.87Å; S1047-D1049 PolarHBondContact O-N 3.29Å; D1049-I1051 PolarHBondContact O-N 3.26Å
1050	R	40.7	Very low	37.4	Very low	206 Å²	206	112.8 Å²	112.8	78%	0.777	59%	0.587	S	S	*	*	H	α-helix	trans	-71.3	-20.7	167.5	-78.5	-177.4	79.4	-173.4	3.8	112.6
1051	I	41.3	Very low	38.8	Very low	13 Å²	13	112.9 Å²	112.9	7%	0.067	58%	0.577	C	S	.	*	H	α-helix	trans	-70.3	-55.9	-176.5	-55.6	-169.7	0	0	0	110.5	W940 R941 E1048 D1049 A1053 Y1054 I1055	W940-I1051 HydrophobicContact CD2-CG2 3.86Å; W940-I1051 HydrophobicContact CE3-CB 4.13Å; W940-I1051 HydrophobicContact CE3-CD1 4.19Å; W940-I1051 HydrophobicContact CE3-CG1 4.21Å; W940-I1051 HydrophobicContact CE3-CG2 3.26Å; W940-I1051 HydrophobicContact CH2-CB 3.56Å; W940-I1051 HydrophobicContact CH2-CD1 4.3Å; W940-I1051 HydrophobicContact CH2-CG1 3.54Å; W940-I1051 HydrophobicContact CH2-CG2 3.52Å; W940-I1051 HydrophobicContact CZ2-CB 4.28Å; W940-I1051 HydrophobicContact CZ2-CG2 3.96Å; W940-I1051 HydrophobicContact CZ3-CB 3.49Å; W940-I1051 VanDerWaalsContact CZ3-CB 3.49Å; W940-I1051 HydrophobicContact CZ3-CD1 3.51Å; W940-I1051 HydrophobicContact CZ3-CG1 3.26Å; W940-I1051 HydrophobicContact CZ3-CG2 3.17Å; R941-I1051 HydrophobicContact CG-CD1 4.19Å; E1048-I1051 HydrophobicContact CB-CD1 4.21Å; E1048-I1051 VanDerWaalsContact O-CB 3.31Å; E1048-I1051 WeakPolarHBondContact O-CB 3.43Å; D1049-I1051 PolarHBondContact O-N 3.26Å; I1051-A1053 VanDerWaalsContact C-N 3.28Å; I1051-A1053 PolarHBondContact O-N 2.9Å; I1051-Y1054 PolarHBondContact O-N 2.9Å; I1051-I1055 HydrophobicContact CG2-CD1 3.7Å; I1051-I1055 WeakPolarHBondContact O-CG1 3.39Å; I1051-I1055 PolarHBondContact O-N 2.91Å
1052	N	39.6	Very low	39.4	Very low	79 Å²	79	113.8 Å²	113.8	42%	0.422	57%	0.569	S	S	.	*	H	α-helix	trans	-64.9	-33.4	-173.6	-62.4	-40.3	0	0	0	112	E1048 I1055 E1056	E1048-N1052 PolarHBondContact O-ND2 3.49Å; N1052-I1055 PolarHBondContact O-N 3.13Å; N1052-E1056 PolarHBondContact O-N 3Å
1053	A	45.3	Very low	39.9	Very low	60 Å²	60	113 Å²	113	50%	0.496	56%	0.559	S	S	.	*	H	α-helix	trans	-62.1	-43.2	176.3	0	0	0	0	0	113.1	I1051 E1057	I1051-A1053 VanDerWaalsContact C-N 3.28Å; I1051-A1053 PolarHBondContact O-N 2.9Å; A1053-E1057 PolarHBondContact O-N 2.97Å
1054	Y	40.8	Very low	40.8	Very low	135 Å²	135	112 Å²	112	53%	0.529	54%	0.542	S	S	.	.	H	α-helix	trans	-72.3	-35.2	179.2	-171.1	-106.2	0	0	0	112	W940 I1051 E1057 E1058	W940-Y1054 HydrophobicContact CZ2-CD1 4.2Å; I1051-Y1054 PolarHBondContact O-N 2.9Å; Y1054-E1057 PolarHBondContact O-N 3.33Å; Y1054-E1058 WeakPolarHBondContact O-CB 3.33Å; Y1054-E1058 PolarHBondContact O-N 2.95Å; Y1054-E1058 VanDerWaalsContact O-N 3.09Å
1055	I	41.7	Very low	41	Very low	54 Å²	54	111.9 Å²	111.9	28%	0.277	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-43.7	175.5	-65.5	170.3	0	0	0	110.9	W940 I1051 N1052 E1057 V1059	W940-I1055 HydrophobicContact CD2-CD1 3.98Å; W940-I1055 HydrophobicContact CD2-CG1 4.36Å; W940-I1055 HydrophobicContact CG-CD1 4.08Å; W940-I1055 HydrophobicContact CG-CG1 4.43Å; W940-I1055 HydrophobicContact CZ2-CG1 4.46Å; I1051-I1055 HydrophobicContact CG2-CD1 3.7Å; I1051-I1055 WeakPolarHBondContact O-CG1 3.39Å; I1051-I1055 PolarHBondContact O-N 2.91Å; N1052-I1055 PolarHBondContact O-N 3.13Å; I1055-E1057 VanDerWaalsContact C-N 3.35Å; I1055-E1057 PolarHBondContact O-N 3.11Å; I1055-V1059 HydrophobicContact CG2-CG2 4.27Å; I1055-V1059 VanDerWaalsContact O-CB 3.29Å; I1055-V1059 WeakPolarHBondContact O-CB 3.46Å; I1055-V1059 WeakPolarHBondContact O-CG2 3.47Å; I1055-V1059 PolarHBondContact O-N 3.38Å
1056	E	43.2	Very low	41.1	Very low	141 Å²	141	112.7 Å²	112.7	66%	0.659	53%	0.53	S	S	*	.	H	α-helix	trans	-63.6	-38.6	177	-76.4	-168.9	135.4	0	0	112.6	N1052 Q1060	N1052-E1056 PolarHBondContact O-N 3Å; E1056-Q1060 WeakPolarHBondContact O-CG 3.44Å; E1056-Q1060 PolarHBondContact O-N 3.2Å; E1056-Q1060 VanDerWaalsContact O-N 3.09Å
1057	E	45.2	Very low	41.7	Very low	137 Å²	137	111.1 Å²	111.1	64%	0.64	52%	0.523	S	S	*	.	H	α-helix	trans	-69.2	-43.7	-179.7	-161.3	170.1	-152.5	0	0	112.2	A1053 Y1054 I1055 Q1060 R1061	A1053-E1057 PolarHBondContact O-N 2.97Å; Y1054-E1057 PolarHBondContact O-N 3.33Å; I1055-E1057 VanDerWaalsContact C-N 3.35Å; I1055-E1057 PolarHBondContact O-N 3.11Å; E1057-Q1060 PolarHBondContact O-N 3.38Å; E1057-R1061 PolarHBondContact O-N 3.04Å
1058	E	44.5	Very low	42	Very low	44 Å²	44	113.9 Å²	113.9	21%	0.206	53%	0.53	C	S	.	.	H	α-helix	trans	-72.9	-33	178.3	-176.7	60	-162.2	0	0	112.5	Y1054 R1061 R1062	Y1054-E1058 WeakPolarHBondContact O-CB 3.33Å; Y1054-E1058 PolarHBondContact O-N 2.95Å; Y1054-E1058 VanDerWaalsContact O-N 3.09Å; E1058-R1061 WeakPolarHBondContact O-CB 3.5Å; E1058-R1061 PolarHBondContact O-N 3.25Å; E1058-R1061 WeakPolarHBondContact OE2-CD 3.48Å; E1058-R1061 IonicContact OE2-CZ 3.9Å; E1058-R1061 IonicContact OE2-NH1 2.85Å; E1058-R1061 PolarHBondContact OE2-NH1 2.96Å; E1058-R1062 WeakPolarHBondContact O-CG 3.41Å; E1058-R1062 PolarHBondContact O-N 3.27Å; E1058-R1062 IonicContact OE1-CZ 3.07Å; E1058-R1062 IonicContact OE1-NE 3.74Å; E1058-R1062 PolarHBondContact OE1-NE 2.76Å; E1058-R1062 IonicContact OE1-NH2 2.88Å; E1058-R1062 PolarHBondContact OE1-NH2 2.95Å
1059	V	42.3	Very low	41.9	Very low	76 Å²	76	116 Å²	116	46%	0.461	54%	0.544	S	S	.	.	H	α-helix	trans	-63.5	-43.1	171.1	165.7	0	0	0	0	111.1	I1055 R1061 R1062 L1063	I1055-V1059 HydrophobicContact CG2-CG2 4.27Å; I1055-V1059 VanDerWaalsContact O-CB 3.29Å; I1055-V1059 WeakPolarHBondContact O-CB 3.46Å; I1055-V1059 WeakPolarHBondContact O-CG2 3.47Å; I1055-V1059 PolarHBondContact O-N 3.38Å; V1059-R1061 VanDerWaalsContact C-N 3.32Å; V1059-R1061 PolarHBondContact O-N 3.48Å; V1059-R1062 PolarHBondContact O-N 2.67Å; V1059-L1063 HydrophobicContact CG1-CD1 3.94Å; V1059-L1063 WeakPolarHBondContact O-CG 3.4Å; V1059-L1063 PolarHBondContact O-N 3.18Å
1060	Q	41.3	Very low	41.5	Very low	107 Å²	107	119.3 Å²	119.3	50%	0.5	56%	0.561	S	S	.	*	H	α-helix	trans	-64.2	-36.6	173.4	-75.4	-159.9	25.3	0	0	112.6	E1056 E1057 R1064	E1056-Q1060 WeakPolarHBondContact O-CG 3.44Å; E1056-Q1060 PolarHBondContact O-N 3.2Å; E1056-Q1060 VanDerWaalsContact O-N 3.09Å; E1057-Q1060 PolarHBondContact O-N 3.38Å; Q1060-R1064 VanDerWaalsContact O-CG 3.27Å; Q1060-R1064 WeakPolarHBondContact O-CG 3.43Å; Q1060-R1064 PolarHBondContact O-N 2.86Å; Q1060-R1064 VanDerWaalsContact O-N 3.15Å
1061	R	55.5	Low	40.9	Very low	162 Å²	162	113.3 Å²	113.3	61%	0.611	56%	0.563	S	S	*	*	H	α-helix	trans	-63.7	-41.1	177	-165.7	-172.4	-100.5	152.4	-9.9	111.7	E1057 E1058 V1059 K1065	E1057-R1061 PolarHBondContact O-N 3.04Å; E1058-R1061 WeakPolarHBondContact O-CB 3.5Å; E1058-R1061 PolarHBondContact O-N 3.25Å; E1058-R1061 WeakPolarHBondContact OE2-CD 3.48Å; E1058-R1061 IonicContact OE2-CZ 3.9Å; E1058-R1061 IonicContact OE2-NH1 2.85Å; E1058-R1061 PolarHBondContact OE2-NH1 2.96Å; V1059-R1061 VanDerWaalsContact C-N 3.32Å; V1059-R1061 PolarHBondContact O-N 3.48Å; R1061-K1065 PolarHBondContact O-N 3.04Å
1062	R	38.8	Very low	40.1	Very low	165 Å²	165	116.9 Å²	116.9	62%	0.623	60%	0.603	S	S	*	*	H	α-helix	trans	-73.4	-37.5	178.7	-67.9	177.4	-171.6	-163	2.1	113.3	E1058 V1059 R1064 K1065 M1066	E1058-R1062 WeakPolarHBondContact O-CG 3.41Å; E1058-R1062 PolarHBondContact O-N 3.27Å; E1058-R1062 IonicContact OE1-CZ 3.07Å; E1058-R1062 IonicContact OE1-NE 3.74Å; E1058-R1062 PolarHBondContact OE1-NE 2.76Å; E1058-R1062 IonicContact OE1-NH2 2.88Å; E1058-R1062 PolarHBondContact OE1-NH2 2.95Å; V1059-R1062 PolarHBondContact O-N 2.67Å; R1062-R1064 VanDerWaalsContact C-N 3.33Å; R1062-R1064 PolarHBondContact O-N 2.9Å; R1062-K1065 PolarHBondContact O-N 3.43Å; R1062-K1065 VanDerWaalsContact O-N 3.08Å; R1062-M1066 PolarHBondContact O-N 3.41Å; R1062-M1066 VanDerWaalsContact O-N 3.07Å
1063	L	41.8	Very low	39.5	Very low	92 Å²	92	116.7 Å²	116.7	48%	0.482	62%	0.62	S	S	.	*	H	α-helix	trans	-63.3	-36.7	173.6	-78.9	165.6	0	0	0	112.6	V1059 K1065 N1067	V1059-L1063 HydrophobicContact CG1-CD1 3.94Å; V1059-L1063 WeakPolarHBondContact O-CG 3.4Å; V1059-L1063 PolarHBondContact O-N 3.18Å; L1063-K1065 VanDerWaalsContact C-N 3.3Å; L1063-K1065 PolarHBondContact O-N 3.25Å; L1063-N1067 PolarHBondContact O-ND2 3.11Å
1064	R	45.3	Very low	38.6	Very low	162 Å²	162	119.9 Å²	119.9	61%	0.611	63%	0.633	S	S	*	*	H	α-helix	trans	-65.3	-33.6	171.9	-67.1	171.2	-150.7	179.1	7.7	112	Q1060 R1062 L1068	Q1060-R1064 VanDerWaalsContact O-CG 3.27Å; Q1060-R1064 WeakPolarHBondContact O-CG 3.43Å; Q1060-R1064 PolarHBondContact O-N 2.86Å; Q1060-R1064 VanDerWaalsContact O-N 3.15Å; R1062-R1064 VanDerWaalsContact C-N 3.33Å; R1062-R1064 PolarHBondContact O-N 2.9Å; R1064-L1068 VanDerWaalsContact O-CD1 3.28Å; R1064-L1068 WeakPolarHBondContact O-CD1 3.44Å
1065	K	37.6	Very low	37.9	Very low	158 Å²	158	120.3 Å²	120.3	69%	0.687	65%	0.645	S	S	*	*	H	α-helix	trans	-76.1	-33.4	-178.4	-159.2	173	-176.6	-179.7	0	113.7	R1061 R1062 L1063	R1061-K1065 PolarHBondContact O-N 3.04Å; R1062-K1065 PolarHBondContact O-N 3.43Å; R1062-K1065 VanDerWaalsContact O-N 3.08Å; L1063-K1065 VanDerWaalsContact C-N 3.3Å; L1063-K1065 PolarHBondContact O-N 3.25Å
1066	M	35.5	Very low	37.1	Very low	129 Å²	129	125 Å²	125	64%	0.635	67%	0.669	S	S	*	*	H	α-helix	trans	-70.5	-33	174.5	-71.4	-150.5	-56.3	0	0	113.3	R1062 L1068 L1069	R1062-M1066 PolarHBondContact O-N 3.41Å; R1062-M1066 VanDerWaalsContact O-N 3.07Å; M1066-L1068 PolarHBondContact O-N 3.02Å; M1066-L1068 VanDerWaalsContact O-N 3.14Å; M1066-L1069 PolarHBondContact O-N 3.21Å
1067	N	42.3	Very low	36.2	Very low	138 Å²	138	122.6 Å²	122.6	74%	0.738	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-1.9	-179.6	-69.9	-15.4	0	0	0	114.3	L1063	L1063-N1067 PolarHBondContact O-ND2 3.11Å
1068	L	41.9	Very low	35.2	Very low	150 Å²	150	122.6 Å²	122.6	79%	0.785	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-5.7	174.1	-96.3	86	0	0	0	114.2	R1064 M1066	R1064-L1068 VanDerWaalsContact O-CD1 3.28Å; R1064-L1068 WeakPolarHBondContact O-CD1 3.44Å; M1066-L1068 PolarHBondContact O-N 3.02Å; M1066-L1068 VanDerWaalsContact O-N 3.14Å
1069	L	35.3	Very low	34.1	Very low	139 Å²	139	125.3 Å²	125.3	73%	0.728	70%	0.701	S	S	*	*	S	Bend	trans	-115.4	2.4	-164	-78.8	166.2	0	0	0	116.8	M1066	M1066-L1069 PolarHBondContact O-N 3.21Å
1070	N	30.9	Very low	33.3	Very low	159 Å²	159	127 Å²	127	85%	0.85	72%	0.715	S	S	*	*	S	Bend	trans	-118.5	89.2	-178.1	-79.7	-9.3	0	0	0	113.8
1071	G	28.1	Very low	32.4	Very low	80 Å²	80	128.2 Å²	128.2	83%	0.825	73%	0.725	S	S	*	*			trans	67.3	133.9	159.5	0	0	0	0	0	118.5
1072	G	25.9	Very low	31	Very low	88 Å²	88	125.2 Å²	125.2	91%	0.907	73%	0.729	S	S	*	*			cis	88.7	120.4	4.4	0	0	0	0	0	113.6
1073	G	26.3	Very low	30.4	Very low	75 Å²	75	124.4 Å²	124.4	77%	0.773	74%	0.736	S	S	*	*			cis	-131.4	-158.8	-10.3	0	0	0	0	0	110.3
1074	V	27.1	Very low	29.6	Very low	127 Å²	127	130.6 Å²	130.6	77%	0.77	75%	0.753	S	S	*	*			cis	-158.2	138.8	21.5	165.6	0	0	0	0	109.2
1075	D	25.2	Very low	28.6	Very low	144 Å²	144	131 Å²	131	77%	0.77	76%	0.761	S	S	*	*			trans	49.4	151.6	157	-63.9	-8.1	0	0	0	122.2
1076	L	24.6	Very low	27.9	Very low	151 Å²	151	131.8 Å²	131.8	79%	0.791	77%	0.768	S	S	*	*			cis	-148.7	163.6	17.3	-125.8	144.6	0	0	0	112
1077	S	24.5	Very low	27.4	Very low	91 Å²	91	131.5 Å²	131.5	64%	0.636	77%	0.765	S	S	*	*			trans	-29.3	150.2	175.6	60.2	0	0	0	0	120.9
1078	V	25.1	Very low	26.6	Very low	138 Å²	138	132.5 Å²	132.5	84%	0.836	76%	0.763	S	S	*	*				-169.8	149.3	91.8	155.3	0	0	0	0	110.3
1079	S	21.1	Very low	25.8	Very low	101 Å²	101	132 Å²	132	71%	0.706	76%	0.76	S	S	*	*			trans	-88	157.6	-178	-170.1	0	0	0	0	113.2
1080	C	24.5	Very low	25.2	Very low	110 Å²	110	134.4 Å²	134.4	74%	0.743	77%	0.768	S	S	*	*				160	119.9	120.5	-165.9	0	0	0	0	113.2
1081	D	23.6	Very low	25	Very low	134 Å²	134	134 Å²	134	72%	0.717	77%	0.765	S	S	*	*			trans	3.8	152.4	150.5	-56.1	-61	0	0	0	124.5
1082	S	24.8	Very low	24.8	Very low	98 Å²	98	137.8 Å²	137.8	69%	0.685	77%	0.765	S	S	*	*				114.5	134.6	116.1	-105.3	0	0	0	0	122
1083	L	26.6	Very low	25.1	Very low	148 Å²	148	140.6 Å²	140.6	78%	0.775	76%	0.759	S	S	*	*			trans	68.1	130.3	155.7	-55.1	166.5	0	0	0	117.4
1084	R	24.9	Very low	25.3	Very low	222 Å²	222	142.8 Å²	142.8	84%	0.838	76%	0.76	S	S	*	*			cis	88.7	150.4	40	-81.4	-162.5	170.8	-144.5	1.1	114.7
1085	E	24	Very low	25.5	Very low	170 Å²	170	148.2 Å²	148.2	79%	0.794	77%	0.766	S	S	*	*			trans	81.9	123.6	175	-56.3	-175.1	179.6	0	0	115
1086	E	23.7	Very low	25.6	Very low	175 Å²	175	152.6 Å²	152.6	82%	0.818	77%	0.772	S	S	*	*				71.1	139.9	55	-73	-170.8	-161.5	0	0	112.4
1087	E	26	Very low	25.7	Very low	124 Å²	124	153.5 Å²	153.5	58%	0.579	78%	0.777	S	S	*	*			cis	-166.4	163.3	-19.5	-140.6	-161.3	149.9	0	0	107.5
1088	K	25.2	Very low	25.9	Very low	159 Å²	159	157.3 Å²	157.3	69%	0.691	78%	0.782	S	S	*	*			trans	64.5	158.3	156	-70.9	164.7	176.9	142.4	0	116.7
1089	L	24.3	Very low	26.1	Very low	138 Å²	138	160.8 Å²	160.8	72%	0.723	78%	0.782	S	S	*	*			cis	-160.1	140.3	0.3	-125.3	164.2	0	0	0	108.7
1090	Q	23.3	Very low	26.3	Very low	191 Å²	191	165.1 Å²	165.1	89%	0.893	79%	0.791	S	S	*	*				169.5	139.9	121.2	-92.2	179.3	2.7	0	0	114.5
1091	N	26.4	Very low	26.3	Very low	149 Å²	149	167.2 Å²	167.2	80%	0.797	79%	0.789	S	S	*	*			trans	-76.1	160.7	174.9	-96.4	-36.7	0	0	0	112.2
1092	I	24.2	Very low	26.6	Very low	160 Å²	160	166.6 Å²	166.6	82%	0.821	79%	0.786	S	S	*	*				179.1	134.7	109.3	-90	160.5	0	0	0	110.8
1093	N	32	Very low	26.6	Very low	147 Å²	147	169.6 Å²	169.6	79%	0.786	79%	0.79	S	S	*	*			trans	-70.6	152.2	169.6	-104.6	-51.8	0	0	0	110.7
1094	P	30.9	Very low	26.6	Very low	121 Å²	121	167.7 Å²	167.7	79%	0.786	79%	0.79	S	S	*	*				-145.2	140.4	110.2	32.8	-17	0	0	0	115.7
1095	R	30.6	Very low	26.8	Very low	241 Å²	241	167.9 Å²	167.9	91%	0.909	79%	0.791	S	S	*	*			trans	-116.6	117.7	150.6	-92	-176.4	169.8	176.2	-1.4	108.2
1096	R	26.7	Very low	27.1	Very low	236 Å²	236	165.8 Å²	165.8	89%	0.891	79%	0.792	S	S	*	*			trans	-158.5	150.1	150.9	-122.4	178.2	-175.4	-167	0.3	113
1097	L	26.5	Very low	27.4	Very low	171 Å²	171	161.4 Å²	161.4	90%	0.895	79%	0.785	S	S	*	*			trans	76.8	141.8	161	-60.6	166.2	0	0	0	119.3
1098	K	30.5	Very low	27.4	Very low	171 Å²	171	158.9 Å²	158.9	74%	0.743	79%	0.793	S	S	*	*			trans	-153	129.5	179.7	-154	-173	-173.5	-175.1	0	106.7
1099	Y	28.4	Very low	27.6	Very low	210 Å²	210	157.6 Å²	157.6	82%	0.824	80%	0.798	S	S	*	*			trans	69.9	111.1	174.2	-66.6	-70.5	0	0	0	119.7
1100	E	24.3	Very low	27.7	Very low	192 Å²	192	162 Å²	162	90%	0.897	81%	0.805	S	S	*	*				-176.3	160.3	121.2	-94.9	-180	175.9	0	0	105.7
1101	H	26.2	Very low	28	Very low	154 Å²	154	158.8 Å²	158.8	71%	0.713	80%	0.802	S	S	*	*			cis	-172.6	129.2	-24.4	-178.8	86.4	0	0	0	105.3
1102	L	28.8	Very low	28.3	Very low	122 Å²	122	156.6 Å²	156.6	64%	0.639	81%	0.805	S	S	*	*			trans	58.2	145.5	161.2	-102.7	61.6	0	0	0	123.9
1103	M	25.1	Very low	29.1	Very low	160 Å²	160	153.3 Å²	153.3	79%	0.788	80%	0.802	S	S	*	*			trans	66.6	131.4	167.1	-52.6	-52.6	169.6	0	0	116.7
1104	S	27.1	Very low	30	Very low	109 Å²	109	155.7 Å²	155.7	76%	0.762	81%	0.805	S	S	*	*			cis	-145.5	158	16.9	-56.3	0	0	0	0	112.3
1105	R	28.4	Very low	31.4	Very low	226 Å²	226	155.8 Å²	155.8	85%	0.853	80%	0.795	S	S	*	*			trans	-77.6	143.1	159.3	-74.4	171.7	70.1	176.7	0.8	109.3
1106	P	30.3	Very low	33.3	Very low	126 Å²	126	147.4 Å²	147.4	82%	0.818	77%	0.772	S	S	*	*				-112.3	171.4	117.2	-12.1	30.1	0	0	0	112.5
1107	A	29.7	Very low	35.9	Very low	83 Å²	83	136.7 Å²	136.7	69%	0.686	73%	0.733	S	S	*	*			trans	-112.8	147.9	-178.2	0	0	0	0	0	112.3
1108	G	27.4	Very low	38.8	Very low	71 Å²	71	136.7 Å²	136.7	73%	0.732	72%	0.721	S	S	*	*			trans	86.2	138.4	176.7	0	0	0	0	0	113.8
1109	T	28.1	Very low	41.6	Very low	131 Å²	131	128.7 Å²	128.7	80%	0.804	69%	0.686	S	S	*	*			cis	-159.2	154.2	5.9	-75.4	0	0	0	0	110.2
1110	R	27.6	Very low	44.7	Very low	231 Å²	231	120.3 Å²	120.3	87%	0.872	66%	0.658	S	S	*	*			trans	75.1	87.9	167.2	-82.9	166.4	175.6	-175.5	-3.6	120.4
1111	C	29.2	Very low	47.9	Very low	123 Å²	123	111.1 Å²	111.1	83%	0.831	62%	0.616	S	S	*	*				40.7	97.7	122.3	-147.6	0	0	0	0	120
1112	A	32.1	Very low	50.6	Low	103 Å²	103	107.2 Å²	107.2	85%	0.851	60%	0.604	S	S	*	*			trans	-89	106	152.9	0	0	0	0	0	109.4	K1114	A1112-K1114 PolarHBondContact O-N 2.91Å
1113	A	41.4	Very low	53.4	Low	92 Å²	92	107.9 Å²	107.9	76%	0.76	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-65.2	123	179.7	0	0	0	0	0	111
1114	K	50.1	Low	56.4	Low	197 Å²	197	102.5 Å²	102.5	86%	0.857	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-66.3	131.8	164.5	-69.5	177.8	178.9	175	0	107.9	A1112	A1112-K1114 PolarHBondContact O-N 2.91Å
1115	E	60.9	Low	59.1	Low	123 Å²	123	99.4 Å²	99.4	58%	0.575	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-52	123.1	169.8	-72.2	-175.6	139.5	0	0	109.2	V1117	E1115-V1117 VanDerWaalsContact C-N 3.25Å; E1115-V1117 PolarHBondContact O-N 3.47Å
1116	P	69.9	Low	61.7	Low	65 Å²	65	92.7 Å²	92.7	42%	0.422	53%	0.526	S	S	.	.	S	Bend	trans	-70.5	-22.8	-171.1	26.9	-35.2	0	0	0	112.9	L1209	P1116-L1209 HydrophobicContact CG-CD1 3.86Å; P1116-L1209 HydrophobicContact CG-CD2 4.26Å
1117	V	82.3	Confident	63.9	Low	11 Å²	11	92.9 Å²	92.9	7%	0.067	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125.9	174.4	-174.3	0	0	0	0	109.7	E1115 V1141 S1142 V1143 F1205 L1209 L1226 I1231	E1115-V1117 VanDerWaalsContact C-N 3.25Å; E1115-V1117 PolarHBondContact O-N 3.47Å; V1117-V1141 HydrophobicContact CG1-CG1 4.11Å; V1117-S1142 WeakPolarHBondContact CA-O 3.31Å; V1117-V1143 HydrophobicContact CG1-CG2 4.34Å; V1117-V1143 HydrophobicContact CG2-CG2 4.31Å; V1117-F1205 HydrophobicContact CB-CD1 4.49Å; V1117-F1205 HydrophobicContact CB-CG 4.49Å; V1117-F1205 HydrophobicContact CG1-CD1 4.08Å; V1117-F1205 HydrophobicContact CG1-CD2 4.09Å; V1117-F1205 HydrophobicContact CG1-CE1 4.22Å; V1117-F1205 HydrophobicContact CG1-CE2 4.22Å; V1117-F1205 HydrophobicContact CG1-CG 4.03Å; V1117-F1205 HydrophobicContact CG1-CZ 4.29Å; V1117-F1205 HydrophobicContact CG2-CD1 4.48Å; V1117-L1209 HydrophobicContact CG2-CD1 4.27Å; V1117-L1226 HydrophobicContact CG2-CD2 3.29Å; V1117-I1231 HydrophobicContact CG1-CD1 3.85Å; V1117-I1231 HydrophobicContact CG2-CD1 3.85Å
1118	R	85.9	Confident	65.8	Low	170 Å²	170	90.7 Å²	90.7	64%	0.642	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	123.4	172.1	-176.4	178.5	-68.9	-175.5	-1.5	110.3	V1141 S1142	R1118-V1141 CarbonylContact O-C 3.57Å; R1118-S1142 PolarHBondContact N-O 3.43Å; R1118-S1142 PolarHBondContact O-N 3.5Å
1119	V	90.9	Very high	67.1	Low	3 Å²	3	95.4 Å²	95.4	2%	0.018	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.5	175.7	66.9	0	0	0	0	112.1	V1139 K1140 V1141 L1201 R1202 F1205	V1119-V1139 HydrophobicContact CG2-CG1 3.88Å; V1119-K1140 WeakPolarHBondContact CA-O 3.46Å; V1119-V1141 HydrophobicContact CG2-CG2 4.17Å; V1119-L1201 HydrophobicContact CG1-CB 3.89Å; V1119-L1201 HydrophobicContact CG2-CB 4.05Å; V1119-L1201 HydrophobicContact CG2-CD1 3.84Å; V1119-R1202 HydrophobicContact CG1-CB 4.4Å; V1119-R1202 HydrophobicContact CG1-CG 3.62Å; V1119-R1202 PolarHBondContact O-NE 3.39Å; V1119-R1202 PolarHBondContact O-NH2 3.47Å; V1119-R1202 VanDerWaalsContact O-NH2 3.11Å; V1119-F1205 HydrophobicContact CB-CD2 4.41Å; V1119-F1205 HydrophobicContact CB-CE2 4.44Å; V1119-F1205 HydrophobicContact CG1-CD2 4.05Å
1120	S	92.1	Very high	68.9	Low	34 Å²	34	91.2 Å²	91.2	24%	0.238	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.2	175.8	59.8	0	0	0	0	111.5	P1122 K1140	S1120-P1122 WeakPolarHBondContact O-CD 3.28Å; S1120-K1140 PolarHBondContact N-O 3Å; S1120-K1140 PolarHBondContact O-N 2.98Å
1121	I	91.8	Very high	70	Confident	0 Å²	0	90 Å²	90	0%	0	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	74.6	175.6	-53	-175.1	0	0	0	108.7	R1123 F1137 E1138 V1139 F1157 R1194 L1197 E1198 L1201	I1121-R1123 PolarHBondContact O-N 3.16Å; I1121-R1123 VanDerWaalsContact O-N 3.15Å; I1121-F1137 HydrophobicContact CG2-CB 3.78Å; I1121-F1137 HydrophobicContact CG2-CD1 4.15Å; I1121-F1137 HydrophobicContact CG2-CG 4.45Å; I1121-E1138 VanDerWaalsContact CA-O 3.29Å; I1121-E1138 WeakPolarHBondContact CA-O 3.41Å; I1121-E1138 WeakPolarHBondContact CG2-O 3.41Å; I1121-V1139 HydrophobicContact CD1-CG2 4.29Å; I1121-V1139 HydrophobicContact CG1-CG2 4.27Å; I1121-F1157 HydrophobicContact CD1-CE1 3.88Å; I1121-F1157 HydrophobicContact CD1-CZ 3.97Å; I1121-R1194 HydrophobicContact CB-CG 4.22Å; I1121-R1194 HydrophobicContact CG2-CG 3.78Å; I1121-R1194 WeakPolarHBondContact O-CD 3.38Å; I1121-R1194 PolarHBondContact O-NH1 2.98Å; I1121-L1197 HydrophobicContact CD1-CB 3.74Å; I1121-E1198 HydrophobicContact CB-CB 4.15Å; I1121-E1198 HydrophobicContact CB-CG 4.47Å; I1121-E1198 HydrophobicContact CD1-CB 4.1Å; I1121-E1198 HydrophobicContact CG1-CB 3.93Å; I1121-E1198 HydrophobicContact CG1-CG 4.28Å; I1121-E1198 PolarHBondContact N-OE2 2.87Å; I1121-L1201 HydrophobicContact CD1-CD1 4.18Å
1122	P	84.4	Confident	71.4	Confident	72 Å²	72	90.1 Å²	90.1	47%	0.468	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	-30.7	-171	21	-35.3	0	0	0	114.9	S1120 E1138	S1120-P1122 WeakPolarHBondContact O-CD 3.28Å; P1122-E1138 WeakPolarHBondContact CD-O 3.3Å; P1122-E1138 WeakPolarHBondContact CG-OE2 3.24Å
1123	R	86	Confident	73.5	Confident	136 Å²	136	88.4 Å²	88.4	51%	0.513	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	169.9	-179.7	56.1	176.4	172.7	169.9	3.9	112.5	I1121 E1138	I1121-R1123 PolarHBondContact O-N 3.16Å; I1121-R1123 VanDerWaalsContact O-N 3.15Å; R1123-E1138 HydrophobicContact CG-CB 4Å; R1123-E1138 WeakPolarHBondContact CG-OE2 3.41Å; R1123-E1138 IonicContact CZ-OE1 3.08Å; R1123-E1138 IonicContact CZ-OE2 3.38Å; R1123-E1138 VanDerWaalsContact NE-CD 3.32Å; R1123-E1138 IonicContact NE-OE1 2.68Å; R1123-E1138 PolarHBondContact NE-OE1 2.89Å; R1123-E1138 IonicContact NE-OE2 2.65Å; R1123-E1138 PolarHBondContact NE-OE2 3.34Å; R1123-E1138 IonicContact NH2-OE1 3.44Å; R1123-E1138 PolarHBondContact NH2-OE1 3.32Å; R1123-E1138 IonicContact NH2-OE2 3.34Å; R1123-E1138 PolarHBondContact NH2-OE2 3.35Å; R1123-E1138 PolarHBondContact O-N 2.97Å
1124	Y	88.1	Confident	75.3	Confident	47 Å²	47	86.4 Å²	86.4	18%	0.184	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	158.9	168.3	51.7	-94.9	0	0	0	109.6	F1135 E1136 F1137 E1187 V1190 R1194	Y1124-F1135 AromaticContact CD2-CD1 3.66Å; Y1124-F1135 HydrophobicContact CD2-CD1 3.66Å; Y1124-F1135 AromaticContact CD2-CE1 3.88Å; Y1124-F1135 HydrophobicContact CD2-CE1 3.88Å; Y1124-F1135 HydrophobicContact CE2-CD1 4.32Å; Y1124-F1135 HydrophobicContact CE2-CE1 4.12Å; Y1124-E1136 CarbonylContact C-O 3.51Å; Y1124-E1136 WeakPolarHBondContact CA-O 3.36Å; Y1124-F1137 HydrophobicContact CD1-CE1 4.37Å; Y1124-F1137 HydrophobicContact CG-CE1 4.38Å; Y1124-E1187 HydrophobicContact CE2-CG 4.44Å; Y1124-E1187 PolarHBondContact OH-O 2.89Å; Y1124-V1190 HydrophobicContact CD1-CG1 3.94Å; Y1124-V1190 HydrophobicContact CD2-CG1 3.45Å; Y1124-V1190 VanDerWaalsContact CD2-CG1 3.45Å; Y1124-V1190 HydrophobicContact CE1-CG1 4.1Å; Y1124-V1190 HydrophobicContact CE2-CB 4.25Å; Y1124-V1190 HydrophobicContact CE2-CG1 3.62Å; Y1124-V1190 HydrophobicContact CG-CG1 3.62Å; Y1124-R1194 HydrophobicContact CD1-CB 3.93Å; Y1124-R1194 HydrophobicContact CD1-CG 4.03Å; Y1124-R1194 HydrophobicContact CE1-CB 4.3Å
1125	V	83.5	Confident	77	Confident	44 Å²	44	78.6 Å²	78.6	27%	0.267	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.6	-177.8	-176.1	0	0	0	0	108.7	F1135 E1136 F1151	V1125-F1135 WeakPolarHBondContact O-CA 3.35Å; V1125-E1136 PolarHBondContact N-O 3.41Å; V1125-E1136 PolarHBondContact O-N 3.04Å; V1125-F1151 HydrophobicContact CG2-CE1 4.35Å
1126	L	84.2	Confident	78.4	Confident	85 Å²	85	74.8 Å²	74.8	45%	0.445	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	131.2	171.9	-172.3	59.4	0	0	0	109.8	E1133 F1135	L1126-E1133 HydrophobicContact CD1-CB 4.18Å; L1126-F1135 HydrophobicContact CB-CD1 4.09Å; L1126-F1135 HydrophobicContact CB-CE1 3.77Å; L1126-F1135 HydrophobicContact CB-CZ 4.23Å; L1126-F1135 HydrophobicContact CD1-CD1 4.22Å; L1126-F1135 HydrophobicContact CD1-CD2 3.96Å; L1126-F1135 HydrophobicContact CD1-CE1 4.09Å; L1126-F1135 HydrophobicContact CD1-CE2 3.78Å; L1126-F1135 HydrophobicContact CD1-CG 4.2Å; L1126-F1135 HydrophobicContact CD1-CZ 3.87Å; L1126-F1135 HydrophobicContact CD2-CZ 4.45Å; L1126-F1135 HydrophobicContact CG-CE1 4.42Å; L1126-F1135 HydrophobicContact CG-CZ 4.42Å
1127	R	76.1	Confident	79.4	Confident	129 Å²	129	71.8 Å²	71.8	49%	0.487	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	158	-179.3	-68.1	-67.3	-169.6	169.4	-2.2	110.1	E1133 H1134 E1136	R1127-E1133 CarbonylContact O-C 3.56Å; R1127-E1133 VanDerWaalsContact O-CA 3.3Å; R1127-E1133 WeakPolarHBondContact O-CA 3.45Å; R1127-H1134 PolarHBondContact N-O 3.3Å; R1127-H1134 PolarHBondContact O-N 3.48Å; R1127-H1134 VanDerWaalsContact O-O 3.12Å; R1127-E1136 HydrophobicContact CB-CG 4.24Å; R1127-E1136 HydrophobicContact CG-CB 4.44Å; R1127-E1136 HydrophobicContact CG-CG 3.97Å
1128	G	69.4	Low	79.9	Confident	38 Å²	38	72.4 Å²	72.4	39%	0.392	36%	0.356	S	S	.	.	S	Bend	trans	88.2	177.9	-172.9	0	0	0	0	0	113.2
1129	Q	55.7	Low	80.2	Confident	170 Å²	170	64.3 Å²	64.3	79%	0.794	33%	0.325	S	S	*	.	S	Bend	trans	-135.3	142.4	179.8	-68.4	-176.8	-3.2	0	0	110.7	K1131 D1132	Q1129-K1131 PolarHBondContact O-N 2.89Å; Q1129-D1132 PolarHBondContact O-N 3.49Å
1130	G	66.3	Low	80.2	Confident	43 Å²	43	68.3 Å²	68.3	44%	0.443	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	63	-122.6	173.1	0	0	0	0	0	112	D1132 E1133 R1185	G1130-D1132 VanDerWaalsContact C-N 3.28Å; G1130-D1132 PolarHBondContact O-N 3.21Å; G1130-E1133 PolarHBondContact N-OE1 2.79Å; G1130-E1133 VanDerWaalsContact O-CD 3.26Å; G1130-E1133 WeakPolarHBondContact O-CG 3.23Å; G1130-R1185 PolarHBondContact O-NH2 3.08Å
1131	K	50.7	Low	80.1	Confident	204 Å²	204	66.8 Å²	66.8	89%	0.887	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-68.9	-24.9	-178.8	-73.4	-176.2	178.2	177.8	0	113.4	Q1129 E1133 R1185	Q1129-K1131 PolarHBondContact O-N 2.89Å; K1131-E1133 VanDerWaalsContact C-N 3.34Å; K1131-R1185 PolarHBondContact O-NH2 3.44Å
1132	D	57.7	Low	79.9	Confident	126 Å²	126	68.1 Å²	68.1	67%	0.674	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-91.6	7.8	-176	-60.4	-56.8	0	0	0	114.1	Q1129 G1130 H1134	Q1129-D1132 PolarHBondContact O-N 3.49Å; G1130-D1132 VanDerWaalsContact C-N 3.28Å; G1130-D1132 PolarHBondContact O-N 3.21Å; D1132-H1134 PolarHBondContact O-N 2.77Å; D1132-H1134 PolarHBondContact O-ND1 2.64Å
1133	E	75.5	Confident	79.9	Confident	68 Å²	68	64.8 Å²	64.8	32%	0.318	32%	0.319	S	S	.	.			trans	-60	122.5	171.8	-77.2	159.8	-164.6	0	0	112.1	L1126 R1127 G1130 K1131 R1185	L1126-E1133 HydrophobicContact CD1-CB 4.18Å; R1127-E1133 CarbonylContact O-C 3.56Å; R1127-E1133 VanDerWaalsContact O-CA 3.3Å; R1127-E1133 WeakPolarHBondContact O-CA 3.45Å; G1130-E1133 PolarHBondContact N-OE1 2.79Å; G1130-E1133 VanDerWaalsContact O-CD 3.26Å; G1130-E1133 WeakPolarHBondContact O-CG 3.23Å; K1131-E1133 VanDerWaalsContact C-N 3.34Å; E1133-R1185 IonicContact OE2-CZ 2.76Å; E1133-R1185 IonicContact OE2-NH1 3.73Å; E1133-R1185 PolarHBondContact OE2-NH1 2.99Å; E1133-R1185 IonicContact OE2-NH2 3.43Å
1134	H	80.2	Confident	79.5	Confident	50 Å²	50	64.4 Å²	64.4	23%	0.231	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	149.7	-178.4	62.6	-86.7	0	0	0	111.6	R1127 D1132	R1127-H1134 PolarHBondContact N-O 3.3Å; R1127-H1134 PolarHBondContact O-N 3.48Å; R1127-H1134 VanDerWaalsContact O-O 3.12Å; D1132-H1134 PolarHBondContact O-N 2.77Å; D1132-H1134 PolarHBondContact O-ND1 2.64Å
1135	F	85.8	Confident	78.6	Confident	32 Å²	32	70 Å²	70	14%	0.14	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	127.8	176	-73	-84.5	0	0	0	111.8	Y1124 V1125 L1126 F1137 R1153 V1190	Y1124-F1135 AromaticContact CD2-CD1 3.66Å; Y1124-F1135 HydrophobicContact CD2-CD1 3.66Å; Y1124-F1135 AromaticContact CD2-CE1 3.88Å; Y1124-F1135 HydrophobicContact CD2-CE1 3.88Å; Y1124-F1135 HydrophobicContact CE2-CD1 4.32Å; Y1124-F1135 HydrophobicContact CE2-CE1 4.12Å; V1125-F1135 WeakPolarHBondContact O-CA 3.35Å; L1126-F1135 HydrophobicContact CB-CD1 4.09Å; L1126-F1135 HydrophobicContact CB-CE1 3.77Å; L1126-F1135 HydrophobicContact CB-CZ 4.23Å; L1126-F1135 HydrophobicContact CD1-CD1 4.22Å; L1126-F1135 HydrophobicContact CD1-CD2 3.96Å; L1126-F1135 HydrophobicContact CD1-CE1 4.09Å; L1126-F1135 HydrophobicContact CD1-CE2 3.78Å; L1126-F1135 HydrophobicContact CD1-CG 4.2Å; L1126-F1135 HydrophobicContact CD1-CZ 3.87Å; L1126-F1135 HydrophobicContact CD2-CZ 4.45Å; L1126-F1135 HydrophobicContact CG-CE1 4.42Å; L1126-F1135 HydrophobicContact CG-CZ 4.42Å; F1135-F1137 HydrophobicContact CB-CE2 4.39Å; F1135-F1137 HydrophobicContact CB-CZ 4.45Å; F1135-R1153 WeakPolarHBondContact O-CA 3.4Å; F1135-V1190 HydrophobicContact CB-CG1 4.02Å; F1135-V1190 HydrophobicContact CD1-CG1 3.84Å; F1135-V1190 HydrophobicContact CD2-CB 4.42Å; F1135-V1190 HydrophobicContact CD2-CG1 4.11Å; F1135-V1190 HydrophobicContact CD2-CG2 3.48Å; F1135-V1190 VanDerWaalsContact CD2-CG2 3.48Å; F1135-V1190 HydrophobicContact CE1-CG1 4.27Å; F1135-V1190 HydrophobicContact CE2-CG2 3.56Å; F1135-V1190 HydrophobicContact CG-CB 4.49Å; F1135-V1190 HydrophobicContact CG-CG1 3.71Å; F1135-V1190 HydrophobicContact CG-CG2 3.98Å; F1135-V1190 HydrophobicContact CZ-CG2 4.12Å
1136	E	90.3	Very high	78.3	Confident	44 Å²	44	71.6 Å²	71.6	21%	0.206	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.5	166.8	-62.8	-154.6	119.5	0	0	110.8	Y1124 V1125 R1127 R1153	Y1124-E1136 CarbonylContact C-O 3.51Å; Y1124-E1136 WeakPolarHBondContact CA-O 3.36Å; V1125-E1136 PolarHBondContact N-O 3.41Å; V1125-E1136 PolarHBondContact O-N 3.04Å; R1127-E1136 HydrophobicContact CB-CG 4.24Å; R1127-E1136 HydrophobicContact CG-CB 4.44Å; R1127-E1136 HydrophobicContact CG-CG 3.97Å; E1136-R1153 HydrophobicContact CG-CB 4.37Å
1137	F	91.1	Very high	78.3	Confident	2 Å²	2	70.6 Å²	70.6	1%	0.009	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.1	179.6	-62.5	-89.9	0	0	0	109.2	I1121 Y1124 F1135 V1139 F1151 R1152 F1157 V1190 R1193 R1194 L1197	I1121-F1137 HydrophobicContact CG2-CB 3.78Å; I1121-F1137 HydrophobicContact CG2-CD1 4.15Å; I1121-F1137 HydrophobicContact CG2-CG 4.45Å; Y1124-F1137 HydrophobicContact CD1-CE1 4.37Å; Y1124-F1137 HydrophobicContact CG-CE1 4.38Å; F1135-F1137 HydrophobicContact CB-CE2 4.39Å; F1135-F1137 HydrophobicContact CB-CZ 4.45Å; F1137-V1139 PolarHBondContact O-N 2.95Å; F1137-F1151 WeakPolarHBondContact O-CA 3.37Å; F1137-R1152 PolarHBondContact N-O 3.39Å; F1137-R1152 PolarHBondContact O-N 3.24Å; F1137-R1152 VanDerWaalsContact O-N 3.08Å; F1137-F1157 HydrophobicContact CB-CE2 3.95Å; F1137-F1157 HydrophobicContact CB-CZ 3.87Å; F1137-F1157 HydrophobicContact CD2-CE2 4.04Å; F1137-F1157 HydrophobicContact CG-CE2 4.29Å; F1137-F1157 HydrophobicContact CG-CZ 4.41Å; F1137-V1190 HydrophobicContact CE1-CG1 4.1Å; F1137-V1190 HydrophobicContact CZ-CG1 4.04Å; F1137-R1193 HydrophobicContact CZ-CG 4.17Å; F1137-R1194 HydrophobicContact CD1-CB 4.09Å; F1137-R1194 HydrophobicContact CD1-CG 4.22Å; F1137-R1194 HydrophobicContact CE1-CB 3.88Å; F1137-R1194 HydrophobicContact CE1-CG 4.5Å; F1137-L1197 HydrophobicContact CD1-CD1 4.17Å; F1137-L1197 HydrophobicContact CD2-CD1 3.89Å; F1137-L1197 HydrophobicContact CE1-CD1 4.12Å; F1137-L1197 HydrophobicContact CE2-CD1 3.84Å; F1137-L1197 HydrophobicContact CG-CD1 4.07Å; F1137-L1197 HydrophobicContact CZ-CD1 3.96Å
1138	E	92.5	Very high	78.9	Confident	24 Å²	24	65.2 Å²	65.2	11%	0.112	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	102.1	175.1	-173.7	179	-129	0	0	108.8	I1121 P1122 R1123 T1149 F1151	I1121-E1138 VanDerWaalsContact CA-O 3.29Å; I1121-E1138 WeakPolarHBondContact CA-O 3.41Å; I1121-E1138 WeakPolarHBondContact CG2-O 3.41Å; P1122-E1138 WeakPolarHBondContact CD-O 3.3Å; P1122-E1138 WeakPolarHBondContact CG-OE2 3.24Å; R1123-E1138 HydrophobicContact CG-CB 4Å; R1123-E1138 WeakPolarHBondContact CG-OE2 3.41Å; R1123-E1138 IonicContact CZ-OE1 3.08Å; R1123-E1138 IonicContact CZ-OE2 3.38Å; R1123-E1138 VanDerWaalsContact NE-CD 3.32Å; R1123-E1138 IonicContact NE-OE1 2.68Å; R1123-E1138 PolarHBondContact NE-OE1 2.89Å; R1123-E1138 IonicContact NE-OE2 2.65Å; R1123-E1138 PolarHBondContact NE-OE2 3.34Å; R1123-E1138 IonicContact NH2-OE1 3.44Å; R1123-E1138 PolarHBondContact NH2-OE1 3.32Å; R1123-E1138 IonicContact NH2-OE2 3.34Å; R1123-E1138 PolarHBondContact NH2-OE2 3.35Å; R1123-E1138 PolarHBondContact O-N 2.97Å; E1138-T1149 HydrophobicContact CG-CG2 3.22Å; E1138-F1151 HydrophobicContact CB-CD1 4.08Å; E1138-F1151 HydrophobicContact CB-CE1 3.6Å; E1138-F1151 HydrophobicContact CB-CZ 4Å; E1138-F1151 HydrophobicContact CG-CD1 4.46Å; E1138-F1151 HydrophobicContact CG-CE1 3.8Å; E1138-F1151 HydrophobicContact CG-CE2 4.18Å; E1138-F1151 HydrophobicContact CG-CZ 3.63Å; E1138-F1151 VanDerWaalsContact OE1-CZ 3.29Å; E1138-F1151 WeakPolarHBondContact OE1-CZ 3.3Å
1139	V	92.4	Very high	79.8	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	114.1	178.4	-175.1	0	0	0	0	109.1	V1119 I1121 F1137 V1141 T1149 V1150 F1157 L1201 F1237	V1119-V1139 HydrophobicContact CG2-CG1 3.88Å; I1121-V1139 HydrophobicContact CD1-CG2 4.29Å; I1121-V1139 HydrophobicContact CG1-CG2 4.27Å; F1137-V1139 PolarHBondContact O-N 2.95Å; V1139-V1141 HydrophobicContact CG1-CG2 4.15Å; V1139-T1149 WeakPolarHBondContact O-CA 3.4Å; V1139-V1150 HydrophobicContact CB-CG2 3.97Å; V1139-V1150 PolarHBondContact N-O 2.78Å; V1139-V1150 PolarHBondContact O-N 3.41Å; V1139-F1157 HydrophobicContact CG2-CE1 4.02Å; V1139-F1157 HydrophobicContact CG2-CE2 4.42Å; V1139-F1157 HydrophobicContact CG2-CZ 3.49Å; V1139-F1157 VanDerWaalsContact CG2-CZ 3.49Å; V1139-L1201 HydrophobicContact CG1-CD1 3.54Å; V1139-L1201 HydrophobicContact CG2-CD1 4.2Å; V1139-F1237 HydrophobicContact CG2-CE1 4.39Å; V1139-F1237 HydrophobicContact CG2-CZ 4.35Å
1140	K	90.6	Very high	81.4	Confident	87 Å²	87	57.6 Å²	57.6	38%	0.378	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	123.8	173	-173.8	175.7	-179.9	177.2	0	109.8	V1119 S1120 S1147 W1148	V1119-K1140 WeakPolarHBondContact CA-O 3.46Å; S1120-K1140 PolarHBondContact N-O 3Å; S1120-K1140 PolarHBondContact O-N 2.98Å; K1140-S1147 WeakPolarHBondContact CE-OG 3.49Å; K1140-W1148 WeakPolarHBondContact CA-O 3.46Å
1141	V	90.9	Very high	82.5	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.4	176.4	-173.8	0	0	0	0	108.5	V1117 R1118 V1119 V1139 V1143 S1147 W1148 I1231 F1238	V1117-V1141 HydrophobicContact CG1-CG1 4.11Å; R1118-V1141 CarbonylContact O-C 3.57Å; V1119-V1141 HydrophobicContact CG2-CG2 4.17Å; V1139-V1141 HydrophobicContact CG1-CG2 4.15Å; V1141-V1143 HydrophobicContact CG1-CG2 4.3Å; V1141-S1147 WeakPolarHBondContact O-CA 3.36Å; V1141-S1147 PolarHBondContact O-OG 2.87Å; V1141-W1148 HydrophobicContact CB-CD2 4.41Å; V1141-W1148 HydrophobicContact CB-CH2 4.17Å; V1141-W1148 HydrophobicContact CB-CZ2 4Å; V1141-W1148 HydrophobicContact CB-CZ3 4.46Å; V1141-W1148 HydrophobicContact CG1-CH2 3.7Å; V1141-W1148 HydrophobicContact CG1-CZ2 3.88Å; V1141-W1148 HydrophobicContact CG1-CZ3 4.2Å; V1141-W1148 PolarHBondContact N-O 3.28Å; V1141-W1148 PolarHBondContact O-N 2.65Å; V1141-W1148 VanDerWaalsContact O-O 3.13Å; V1141-I1231 HydrophobicContact CG1-CD1 4.2Å; V1141-F1238 HydrophobicContact CG2-CD1 3.76Å; V1141-F1238 HydrophobicContact CG2-CE1 4.05Å
1142	S	86.8	Confident	84.4	Confident	28 Å²	28	50.2 Å²	50.2	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	133.9	173.6	-41.5	0	0	0	0	110.1	V1117 R1118 D1146 S1147	V1117-S1142 WeakPolarHBondContact CA-O 3.31Å; R1118-S1142 PolarHBondContact N-O 3.43Å; R1118-S1142 PolarHBondContact O-N 3.5Å; S1142-D1146 CarbonylContact C-O 3.6Å; S1142-D1146 WeakPolarHBondContact CA-O 3.48Å; S1142-S1147 PolarHBondContact OG-OG 3.43Å
1143	V	85.3	Confident	85.9	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.018	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	113.5	-178.3	-172	0	0	0	0	107.5	V1117 V1141 D1145 D1146 W1148 L1226 I1231	V1117-V1143 HydrophobicContact CG1-CG2 4.34Å; V1117-V1143 HydrophobicContact CG2-CG2 4.31Å; V1141-V1143 HydrophobicContact CG1-CG2 4.3Å; V1143-D1145 PolarHBondContact O-N 3.23Å; V1143-D1146 PolarHBondContact N-O 3.14Å; V1143-D1146 PolarHBondContact O-N 2.98Å; V1143-W1148 HydrophobicContact CB-CZ3 4.43Å; V1143-W1148 HydrophobicContact CG2-CH2 3.73Å; V1143-W1148 HydrophobicContact CG2-CZ3 3.81Å; V1143-L1226 HydrophobicContact CG1-CB 4.19Å; V1143-L1226 HydrophobicContact CG1-CD2 4.04Å; V1143-L1226 HydrophobicContact CG1-CG 4Å; V1143-L1226 WeakPolarHBondContact CG1-O 3.4Å; V1143-I1231 HydrophobicContact CG2-CD1 3.28Å; V1143-I1231 HydrophobicContact CG2-CG1 4.16Å
1144	M	75.7	Confident	86.5	Confident	128 Å²	128	45.6 Å²	45.6	63%	0.631	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.6	-111.2	-168.8	-48.6	-150.8	88.8	0	0	111.6
1145	D	69.9	Low	86.7	Confident	163 Å²	163	45.2 Å²	45.2	87%	0.872	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-12.6	-179.4	-56.5	-50.4	0	0	0	113.8	V1143	V1143-D1145 PolarHBondContact O-N 3.23Å
1146	D	77.9	Confident	86.8	Confident	79 Å²	79	47 Å²	47	42%	0.422	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	130.1	177.8	-95.4	-31	0	0	0	111.2	S1142 V1143 W1148 K1228	S1142-D1146 CarbonylContact C-O 3.6Å; S1142-D1146 WeakPolarHBondContact CA-O 3.48Å; V1143-D1146 PolarHBondContact N-O 3.14Å; V1143-D1146 PolarHBondContact O-N 2.98Å; D1146-W1148 HydrophobicContact CB-CZ3 4.4Å; D1146-K1228 HydrophobicContact CB-CB 4.18Å; D1146-K1228 WeakPolarHBondContact OD2-CB 3.27Å
1147	S	84.1	Confident	86.9	Confident	63 Å²	63	45 Å²	45	44%	0.441	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	130.8	173.5	-164.3	0	0	0	0	111.4	K1140 V1141 S1142	K1140-S1147 WeakPolarHBondContact CE-OG 3.49Å; V1141-S1147 WeakPolarHBondContact O-CA 3.36Å; V1141-S1147 PolarHBondContact O-OG 2.87Å; S1142-S1147 PolarHBondContact OG-OG 3.43Å
1148	W	88.9	Confident	86.7	Confident	17 Å²	17	49.7 Å²	49.7	6%	0.064	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	166.8	178.2	73.2	103	0	0	0	112.5	K1140 V1141 V1143 D1146 K1228 I1231 F1238	K1140-W1148 WeakPolarHBondContact CA-O 3.46Å; V1141-W1148 HydrophobicContact CB-CD2 4.41Å; V1141-W1148 HydrophobicContact CB-CH2 4.17Å; V1141-W1148 HydrophobicContact CB-CZ2 4Å; V1141-W1148 HydrophobicContact CB-CZ3 4.46Å; V1141-W1148 HydrophobicContact CG1-CH2 3.7Å; V1141-W1148 HydrophobicContact CG1-CZ2 3.88Å; V1141-W1148 HydrophobicContact CG1-CZ3 4.2Å; V1141-W1148 PolarHBondContact N-O 3.28Å; V1141-W1148 PolarHBondContact O-N 2.65Å; V1141-W1148 VanDerWaalsContact O-O 3.13Å; V1143-W1148 HydrophobicContact CB-CZ3 4.43Å; V1143-W1148 HydrophobicContact CG2-CH2 3.73Å; V1143-W1148 HydrophobicContact CG2-CZ3 3.81Å; D1146-W1148 HydrophobicContact CB-CZ3 4.4Å; W1148-K1228 HydrophobicContact CD2-CD 3.93Å; W1148-K1228 HydrophobicContact CD2-CG 3.9Å; W1148-K1228 HydrophobicContact CE3-CB 4.09Å; W1148-K1228 HydrophobicContact CE3-CD 3.73Å; W1148-K1228 HydrophobicContact CE3-CG 3.69Å; W1148-K1228 HydrophobicContact CG-CD 4.38Å; W1148-K1228 HydrophobicContact CH2-CB 3.91Å; W1148-K1228 HydrophobicContact CH2-CG 3.8Å; W1148-K1228 HydrophobicContact CZ2-CG 3.98Å; W1148-K1228 HydrophobicContact CZ3-CB 3.63Å; W1148-K1228 HydrophobicContact CZ3-CD 4.16Å; W1148-K1228 HydrophobicContact CZ3-CG 3.65Å; W1148-I1231 HydrophobicContact CH2-CB 4.05Å; W1148-I1231 HydrophobicContact CH2-CD1 4.31Å; W1148-I1231 HydrophobicContact CH2-CG2 4.23Å; W1148-I1231 HydrophobicContact CZ2-CB 4.09Å; W1148-I1231 HydrophobicContact CZ2-CG2 3.92Å; W1148-F1238 PolarHBondContact NE1-O 3.44Å
1149	T	88.4	Confident	86.4	Confident	43 Å²	43	51.7 Å²	51.7	26%	0.264	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	138.3	-173.4	-52.1	0	0	0	0	110.4	E1138 V1139 F1151	E1138-T1149 HydrophobicContact CG-CG2 3.22Å; V1139-T1149 WeakPolarHBondContact O-CA 3.4Å; T1149-F1151 HydrophobicContact CG2-CE2 4.38Å
1150	V	89.4	Confident	86.3	Confident	5 Å²	5	52.1 Å²	52.1	3%	0.03	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.8	171.5	-63.1	0	0	0	0	110.4	V1139 R1152 K1240	V1139-V1150 HydrophobicContact CB-CG2 3.97Å; V1139-V1150 PolarHBondContact N-O 2.78Å; V1139-V1150 PolarHBondContact O-N 3.41Å; V1150-R1152 HydrophobicContact CG2-CG 4.17Å; V1150-K1240 HydrophobicContact CG1-CB 4.35Å
1151	F	88.9	Confident	86.2	Confident	69 Å²	69	48.8 Å²	48.8	30%	0.303	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.6	173.5	-72.2	-95.2	0	0	0	109.4	V1125 F1137 E1138 T1149	V1125-F1151 HydrophobicContact CG2-CE1 4.35Å; F1137-F1151 WeakPolarHBondContact O-CA 3.37Å; E1138-F1151 HydrophobicContact CB-CD1 4.08Å; E1138-F1151 HydrophobicContact CB-CE1 3.6Å; E1138-F1151 HydrophobicContact CB-CZ 4Å; E1138-F1151 HydrophobicContact CG-CD1 4.46Å; E1138-F1151 HydrophobicContact CG-CE1 3.8Å; E1138-F1151 HydrophobicContact CG-CE2 4.18Å; E1138-F1151 HydrophobicContact CG-CZ 3.63Å; E1138-F1151 VanDerWaalsContact OE1-CZ 3.29Å; E1138-F1151 WeakPolarHBondContact OE1-CZ 3.3Å; T1149-F1151 HydrophobicContact CG2-CE2 4.38Å
1152	R	89.3	Confident	86	Confident	23 Å²	23	55.9 Å²	55.9	9%	0.087	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	125.5	-174	-63.5	-65.9	175	-142.6	20.5	111.5	F1137 V1150 R1156 F1157 P1236 F1237 K1239 E1244	F1137-R1152 PolarHBondContact N-O 3.39Å; F1137-R1152 PolarHBondContact O-N 3.24Å; F1137-R1152 VanDerWaalsContact O-N 3.08Å; V1150-R1152 HydrophobicContact CG2-CG 4.17Å; R1152-R1156 HydrophobicContact CB-CB 4.38Å; R1152-F1157 HydrophobicContact CB-CD2 4.18Å; R1152-F1157 HydrophobicContact CB-CE2 3.68Å; R1152-F1157 HydrophobicContact CB-CZ 4.4Å; R1152-F1157 WeakPolarHBondContact O-CE2 3.43Å; R1152-P1236 PolarHBondContact NH2-O 2.74Å; R1152-F1237 HydrophobicContact CB-CE2 3.72Å; R1152-F1237 HydrophobicContact CB-CZ 3.82Å; R1152-F1237 HydrophobicContact CG-CD2 4.07Å; R1152-F1237 HydrophobicContact CG-CE1 4.19Å; R1152-F1237 HydrophobicContact CG-CE2 3.55Å; R1152-F1237 HydrophobicContact CG-CZ 3.62Å; R1152-F1237 PolarHBondContact NE-O 2.9Å; R1152-F1237 PolarHBondContact NH2-O 3.48Å; R1152-K1239 PolarHBondContact NH2-O 3.31Å; R1152-E1244 IonicContact CZ-OE1 2.72Å; R1152-E1244 IonicContact NH1-OE1 3.69Å; R1152-E1244 PolarHBondContact NH1-OE1 3.35Å; R1152-E1244 IonicContact NH2-OE1 3.58Å; R1152-E1244 PolarHBondContact NH2-OE1 3Å
1153	R	89.4	Confident	86	Confident	67 Å²	67	57.6 Å²	57.6	25%	0.253	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	150.6	166.4	64.6	179.2	-165.5	-178.8	5.1	112.1	F1135 E1136 S1155 R1156	F1135-R1153 WeakPolarHBondContact O-CA 3.4Å; E1136-R1153 HydrophobicContact CG-CB 4.37Å; R1153-S1155 WeakPolarHBondContact CD-OG 3.42Å; R1153-S1155 WeakPolarHBondContact CG-OG 3.48Å; R1153-S1155 PolarHBondContact NE-OG 2.97Å; R1153-S1155 PolarHBondContact O-N 3.38Å; R1153-S1155 VanDerWaalsContact O-N 3.09Å; R1153-R1156 HydrophobicContact CG-CG 3.89Å; R1153-R1156 WeakPolarHBondContact O-CB 2.99Å; R1153-R1156 PolarHBondContact O-N 3.39Å
1154	Y	87.8	Confident	85.9	Confident	29 Å²	29	57.8 Å²	57.8	11%	0.114	28%	0.281	C	S	.	.	H	α-helix	trans	-50.6	-36.7	-177.8	168.7	-103.8	0	0	0	114.7	R1156 F1157 R1158 F1176 P1177 K1179 R1193 L1197	Y1154-R1156 VanDerWaalsContact C-N 3.31Å; Y1154-R1156 PolarHBondContact O-N 3.02Å; Y1154-F1157 WeakPolarHBondContact O-CB 3.11Å; Y1154-F1157 PolarHBondContact O-N 2.87Å; Y1154-R1158 PolarHBondContact O-N 3.03Å; Y1154-F1176 AromaticContact CE2-CE1 3.75Å; Y1154-F1176 HydrophobicContact CE2-CE1 3.75Å; Y1154-F1176 HydrophobicContact CE2-CZ 4.09Å; Y1154-F1176 AromaticContact CZ-CE1 3.95Å; Y1154-P1177 PolarHBondContact OH-O 3.39Å; Y1154-K1179 HydrophobicContact CE1-CB 4.24Å; Y1154-K1179 HydrophobicContact CE1-CG 4.33Å; Y1154-K1179 PolarHBondContact OH-N 2.99Å; Y1154-R1193 HydrophobicContact CD2-CG 4.41Å; Y1154-L1197 HydrophobicContact CD2-CD1 4.21Å; Y1154-L1197 HydrophobicContact CD2-CD2 4.17Å; Y1154-L1197 HydrophobicContact CE2-CD2 4.35Å
1155	S	84.8	Confident	86.3	Confident	43 Å²	43	56 Å²	56	30%	0.301	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-35.7	176.4	39.1	0	0	0	0	113.1	R1153 F1157 R1158 E1159	R1153-S1155 WeakPolarHBondContact CD-OG 3.42Å; R1153-S1155 WeakPolarHBondContact CG-OG 3.48Å; R1153-S1155 PolarHBondContact NE-OG 2.97Å; R1153-S1155 PolarHBondContact O-N 3.38Å; R1153-S1155 VanDerWaalsContact O-N 3.09Å; S1155-F1157 VanDerWaalsContact C-N 3.33Å; S1155-F1157 PolarHBondContact O-N 3.31Å; S1155-R1158 CarbonylContact O-C 3.52Å; S1155-R1158 PolarHBondContact O-N 2.86Å; S1155-R1158 VanDerWaalsContact O-N 3.11Å; S1155-E1159 WeakPolarHBondContact O-CB 3.29Å; S1155-E1159 VanDerWaalsContact O-CG 3.29Å; S1155-E1159 WeakPolarHBondContact O-CG 3.32Å; S1155-E1159 PolarHBondContact O-N 3.2Å
1156	R	89.3	Confident	86.9	Confident	70 Å²	70	53.4 Å²	53.4	26%	0.264	26%	0.264	S	S	.	.	H	α-helix	trans	-63.4	-35.8	175.1	-67.9	-56.4	-150.8	-170.5	6.2	112.4	R1152 R1153 Y1154 E1159 M1160 F1237 E1244	R1152-R1156 HydrophobicContact CB-CB 4.38Å; R1153-R1156 HydrophobicContact CG-CG 3.89Å; R1153-R1156 WeakPolarHBondContact O-CB 2.99Å; R1153-R1156 PolarHBondContact O-N 3.39Å; Y1154-R1156 VanDerWaalsContact C-N 3.31Å; Y1154-R1156 PolarHBondContact O-N 3.02Å; R1156-E1159 WeakPolarHBondContact CD-OE2 3.21Å; R1156-E1159 IonicContact CZ-OE2 3.64Å; R1156-E1159 IonicContact NE-OE2 3.5Å; R1156-E1159 IonicContact NH1-OE2 3.89Å; R1156-E1159 PolarHBondContact NH1-OE2 3.37Å; R1156-M1160 WeakPolarHBondContact O-CB 3.4Å; R1156-M1160 PolarHBondContact O-N 3.06Å; R1156-F1237 HydrophobicContact CB-CD2 4.17Å; R1156-F1237 HydrophobicContact CB-CE2 4.05Å; R1156-E1244 IonicContact CZ-OE2 2.68Å; R1156-E1244 IonicContact NE-OE2 3.07Å; R1156-E1244 IonicContact NH2-OE2 3.92Å; R1156-E1244 PolarHBondContact NH2-OE2 2.94Å
1157	F	90.9	Very high	87	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-40.5	173.5	-70.1	-107.4	0	0	0	111.2	I1121 F1137 V1139 R1152 Y1154 S1155 M1160 H1161 F1176 L1197 L1201 F1237	I1121-F1157 HydrophobicContact CD1-CE1 3.88Å; I1121-F1157 HydrophobicContact CD1-CZ 3.97Å; F1137-F1157 HydrophobicContact CB-CE2 3.95Å; F1137-F1157 HydrophobicContact CB-CZ 3.87Å; F1137-F1157 HydrophobicContact CD2-CE2 4.04Å; F1137-F1157 HydrophobicContact CG-CE2 4.29Å; F1137-F1157 HydrophobicContact CG-CZ 4.41Å; V1139-F1157 HydrophobicContact CG2-CE1 4.02Å; V1139-F1157 HydrophobicContact CG2-CE2 4.42Å; V1139-F1157 HydrophobicContact CG2-CZ 3.49Å; V1139-F1157 VanDerWaalsContact CG2-CZ 3.49Å; R1152-F1157 HydrophobicContact CB-CD2 4.18Å; R1152-F1157 HydrophobicContact CB-CE2 3.68Å; R1152-F1157 HydrophobicContact CB-CZ 4.4Å; R1152-F1157 WeakPolarHBondContact O-CE2 3.43Å; Y1154-F1157 WeakPolarHBondContact O-CB 3.11Å; Y1154-F1157 PolarHBondContact O-N 2.87Å; S1155-F1157 VanDerWaalsContact C-N 3.33Å; S1155-F1157 PolarHBondContact O-N 3.31Å; F1157-M1160 PolarHBondContact O-N 2.9Å; F1157-H1161 WeakPolarHBondContact O-CB 3.34Å; F1157-H1161 PolarHBondContact O-N 2.67Å; F1157-F1176 HydrophobicContact CB-CE2 3.99Å; F1157-F1176 HydrophobicContact CB-CZ 3.78Å; F1157-L1197 HydrophobicContact CB-CD2 4.07Å; F1157-L1197 HydrophobicContact CD1-CB 4.33Å; F1157-L1197 HydrophobicContact CD1-CD1 4.42Å; F1157-L1197 HydrophobicContact CD1-CD2 3.83Å; F1157-L1197 HydrophobicContact CD1-CG 4.42Å; F1157-L1197 HydrophobicContact CD2-CD1 4.36Å; F1157-L1197 HydrophobicContact CE1-CB 4.03Å; F1157-L1197 HydrophobicContact CE1-CD1 4.3Å; F1157-L1197 HydrophobicContact CE1-CD2 4.35Å; F1157-L1197 HydrophobicContact CE1-CG 4.46Å; F1157-L1197 HydrophobicContact CE2-CD1 4.25Å; F1157-L1197 HydrophobicContact CG-CD1 4.44Å; F1157-L1197 HydrophobicContact CG-CD2 4Å; F1157-L1197 HydrophobicContact CZ-CD1 4.21Å; F1157-L1201 HydrophobicContact CD1-CD2 4.43Å; F1157-L1201 HydrophobicContact CD1-CG 4.49Å; F1157-L1201 HydrophobicContact CE1-CD1 3.82Å; F1157-L1201 HydrophobicContact CE1-CD2 4.48Å; F1157-L1201 HydrophobicContact CE1-CG 4.18Å; F1157-F1237 HydrophobicContact CB-CE2 4.37Å; F1157-F1237 HydrophobicContact CD1-CE2 4.17Å; F1157-F1237 AromaticContact CD1-CZ 3.63Å; F1157-F1237 HydrophobicContact CD1-CZ 3.63Å; F1157-F1237 AromaticContact CD2-CE2 3.87Å; F1157-F1237 HydrophobicContact CD2-CE2 3.87Å; F1157-F1237 AromaticContact CD2-CZ 3.87Å; F1157-F1237 HydrophobicContact CD2-CZ 3.87Å; F1157-F1237 HydrophobicContact CE1-CE1 4.43Å; F1157-F1237 AromaticContact CE1-CZ 3.67Å; F1157-F1237 HydrophobicContact CE1-CZ 3.67Å; F1157-F1237 HydrophobicContact CE2-CE2 4.25Å; F1157-F1237 AromaticContact CE2-CZ 3.88Å; F1157-F1237 HydrophobicContact CE2-CZ 3.88Å; F1157-F1237 AromaticContact CG-CE2 3.83Å; F1157-F1237 HydrophobicContact CG-CE2 3.83Å; F1157-F1237 AromaticContact CG-CZ 3.75Å; F1157-F1237 HydrophobicContact CG-CZ 3.75Å; F1157-F1237 AromaticContact CZ-CZ 3.79Å; F1157-F1237 HydrophobicContact CZ-CZ 3.79Å
1158	R	87.1	Confident	87	Confident	101 Å²	101	55.6 Å²	55.6	38%	0.381	26%	0.262	S	S	.	.	H	α-helix	trans	-73.3	-32.9	179	-167.8	-179.6	-179.6	-165.1	1.5	112.8	Y1154 S1155 R1162 F1176	Y1154-R1158 PolarHBondContact O-N 3.03Å; S1155-R1158 CarbonylContact O-C 3.52Å; S1155-R1158 PolarHBondContact O-N 2.86Å; S1155-R1158 VanDerWaalsContact O-N 3.11Å; R1158-R1162 WeakPolarHBondContact O-CB 3.48Å; R1158-R1162 WeakPolarHBondContact O-CG 3.48Å; R1158-R1162 PolarHBondContact O-N 3.28Å; R1158-R1162 VanDerWaalsContact O-N 3.07Å; R1158-F1176 HydrophobicContact CB-CE1 3.76Å; R1158-F1176 HydrophobicContact CB-CZ 3.87Å; R1158-F1176 HydrophobicContact CG-CD1 4.38Å; R1158-F1176 HydrophobicContact CG-CE1 3.95Å; R1158-F1176 HydrophobicContact CG-CZ 4.48Å
1159	E	87.1	Confident	86.6	Confident	67 Å²	67	59.4 Å²	59.4	31%	0.313	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-51.1	169.3	-73.9	158.1	-138.1	0	0	109.9	S1155 R1156 H1161 R1162 S1163	S1155-E1159 WeakPolarHBondContact O-CB 3.29Å; S1155-E1159 VanDerWaalsContact O-CG 3.29Å; S1155-E1159 WeakPolarHBondContact O-CG 3.32Å; S1155-E1159 PolarHBondContact O-N 3.2Å; R1156-E1159 WeakPolarHBondContact CD-OE2 3.21Å; R1156-E1159 IonicContact CZ-OE2 3.64Å; R1156-E1159 IonicContact NE-OE2 3.5Å; R1156-E1159 IonicContact NH1-OE2 3.89Å; R1156-E1159 PolarHBondContact NH1-OE2 3.37Å; E1159-H1161 PolarHBondContact O-N 2.74Å; E1159-R1162 PolarHBondContact O-N 2.91Å; E1159-S1163 WeakPolarHBondContact O-CB 3.47Å; E1159-S1163 PolarHBondContact O-N 3Å
1160	M	90.8	Very high	86.1	Confident	9 Å²	9	61.6 Å²	61.6	4%	0.044	30%	0.296	C	S	.	.	H	α-helix	trans	-58.6	-48.1	175.6	-176	-172.1	65.8	0	0	112	R1156 F1157 R1162 S1163 L1164 Y1200 L1201 L1204 F1237 F1238	R1156-M1160 WeakPolarHBondContact O-CB 3.4Å; R1156-M1160 PolarHBondContact O-N 3.06Å; F1157-M1160 PolarHBondContact O-N 2.9Å; M1160-R1162 PolarHBondContact O-N 3.48Å; M1160-S1163 PolarHBondContact O-N 2.84Å; M1160-L1164 HydrophobicContact CG-CD1 3.69Å; M1160-L1164 HydrophobicContact CG-CG 4.18Å; M1160-L1164 WeakPolarHBondContact O-CB 3.46Å; M1160-L1164 WeakPolarHBondContact O-CG 3.5Å; M1160-L1164 PolarHBondContact O-N 3.03Å; M1160-L1164 HydrophobicContact SD-CD1 4.2Å; M1160-Y1200 HydrophobicContact CE-CE1 4.13Å; M1160-L1201 HydrophobicContact CE-CD2 3.66Å; M1160-L1204 HydrophobicContact CE-CD2 3.65Å; M1160-L1204 HydrophobicContact SD-CD2 4.38Å; M1160-F1237 HydrophobicContact CB-CB 4.31Å; M1160-F1237 HydrophobicContact CB-CD2 4.1Å; M1160-F1237 HydrophobicContact CB-CG 4.32Å; M1160-F1237 HydrophobicContact CE-CD1 4.21Å; M1160-F1237 HydrophobicContact CE-CE1 4.34Å; M1160-F1237 HydrophobicContact CE-CG 4.35Å; M1160-F1237 HydrophobicContact CG-CB 4.12Å; M1160-F1237 HydrophobicContact CG-CG 4.35Å; M1160-F1237 HydrophobicContact SD-CB 3.54Å; M1160-F1237 VanDerWaalsContact SD-CB 3.54Å; M1160-F1237 HydrophobicContact SD-CD1 3.58Å; M1160-F1237 VanDerWaalsContact SD-CD1 3.58Å; M1160-F1237 HydrophobicContact SD-CD2 4.08Å; M1160-F1237 HydrophobicContact SD-CE1 4.29Å; M1160-F1237 HydrophobicContact SD-CG 3.46Å; M1160-F1237 WeakPolarHBondContact SD-CG 3.48Å; M1160-F1238 HydrophobicContact SD-CE2 4.03Å; M1160-F1238 HydrophobicContact SD-CZ 4.12Å
1161	H	88.2	Confident	85.7	Confident	17 Å²	17	61.4 Å²	61.4	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-58.6	-46.3	178.4	175.9	73.6	0	0	0	112.1	F1157 E1159 L1164 K1165 F1176 Y1200	F1157-H1161 WeakPolarHBondContact O-CB 3.34Å; F1157-H1161 PolarHBondContact O-N 2.67Å; E1159-H1161 PolarHBondContact O-N 2.74Å; H1161-L1164 PolarHBondContact O-N 3.02Å; H1161-K1165 WeakPolarHBondContact O-CB 3.35Å; H1161-K1165 PolarHBondContact O-N 3.1Å; H1161-F1176 HydrophobicContact CB-CD2 3.51Å; H1161-F1176 HydrophobicContact CB-CE2 3.84Å; H1161-F1176 HydrophobicContact CB-CG 4.15Å; H1161-F1176 AromaticContact CD2-CG 3.92Å; H1161-F1176 AromaticContact CG-CD2 3.58Å; H1161-F1176 AromaticContact CG-CG 3.87Å; H1161-Y1200 WeakPolarHBondContact CB-OH 3.39Å; H1161-Y1200 AromaticContact ND1-CE2 3.48Å; H1161-Y1200 WeakPolarHBondContact ND1-CE2 3.45Å; H1161-Y1200 AromaticContact ND1-CZ 3.5Å; H1161-Y1200 PolarHBondContact ND1-OH 3.49Å
1162	R	86.6	Confident	85	Confident	150 Å²	150	60.4 Å²	60.4	57%	0.566	30%	0.299	S	S	*	.	H	α-helix	trans	-64.2	-41.7	177.4	-77.3	-171.7	-74.6	-179	1.9	112.4	R1158 E1159 M1160 S1166	R1158-R1162 WeakPolarHBondContact O-CB 3.48Å; R1158-R1162 WeakPolarHBondContact O-CG 3.48Å; R1158-R1162 PolarHBondContact O-N 3.28Å; R1158-R1162 VanDerWaalsContact O-N 3.07Å; E1159-R1162 PolarHBondContact O-N 2.91Å; M1160-R1162 PolarHBondContact O-N 3.48Å; R1162-S1166 PolarHBondContact O-N 2.82Å
1163	S	85.7	Confident	84.2	Confident	64 Å²	64	63.8 Å²	63.8	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-40.1	178.1	-175.2	0	0	0	0	112.7	E1159 M1160 K1167	E1159-S1163 WeakPolarHBondContact O-CB 3.47Å; E1159-S1163 PolarHBondContact O-N 3Å; M1160-S1163 PolarHBondContact O-N 2.84Å; S1163-K1167 WeakPolarHBondContact O-CG 3.44Å
1164	L	84.4	Confident	83.9	Confident	6 Å²	6	61.8 Å²	61.8	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-76.6	-40.4	179.1	-67.2	178.2	0	0	0	112.3	M1160 H1161 S1166 K1167 Y1168 L1171 L1204 F1234	M1160-L1164 HydrophobicContact CG-CD1 3.69Å; M1160-L1164 HydrophobicContact CG-CG 4.18Å; M1160-L1164 WeakPolarHBondContact O-CB 3.46Å; M1160-L1164 WeakPolarHBondContact O-CG 3.5Å; M1160-L1164 PolarHBondContact O-N 3.03Å; M1160-L1164 HydrophobicContact SD-CD1 4.2Å; H1161-L1164 PolarHBondContact O-N 3.02Å; L1164-S1166 PolarHBondContact O-N 3.44Å; L1164-K1167 PolarHBondContact O-N 3.45Å; L1164-Y1168 HydrophobicContact CD2-CD2 4.26Å; L1164-Y1168 HydrophobicContact CD2-CE2 4.05Å; L1164-Y1168 PolarHBondContact O-N 2.78Å; L1164-L1171 HydrophobicContact CB-CD1 3.64Å; L1164-L1204 HydrophobicContact CD1-CD1 4.13Å; L1164-L1204 HydrophobicContact CD1-CD2 4.14Å; L1164-F1234 HydrophobicContact CD1-CE1 4.01Å; L1164-F1234 HydrophobicContact CD1-CZ 3.97Å; L1164-F1234 HydrophobicContact CD2-CE1 4.29Å; L1164-F1234 HydrophobicContact CD2-CE2 4.08Å; L1164-F1234 HydrophobicContact CD2-CZ 3.74Å
1165	K	84.4	Confident	83.4	Confident	92 Å²	92	69.1 Å²	69.1	40%	0.4	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-27.1	175.9	179.5	164.7	175.6	153.9	0	113	H1161 K1167 A1172	H1161-K1165 WeakPolarHBondContact O-CB 3.35Å; H1161-K1165 PolarHBondContact O-N 3.1Å; K1165-K1167 VanDerWaalsContact C-N 3.35Å; K1165-A1172 HydrophobicContact CD-CB 4.41Å; K1165-A1172 HydrophobicContact CG-CB 4.39Å; K1165-A1172 PolarHBondContact NZ-O 2.61Å
1166	S	81.3	Confident	83.5	Confident	107 Å²	107	68.7 Å²	68.7	75%	0.748	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-13.8	173.1	-170.4	0	0	0	0	114.2	R1162 L1164	R1162-S1166 PolarHBondContact O-N 2.82Å; L1164-S1166 PolarHBondContact O-N 3.44Å
1167	K	81	Confident	83	Confident	147 Å²	147	66.2 Å²	66.2	64%	0.639	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-30.6	-178.1	-71.4	-176.4	175.7	-169.9	0	113.2	S1163 L1164 K1165	S1163-K1167 WeakPolarHBondContact O-CG 3.44Å; L1164-K1167 PolarHBondContact O-N 3.45Å; K1165-K1167 VanDerWaalsContact C-N 3.35Å
1168	Y	84.1	Confident	82.1	Confident	42 Å²	42	71 Å²	71	17%	0.165	38%	0.378	C	S	.	.			trans	-128.9	97.9	-176.9	-55	-75.8	0	0	0	108.8	L1164 E1170 L1171 M1208 P1215 F1234	L1164-Y1168 HydrophobicContact CD2-CD2 4.26Å; L1164-Y1168 HydrophobicContact CD2-CE2 4.05Å; L1164-Y1168 PolarHBondContact O-N 2.78Å; Y1168-E1170 VanDerWaalsContact C-OE2 3.22Å; Y1168-E1170 WeakPolarHBondContact CA-OE2 3.49Å; Y1168-E1170 PolarHBondContact O-N 3.32Å; Y1168-E1170 VanDerWaalsContact O-N 3.15Å; Y1168-L1171 HydrophobicContact CD2-CD1 4.26Å; Y1168-L1171 WeakPolarHBondContact O-CB 3.38Å; Y1168-L1171 PolarHBondContact O-N 3.4Å; Y1168-M1208 HydrophobicContact CD1-CE 3.65Å; Y1168-M1208 HydrophobicContact CD2-CE 3.55Å; Y1168-M1208 HydrophobicContact CD2-SD 4.35Å; Y1168-M1208 HydrophobicContact CE1-CE 3.76Å; Y1168-M1208 HydrophobicContact CE2-CE 3.66Å; Y1168-M1208 HydrophobicContact CG-CE 3.53Å; Y1168-M1208 HydrophobicContact CG-SD 4.15Å; Y1168-P1215 VanDerWaalsContact OH-CD 3.27Å; Y1168-P1215 WeakPolarHBondContact OH-CD 3.49Å; Y1168-F1234 AromaticContact CE2-CE2 3.86Å; Y1168-F1234 HydrophobicContact CE2-CE2 3.86Å
1169	P	78.8	Confident	81	Confident	97 Å²	97	72.8 Å²	72.8	63%	0.63	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-57.1	-26.1	-177.9	-26	35.8	0	0	0	113.9	L1171 A1172	P1169-L1171 PolarHBondContact O-N 3.41Å; P1169-A1172 WeakPolarHBondContact O-CB 3.45Å; P1169-A1172 PolarHBondContact O-N 3.28Å
1170	E	78.8	Confident	79.7	Confident	89 Å²	89	74.2 Å²	74.2	42%	0.416	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-61.1	-26.8	177.1	-52.8	79.3	-176.7	0	0	112	Y1168 A1172 V1207	Y1168-E1170 VanDerWaalsContact C-OE2 3.22Å; Y1168-E1170 WeakPolarHBondContact CA-OE2 3.49Å; Y1168-E1170 PolarHBondContact O-N 3.32Å; Y1168-E1170 VanDerWaalsContact O-N 3.15Å; E1170-A1172 PolarHBondContact O-N 2.9Å; E1170-V1207 HydrophobicContact CB-CG1 4.15Å
1171	L	80.9	Confident	77.4	Confident	1 Å²	1	81.5 Å²	81.5	1%	0.005	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-77.6	-6.1	174.9	-58.4	-178.7	0	0	0	113.1	L1164 Y1168 P1169 A1173 L1174 L1204 V1207 M1208	L1164-L1171 HydrophobicContact CB-CD1 3.64Å; Y1168-L1171 HydrophobicContact CD2-CD1 4.26Å; Y1168-L1171 WeakPolarHBondContact O-CB 3.38Å; Y1168-L1171 PolarHBondContact O-N 3.4Å; P1169-L1171 PolarHBondContact O-N 3.41Å; L1171-A1173 PolarHBondContact O-N 3.35Å; L1171-L1174 HydrophobicContact CD2-CD1 3.73Å; L1171-L1174 PolarHBondContact O-N 3.37Å; L1171-L1204 HydrophobicContact CD1-CD1 3.75Å; L1171-L1204 HydrophobicContact CD2-CD1 3.69Å; L1171-L1204 HydrophobicContact CG-CD1 4.36Å; L1171-V1207 HydrophobicContact CD2-CB 4.07Å; L1171-V1207 HydrophobicContact CD2-CG1 3.78Å; L1171-M1208 HydrophobicContact CD1-CG 4.43Å; L1171-M1208 HydrophobicContact CD1-SD 3.79Å; L1171-M1208 HydrophobicContact CD2-CG 4.09Å; L1171-M1208 HydrophobicContact CD2-SD 3.73Å; L1171-M1208 HydrophobicContact CG-SD 3.89Å
1172	A	73.5	Confident	75.2	Confident	48 Å²	48	89.3 Å²	89.3	40%	0.397	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-64.8	-28.8	178.7	0	0	0	0	0	113	K1165 P1169 E1170	K1165-A1172 HydrophobicContact CD-CB 4.41Å; K1165-A1172 HydrophobicContact CG-CB 4.39Å; K1165-A1172 PolarHBondContact NZ-O 2.61Å; P1169-A1172 WeakPolarHBondContact O-CB 3.45Å; P1169-A1172 PolarHBondContact O-N 3.28Å; E1170-A1172 PolarHBondContact O-N 2.9Å
1173	A	74.1	Confident	73.7	Confident	93 Å²	93	84 Å²	84	77%	0.769	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-81.4	-8.5	177.8	0	0	0	0	0	114.3	L1171 E1175	L1171-A1173 PolarHBondContact O-N 3.35Å; A1173-E1175 PolarHBondContact O-N 3.44Å
1174	L	83	Confident	72.2	Confident	25 Å²	25	83.4 Å²	83.4	13%	0.131	45%	0.449	C	S	.	.	S	Bend	trans	-81.6	112.6	173.9	-70	-177.6	0	0	0	110.7	L1171 F1176 Y1200 N1203 L1204 V1207	L1171-L1174 HydrophobicContact CD2-CD1 3.73Å; L1171-L1174 PolarHBondContact O-N 3.37Å; L1174-F1176 PolarHBondContact O-N 2.95Å; L1174-Y1200 HydrophobicContact CB-CE2 4.28Å; L1174-N1203 HydrophobicContact CD2-CB 3.81Å; L1174-L1204 HydrophobicContact CD1-CB 4.34Å; L1174-L1204 HydrophobicContact CD1-CD1 4.38Å; L1174-V1207 HydrophobicContact CD1-CG2 4.25Å; L1174-V1207 HydrophobicContact CD2-CG2 4.12Å; L1174-V1207 HydrophobicContact CG-CG2 4.36Å
1175	E	77.6	Confident	71	Confident	183 Å²	183	89.7 Å²	89.7	86%	0.855	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-61.6	123	171.8	-65.9	-167.3	148.7	0	0	111.4	A1173	A1173-E1175 PolarHBondContact O-N 3.44Å
1176	F	85.2	Confident	70.2	Confident	34 Å²	34	89.2 Å²	89.2	15%	0.149	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-95.6	134	171.3	-170.5	-90.3	0	0	0	110	Y1154 F1157 R1158 H1161 L1174 L1197 Y1200	Y1154-F1176 AromaticContact CE2-CE1 3.75Å; Y1154-F1176 HydrophobicContact CE2-CE1 3.75Å; Y1154-F1176 HydrophobicContact CE2-CZ 4.09Å; Y1154-F1176 AromaticContact CZ-CE1 3.95Å; F1157-F1176 HydrophobicContact CB-CE2 3.99Å; F1157-F1176 HydrophobicContact CB-CZ 3.78Å; R1158-F1176 HydrophobicContact CB-CE1 3.76Å; R1158-F1176 HydrophobicContact CB-CZ 3.87Å; R1158-F1176 HydrophobicContact CG-CD1 4.38Å; R1158-F1176 HydrophobicContact CG-CE1 3.95Å; R1158-F1176 HydrophobicContact CG-CZ 4.48Å; H1161-F1176 HydrophobicContact CB-CD2 3.51Å; H1161-F1176 HydrophobicContact CB-CE2 3.84Å; H1161-F1176 HydrophobicContact CB-CG 4.15Å; H1161-F1176 AromaticContact CD2-CG 3.92Å; H1161-F1176 AromaticContact CG-CD2 3.58Å; H1161-F1176 AromaticContact CG-CG 3.87Å; L1174-F1176 PolarHBondContact O-N 2.95Å; F1176-L1197 HydrophobicContact CE2-CD2 4.33Å; F1176-L1197 HydrophobicContact CZ-CD2 4.07Å; F1176-Y1200 HydrophobicContact CD2-CD1 4.21Å; F1176-Y1200 HydrophobicContact CD2-CD2 4.02Å; F1176-Y1200 HydrophobicContact CD2-CE1 4.04Å; F1176-Y1200 AromaticContact CD2-CE2 3.84Å; F1176-Y1200 HydrophobicContact CD2-CE2 3.84Å; F1176-Y1200 HydrophobicContact CD2-CG 4.22Å; F1176-Y1200 AromaticContact CD2-CZ 3.87Å; F1176-Y1200 HydrophobicContact CE2-CD1 4.2Å; F1176-Y1200 HydrophobicContact CE2-CE1 4.09Å
1177	P	80.4	Confident	69.7	Low	18 Å²	18	90.5 Å²	90.5	12%	0.117	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-57.3	133.7	-176.2	-26.1	35.8	0	0	0	112.6	Y1154 H1196 L1197	Y1154-P1177 PolarHBondContact OH-O 3.39Å; P1177-H1196 HydrophobicContact CB-CB 4.21Å; P1177-H1196 HydrophobicContact CG-CB 3.73Å; P1177-L1197 HydrophobicContact CG-CD2 4.3Å
1178	P	70.4	Confident	69.5	Low	100 Å²	100	93.7 Å²	93.7	65%	0.649	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-76.2	154.4	-175.2	27.8	-34.2	0	0	0	113.8	K1180	P1178-K1180 PolarHBondContact O-N 3.02Å
1179	K	65.1	Low	69.2	Low	140 Å²	140	92.4 Å²	92.4	61%	0.609	47%	0.473	S	S	*	.			trans	-83	93.1	172.3	-170.4	-173.2	179.4	-169.9	0	109.3	Y1154	Y1154-K1179 HydrophobicContact CE1-CB 4.24Å; Y1154-K1179 HydrophobicContact CE1-CG 4.33Å; Y1154-K1179 PolarHBondContact OH-N 2.99Å
1180	K	59.8	Low	69.4	Low	97 Å²	97	87.9 Å²	87.9	42%	0.422	44%	0.443	S	S	.	.			trans	-58.2	140.4	171.5	-55	-178.9	-178.2	171.8	0	109.9	P1178 N1184 M1189 E1192	P1178-K1180 PolarHBondContact O-N 3.02Å; K1180-N1184 PolarHBondContact O-ND2 3.17Å; K1180-M1189 HydrophobicContact CB-CE 3.66Å; K1180-M1189 HydrophobicContact CD-CE 4.04Å; K1180-M1189 HydrophobicContact CG-CE 4.09Å; K1180-E1192 VanDerWaalsContact NZ-CD 3.33Å; K1180-E1192 IonicContact NZ-OE1 2.67Å; K1180-E1192 PolarHBondContact NZ-OE1 2.91Å; K1180-E1192 IonicContact NZ-OE2 3.12Å; K1180-E1192 PolarHBondContact NZ-OE2 3.45Å
1181	L	43.2	Very low	69.5	Low	161 Å²	161	86 Å²	86	84%	0.843	44%	0.44	S	S	*	.	S	Bend	trans	-67	-37.5	-173.7	-85	150.3	0	0	0	113.1
1182	F	41.5	Very low	69.6	Low	181 Å²	181	89.8 Å²	89.8	79%	0.794	46%	0.458	S	S	*	.	S	Bend	trans	-116	166.8	179.1	-57.2	-78	0	0	0	111.3	N1184	F1182-N1184 PolarHBondContact O-N 3.36Å
1183	G	54.1	Low	70.2	Confident	38 Å²	38	88.5 Å²	88.5	39%	0.392	44%	0.443	S	S	.	.			trans	77.3	11.9	172.3	0	0	0	0	0	116.7	R1185 D1186	G1183-R1185 PolarHBondContact O-N 3.1Å; G1183-D1186 WeakPolarHBondContact O-CB 3.4Å; G1183-D1186 PolarHBondContact O-N 3.16Å
1184	N	55.1	Low	71	Confident	52 Å²	52	86.8 Å²	86.8	28%	0.278	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-3.6	178.2	-71.7	-65.5	0	0	0	114.8	K1180 F1182 R1193	K1180-N1184 PolarHBondContact O-ND2 3.17Å; F1182-N1184 PolarHBondContact O-N 3.36Å; N1184-R1193 PolarHBondContact OD1-NH1 3.3Å; N1184-R1193 PolarHBondContact OD1-NH2 3.13Å
1185	R	58.2	Low	71.2	Confident	138 Å²	138	87.4 Å²	87.4	52%	0.521	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-2.9	172.8	-65.6	-176.3	177.8	-141.3	-9.7	113.9	G1130 K1131 E1133 G1183	G1130-R1185 PolarHBondContact O-NH2 3.08Å; K1131-R1185 PolarHBondContact O-NH2 3.44Å; E1133-R1185 IonicContact OE2-CZ 2.76Å; E1133-R1185 IonicContact OE2-NH1 3.73Å; E1133-R1185 PolarHBondContact OE2-NH1 2.99Å; E1133-R1185 IonicContact OE2-NH2 3.43Å; G1183-R1185 PolarHBondContact O-N 3.1Å
1186	D	68.6	Low	71.7	Confident	82 Å²	82	81.9 Å²	81.9	44%	0.439	40%	0.397	S	S	.	.			trans	-78.8	123.2	178.8	-178.9	-16.3	0	0	0	109.9	G1183 R1188 M1189 V1190	G1183-D1186 WeakPolarHBondContact O-CB 3.4Å; G1183-D1186 PolarHBondContact O-N 3.16Å; D1186-R1188 VanDerWaalsContact C-N 3.28Å; D1186-R1188 PolarHBondContact O-N 2.95Å; D1186-R1188 WeakPolarHBondContact OD1-CB 3.44Å; D1186-R1188 PolarHBondContact OD1-N 3.44Å; D1186-M1189 HydrophobicContact CB-CB 4.08Å; D1186-M1189 WeakPolarHBondContact O-CB 3.47Å; D1186-M1189 PolarHBondContact O-N 3.03Å; D1186-M1189 VanDerWaalsContact O-N 3.14Å; D1186-V1190 WeakPolarHBondContact O-CG2 3.45Å; D1186-V1190 PolarHBondContact O-N 3.33Å
1187	E	71.6	Confident	72.1	Confident	135 Å²	135	80.2 Å²	80.2	63%	0.631	39%	0.39	S	S	*	.	H	α-helix	trans	-60.8	-34.4	-177.7	-172.9	167.9	-152	0	0	113	Y1124 M1189 V1190 S1191	Y1124-E1187 HydrophobicContact CE2-CG 4.44Å; Y1124-E1187 PolarHBondContact OH-O 2.89Å; E1187-M1189 VanDerWaalsContact C-N 3.33Å; E1187-M1189 PolarHBondContact O-N 3.37Å; E1187-V1190 PolarHBondContact O-N 2.94Å; E1187-S1191 WeakPolarHBondContact O-CB 3.24Å; E1187-S1191 PolarHBondContact O-N 3.17Å
1188	R	75.9	Confident	72.6	Confident	214 Å²	214	80.7 Å²	80.7	81%	0.808	39%	0.39	S	S	*	.	H	α-helix	trans	-62.7	-43.7	175.7	-66.9	-175.9	176.4	-169.8	-0.1	110.8	D1186 S1191 E1192	D1186-R1188 VanDerWaalsContact C-N 3.28Å; D1186-R1188 PolarHBondContact O-N 2.95Å; D1186-R1188 WeakPolarHBondContact OD1-CB 3.44Å; D1186-R1188 PolarHBondContact OD1-N 3.44Å; R1188-S1191 PolarHBondContact O-N 3.45Å; R1188-E1192 PolarHBondContact O-N 3.35Å
1189	M	78.1	Confident	73.6	Confident	15 Å²	15	82.7 Å²	82.7	7%	0.074	39%	0.385	C	S	.	.	H	α-helix	trans	-69.4	-34.1	-179.9	-172	-94.7	-149.7	0	0	112.4	K1180 D1186 E1187 R1193	K1180-M1189 HydrophobicContact CB-CE 3.66Å; K1180-M1189 HydrophobicContact CD-CE 4.04Å; K1180-M1189 HydrophobicContact CG-CE 4.09Å; D1186-M1189 HydrophobicContact CB-CB 4.08Å; D1186-M1189 WeakPolarHBondContact O-CB 3.47Å; D1186-M1189 PolarHBondContact O-N 3.03Å; D1186-M1189 VanDerWaalsContact O-N 3.14Å; E1187-M1189 VanDerWaalsContact C-N 3.33Å; E1187-M1189 PolarHBondContact O-N 3.37Å; M1189-R1193 VanDerWaalsContact O-CB 3.24Å; M1189-R1193 WeakPolarHBondContact O-CB 3.32Å; M1189-R1193 PolarHBondContact O-N 3.45Å
1190	V	81.6	Confident	74.9	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.006	36%	0.357	C	S	.	.	H	α-helix	trans	-71.1	-36.4	174.8	178.3	0	0	0	0	111.4	Y1124 F1135 F1137 D1186 E1187 R1193 R1194	Y1124-V1190 HydrophobicContact CD1-CG1 3.94Å; Y1124-V1190 HydrophobicContact CD2-CG1 3.45Å; Y1124-V1190 VanDerWaalsContact CD2-CG1 3.45Å; Y1124-V1190 HydrophobicContact CE1-CG1 4.1Å; Y1124-V1190 HydrophobicContact CE2-CB 4.25Å; Y1124-V1190 HydrophobicContact CE2-CG1 3.62Å; Y1124-V1190 HydrophobicContact CG-CG1 3.62Å; F1135-V1190 HydrophobicContact CB-CG1 4.02Å; F1135-V1190 HydrophobicContact CD1-CG1 3.84Å; F1135-V1190 HydrophobicContact CD2-CB 4.42Å; F1135-V1190 HydrophobicContact CD2-CG1 4.11Å; F1135-V1190 HydrophobicContact CD2-CG2 3.48Å; F1135-V1190 VanDerWaalsContact CD2-CG2 3.48Å; F1135-V1190 HydrophobicContact CE1-CG1 4.27Å; F1135-V1190 HydrophobicContact CE2-CG2 3.56Å; F1135-V1190 HydrophobicContact CG-CB 4.49Å; F1135-V1190 HydrophobicContact CG-CG1 3.71Å; F1135-V1190 HydrophobicContact CG-CG2 3.98Å; F1135-V1190 HydrophobicContact CZ-CG2 4.12Å; F1137-V1190 HydrophobicContact CE1-CG1 4.1Å; F1137-V1190 HydrophobicContact CZ-CG1 4.04Å; D1186-V1190 WeakPolarHBondContact O-CG2 3.45Å; D1186-V1190 PolarHBondContact O-N 3.33Å; E1187-V1190 PolarHBondContact O-N 2.94Å; V1190-R1193 PolarHBondContact O-N 3.41Å; V1190-R1194 WeakPolarHBondContact O-CB 3.41Å; V1190-R1194 PolarHBondContact O-N 3.22Å
1191	S	81.3	Confident	76.4	Confident	51 Å²	51	71.8 Å²	71.8	36%	0.357	34%	0.337	S	S	.	.	H	α-helix	trans	-67.1	-41.5	173.8	-168	0	0	0	0	113.2	E1187 R1188 R1194 S1195	E1187-S1191 WeakPolarHBondContact O-CB 3.24Å; E1187-S1191 PolarHBondContact O-N 3.17Å; R1188-S1191 PolarHBondContact O-N 3.45Å; S1191-R1194 WeakPolarHBondContact O-CB 3.38Å; S1191-R1194 PolarHBondContact O-N 2.67Å; S1191-S1195 PolarHBondContact O-N 2.99Å; S1191-S1195 PolarHBondContact O-OG 2.76Å
1192	E	83.8	Confident	78.7	Confident	80 Å²	80	69.3 Å²	69.3	37%	0.374	32%	0.316	S	S	.	.	H	α-helix	trans	-56.9	-52.2	169.2	-172	-157.5	166.9	0	0	110	K1180 R1188 R1194 S1195 H1196	K1180-E1192 VanDerWaalsContact NZ-CD 3.33Å; K1180-E1192 IonicContact NZ-OE1 2.67Å; K1180-E1192 PolarHBondContact NZ-OE1 2.91Å; K1180-E1192 IonicContact NZ-OE2 3.12Å; K1180-E1192 PolarHBondContact NZ-OE2 3.45Å; R1188-E1192 PolarHBondContact O-N 3.35Å; E1192-R1194 PolarHBondContact O-N 3.04Å; E1192-S1195 WeakPolarHBondContact O-CB 3.43Å; E1192-S1195 PolarHBondContact O-N 3.11Å; E1192-S1195 VanDerWaalsContact O-N 3.16Å; E1192-H1196 PolarHBondContact O-N 3.38Å; E1192-H1196 VanDerWaalsContact O-N 3.11Å; E1192-H1196 IonicContact OE1-CE1 3.92Å
1193	R	86.4	Confident	80.9	Confident	21 Å²	21	63.3 Å²	63.3	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-39.4	-179.8	-179.7	176.7	-78.1	160.4	-9.1	113.2	F1137 Y1154 N1184 M1189 V1190 S1195 H1196 L1197	F1137-R1193 HydrophobicContact CZ-CG 4.17Å; Y1154-R1193 HydrophobicContact CD2-CG 4.41Å; N1184-R1193 PolarHBondContact OD1-NH1 3.3Å; N1184-R1193 PolarHBondContact OD1-NH2 3.13Å; M1189-R1193 VanDerWaalsContact O-CB 3.24Å; M1189-R1193 WeakPolarHBondContact O-CB 3.32Å; M1189-R1193 PolarHBondContact O-N 3.45Å; V1190-R1193 PolarHBondContact O-N 3.41Å; R1193-S1195 VanDerWaalsContact C-N 3.29Å; R1193-S1195 PolarHBondContact O-N 3.13Å; R1193-H1196 PolarHBondContact O-N 3.24Å; R1193-L1197 HydrophobicContact CG-CD1 4.01Å; R1193-L1197 HydrophobicContact CG-CG 4.27Å; R1193-L1197 VanDerWaalsContact O-CG 3.31Å; R1193-L1197 WeakPolarHBondContact O-CG 3.5Å; R1193-L1197 PolarHBondContact O-N 3.02Å
1194	R	91	Very high	82.6	Confident	56 Å²	56	61.5 Å²	61.5	21%	0.211	27%	0.274	C	S	.	.	H	α-helix	trans	-53.2	-49.3	173.4	-177.6	-151.9	70.7	83.6	7	110.5	I1121 Y1124 F1137 V1190 S1191 E1192 H1196 L1197 E1198	I1121-R1194 HydrophobicContact CB-CG 4.22Å; I1121-R1194 HydrophobicContact CG2-CG 3.78Å; I1121-R1194 WeakPolarHBondContact O-CD 3.38Å; I1121-R1194 PolarHBondContact O-NH1 2.98Å; Y1124-R1194 HydrophobicContact CD1-CB 3.93Å; Y1124-R1194 HydrophobicContact CD1-CG 4.03Å; Y1124-R1194 HydrophobicContact CE1-CB 4.3Å; F1137-R1194 HydrophobicContact CD1-CB 4.09Å; F1137-R1194 HydrophobicContact CD1-CG 4.22Å; F1137-R1194 HydrophobicContact CE1-CB 3.88Å; F1137-R1194 HydrophobicContact CE1-CG 4.5Å; V1190-R1194 WeakPolarHBondContact O-CB 3.41Å; V1190-R1194 PolarHBondContact O-N 3.22Å; S1191-R1194 WeakPolarHBondContact O-CB 3.38Å; S1191-R1194 PolarHBondContact O-N 2.67Å; E1192-R1194 PolarHBondContact O-N 3.04Å; R1194-H1196 VanDerWaalsContact C-N 3.35Å; R1194-H1196 PolarHBondContact O-N 3.04Å; R1194-L1197 PolarHBondContact O-N 3Å; R1194-E1198 IonicContact CZ-OE2 3.63Å; R1194-E1198 IonicContact NH1-OE2 2.76Å; R1194-E1198 PolarHBondContact NH1-OE2 3.38Å; R1194-E1198 WeakPolarHBondContact O-CB 3.47Å; R1194-E1198 PolarHBondContact O-N 3.44Å
1195	S	87.1	Confident	84.2	Confident	39 Å²	39	59.3 Å²	59.3	27%	0.273	26%	0.262	S	S	.	.	H	α-helix	trans	-66.7	-36.9	-176.8	-51.6	0	0	0	0	111.8	S1191 E1192 R1193 R1199	S1191-S1195 PolarHBondContact O-N 2.99Å; S1191-S1195 PolarHBondContact O-OG 2.76Å; E1192-S1195 WeakPolarHBondContact O-CB 3.43Å; E1192-S1195 PolarHBondContact O-N 3.11Å; E1192-S1195 VanDerWaalsContact O-N 3.16Å; R1193-S1195 VanDerWaalsContact C-N 3.29Å; R1193-S1195 PolarHBondContact O-N 3.13Å; S1195-R1199 PolarHBondContact O-N 3.37Å; S1195-R1199 VanDerWaalsContact O-N 3.16Å
1196	H	88.5	Confident	85.5	Confident	66 Å²	66	59.7 Å²	59.7	31%	0.306	26%	0.263	S	S	.	.	H	α-helix	trans	-70.5	-40.7	173.8	-66.6	158.7	0	0	0	113.6	P1177 E1192 R1193 R1194 R1199 Y1200	P1177-H1196 HydrophobicContact CB-CB 4.21Å; P1177-H1196 HydrophobicContact CG-CB 3.73Å; E1192-H1196 PolarHBondContact O-N 3.38Å; E1192-H1196 VanDerWaalsContact O-N 3.11Å; E1192-H1196 IonicContact OE1-CE1 3.92Å; R1193-H1196 PolarHBondContact O-N 3.24Å; R1194-H1196 VanDerWaalsContact C-N 3.35Å; R1194-H1196 PolarHBondContact O-N 3.04Å; H1196-R1199 PolarHBondContact CD2-NH1 3.21Å; H1196-R1199 PolarHBondContact O-N 3.47Å; H1196-Y1200 WeakPolarHBondContact O-CB 3.42Å; H1196-Y1200 PolarHBondContact O-N 3.23Å
1197	L	92.2	Very high	86.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.6	-37.2	174.9	-68.8	172.5	0	0	0	112.2	I1121 F1137 Y1154 F1157 F1176 P1177 R1193 R1194 Y1200 L1201	I1121-L1197 HydrophobicContact CD1-CB 3.74Å; F1137-L1197 HydrophobicContact CD1-CD1 4.17Å; F1137-L1197 HydrophobicContact CD2-CD1 3.89Å; F1137-L1197 HydrophobicContact CE1-CD1 4.12Å; F1137-L1197 HydrophobicContact CE2-CD1 3.84Å; F1137-L1197 HydrophobicContact CG-CD1 4.07Å; F1137-L1197 HydrophobicContact CZ-CD1 3.96Å; Y1154-L1197 HydrophobicContact CD2-CD1 4.21Å; Y1154-L1197 HydrophobicContact CD2-CD2 4.17Å; Y1154-L1197 HydrophobicContact CE2-CD2 4.35Å; F1157-L1197 HydrophobicContact CB-CD2 4.07Å; F1157-L1197 HydrophobicContact CD1-CB 4.33Å; F1157-L1197 HydrophobicContact CD1-CD1 4.42Å; F1157-L1197 HydrophobicContact CD1-CD2 3.83Å; F1157-L1197 HydrophobicContact CD1-CG 4.42Å; F1157-L1197 HydrophobicContact CD2-CD1 4.36Å; F1157-L1197 HydrophobicContact CE1-CB 4.03Å; F1157-L1197 HydrophobicContact CE1-CD1 4.3Å; F1157-L1197 HydrophobicContact CE1-CD2 4.35Å; F1157-L1197 HydrophobicContact CE1-CG 4.46Å; F1157-L1197 HydrophobicContact CE2-CD1 4.25Å; F1157-L1197 HydrophobicContact CG-CD1 4.44Å; F1157-L1197 HydrophobicContact CG-CD2 4Å; F1157-L1197 HydrophobicContact CZ-CD1 4.21Å; F1176-L1197 HydrophobicContact CE2-CD2 4.33Å; F1176-L1197 HydrophobicContact CZ-CD2 4.07Å; P1177-L1197 HydrophobicContact CG-CD2 4.3Å; R1193-L1197 HydrophobicContact CG-CD1 4.01Å; R1193-L1197 HydrophobicContact CG-CG 4.27Å; R1193-L1197 VanDerWaalsContact O-CG 3.31Å; R1193-L1197 WeakPolarHBondContact O-CG 3.5Å; R1193-L1197 PolarHBondContact O-N 3.02Å; R1194-L1197 PolarHBondContact O-N 3Å; L1197-Y1200 PolarHBondContact O-N 2.95Å; L1197-L1201 WeakPolarHBondContact O-CG 3.33Å; L1197-L1201 PolarHBondContact O-N 3.08Å
1198	E	92.3	Very high	86.9	Confident	27 Å²	27	51.3 Å²	51.3	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-44.7	175.6	-173.6	174.1	144.7	0	0	111.5	I1121 R1194 L1201 R1202	I1121-E1198 HydrophobicContact CB-CB 4.15Å; I1121-E1198 HydrophobicContact CB-CG 4.47Å; I1121-E1198 HydrophobicContact CD1-CB 4.1Å; I1121-E1198 HydrophobicContact CG1-CB 3.93Å; I1121-E1198 HydrophobicContact CG1-CG 4.28Å; I1121-E1198 PolarHBondContact N-OE2 2.87Å; R1194-E1198 IonicContact CZ-OE2 3.63Å; R1194-E1198 IonicContact NH1-OE2 2.76Å; R1194-E1198 PolarHBondContact NH1-OE2 3.38Å; R1194-E1198 WeakPolarHBondContact O-CB 3.47Å; R1194-E1198 PolarHBondContact O-N 3.44Å; E1198-L1201 PolarHBondContact O-N 3.49Å; E1198-R1202 PolarHBondContact O-N 2.94Å; E1198-R1202 VanDerWaalsContact O-N 3.14Å; E1198-R1202 IonicContact OE1-CZ 3.6Å; E1198-R1202 VanDerWaalsContact OE1-CZ 3.29Å; E1198-R1202 IonicContact OE1-NH1 3.61Å; E1198-R1202 IonicContact OE1-NH2 3.94Å; E1198-R1202 PolarHBondContact OE1-NH2 3.13Å
1199	R	90.6	Very high	87.2	Confident	142 Å²	142	42.7 Å²	42.7	54%	0.536	19%	0.194	S	C	.	.	H	α-helix	trans	-62.2	-43.9	174.9	-169.5	-178.4	-63.4	136.7	1.4	111.6	S1195 H1196 R1202 N1203	S1195-R1199 PolarHBondContact O-N 3.37Å; S1195-R1199 VanDerWaalsContact O-N 3.16Å; H1196-R1199 PolarHBondContact CD2-NH1 3.21Å; H1196-R1199 PolarHBondContact O-N 3.47Å; R1199-R1202 PolarHBondContact O-N 3.2Å; R1199-N1203 PolarHBondContact O-N 3.26Å
1200	Y	92.9	Very high	87.1	Confident	8 Å²	8	46.6 Å²	46.6	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-58	-47.9	175.2	170	-94.4	0	0	0	111.9	M1160 H1161 L1174 F1176 H1196 L1197 R1202 N1203 L1204	M1160-Y1200 HydrophobicContact CE-CE1 4.13Å; H1161-Y1200 WeakPolarHBondContact CB-OH 3.39Å; H1161-Y1200 AromaticContact ND1-CE2 3.48Å; H1161-Y1200 WeakPolarHBondContact ND1-CE2 3.45Å; H1161-Y1200 AromaticContact ND1-CZ 3.5Å; H1161-Y1200 PolarHBondContact ND1-OH 3.49Å; L1174-Y1200 HydrophobicContact CB-CE2 4.28Å; F1176-Y1200 HydrophobicContact CD2-CD1 4.21Å; F1176-Y1200 HydrophobicContact CD2-CD2 4.02Å; F1176-Y1200 HydrophobicContact CD2-CE1 4.04Å; F1176-Y1200 AromaticContact CD2-CE2 3.84Å; F1176-Y1200 HydrophobicContact CD2-CE2 3.84Å; F1176-Y1200 HydrophobicContact CD2-CG 4.22Å; F1176-Y1200 AromaticContact CD2-CZ 3.87Å; F1176-Y1200 HydrophobicContact CE2-CD1 4.2Å; F1176-Y1200 HydrophobicContact CE2-CE1 4.09Å; H1196-Y1200 WeakPolarHBondContact O-CB 3.42Å; H1196-Y1200 PolarHBondContact O-N 3.23Å; L1197-Y1200 PolarHBondContact O-N 2.95Å; Y1200-R1202 VanDerWaalsContact C-N 3.35Å; Y1200-R1202 PolarHBondContact O-N 3.37Å; Y1200-N1203 PolarHBondContact O-N 2.97Å; Y1200-L1204 HydrophobicContact CE1-CB 4.49Å; Y1200-L1204 HydrophobicContact CE1-CD2 4.08Å; Y1200-L1204 WeakPolarHBondContact O-CB 3.41Å; Y1200-L1204 PolarHBondContact O-N 3.43Å
1201	L	91.6	Very high	86.9	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.8	-36.7	179.3	-72.2	-174.6	0	0	0	113	V1119 I1121 V1139 F1157 M1160 L1197 E1198 L1204 F1205 F1237 F1238	V1119-L1201 HydrophobicContact CG1-CB 3.89Å; V1119-L1201 HydrophobicContact CG2-CB 4.05Å; V1119-L1201 HydrophobicContact CG2-CD1 3.84Å; I1121-L1201 HydrophobicContact CD1-CD1 4.18Å; V1139-L1201 HydrophobicContact CG1-CD1 3.54Å; V1139-L1201 HydrophobicContact CG2-CD1 4.2Å; F1157-L1201 HydrophobicContact CD1-CD2 4.43Å; F1157-L1201 HydrophobicContact CD1-CG 4.49Å; F1157-L1201 HydrophobicContact CE1-CD1 3.82Å; F1157-L1201 HydrophobicContact CE1-CD2 4.48Å; F1157-L1201 HydrophobicContact CE1-CG 4.18Å; M1160-L1201 HydrophobicContact CE-CD2 3.66Å; L1197-L1201 WeakPolarHBondContact O-CG 3.33Å; L1197-L1201 PolarHBondContact O-N 3.08Å; E1198-L1201 PolarHBondContact O-N 3.49Å; L1201-L1204 HydrophobicContact CD2-CD2 4.16Å; L1201-L1204 PolarHBondContact O-N 3.28Å; L1201-F1205 WeakPolarHBondContact O-CD2 3.42Å; L1201-F1205 PolarHBondContact O-N 3.43Å; L1201-F1205 VanDerWaalsContact O-N 3.12Å; L1201-F1237 HydrophobicContact CD2-CE1 4.48Å; L1201-F1238 HydrophobicContact CD2-CZ 4.36Å
1202	R	90.4	Very high	86.2	Confident	109 Å²	109	49.3 Å²	49.3	41%	0.411	24%	0.242	S	C	.	.	H	α-helix	trans	-64.5	-45.4	174.4	-72.6	-175.3	-178.8	153.2	11.6	111.9	V1119 E1198 R1199 Y1200 L1204 F1205 R1206	V1119-R1202 HydrophobicContact CG1-CB 4.4Å; V1119-R1202 HydrophobicContact CG1-CG 3.62Å; V1119-R1202 PolarHBondContact O-NE 3.39Å; V1119-R1202 PolarHBondContact O-NH2 3.47Å; V1119-R1202 VanDerWaalsContact O-NH2 3.11Å; E1198-R1202 PolarHBondContact O-N 2.94Å; E1198-R1202 VanDerWaalsContact O-N 3.14Å; E1198-R1202 IonicContact OE1-CZ 3.6Å; E1198-R1202 VanDerWaalsContact OE1-CZ 3.29Å; E1198-R1202 IonicContact OE1-NH1 3.61Å; E1198-R1202 IonicContact OE1-NH2 3.94Å; E1198-R1202 PolarHBondContact OE1-NH2 3.13Å; R1199-R1202 PolarHBondContact O-N 3.2Å; Y1200-R1202 VanDerWaalsContact C-N 3.35Å; Y1200-R1202 PolarHBondContact O-N 3.37Å; R1202-L1204 VanDerWaalsContact C-N 3.34Å; R1202-F1205 PolarHBondContact O-N 2.94Å; R1202-R1206 WeakPolarHBondContact O-CB 3.47Å; R1202-R1206 PolarHBondContact O-N 3.44Å
1203	N	88.6	Confident	85.3	Confident	56 Å²	56	48 Å²	48	30%	0.299	25%	0.25	S	S	.	.	H	α-helix	trans	-67	-37	178.3	-68.8	-4.8	0	0	0	111.7	L1174 R1199 Y1200 R1206 V1207	L1174-N1203 HydrophobicContact CD2-CB 3.81Å; R1199-N1203 PolarHBondContact O-N 3.26Å; Y1200-N1203 PolarHBondContact O-N 2.97Å; N1203-R1206 PolarHBondContact O-N 3.36Å; N1203-V1207 WeakPolarHBondContact O-CG2 3.37Å; N1203-V1207 PolarHBondContact O-N 3.32Å
1204	L	89.7	Confident	84.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-57	-53.3	173.3	177.8	65.9	0	0	0	111.5	M1160 L1164 L1171 L1174 Y1200 L1201 R1202 R1206 V1207 M1208	M1160-L1204 HydrophobicContact CE-CD2 3.65Å; M1160-L1204 HydrophobicContact SD-CD2 4.38Å; L1164-L1204 HydrophobicContact CD1-CD1 4.13Å; L1164-L1204 HydrophobicContact CD1-CD2 4.14Å; L1171-L1204 HydrophobicContact CD1-CD1 3.75Å; L1171-L1204 HydrophobicContact CD2-CD1 3.69Å; L1171-L1204 HydrophobicContact CG-CD1 4.36Å; L1174-L1204 HydrophobicContact CD1-CB 4.34Å; L1174-L1204 HydrophobicContact CD1-CD1 4.38Å; Y1200-L1204 HydrophobicContact CE1-CB 4.49Å; Y1200-L1204 HydrophobicContact CE1-CD2 4.08Å; Y1200-L1204 WeakPolarHBondContact O-CB 3.41Å; Y1200-L1204 PolarHBondContact O-N 3.43Å; L1201-L1204 HydrophobicContact CD2-CD2 4.16Å; L1201-L1204 PolarHBondContact O-N 3.28Å; R1202-L1204 VanDerWaalsContact C-N 3.34Å; L1204-R1206 VanDerWaalsContact C-N 3.34Å; L1204-R1206 PolarHBondContact O-N 3.31Å; L1204-V1207 PolarHBondContact O-N 3.49Å; L1204-M1208 HydrophobicContact CD1-CG 4.25Å; L1204-M1208 WeakPolarHBondContact O-CB 3.45Å; L1204-M1208 VanDerWaalsContact O-CG 3.3Å; L1204-M1208 WeakPolarHBondContact O-CG 3.41Å; L1204-M1208 PolarHBondContact O-N 3.04Å
1205	F	88.6	Confident	83.9	Confident	5 Å²	5	48.1 Å²	48.1	2%	0.022	26%	0.261	C	S	.	.	H	α-helix	trans	-64.1	-38.4	176.6	-79.8	-65.7	0	0	0	112.1	V1117 V1119 L1201 R1202 V1207 M1208 L1209 L1216 I1231 F1238	V1117-F1205 HydrophobicContact CB-CD1 4.49Å; V1117-F1205 HydrophobicContact CB-CG 4.49Å; V1117-F1205 HydrophobicContact CG1-CD1 4.08Å; V1117-F1205 HydrophobicContact CG1-CD2 4.09Å; V1117-F1205 HydrophobicContact CG1-CE1 4.22Å; V1117-F1205 HydrophobicContact CG1-CE2 4.22Å; V1117-F1205 HydrophobicContact CG1-CG 4.03Å; V1117-F1205 HydrophobicContact CG1-CZ 4.29Å; V1117-F1205 HydrophobicContact CG2-CD1 4.48Å; V1119-F1205 HydrophobicContact CB-CD2 4.41Å; V1119-F1205 HydrophobicContact CB-CE2 4.44Å; V1119-F1205 HydrophobicContact CG1-CD2 4.05Å; L1201-F1205 WeakPolarHBondContact O-CD2 3.42Å; L1201-F1205 PolarHBondContact O-N 3.43Å; L1201-F1205 VanDerWaalsContact O-N 3.12Å; R1202-F1205 PolarHBondContact O-N 2.94Å; F1205-V1207 PolarHBondContact O-N 3.13Å; F1205-M1208 PolarHBondContact O-N 3.29Å; F1205-L1209 HydrophobicContact CB-CD1 4.44Å; F1205-L1209 VanDerWaalsContact O-CB 3.31Å; F1205-L1209 WeakPolarHBondContact O-CB 3.45Å; F1205-L1209 WeakPolarHBondContact O-CD1 3.47Å; F1205-L1209 WeakPolarHBondContact O-CG 3.49Å; F1205-L1209 PolarHBondContact O-N 3.42Å; F1205-L1216 HydrophobicContact CD1-CD1 4.01Å; F1205-L1216 HydrophobicContact CE1-CD1 3.91Å; F1205-I1231 HydrophobicContact CE1-CD1 3.8Å; F1205-I1231 HydrophobicContact CE1-CG1 4.43Å; F1205-I1231 HydrophobicContact CE1-CG2 4.2Å; F1205-I1231 HydrophobicContact CZ-CD1 4.11Å; F1205-I1231 HydrophobicContact CZ-CG2 3.95Å; F1205-F1238 HydrophobicContact CE1-CE2 4.46Å; F1205-F1238 AromaticContact CE2-CE1 3.92Å; F1205-F1238 HydrophobicContact CE2-CE1 3.92Å; F1205-F1238 HydrophobicContact CE2-CE2 4.31Å; F1205-F1238 AromaticContact CE2-CZ 3.61Å; F1205-F1238 HydrophobicContact CE2-CZ 3.61Å; F1205-F1238 HydrophobicContact CZ-CD2 4.32Å; F1205-F1238 AromaticContact CZ-CE1 3.91Å; F1205-F1238 HydrophobicContact CZ-CE1 3.91Å; F1205-F1238 AromaticContact CZ-CE2 3.67Å; F1205-F1238 HydrophobicContact CZ-CE2 3.67Å; F1205-F1238 AromaticContact CZ-CZ 3.43Å; F1205-F1238 HydrophobicContact CZ-CZ 3.43Å; F1205-F1238 VanDerWaalsContact CZ-CZ 3.43Å
1206	R	85.6	Confident	83.3	Confident	146 Å²	146	46.2 Å²	46.2	55%	0.551	25%	0.248	S	C	*	.	H	α-helix	trans	-59.6	-45.1	176.5	-174.5	-180	-66.7	163.5	-2.7	112.6	R1202 N1203 L1204 S1210	R1202-R1206 WeakPolarHBondContact O-CB 3.47Å; R1202-R1206 PolarHBondContact O-N 3.44Å; N1203-R1206 PolarHBondContact O-N 3.36Å; L1204-R1206 VanDerWaalsContact C-N 3.34Å; L1204-R1206 PolarHBondContact O-N 3.31Å; R1206-S1210 PolarHBondContact O-N 3.32Å; R1206-S1210 PolarHBondContact O-OG 3.42Å
1207	V	84.8	Confident	82.7	Confident	42 Å²	42	47.5 Å²	47.5	26%	0.255	25%	0.25	S	S	.	.	H	α-helix	trans	-68.4	-44.2	177	175.9	0	0	0	0	110.6	E1170 L1171 L1174 N1203 L1204 F1205 L1209 S1210 C1211	E1170-V1207 HydrophobicContact CB-CG1 4.15Å; L1171-V1207 HydrophobicContact CD2-CB 4.07Å; L1171-V1207 HydrophobicContact CD2-CG1 3.78Å; L1174-V1207 HydrophobicContact CD1-CG2 4.25Å; L1174-V1207 HydrophobicContact CD2-CG2 4.12Å; L1174-V1207 HydrophobicContact CG-CG2 4.36Å; N1203-V1207 WeakPolarHBondContact O-CG2 3.37Å; N1203-V1207 PolarHBondContact O-N 3.32Å; L1204-V1207 PolarHBondContact O-N 3.49Å; F1205-V1207 PolarHBondContact O-N 3.13Å; V1207-L1209 VanDerWaalsContact C-N 3.32Å; V1207-L1209 PolarHBondContact O-N 3.31Å; V1207-S1210 PolarHBondContact O-N 2.95Å; V1207-S1210 VanDerWaalsContact O-N 3.15Å; V1207-C1211 WeakPolarHBondContact O-CB 3.42Å; V1207-C1211 PolarHBondContact O-N 3.12Å
1208	M	84.2	Confident	81.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-71.9	-19.6	-179	-65	-52.2	-72	0	0	114.4	Y1168 L1171 L1204 F1205 S1214 L1216 F1234	Y1168-M1208 HydrophobicContact CD1-CE 3.65Å; Y1168-M1208 HydrophobicContact CD2-CE 3.55Å; Y1168-M1208 HydrophobicContact CD2-SD 4.35Å; Y1168-M1208 HydrophobicContact CE1-CE 3.76Å; Y1168-M1208 HydrophobicContact CE2-CE 3.66Å; Y1168-M1208 HydrophobicContact CG-CE 3.53Å; Y1168-M1208 HydrophobicContact CG-SD 4.15Å; L1171-M1208 HydrophobicContact CD1-CG 4.43Å; L1171-M1208 HydrophobicContact CD1-SD 3.79Å; L1171-M1208 HydrophobicContact CD2-CG 4.09Å; L1171-M1208 HydrophobicContact CD2-SD 3.73Å; L1171-M1208 HydrophobicContact CG-SD 3.89Å; L1204-M1208 HydrophobicContact CD1-CG 4.25Å; L1204-M1208 WeakPolarHBondContact O-CB 3.45Å; L1204-M1208 VanDerWaalsContact O-CG 3.3Å; L1204-M1208 WeakPolarHBondContact O-CG 3.41Å; L1204-M1208 PolarHBondContact O-N 3.04Å; F1205-M1208 PolarHBondContact O-N 3.29Å; M1208-S1214 WeakPolarHBondContact CE-OG 3.43Å; M1208-S1214 WeakPolarHBondContact O-CB 3.49Å; M1208-S1214 PolarHBondContact O-OG 3.32Å; M1208-L1216 HydrophobicContact CB-CD1 4.18Å; M1208-F1234 HydrophobicContact CE-CE2 3.57Å; M1208-F1234 HydrophobicContact CE-CZ 3.73Å; M1208-F1234 HydrophobicContact CG-CZ 3.96Å
1209	L	81.3	Confident	79.8	Confident	32 Å²	32	54.7 Å²	54.7	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-81.4	-20.3	171.9	-71.3	164.1	0	0	0	112.5	P1116 V1117 F1205 V1207 L1216 L1226	P1116-L1209 HydrophobicContact CG-CD1 3.86Å; P1116-L1209 HydrophobicContact CG-CD2 4.26Å; V1117-L1209 HydrophobicContact CG2-CD1 4.27Å; F1205-L1209 HydrophobicContact CB-CD1 4.44Å; F1205-L1209 VanDerWaalsContact O-CB 3.31Å; F1205-L1209 WeakPolarHBondContact O-CB 3.45Å; F1205-L1209 WeakPolarHBondContact O-CD1 3.47Å; F1205-L1209 WeakPolarHBondContact O-CG 3.49Å; F1205-L1209 PolarHBondContact O-N 3.42Å; V1207-L1209 VanDerWaalsContact C-N 3.32Å; V1207-L1209 PolarHBondContact O-N 3.31Å; L1209-L1216 HydrophobicContact CD2-CB 4.41Å; L1209-L1216 WeakPolarHBondContact CD2-O 3.43Å; L1209-L1226 HydrophobicContact CD2-CD2 4.05Å
1210	S	77.1	Confident	78.1	Confident	98 Å²	98	55.8 Å²	55.8	69%	0.685	31%	0.305	S	S	*	.	H	α-helix	trans	-105.5	-12	-178.4	-58.5	0	0	0	0	114.4	R1206 V1207	R1206-S1210 PolarHBondContact O-N 3.32Å; R1206-S1210 PolarHBondContact O-OG 3.42Å; V1207-S1210 PolarHBondContact O-N 2.95Å; V1207-S1210 VanDerWaalsContact O-N 3.15Å
1211	C	77.6	Confident	76.1	Confident	10 Å²	10	62.5 Å²	62.5	7%	0.068	34%	0.341	C	S	.	.			trans	-78.5	132.4	179.1	174.4	0	0	0	0	111.3	V1207 G1213 S1214	V1207-C1211 WeakPolarHBondContact O-CB 3.42Å; V1207-C1211 PolarHBondContact O-N 3.12Å; C1211-G1213 VanDerWaalsContact C-N 3.33Å; C1211-G1213 PolarHBondContact O-N 3.34Å; C1211-S1214 WeakPolarHBondContact O-CB 3.3Å; C1211-S1214 PolarHBondContact O-N 3.4Å
1212	S	65.1	Low	74.2	Confident	98 Å²	98	65.8 Å²	65.8	69%	0.685	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-28.1	-177.7	49.1	0	0	0	0	114.3
1213	G	65.6	Low	72.4	Confident	53 Å²	53	66.8 Å²	66.8	55%	0.546	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	8.4	177.3	0	0	0	0	0	115	C1211	C1211-G1213 VanDerWaalsContact C-N 3.33Å; C1211-G1213 PolarHBondContact O-N 3.34Å
1214	S	76.4	Confident	70.9	Confident	10 Å²	10	67.9 Å²	67.9	7%	0.07	40%	0.395	C	S	.	.			trans	-91.1	132	-173.6	174.2	0	0	0	0	113.3	M1208 C1211 L1216 R1217	M1208-S1214 WeakPolarHBondContact CE-OG 3.43Å; M1208-S1214 WeakPolarHBondContact O-CB 3.49Å; M1208-S1214 PolarHBondContact O-OG 3.32Å; C1211-S1214 WeakPolarHBondContact O-CB 3.3Å; C1211-S1214 PolarHBondContact O-N 3.4Å; S1214-L1216 PolarHBondContact O-N 3.43Å; S1214-L1216 VanDerWaalsContact O-N 3.07Å; S1214-L1216 PolarHBondContact OG-N 3.04Å; S1214-R1217 PolarHBondContact O-N 3.06Å; S1214-R1217 VanDerWaalsContact O-N 3.15Å
1215	P	71.1	Confident	69.8	Low	69 Å²	69	77.3 Å²	77.3	45%	0.448	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	4.5	174.9	34.6	-39.1	0	0	0	113.8	Y1168 F1234	Y1168-P1215 VanDerWaalsContact OH-CD 3.27Å; Y1168-P1215 WeakPolarHBondContact OH-CD 3.49Å; P1215-F1234 HydrophobicContact CG-CD2 3.75Å; P1215-F1234 HydrophobicContact CG-CE2 4.31Å
1216	L	76.2	Confident	69.2	Low	0 Å²	0	78 Å²	78	0%	0	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-7.5	172.4	-60.3	179.6	0	0	0	112.9	F1205 M1208 L1209 S1214 L1226 I1231 F1234	F1205-L1216 HydrophobicContact CD1-CD1 4.01Å; F1205-L1216 HydrophobicContact CE1-CD1 3.91Å; M1208-L1216 HydrophobicContact CB-CD1 4.18Å; L1209-L1216 HydrophobicContact CD2-CB 4.41Å; L1209-L1216 WeakPolarHBondContact CD2-O 3.43Å; S1214-L1216 PolarHBondContact O-N 3.43Å; S1214-L1216 VanDerWaalsContact O-N 3.07Å; S1214-L1216 PolarHBondContact OG-N 3.04Å; L1216-L1226 HydrophobicContact CB-CD1 4.35Å; L1216-L1226 HydrophobicContact CD2-CD1 3.89Å; L1216-I1231 HydrophobicContact CD2-CG1 4.24Å; L1216-F1234 HydrophobicContact CD1-CB 4.45Å; L1216-F1234 HydrophobicContact CD1-CD1 3.64Å; L1216-F1234 HydrophobicContact CD1-CD2 4.17Å; L1216-F1234 HydrophobicContact CD1-CE1 3.83Å; L1216-F1234 HydrophobicContact CD1-CE2 4.34Å; L1216-F1234 HydrophobicContact CD1-CG 3.8Å; L1216-F1234 HydrophobicContact CD1-CZ 4.18Å; L1216-F1234 HydrophobicContact CD2-CB 3.84Å; L1216-F1234 HydrophobicContact CD2-CG 4.06Å; L1216-F1234 HydrophobicContact CG-CB 4.26Å; L1216-F1234 HydrophobicContact CG-CD1 4.29Å; L1216-F1234 HydrophobicContact CG-CD2 4.07Å; L1216-F1234 HydrophobicContact CG-CG 3.93Å
1217	R	74.9	Confident	69	Low	93 Å²	93	72.9 Å²	72.9	35%	0.351	42%	0.421	S	S	.	.	S	Bend	trans	-69.2	133	176.2	-175.3	-177.5	173.9	-168.5	1.3	109.4	S1214 E1220	S1214-R1217 PolarHBondContact O-N 3.06Å; S1214-R1217 VanDerWaalsContact O-N 3.15Å; R1217-E1220 IonicContact CZ-OE1 3.14Å; R1217-E1220 IonicContact NH2-OE1 3.69Å; R1217-E1220 PolarHBondContact NH2-OE1 3.33Å
1218	P	63.9	Low	68.9	Low	71 Å²	71	75 Å²	75	46%	0.461	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-73.3	135.7	169.2	30.1	-32.7	0	0	0	110.6
1219	D	59.5	Low	68.8	Low	107 Å²	107	81.5 Å²	81.5	57%	0.572	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-60.9	147.7	172.1	-88.1	-38.2	0	0	0	112.1	D1221 G1222 F1224	D1219-D1221 PolarHBondContact O-N 3.21Å; D1219-G1222 PolarHBondContact O-N 3.14Å; D1219-G1222 VanDerWaalsContact O-N 3.16Å; D1219-F1224 HydrophobicContact CB-CB 4.31Å
1220	E	54.5	Low	68.8	Low	165 Å²	165	81.8 Å²	81.8	77%	0.771	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.8	-175.7	-56.5	-153.4	162.4	0	0	113.2	R1217 G1222	R1217-E1220 IonicContact CZ-OE1 3.14Å; R1217-E1220 IonicContact NH2-OE1 3.69Å; R1217-E1220 PolarHBondContact NH2-OE1 3.33Å; E1220-G1222 PolarHBondContact O-N 3.45Å
1221	D	51.8	Low	69.2	Low	149 Å²	149	77.1 Å²	77.1	80%	0.797	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	1.5	174.7	-64.6	-43.8	0	0	0	114.1	D1219 V1223	D1219-D1221 PolarHBondContact O-N 3.21Å; D1221-V1223 PolarHBondContact O-N 3.34Å; D1221-V1223 VanDerWaalsContact O-N 3.13Å
1222	G	52.2	Low	69.5	Low	69 Å²	69	77.6 Å²	77.6	71%	0.711	43%	0.427	S	S	*	.	S	Bend	trans	73.5	3.7	169.3	0	0	0	0	0	116.4	D1219 E1220	D1219-G1222 PolarHBondContact O-N 3.14Å; D1219-G1222 VanDerWaalsContact O-N 3.16Å; E1220-G1222 PolarHBondContact O-N 3.45Å
1223	V	51	Low	70.3	Confident	129 Å²	129	78.7 Å²	78.7	78%	0.782	42%	0.422	S	S	*	.			trans	-81.1	-26	180	-177.6	0	0	0	0	112.6	D1221 R1225	D1221-V1223 PolarHBondContact O-N 3.34Å; D1221-V1223 VanDerWaalsContact O-N 3.13Å; V1223-R1225 PolarHBondContact O-N 3.07Å; V1223-R1225 VanDerWaalsContact O-N 3.11Å
1224	F	58.8	Low	71.1	Confident	80 Å²	80	77.3 Å²	77.3	35%	0.351	40%	0.401	S	S	.	.			trans	-81.7	93	-173.3	-156.1	-90.4	0	0	0	113.1	D1219 L1226	D1219-F1224 HydrophobicContact CB-CB 4.31Å; F1224-L1226 PolarHBondContact O-N 3.06Å
1225	R	65.3	Low	71.5	Confident	197 Å²	197	77.3 Å²	77.3	74%	0.743	40%	0.401	S	S	*	.			trans	-79.1	114.3	167.4	-80	-164.6	-176.6	-165.4	4	111.2	V1223 S1227	V1223-R1225 PolarHBondContact O-N 3.07Å; V1223-R1225 VanDerWaalsContact O-N 3.11Å; R1225-S1227 PolarHBondContact O-N 3.45Å
1226	L	76.1	Confident	72.1	Confident	19 Å²	19	78.7 Å²	78.7	10%	0.099	41%	0.41	C	S	.	.			trans	-60.3	122.3	170.2	-166.4	72	0	0	0	110.5	V1117 V1143 L1209 L1216 F1224 N1230	V1117-L1226 HydrophobicContact CG2-CD2 3.29Å; V1143-L1226 HydrophobicContact CG1-CB 4.19Å; V1143-L1226 HydrophobicContact CG1-CD2 4.04Å; V1143-L1226 HydrophobicContact CG1-CG 4Å; V1143-L1226 WeakPolarHBondContact CG1-O 3.4Å; L1209-L1226 HydrophobicContact CD2-CD2 4.05Å; L1216-L1226 HydrophobicContact CB-CD1 4.35Å; L1216-L1226 HydrophobicContact CD2-CD1 3.89Å; F1224-L1226 PolarHBondContact O-N 3.06Å; L1226-N1230 HydrophobicContact CD1-CB 4.08Å
1227	S	81.6	Confident	72.7	Confident	40 Å²	40	79.2 Å²	79.2	28%	0.28	41%	0.412	S	S	.	.			trans	-119.2	169.5	-179.8	78.1	0	0	0	0	112.4	R1225 F1229 N1230 I1231	R1225-S1227 PolarHBondContact O-N 3.45Å; S1227-F1229 PolarHBondContact O-N 3.03Å; S1227-F1229 PolarHBondContact OG-N 2.98Å; S1227-N1230 WeakPolarHBondContact CB-OD1 3.25Å; S1227-N1230 PolarHBondContact N-OD1 3.22Å; S1227-N1230 PolarHBondContact O-N 3.1Å; S1227-N1230 PolarHBondContact OG-OD1 3.43Å; S1227-I1231 PolarHBondContact O-N 3.02Å
1228	K	82.8	Confident	73.3	Confident	85 Å²	85	74.8 Å²	74.8	37%	0.37	40%	0.395	S	S	.	.	H	α-helix	trans	-53.6	-36.2	169.8	174.6	176	175.4	-168	0	113.2	D1146 W1148 I1231 C1232	D1146-K1228 HydrophobicContact CB-CB 4.18Å; D1146-K1228 WeakPolarHBondContact OD2-CB 3.27Å; W1148-K1228 HydrophobicContact CD2-CD 3.93Å; W1148-K1228 HydrophobicContact CD2-CG 3.9Å; W1148-K1228 HydrophobicContact CE3-CB 4.09Å; W1148-K1228 HydrophobicContact CE3-CD 3.73Å; W1148-K1228 HydrophobicContact CE3-CG 3.69Å; W1148-K1228 HydrophobicContact CG-CD 4.38Å; W1148-K1228 HydrophobicContact CH2-CB 3.91Å; W1148-K1228 HydrophobicContact CH2-CG 3.8Å; W1148-K1228 HydrophobicContact CZ2-CG 3.98Å; W1148-K1228 HydrophobicContact CZ3-CB 3.63Å; W1148-K1228 HydrophobicContact CZ3-CD 4.16Å; W1148-K1228 HydrophobicContact CZ3-CG 3.65Å; K1228-I1231 PolarHBondContact O-N 3.19Å; K1228-C1232 PolarHBondContact O-N 3.38Å; K1228-C1232 VanDerWaalsContact O-N 3.1Å; K1228-C1232 PolarHBondContact O-SG 3.35Å; K1228-C1232 VanDerWaalsContact O-SG 3.4Å
1229	F	82.1	Confident	74.2	Confident	138 Å²	138	77.2 Å²	77.2	61%	0.605	40%	0.399	S	S	*	.	H	α-helix	trans	-61.6	-47.1	178.4	-179.1	-99	0	0	0	111.1	S1227 I1231 C1232 E1233	S1227-F1229 PolarHBondContact O-N 3.03Å; S1227-F1229 PolarHBondContact OG-N 2.98Å; F1229-I1231 VanDerWaalsContact C-N 3.33Å; F1229-I1231 PolarHBondContact O-N 3.49Å; F1229-C1232 PolarHBondContact O-N 2.84Å; F1229-C1232 VanDerWaalsContact O-N 3.13Å; F1229-E1233 HydrophobicContact CD1-CG 4.08Å; F1229-E1233 HydrophobicContact CE1-CG 3.62Å; F1229-E1233 HydrophobicContact CE2-CG 4.18Å; F1229-E1233 HydrophobicContact CZ-CG 3.68Å; F1229-E1233 PolarHBondContact O-N 2.8Å
1230	N	82	Confident	74.7	Confident	37 Å²	37	79.9 Å²	79.9	20%	0.198	41%	0.405	C	S	.	.	H	α-helix	trans	-60.8	-39.1	-179.9	-52.5	99	0	0	0	112.4	L1226 S1227 F1234	L1226-N1230 HydrophobicContact CD1-CB 4.08Å; S1227-N1230 WeakPolarHBondContact CB-OD1 3.25Å; S1227-N1230 PolarHBondContact N-OD1 3.22Å; S1227-N1230 PolarHBondContact O-N 3.1Å; S1227-N1230 PolarHBondContact OG-OD1 3.43Å; N1230-F1234 VanDerWaalsContact O-CB 3.27Å; N1230-F1234 WeakPolarHBondContact O-CB 3.37Å; N1230-F1234 PolarHBondContact O-N 3.14Å
1231	I	84.6	Confident	74.6	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-70.4	-36.3	176.8	-62	-160.6	0	0	0	112.1	V1117 V1141 V1143 W1148 F1205 L1216 S1227 K1228 F1229 S1235 F1238	V1117-I1231 HydrophobicContact CG1-CD1 3.85Å; V1117-I1231 HydrophobicContact CG2-CD1 3.85Å; V1141-I1231 HydrophobicContact CG1-CD1 4.2Å; V1143-I1231 HydrophobicContact CG2-CD1 3.28Å; V1143-I1231 HydrophobicContact CG2-CG1 4.16Å; W1148-I1231 HydrophobicContact CH2-CB 4.05Å; W1148-I1231 HydrophobicContact CH2-CD1 4.31Å; W1148-I1231 HydrophobicContact CH2-CG2 4.23Å; W1148-I1231 HydrophobicContact CZ2-CB 4.09Å; W1148-I1231 HydrophobicContact CZ2-CG2 3.92Å; F1205-I1231 HydrophobicContact CE1-CD1 3.8Å; F1205-I1231 HydrophobicContact CE1-CG1 4.43Å; F1205-I1231 HydrophobicContact CE1-CG2 4.2Å; F1205-I1231 HydrophobicContact CZ-CD1 4.11Å; F1205-I1231 HydrophobicContact CZ-CG2 3.95Å; L1216-I1231 HydrophobicContact CD2-CG1 4.24Å; S1227-I1231 PolarHBondContact O-N 3.02Å; K1228-I1231 PolarHBondContact O-N 3.19Å; F1229-I1231 VanDerWaalsContact C-N 3.33Å; F1229-I1231 PolarHBondContact O-N 3.49Å; I1231-S1235 PolarHBondContact O-N 3.24Å; I1231-F1238 HydrophobicContact CG2-CB 3.77Å; I1231-F1238 HydrophobicContact CG2-CD1 4.39Å; I1231-F1238 HydrophobicContact CG2-CD2 3.64Å; I1231-F1238 HydrophobicContact CG2-CE2 4.34Å; I1231-F1238 HydrophobicContact CG2-CG 3.67Å
1232	C	83.8	Confident	74.2	Confident	20 Å²	20	73.3 Å²	73.3	14%	0.135	39%	0.39	C	S	.	.	H	α-helix	trans	-72.1	-32.7	176.6	-70	0	0	0	0	113.4	K1228 F1229 S1235 F1238 K1239	K1228-C1232 PolarHBondContact O-N 3.38Å; K1228-C1232 VanDerWaalsContact O-N 3.1Å; K1228-C1232 PolarHBondContact O-SG 3.35Å; K1228-C1232 VanDerWaalsContact O-SG 3.4Å; F1229-C1232 PolarHBondContact O-N 2.84Å; F1229-C1232 VanDerWaalsContact O-N 3.13Å; C1232-S1235 CarbonylContact O-C 3.59Å; C1232-F1238 PolarHBondContact SG-O 3.35Å; C1232-F1238 VanDerWaalsContact SG-O 3.42Å; C1232-K1239 HydrophobicContact CB-CB 4.32Å; C1232-K1239 HydrophobicContact CB-CG 4.49Å
1233	E	81.3	Confident	73.6	Confident	121 Å²	121	78 Å²	78	57%	0.565	39%	0.391	S	S	*	.	H	α-helix	trans	-68.7	-46.7	170.8	-79.5	-71	106.4	0	0	111.4	F1229 S1235	F1229-E1233 HydrophobicContact CD1-CG 4.08Å; F1229-E1233 HydrophobicContact CE1-CG 3.62Å; F1229-E1233 HydrophobicContact CE2-CG 4.18Å; F1229-E1233 HydrophobicContact CZ-CG 3.68Å; F1229-E1233 PolarHBondContact O-N 2.8Å; E1233-S1235 VanDerWaalsContact C-N 3.25Å; E1233-S1235 PolarHBondContact O-N 2.76Å
1234	F	83.6	Confident	72.8	Confident	24 Å²	24	75.8 Å²	75.8	11%	0.105	37%	0.372	C	S	.	.	H	α-helix	trans	-55.3	-38.8	179.7	171.2	-108.4	0	0	0	113.4	L1164 Y1168 M1208 P1215 L1216 N1230	L1164-F1234 HydrophobicContact CD1-CE1 4.01Å; L1164-F1234 HydrophobicContact CD1-CZ 3.97Å; L1164-F1234 HydrophobicContact CD2-CE1 4.29Å; L1164-F1234 HydrophobicContact CD2-CE2 4.08Å; L1164-F1234 HydrophobicContact CD2-CZ 3.74Å; Y1168-F1234 AromaticContact CE2-CE2 3.86Å; Y1168-F1234 HydrophobicContact CE2-CE2 3.86Å; M1208-F1234 HydrophobicContact CE-CE2 3.57Å; M1208-F1234 HydrophobicContact CE-CZ 3.73Å; M1208-F1234 HydrophobicContact CG-CZ 3.96Å; P1215-F1234 HydrophobicContact CG-CD2 3.75Å; P1215-F1234 HydrophobicContact CG-CE2 4.31Å; L1216-F1234 HydrophobicContact CD1-CB 4.45Å; L1216-F1234 HydrophobicContact CD1-CD1 3.64Å; L1216-F1234 HydrophobicContact CD1-CD2 4.17Å; L1216-F1234 HydrophobicContact CD1-CE1 3.83Å; L1216-F1234 HydrophobicContact CD1-CE2 4.34Å; L1216-F1234 HydrophobicContact CD1-CG 3.8Å; L1216-F1234 HydrophobicContact CD1-CZ 4.18Å; L1216-F1234 HydrophobicContact CD2-CB 3.84Å; L1216-F1234 HydrophobicContact CD2-CG 4.06Å; L1216-F1234 HydrophobicContact CG-CB 4.26Å; L1216-F1234 HydrophobicContact CG-CD1 4.29Å; L1216-F1234 HydrophobicContact CG-CD2 4.07Å; L1216-F1234 HydrophobicContact CG-CG 3.93Å; N1230-F1234 VanDerWaalsContact O-CB 3.27Å; N1230-F1234 WeakPolarHBondContact O-CB 3.37Å; N1230-F1234 PolarHBondContact O-N 3.14Å
1235	S	84.9	Confident	71.6	Confident	10 Å²	10	78 Å²	78	7%	0.07	40%	0.398	C	S	.	.			trans	-150.9	127.4	170.9	-169.6	0	0	0	0	112.6	I1231 C1232 E1233 F1237 F1238	I1231-S1235 PolarHBondContact O-N 3.24Å; C1232-S1235 CarbonylContact O-C 3.59Å; E1233-S1235 VanDerWaalsContact C-N 3.25Å; E1233-S1235 PolarHBondContact O-N 2.76Å; S1235-F1237 PolarHBondContact O-N 3.45Å; S1235-F1237 WeakPolarHBondContact OG-CB 3.43Å; S1235-F1237 PolarHBondContact OG-N 2.93Å; S1235-F1238 PolarHBondContact O-N 3.47Å
1236	P	82.3	Confident	70	Confident	98 Å²	98	71.8 Å²	71.8	64%	0.636	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-53.5	-21.9	170.5	-27.3	35.1	0	0	0	113.9	R1152 F1238 K1239	R1152-P1236 PolarHBondContact NH2-O 2.74Å; P1236-F1238 PolarHBondContact O-N 3.15Å; P1236-K1239 WeakPolarHBondContact O-CB 3.34Å; P1236-K1239 PolarHBondContact O-N 3.07Å
1237	F	89.4	Confident	67.9	Low	12 Å²	12	76.4 Å²	76.4	5%	0.053	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-51.6	-37.2	172.8	-177.2	-90.3	0	0	0	112.6	V1139 R1152 R1156 F1157 M1160 L1201 S1235	V1139-F1237 HydrophobicContact CG2-CE1 4.39Å; V1139-F1237 HydrophobicContact CG2-CZ 4.35Å; R1152-F1237 HydrophobicContact CB-CE2 3.72Å; R1152-F1237 HydrophobicContact CB-CZ 3.82Å; R1152-F1237 HydrophobicContact CG-CD2 4.07Å; R1152-F1237 HydrophobicContact CG-CE1 4.19Å; R1152-F1237 HydrophobicContact CG-CE2 3.55Å; R1152-F1237 HydrophobicContact CG-CZ 3.62Å; R1152-F1237 PolarHBondContact NE-O 2.9Å; R1152-F1237 PolarHBondContact NH2-O 3.48Å; R1156-F1237 HydrophobicContact CB-CD2 4.17Å; R1156-F1237 HydrophobicContact CB-CE2 4.05Å; F1157-F1237 HydrophobicContact CB-CE2 4.37Å; F1157-F1237 HydrophobicContact CD1-CE2 4.17Å; F1157-F1237 AromaticContact CD1-CZ 3.63Å; F1157-F1237 HydrophobicContact CD1-CZ 3.63Å; F1157-F1237 AromaticContact CD2-CE2 3.87Å; F1157-F1237 HydrophobicContact CD2-CE2 3.87Å; F1157-F1237 AromaticContact CD2-CZ 3.87Å; F1157-F1237 HydrophobicContact CD2-CZ 3.87Å; F1157-F1237 HydrophobicContact CE1-CE1 4.43Å; F1157-F1237 AromaticContact CE1-CZ 3.67Å; F1157-F1237 HydrophobicContact CE1-CZ 3.67Å; F1157-F1237 HydrophobicContact CE2-CE2 4.25Å; F1157-F1237 AromaticContact CE2-CZ 3.88Å; F1157-F1237 HydrophobicContact CE2-CZ 3.88Å; F1157-F1237 AromaticContact CG-CE2 3.83Å; F1157-F1237 HydrophobicContact CG-CE2 3.83Å; F1157-F1237 AromaticContact CG-CZ 3.75Å; F1157-F1237 HydrophobicContact CG-CZ 3.75Å; F1157-F1237 AromaticContact CZ-CZ 3.79Å; F1157-F1237 HydrophobicContact CZ-CZ 3.79Å; M1160-F1237 HydrophobicContact CB-CB 4.31Å; M1160-F1237 HydrophobicContact CB-CD2 4.1Å; M1160-F1237 HydrophobicContact CB-CG 4.32Å; M1160-F1237 HydrophobicContact CE-CD1 4.21Å; M1160-F1237 HydrophobicContact CE-CE1 4.34Å; M1160-F1237 HydrophobicContact CE-CG 4.35Å; M1160-F1237 HydrophobicContact CG-CB 4.12Å; M1160-F1237 HydrophobicContact CG-CG 4.35Å; M1160-F1237 HydrophobicContact SD-CB 3.54Å; M1160-F1237 VanDerWaalsContact SD-CB 3.54Å; M1160-F1237 HydrophobicContact SD-CD1 3.58Å; M1160-F1237 VanDerWaalsContact SD-CD1 3.58Å; M1160-F1237 HydrophobicContact SD-CD2 4.08Å; M1160-F1237 HydrophobicContact SD-CE1 4.29Å; M1160-F1237 HydrophobicContact SD-CG 3.46Å; M1160-F1237 WeakPolarHBondContact SD-CG 3.48Å; L1201-F1237 HydrophobicContact CD2-CE1 4.48Å; S1235-F1237 PolarHBondContact O-N 3.45Å; S1235-F1237 WeakPolarHBondContact OG-CB 3.43Å; S1235-F1237 PolarHBondContact OG-N 2.93Å
1238	F	87.5	Confident	66	Low	0 Å²	0	81.2 Å²	81.2	0%	0	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-90.7	-4.8	-179.1	-58.5	-67.6	0	0	0	114.5	V1141 W1148 M1160 L1201 F1205 I1231 C1232 S1235 P1236	V1141-F1238 HydrophobicContact CG2-CD1 3.76Å; V1141-F1238 HydrophobicContact CG2-CE1 4.05Å; W1148-F1238 PolarHBondContact NE1-O 3.44Å; M1160-F1238 HydrophobicContact SD-CE2 4.03Å; M1160-F1238 HydrophobicContact SD-CZ 4.12Å; L1201-F1238 HydrophobicContact CD2-CZ 4.36Å; F1205-F1238 HydrophobicContact CE1-CE2 4.46Å; F1205-F1238 AromaticContact CE2-CE1 3.92Å; F1205-F1238 HydrophobicContact CE2-CE1 3.92Å; F1205-F1238 HydrophobicContact CE2-CE2 4.31Å; F1205-F1238 AromaticContact CE2-CZ 3.61Å; F1205-F1238 HydrophobicContact CE2-CZ 3.61Å; F1205-F1238 HydrophobicContact CZ-CD2 4.32Å; F1205-F1238 AromaticContact CZ-CE1 3.91Å; F1205-F1238 HydrophobicContact CZ-CE1 3.91Å; F1205-F1238 AromaticContact CZ-CE2 3.67Å; F1205-F1238 HydrophobicContact CZ-CE2 3.67Å; F1205-F1238 AromaticContact CZ-CZ 3.43Å; F1205-F1238 HydrophobicContact CZ-CZ 3.43Å; F1205-F1238 VanDerWaalsContact CZ-CZ 3.43Å; I1231-F1238 HydrophobicContact CG2-CB 3.77Å; I1231-F1238 HydrophobicContact CG2-CD1 4.39Å; I1231-F1238 HydrophobicContact CG2-CD2 3.64Å; I1231-F1238 HydrophobicContact CG2-CE2 4.34Å; I1231-F1238 HydrophobicContact CG2-CG 3.67Å; C1232-F1238 PolarHBondContact SG-O 3.35Å; C1232-F1238 VanDerWaalsContact SG-O 3.42Å; S1235-F1238 PolarHBondContact O-N 3.47Å; P1236-F1238 PolarHBondContact O-N 3.15Å
1239	K	84.2	Confident	63.5	Low	122 Å²	122	79.9 Å²	79.9	53%	0.53	45%	0.447	S	S	.	.	S	Bend	trans	-79.3	129	177.8	-165	169	-175.4	169.7	0	110	R1152 C1232 P1236 G1241	R1152-K1239 PolarHBondContact NH2-O 3.31Å; C1232-K1239 HydrophobicContact CB-CB 4.32Å; C1232-K1239 HydrophobicContact CB-CG 4.49Å; P1236-K1239 WeakPolarHBondContact O-CB 3.34Å; P1236-K1239 PolarHBondContact O-N 3.07Å; K1239-G1241 PolarHBondContact O-N 2.92Å
1240	K	68.5	Low	61.1	Low	163 Å²	163	78.9 Å²	78.9	71%	0.709	45%	0.452	S	S	*	.			trans	-76.3	106.3	175.9	-169.1	178.7	-178.5	-174.7	0	108.8	V1150	V1150-K1240 HydrophobicContact CG1-CB 4.35Å
1241	G	52.8	Low	58.6	Low	44 Å²	44	84.7 Å²	84.7	45%	0.454	50%	0.495	S	S	.	.			trans	-67.4	131	-178.4	0	0	0	0	0	112.5	K1239	K1239-G1241 PolarHBondContact O-N 2.92Å
1242	V	44.1	Very low	57.3	Low	131 Å²	131	88.9 Å²	88.9	79%	0.794	52%	0.52	S	S	*	.	S	Bend	trans	-101	91.9	160.3	179.9	0	0	0	0	104.9
1243	F	37.9	Very low	55.9	Low	168 Å²	168	92.5 Å²	92.5	74%	0.737	54%	0.54	S	S	*	.			trans	55.6	97	-170.5	-61.6	-83.5	0	0	0	115.2	S1245	F1243-S1245 PolarHBondContact O-N 3.4Å
1244	E	35.3	Very low	54.5	Low	82 Å²	82	90.9 Å²	90.9	38%	0.383	54%	0.539	S	S	.	.			trans	-73.5	89.9	166.4	-78.6	179.3	-150.7	0	0	109.8	R1152 R1156 S1246	R1152-E1244 IonicContact CZ-OE1 2.72Å; R1152-E1244 IonicContact NH1-OE1 3.69Å; R1152-E1244 PolarHBondContact NH1-OE1 3.35Å; R1152-E1244 IonicContact NH2-OE1 3.58Å; R1152-E1244 PolarHBondContact NH2-OE1 3Å; R1156-E1244 IonicContact CZ-OE2 2.68Å; R1156-E1244 IonicContact NE-OE2 3.07Å; R1156-E1244 IonicContact NH2-OE2 3.92Å; R1156-E1244 PolarHBondContact NH2-OE2 2.94Å; E1244-S1246 VanDerWaalsContact C-N 3.3Å; E1244-S1246 PolarHBondContact O-N 3.48Å
1245	S	33.2	Very low	52.8	Low	126 Å²	126	94.9 Å²	94.9	88%	0.881	56%	0.564	S	S	*	*			trans	-68.2	82.5	173.3	57.1	0	0	0	0	111.7	F1243	F1243-S1245 PolarHBondContact O-N 3.4Å
1246	S	32.3	Very low	50.8	Low	68 Å²	68	100.2 Å²	100.2	48%	0.476	60%	0.595	S	S	.	*	S	Bend	trans	-144.9	157.8	165.7	63.5	0	0	0	0	108.9	E1244 H1248 G1249	E1244-S1246 VanDerWaalsContact C-N 3.3Å; E1244-S1246 PolarHBondContact O-N 3.48Å; S1246-H1248 PolarHBondContact O-N 2.96Å; S1246-G1249 PolarHBondContact O-N 2.68Å
1247	S	32.1	Very low	48.7	Very low	115 Å²	115	100.3 Å²	100.3	80%	0.804	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	7.7	-162.8	54.3	0	0	0	0	118.1
1248	H	41.3	Very low	45.8	Very low	142 Å²	142	106.6 Å²	106.6	66%	0.657	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.8	23.8	-176.4	-65.3	75.5	0	0	0	112.8	S1246	S1246-H1248 PolarHBondContact O-N 2.96Å
1249	G	29.7	Very low	42.6	Very low	57 Å²	57	114.8 Å²	114.8	59%	0.588	68%	0.68	S	S	*	*			trans	-95.9	107.6	176.2	0	0	0	0	0	112.7	S1246	S1246-G1249 PolarHBondContact O-N 2.68Å
1250	T	32.1	Very low	39.1	Very low	116 Å²	116	114.3 Å²	114.3	71%	0.712	69%	0.692	S	S	*	*			trans	-85.7	132.5	168.2	48.4	0	0	0	0	110.9
1251	S	30.1	Very low	36.4	Very low	159 Å²	159	109.8 Å²	109.8	100%	1.112	69%	0.691	S	S	*	*			trans	-88.2	0	155.8	-57	0	0	0	0	109.6

Retrieved 1,251 of 1,251 residues in 465.9 ms (Link to these results)

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