A0A087X8Z3_POEFO Loading...

glycogenin glucosyltransferase

Glycogenin participates in the glycogen biosynthetic process along with glycogen synthase and glycogen branching enzyme. It catalyzes the formation of a short alpha (1,4)-glucosyl chain covalently attached via a glucose 1-O-tyrosyl linkage to internal tyrosine residues and these chains act as primers for the elongation reaction catalyzed by glycogen synthase. Self-glucosylating initiator of glycogen synthesis. It catalyzes the formation of a short alpha (1,4)-glucosyl chain covalently attached via a glucose 1-O-tyrosyl linkage to internal tyrosine residues and these chains act as primers for the elongation reaction catalyzed by glycogen synthase.

AlphaFold DB , UniProt , Accession A0A087X8Z3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 399 aa.

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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	47.1	Very low	85	Confident	202 Å²	202	36.4 Å²	36.4	100%	0.995	22%	0.224	S	C	*	.				0	121	0	-61.4	-176.1	-136.4	0	0	107.2	A3	M1-A3 PolarHBondContact O-N 3.41Å; M1-A3 VanDerWaalsContact O-N 3.16Å
2	S	49.6	Very low	85.6	Confident	45 Å²	45	35.7 Å²	35.7	32%	0.315	22%	0.22	S	C	.	.			trans	-66	107.6	169.5	-179.4	0	0	0	0	106.7	G4 E5	S2-G4 PolarHBondContact O-N 3.48Å; S2-E5 PolarHBondContact O-N 3.29Å; S2-E5 PolarHBondContact OG-OE2 3.38Å
3	A	61.6	Low	86.1	Confident	99 Å²	99	35.5 Å²	35.5	82%	0.818	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	104.3	-176.7	0	0	0	0	0	108.6	M1	M1-A3 PolarHBondContact O-N 3.41Å; M1-A3 VanDerWaalsContact O-N 3.16Å
4	G	90.3	Very high	86.7	Confident	14 Å²	14	37.4 Å²	37.4	14%	0.144	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	121.4	4.1	175.4	0	0	0	0	0	116.2	S2 Y96 N97	S2-G4 PolarHBondContact O-N 3.48Å; G4-Y96 CarbonylContact O-C 3.45Å; G4-Y96 VanDerWaalsContact O-CA 3.28Å; G4-Y96 WeakPolarHBondContact O-CA 3.24Å; G4-Y96 WeakPolarHBondContact O-CB 3.41Å; G4-N97 VanDerWaalsContact O-CG 3.29Å; G4-N97 PolarHBondContact O-N 3.05Å; G4-N97 PolarHBondContact O-OD1 2.83Å
5	E	98.1	Very high	87.1	Confident	24 Å²	24	38.1 Å²	38.1	11%	0.112	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	135.7	177.5	-72.1	177	150.1	0	0	112.1	S2 R34 C35 K98 F116	S2-E5 PolarHBondContact O-N 3.29Å; S2-E5 PolarHBondContact OG-OE2 3.38Å; E5-R34 HydrophobicContact CB-CG 4.41Å; E5-R34 IonicContact OE2-CZ 3.09Å; E5-R34 IonicContact OE2-NE 2.7Å; E5-R34 PolarHBondContact OE2-NE 2.98Å; E5-R34 IonicContact OE2-NH2 2.79Å; E5-R34 PolarHBondContact OE2-NH2 3.39Å; E5-C35 PolarHBondContact O-N 2.99Å; E5-K98 WeakPolarHBondContact CA-O 3.43Å; E5-K98 HydrophobicContact CG-CB 4.38Å; E5-F116 HydrophobicContact CB-CD1 3.72Å; E5-F116 HydrophobicContact CB-CE1 3.71Å; E5-F116 HydrophobicContact CB-CG 4.49Å; E5-F116 HydrophobicContact CB-CZ 4.48Å; E5-F116 HydrophobicContact CG-CD1 3.77Å; E5-F116 HydrophobicContact CG-CE1 4.24Å
6	A	98.6	Very high	87.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	147.4	-178.9	0	0	0	0	0	114.8	V8 C35 V37 Y96 K98 C99 V100 F116	A6-V8 HydrophobicContact CB-CG2 4.44Å; A6-C35 CarbonylContact C-O 3.44Å; A6-C35 WeakPolarHBondContact CA-O 3.28Å; A6-C35 HydrophobicContact CB-CB 4.07Å; A6-V37 HydrophobicContact CB-CG2 3.89Å; A6-Y96 HydrophobicContact CB-CD1 3.62Å; A6-Y96 HydrophobicContact CB-CD2 4.14Å; A6-Y96 HydrophobicContact CB-CE1 3.58Å; A6-Y96 HydrophobicContact CB-CE2 4.12Å; A6-Y96 HydrophobicContact CB-CG 3.91Å; A6-K98 PolarHBondContact N-O 2.88Å; A6-C99 CarbonylContact O-C 3.14Å; A6-C99 WeakPolarHBondContact O-CA 3.46Å; A6-V100 PolarHBondContact O-N 2.96Å; A6-F116 WeakPolarHBondContact O-CE1 3.36Å; A6-F116 WeakPolarHBondContact O-CZ 3.43Å
7	F	98.9	Very high	88.2	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	135.4	156.5	-73.1	-79.2	0	0	0	109.1	L27 T32 R34 C35 V37 V100 L102 V112 F116	F7-L27 HydrophobicContact CB-CD1 3.69Å; F7-L27 HydrophobicContact CD1-CD1 4.24Å; F7-L27 HydrophobicContact CD1-CD2 4.12Å; F7-L27 HydrophobicContact CD2-CD1 3.99Å; F7-L27 HydrophobicContact CD2-CD2 3.87Å; F7-L27 HydrophobicContact CE1-CD2 4.04Å; F7-L27 HydrophobicContact CE2-CD2 3.79Å; F7-L27 HydrophobicContact CG-CD1 3.71Å; F7-L27 HydrophobicContact CG-CD2 4.04Å; F7-L27 HydrophobicContact CZ-CD2 3.88Å; F7-T32 VanDerWaalsContact CE2-OG1 3.31Å; F7-T32 WeakPolarHBondContact CE2-OG1 3.43Å; F7-R34 HydrophobicContact CD2-CB 4.13Å; F7-R34 HydrophobicContact CE2-CB 4.26Å; F7-R34 HydrophobicContact CE2-CG 4.41Å; F7-C35 PolarHBondContact N-O 3.42Å; F7-V37 PolarHBondContact O-N 3.19Å; F7-V100 CarbonylContact C-O 3.53Å; F7-V100 WeakPolarHBondContact CA-O 3.43Å; F7-V100 HydrophobicContact CD1-CB 3.62Å; F7-V100 HydrophobicContact CD1-CG1 3.91Å; F7-V100 HydrophobicContact CD1-CG2 4.44Å; F7-V100 HydrophobicContact CE1-CB 3.67Å; F7-V100 HydrophobicContact CE1-CG1 3.78Å; F7-V100 HydrophobicContact CE1-CG2 4.09Å; F7-L102 HydrophobicContact CB-CD1 4.45Å; F7-L102 HydrophobicContact CD1-CD1 3.53Å; F7-L102 HydrophobicContact CD1-CG 4.18Å; F7-L102 HydrophobicContact CE1-CD1 4.15Å; F7-L102 HydrophobicContact CG-CD1 4.28Å; F7-V112 HydrophobicContact CE1-CG2 4.02Å; F7-V112 HydrophobicContact CZ-CG2 3.82Å; F7-F116 HydrophobicContact CD1-CZ 4.49Å; F7-F116 HydrophobicContact CD2-CE2 4.08Å; F7-F116 HydrophobicContact CD2-CZ 4.13Å; F7-F116 HydrophobicContact CE1-CE2 4.04Å; F7-F116 HydrophobicContact CE1-CZ 4.4Å; F7-F116 AromaticContact CE2-CE2 3.51Å; F7-F116 HydrophobicContact CE2-CE2 3.51Å; F7-F116 HydrophobicContact CE2-CZ 4.03Å; F7-F116 HydrophobicContact CG-CZ 4.36Å; F7-F116 HydrophobicContact CZ-CD2 4.46Å; F7-F116 AromaticContact CZ-CE2 3.49Å; F7-F116 HydrophobicContact CZ-CE2 3.49Å; F7-F116 VanDerWaalsContact CZ-CE2 3.49Å; F7-F116 HydrophobicContact CZ-CZ 4.18Å
8	V	98.8	Very high	88.6	Confident	1 Å²	1	39 Å²	39	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.8	-177.7	-176.2	0	0	0	0	109.2	A6 V37 M39 C90 L93 C99 V100 F101 L102 F140	A6-V8 HydrophobicContact CB-CG2 4.44Å; V8-V37 WeakPolarHBondContact CA-O 3.29Å; V8-V37 HydrophobicContact CG2-CB 4.39Å; V8-M39 HydrophobicContact CG1-CE 4.33Å; V8-M39 HydrophobicContact CG1-CG 4.29Å; V8-M39 HydrophobicContact CG1-SD 4.45Å; V8-C90 HydrophobicContact CG1-CB 4.15Å; V8-L93 HydrophobicContact CG1-CD1 3.82Å; V8-L93 HydrophobicContact CG2-CD1 3.88Å; V8-C99 HydrophobicContact CG2-CB 3.89Å; V8-V100 PolarHBondContact N-O 3.14Å; V8-F101 HydrophobicContact CB-CD2 4.31Å; V8-F101 HydrophobicContact CG1-CD2 4.16Å; V8-F101 HydrophobicContact CG1-CE2 4.24Å; V8-F101 CarbonylContact O-C 3.01Å; V8-F101 WeakPolarHBondContact O-CA 3.16Å; V8-L102 PolarHBondContact O-N 3.25Å; V8-F140 HydrophobicContact CG2-CZ 4.5Å
9	T	98.6	Very high	89	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	165.3	171.1	-175.9	0	0	0	0	110.4	A20 V37 V38 M39 F56 L102	T9-A20 HydrophobicContact CG2-CB 4.07Å; T9-V37 PolarHBondContact N-O 2.78Å; T9-V38 HydrophobicContact CG2-CB 3.92Å; T9-V38 HydrophobicContact CG2-CG2 3.91Å; T9-V38 WeakPolarHBondContact O-CA 3.21Å; T9-M39 PolarHBondContact O-N 2.98Å; T9-F56 HydrophobicContact CG2-CE1 3.57Å; T9-F56 HydrophobicContact CG2-CZ 3.66Å; T9-L102 VanDerWaalsContact CA-O 3.3Å; T9-L102 WeakPolarHBondContact CA-O 3.35Å; T9-L102 VanDerWaalsContact CB-O 3.27Å; T9-L102 WeakPolarHBondContact CB-O 3.32Å; T9-L102 PolarHBondContact OG1-O 2.77Å; T9-L102 VanDerWaalsContact OG1-O 3.09Å
10	L	97.7	Very high	89.5	Confident	13 Å²	13	35.1 Å²	35.1	7%	0.068	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136	177.6	172.9	64.6	0	0	0	110.9	T12 M39 T86 K87 F101 A104	L10-T12 HydrophobicContact CD1-CG2 3.99Å; L10-T12 HydrophobicContact CD2-CG2 3.9Å; L10-T12 HydrophobicContact CG-CG2 3.88Å; L10-M39 WeakPolarHBondContact CA-O 3.26Å; L10-M39 HydrophobicContact CB-CE 4.35Å; L10-M39 HydrophobicContact CD1-CB 3.87Å; L10-M39 HydrophobicContact CD1-CE 4.41Å; L10-M39 WeakPolarHBondContact CD1-O 3.49Å; L10-T86 HydrophobicContact CD1-CG2 3.62Å; L10-T86 HydrophobicContact CD2-CG2 4.26Å; L10-K87 HydrophobicContact CD2-CB 3.83Å; L10-F101 HydrophobicContact CB-CZ 3.95Å; L10-A104 WeakPolarHBondContact O-CB 3.41Å
11	A	96.1	Very high	89.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.1	167.7	0	0	0	0	0	110.9	A20 V38 M39 V40 T41	A11-A20 HydrophobicContact CB-CB 4.29Å; A11-V38 HydrophobicContact CB-CG2 4.32Å; A11-M39 PolarHBondContact N-O 2.85Å; A11-V40 HydrophobicContact CB-CG1 4.44Å; A11-V40 WeakPolarHBondContact O-CA 3.4Å; A11-T41 PolarHBondContact O-N 3.48Å
12	T	91.8	Very high	92.3	Very high	28 Å²	28	24.6 Å²	24.6	17%	0.172	15%	0.153	C	C	.	.	S	Bend	trans	-103	-7.3	-178.4	56.1	0	0	0	0	113.9	L10 T41 N43 V83	L10-T12 HydrophobicContact CD1-CG2 3.99Å; L10-T12 HydrophobicContact CD2-CG2 3.9Å; L10-T12 HydrophobicContact CG-CG2 3.88Å; T12-T41 WeakPolarHBondContact CA-OG1 3.36Å; T12-T41 HydrophobicContact CG2-CG2 3.99Å; T12-T41 PolarHBondContact O-OG1 2.99Å; T12-N43 PolarHBondContact O-ND2 3.26Å; T12-N43 VanDerWaalsContact O-ND2 3.16Å; T12-V83 HydrophobicContact CG2-CG1 4.22Å; T12-V83 HydrophobicContact CG2-CG2 4.44Å
13	S	92.7	Very high	94.6	Very high	34 Å²	34	22.5 Å²	22.5	24%	0.238	14%	0.138	C	C	.	.	S	Bend	trans	-145.8	165	173	75.4	0	0	0	0	111.4	S15 Y16 C17 I44	S13-S15 PolarHBondContact O-N 3.14Å; S13-S15 PolarHBondContact OG-N 2.96Å; S13-S15 PolarHBondContact OG-OG 3.47Å; S13-Y16 PolarHBondContact O-N 3.16Å; S13-Y16 VanDerWaalsContact O-N 3.11Å; S13-Y16 WeakPolarHBondContact OG-CD2 3.31Å; S13-Y16 PolarHBondContact OG-N 2.72Å; S13-C17 PolarHBondContact O-N 2.79Å; S13-C17 VanDerWaalsContact O-N 3.1Å; S13-C17 PolarHBondContact O-SG 3.37Å; S13-I44 WeakPolarHBondContact O-CD1 3.29Å
14	D	93.4	Very high	96.4	Very high	62 Å²	62	17.8 Å²	17.8	33%	0.332	10%	0.1	S	C	.	.	H	α-helix	trans	-60.1	-29.7	175.5	-77.1	6.8	0	0	0	112.8	C17 S45 S48	D14-C17 WeakPolarHBondContact O-CB 3.41Å; D14-C17 PolarHBondContact O-N 2.92Å; D14-S45 VanDerWaalsContact CG-OG 3.3Å; D14-S45 PolarHBondContact OD1-N 2.83Å; D14-S45 PolarHBondContact OD1-OG 3.03Å; D14-S45 WeakPolarHBondContact OD2-CB 3.49Å; D14-S45 PolarHBondContact OD2-OG 3.48Å; D14-S48 VanDerWaalsContact CG-OG 3.25Å; D14-S48 PolarHBondContact OD1-OG 3.47Å; D14-S48 PolarHBondContact OD2-OG 3.45Å
15	S	93.3	Very high	96.7	Very high	47 Å²	47	19.7 Å²	19.7	33%	0.329	10%	0.102	S	C	.	.	H	α-helix	trans	-68.8	-41.2	174.7	57.3	0	0	0	0	111.9	S13 C17 Q18	S13-S15 PolarHBondContact O-N 3.14Å; S13-S15 PolarHBondContact OG-N 2.96Å; S13-S15 PolarHBondContact OG-OG 3.47Å; S15-C17 PolarHBondContact O-N 3.25Å; S15-Q18 WeakPolarHBondContact O-CB 3.35Å; S15-Q18 PolarHBondContact O-N 3.22Å; S15-Q18 VanDerWaalsContact O-N 3.13Å
16	Y	95.4	Very high	96.7	Very high	74 Å²	74	18.6 Å²	18.6	29%	0.29	10%	0.097	S	C	.	.	H	α-helix	trans	-69.1	-20	174.1	-82.7	-96.4	0	0	0	113.1	S13 Q18 G19 A20 A104 K219 W221	S13-Y16 PolarHBondContact O-N 3.16Å; S13-Y16 VanDerWaalsContact O-N 3.11Å; S13-Y16 WeakPolarHBondContact OG-CD2 3.31Å; S13-Y16 PolarHBondContact OG-N 2.72Å; Y16-Q18 PolarHBondContact O-N 3.13Å; Y16-G19 PolarHBondContact O-N 3.02Å; Y16-A20 PolarHBondContact O-N 2.99Å; Y16-A104 HydrophobicContact CD1-CB 4.06Å; Y16-K219 WeakPolarHBondContact OH-CE 3.35Å; Y16-W221 HydrophobicContact CD1-CH2 4.12Å; Y16-W221 AromaticContact CD1-CZ2 3.81Å; Y16-W221 HydrophobicContact CD1-CZ2 3.81Å; Y16-W221 HydrophobicContact CD2-CZ2 4.21Å; Y16-W221 HydrophobicContact CE1-CH2 4.29Å; Y16-W221 AromaticContact CE1-CZ2 3.93Å; Y16-W221 HydrophobicContact CE1-CZ2 3.93Å; Y16-W221 HydrophobicContact CE2-CZ2 4.34Å; Y16-W221 AromaticContact CG-CZ2 3.96Å; Y16-W221 HydrophobicContact CG-CZ2 3.96Å
17	C	96.8	Very high	96.7	Very high	6 Å²	6	18.7 Å²	18.7	4%	0.041	10%	0.098	C	C	.	.	H	α-helix	trans	-63.1	-28.6	170.7	-62.8	0	0	0	0	112.2	S13 D14 S15 T21 L52	S13-C17 PolarHBondContact O-N 2.79Å; S13-C17 VanDerWaalsContact O-N 3.1Å; S13-C17 PolarHBondContact O-SG 3.37Å; D14-C17 WeakPolarHBondContact O-CB 3.41Å; D14-C17 PolarHBondContact O-N 2.92Å; S15-C17 PolarHBondContact O-N 3.25Å; C17-T21 WeakPolarHBondContact O-CB 3.01Å; C17-T21 PolarHBondContact O-N 3.13Å; C17-T21 PolarHBondContact O-OG1 3.22Å; C17-L52 HydrophobicContact CB-CD1 4.32Å; C17-L52 HydrophobicContact CB-CD2 4.32Å; C17-L52 HydrophobicContact CB-CG 4.47Å
18	Q	96	Very high	96.7	Very high	51 Å²	51	23.1 Å²	23.1	24%	0.238	11%	0.114	C	C	.	.	H	α-helix	trans	-66.7	-47.5	174.2	-56.6	-178.1	43.1	0	0	110.8	S15 Y16 T21 V22 W221 W240 Y244	S15-Q18 WeakPolarHBondContact O-CB 3.35Å; S15-Q18 PolarHBondContact O-N 3.22Å; S15-Q18 VanDerWaalsContact O-N 3.13Å; Y16-Q18 PolarHBondContact O-N 3.13Å; Q18-T21 WeakPolarHBondContact O-CB 3.42Å; Q18-T21 PolarHBondContact O-N 3.48Å; Q18-V22 PolarHBondContact O-N 2.7Å; Q18-V22 VanDerWaalsContact O-N 3.14Å; Q18-W221 HydrophobicContact CB-CB 4.48Å; Q18-W240 HydrophobicContact CB-CH2 4.22Å; Q18-Y244 HydrophobicContact CB-CD2 4.28Å; Q18-Y244 HydrophobicContact CB-CE2 3.65Å; Q18-Y244 HydrophobicContact CG-CE2 3.96Å
19	G	97.1	Very high	96.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-56.2	-52.8	173	0	0	0	0	0	112.9	Y16 T21 V22 V23 A104 W221	Y16-G19 PolarHBondContact O-N 3.02Å; G19-T21 VanDerWaalsContact C-N 3.25Å; G19-T21 PolarHBondContact O-N 2.74Å; G19-V22 WeakPolarHBondContact O-CA 3.27Å; G19-V22 WeakPolarHBondContact O-CB 3.36Å; G19-V22 PolarHBondContact O-N 3.25Å; G19-V23 PolarHBondContact O-N 3.22Å; G19-A104 CarbonylContact C-O 3.45Å; G19-A104 WeakPolarHBondContact CA-O 3.4Å; G19-W221 VanDerWaalsContact CA-CZ3 3.44Å
20	A	98.2	Very high	96.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-56.7	-40.4	177.5	0	0	0	0	0	111.9	T9 A11 Y16 V22 V23 A24 V38 L52 F56 A104	T9-A20 HydrophobicContact CG2-CB 4.07Å; A11-A20 HydrophobicContact CB-CB 4.29Å; Y16-A20 PolarHBondContact O-N 2.99Å; A20-V22 VanDerWaalsContact C-N 3.31Å; A20-V22 PolarHBondContact O-N 3.04Å; A20-V23 WeakPolarHBondContact O-CB 3.19Å; A20-V23 PolarHBondContact O-N 3.25Å; A20-A24 PolarHBondContact O-N 3.32Å; A20-V38 HydrophobicContact CB-CG2 4.28Å; A20-L52 HydrophobicContact CB-CD2 4.2Å; A20-F56 HydrophobicContact CB-CE2 4.24Å; A20-F56 HydrophobicContact CB-CZ 3.95Å; A20-F56 WeakPolarHBondContact O-CZ 3.43Å; A20-A104 HydrophobicContact CB-CB 4.24Å
21	T	97.7	Very high	96.5	Very high	16 Å²	16	32 Å²	32	10%	0.098	16%	0.162	C	C	.	.	H	α-helix	trans	-59.8	-40.8	175.3	-61.3	0	0	0	0	111.9	C17 Q18 G19 A24 R25 V55	C17-T21 WeakPolarHBondContact O-CB 3.01Å; C17-T21 PolarHBondContact O-N 3.13Å; C17-T21 PolarHBondContact O-OG1 3.22Å; Q18-T21 WeakPolarHBondContact O-CB 3.42Å; Q18-T21 PolarHBondContact O-N 3.48Å; G19-T21 VanDerWaalsContact C-N 3.25Å; G19-T21 PolarHBondContact O-N 2.74Å; T21-A24 PolarHBondContact O-N 2.78Å; T21-R25 HydrophobicContact CG2-CG 4.48Å; T21-R25 WeakPolarHBondContact O-CB 3.5Å; T21-R25 WeakPolarHBondContact O-CG 3.19Å; T21-R25 PolarHBondContact O-N 2.58Å; T21-V55 HydrophobicContact CG2-CG2 4.38Å
22	V	98	Very high	96.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.2	-41.7	175.7	173.6	0	0	0	0	111.7	Q18 G19 A20 A24 R25 S26 L107 W240 E243 Y244	Q18-V22 PolarHBondContact O-N 2.7Å; Q18-V22 VanDerWaalsContact O-N 3.14Å; G19-V22 WeakPolarHBondContact O-CA 3.27Å; G19-V22 WeakPolarHBondContact O-CB 3.36Å; G19-V22 PolarHBondContact O-N 3.25Å; A20-V22 VanDerWaalsContact C-N 3.31Å; A20-V22 PolarHBondContact O-N 3.04Å; V22-A24 PolarHBondContact O-N 2.87Å; V22-R25 PolarHBondContact O-N 2.93Å; V22-S26 VanDerWaalsContact O-CB 3.27Å; V22-S26 WeakPolarHBondContact O-CB 3.36Å; V22-S26 PolarHBondContact O-N 3.17Å; V22-S26 PolarHBondContact O-OG 3.31Å; V22-L107 HydrophobicContact CG1-CD1 3.64Å; V22-W240 HydrophobicContact CB-CZ2 4.27Å; V22-W240 HydrophobicContact CG1-CG 4.3Å; V22-W240 HydrophobicContact CG2-CD2 4.12Å; V22-W240 HydrophobicContact CG2-CH2 4.19Å; V22-W240 HydrophobicContact CG2-CZ2 3.56Å; V22-E243 HydrophobicContact CG1-CB 4.16Å; V22-E243 HydrophobicContact CG1-CG 4.21Å; V22-Y244 HydrophobicContact CG2-CD2 3.9Å; V22-Y244 HydrophobicContact CG2-CG 4.24Å
23	V	98.5	Very high	96.8	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-56.3	-52	174.5	171.6	0	0	0	0	110.6	G19 A20 R25 S26 L27 L102 T106 I108	G19-V23 PolarHBondContact O-N 3.22Å; A20-V23 WeakPolarHBondContact O-CB 3.19Å; A20-V23 PolarHBondContact O-N 3.25Å; V23-R25 PolarHBondContact O-N 3.03Å; V23-S26 PolarHBondContact O-N 3.12Å; V23-S26 PolarHBondContact O-OG 2.94Å; V23-L27 HydrophobicContact CG1-CD1 3.98Å; V23-L27 WeakPolarHBondContact O-CB 3.5Å; V23-L27 WeakPolarHBondContact O-CG 3.46Å; V23-L27 PolarHBondContact O-N 2.63Å; V23-L102 HydrophobicContact CG1-CB 4.28Å; V23-L102 HydrophobicContact CG1-CD1 3.94Å; V23-T106 WeakPolarHBondContact CG2-O 3.39Å; V23-T106 WeakPolarHBondContact CG2-OG1 3.46Å; V23-I108 HydrophobicContact CB-CD1 4.37Å; V23-I108 HydrophobicContact CG1-CD1 3.99Å; V23-I108 HydrophobicContact CG2-CD1 4.43Å
24	A	98.3	Very high	97	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.2	-44.9	-179.5	0	0	0	0	0	112.9	A20 T21 V22 L27 R28 I36 V55 F56	A20-A24 PolarHBondContact O-N 3.32Å; T21-A24 PolarHBondContact O-N 2.78Å; V22-A24 PolarHBondContact O-N 2.87Å; A24-L27 PolarHBondContact O-N 3.15Å; A24-R28 WeakPolarHBondContact O-CG 3.24Å; A24-R28 PolarHBondContact O-N 3.11Å; A24-I36 HydrophobicContact CB-CG2 4.08Å; A24-V55 HydrophobicContact CB-CB 4.43Å; A24-V55 HydrophobicContact CB-CG2 4.37Å; A24-F56 HydrophobicContact CB-CD1 4.21Å; A24-F56 HydrophobicContact CB-CD2 4.26Å; A24-F56 HydrophobicContact CB-CE1 3.78Å; A24-F56 HydrophobicContact CB-CE2 3.81Å; A24-F56 HydrophobicContact CB-CG 4.44Å; A24-F56 HydrophobicContact CB-CZ 3.57Å
25	R	97.7	Very high	97.3	Very high	53 Å²	53	34.3 Å²	34.3	20%	0.2	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-45.6	179.9	-74.9	-178.1	179.5	165.5	1.9	112.2	T21 V22 V23 L27 R28 R29 E243 Y244 S246	T21-R25 HydrophobicContact CG2-CG 4.48Å; T21-R25 WeakPolarHBondContact O-CB 3.5Å; T21-R25 WeakPolarHBondContact O-CG 3.19Å; T21-R25 PolarHBondContact O-N 2.58Å; V22-R25 PolarHBondContact O-N 2.93Å; V23-R25 PolarHBondContact O-N 3.03Å; R25-L27 VanDerWaalsContact C-N 3.34Å; R25-L27 PolarHBondContact O-N 3.02Å; R25-R28 PolarHBondContact O-N 3.42Å; R25-R29 VanDerWaalsContact O-CB 3.27Å; R25-R29 WeakPolarHBondContact O-CB 3.38Å; R25-R29 PolarHBondContact O-N 2.8Å; R25-E243 HydrophobicContact CB-CG 4.22Å; R25-Y244 PolarHBondContact NH1-O 3.49Å; R25-S246 VanDerWaalsContact CZ-O 3.24Å; R25-S246 PolarHBondContact NH1-O 3.34Å
26	S	98.3	Very high	97.5	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.007	16%	0.157	C	C	.	.	H	α-helix	trans	-63.7	-38.6	178.5	58.3	0	0	0	0	112.2	V22 V23 H30 I108 E243	V22-S26 VanDerWaalsContact O-CB 3.27Å; V22-S26 WeakPolarHBondContact O-CB 3.36Å; V22-S26 PolarHBondContact O-N 3.17Å; V22-S26 PolarHBondContact O-OG 3.31Å; V23-S26 PolarHBondContact O-N 3.12Å; V23-S26 PolarHBondContact O-OG 2.94Å; S26-H30 PolarHBondContact O-N 3.01Å; S26-H30 PolarHBondContact O-ND1 2.96Å; S26-I108 WeakPolarHBondContact CB-O 3.33Å; S26-I108 VanDerWaalsContact OG-CD1 3.29Å; S26-I108 WeakPolarHBondContact OG-CD1 3.36Å; S26-I108 PolarHBondContact OG-N 3.49Å; S26-E243 PolarHBondContact N-OE1 3.31Å
27	L	98.4	Very high	97.7	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-48.9	171.4	-77.5	170.1	0	0	0	112.4	F7 V23 A24 R25 R29 H30 G31 T32 I36 L102 I108 V112	F7-L27 HydrophobicContact CB-CD1 3.69Å; F7-L27 HydrophobicContact CD1-CD1 4.24Å; F7-L27 HydrophobicContact CD1-CD2 4.12Å; F7-L27 HydrophobicContact CD2-CD1 3.99Å; F7-L27 HydrophobicContact CD2-CD2 3.87Å; F7-L27 HydrophobicContact CE1-CD2 4.04Å; F7-L27 HydrophobicContact CE2-CD2 3.79Å; F7-L27 HydrophobicContact CG-CD1 3.71Å; F7-L27 HydrophobicContact CG-CD2 4.04Å; F7-L27 HydrophobicContact CZ-CD2 3.88Å; V23-L27 HydrophobicContact CG1-CD1 3.98Å; V23-L27 WeakPolarHBondContact O-CB 3.5Å; V23-L27 WeakPolarHBondContact O-CG 3.46Å; V23-L27 PolarHBondContact O-N 2.63Å; A24-L27 PolarHBondContact O-N 3.15Å; R25-L27 VanDerWaalsContact C-N 3.34Å; R25-L27 PolarHBondContact O-N 3.02Å; L27-R29 PolarHBondContact O-N 3.4Å; L27-H30 PolarHBondContact O-N 3.38Å; L27-G31 PolarHBondContact O-N 2.99Å; L27-T32 HydrophobicContact CB-CG2 3.92Å; L27-T32 PolarHBondContact O-N 2.86Å; L27-T32 VanDerWaalsContact O-N 3.17Å; L27-I36 HydrophobicContact CB-CD1 3.82Å; L27-I36 HydrophobicContact CD1-CD1 4.29Å; L27-I36 HydrophobicContact CD1-CG1 4.39Å; L27-I36 HydrophobicContact CD1-CG2 4.03Å; L27-L102 HydrophobicContact CD1-CD1 3.98Å; L27-L102 HydrophobicContact CD2-CD1 4.4Å; L27-I108 HydrophobicContact CD2-CD1 4.49Å; L27-I108 HydrophobicContact CD2-CG1 4.06Å; L27-I108 HydrophobicContact CD2-CG2 4.31Å; L27-I108 HydrophobicContact CG-CD1 4.12Å; L27-I108 HydrophobicContact CG-CG1 4.19Å; L27-V112 HydrophobicContact CD2-CG2 4.28Å
28	R	97.3	Very high	97.7	Very high	93 Å²	93	28.4 Å²	28.4	35%	0.351	14%	0.141	S	C	.	.	H	α-helix	trans	-62.8	-42	178.8	-75.5	-175.6	172.3	172.8	0.1	112	A24 R25 H30 G31 I36 V55 D57	A24-R28 WeakPolarHBondContact O-CG 3.24Å; A24-R28 PolarHBondContact O-N 3.11Å; R25-R28 PolarHBondContact O-N 3.42Å; R28-H30 VanDerWaalsContact C-N 3.27Å; R28-H30 PolarHBondContact O-N 3.46Å; R28-G31 PolarHBondContact O-N 2.66Å; R28-I36 HydrophobicContact CG-CD1 3.59Å; R28-V55 PolarHBondContact NE-O 2.75Å; R28-V55 PolarHBondContact NH1-O 3.2Å; R28-V55 PolarHBondContact NH2-O 3.36Å; R28-V55 VanDerWaalsContact NH2-O 3.15Å; R28-D57 IonicContact CZ-OD1 3.29Å; R28-D57 IonicContact NH2-OD1 3.8Å; R28-D57 PolarHBondContact NH2-OD1 2.86Å
29	R	96.9	Very high	97.8	Very high	122 Å²	122	26 Å²	26	46%	0.46	13%	0.13	S	C	.	.	H	α-helix	trans	-56.7	-41.8	177.1	179.2	-173.9	-177.6	111.9	15.4	111.9	R25 L27 G31 E243	R25-R29 VanDerWaalsContact O-CB 3.27Å; R25-R29 WeakPolarHBondContact O-CB 3.38Å; R25-R29 PolarHBondContact O-N 2.8Å; L27-R29 PolarHBondContact O-N 3.4Å; R29-G31 PolarHBondContact O-N 3.05Å; R29-E243 WeakPolarHBondContact CD-OE2 3.34Å; R29-E243 IonicContact CZ-OE2 2.87Å; R29-E243 IonicContact NE-OE2 3.8Å; R29-E243 IonicContact NH1-OE2 2.58Å; R29-E243 PolarHBondContact NH1-OE2 3.22Å
30	H	97.8	Very high	97.8	Very high	36 Å²	36	26 Å²	26	17%	0.167	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	14.8	178.7	-60.6	105	0	0	0	113.2	S26 L27 R28 T32 I108 L109 N111	S26-H30 PolarHBondContact O-N 3.01Å; S26-H30 PolarHBondContact O-ND1 2.96Å; L27-H30 PolarHBondContact O-N 3.38Å; R28-H30 VanDerWaalsContact C-N 3.27Å; R28-H30 PolarHBondContact O-N 3.46Å; H30-T32 PolarHBondContact O-N 2.77Å; H30-I108 PolarHBondContact CE1-O 2.73Å; H30-I108 PolarHBondContact ND1-O 3.17Å; H30-L109 VanDerWaalsContact CE1-C 3.48Å; H30-L109 PolarHBondContact NE2-O 3Å; H30-L109 VanDerWaalsContact NE2-O 3.11Å; H30-N111 HydrophobicContact CB-CB 4.5Å; H30-N111 WeakPolarHBondContact O-CB 3.27Å; H30-N111 PolarHBondContact O-ND2 2.86Å
31	G	97.2	Very high	97.5	Very high	43 Å²	43	26.6 Å²	26.6	44%	0.443	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	36.4	168.2	0	0	0	0	0	113.8	L27 R28 R29 N111	L27-G31 PolarHBondContact O-N 2.99Å; R28-G31 PolarHBondContact O-N 2.66Å; R29-G31 PolarHBondContact O-N 3.05Å; G31-N111 PolarHBondContact O-ND2 3.45Å
32	T	97.6	Very high	97.1	Very high	24 Å²	24	29 Å²	29	15%	0.147	15%	0.149	C	C	.	.			trans	-54.9	144	170.1	-173.3	0	0	0	0	110.6	F7 L27 H30 R34 I36 D113	F7-T32 VanDerWaalsContact CE2-OG1 3.31Å; F7-T32 WeakPolarHBondContact CE2-OG1 3.43Å; L27-T32 HydrophobicContact CB-CG2 3.92Å; L27-T32 PolarHBondContact O-N 2.86Å; L27-T32 VanDerWaalsContact O-N 3.17Å; H30-T32 PolarHBondContact O-N 2.77Å; T32-R34 PolarHBondContact OG1-N 2.75Å; T32-I36 HydrophobicContact CG2-CD1 3.92Å; T32-I36 HydrophobicContact CG2-CG1 4.19Å; T32-D113 WeakPolarHBondContact CB-OD1 3.31Å; T32-D113 PolarHBondContact OG1-OD1 2.99Å
33	T	96.6	Very high	96.6	Very high	71 Å²	71	34.4 Å²	34.4	44%	0.436	18%	0.178	S	C	.	.			trans	-106.5	4.6	179.2	57.1	0	0	0	0	112.9	D113	T33-D113 PolarHBondContact N-OD2 2.92Å; T33-D113 PolarHBondContact OG1-OD2 3.32Å
34	R	97.6	Very high	96.4	Very high	55 Å²	55	34.6 Å²	34.6	21%	0.208	18%	0.179	C	C	.	.	S	Bend	trans	-101.5	158.1	-177.1	-54.6	-44.5	-164.3	-113.4	6.5	111.1	E5 F7 T32 F116	E5-R34 HydrophobicContact CB-CG 4.41Å; E5-R34 IonicContact OE2-CZ 3.09Å; E5-R34 IonicContact OE2-NE 2.7Å; E5-R34 PolarHBondContact OE2-NE 2.98Å; E5-R34 IonicContact OE2-NH2 2.79Å; E5-R34 PolarHBondContact OE2-NH2 3.39Å; F7-R34 HydrophobicContact CD2-CB 4.13Å; F7-R34 HydrophobicContact CE2-CB 4.26Å; F7-R34 HydrophobicContact CE2-CG 4.41Å; T32-R34 PolarHBondContact OG1-N 2.75Å; R34-F116 HydrophobicContact CB-CE2 4.18Å; R34-F116 HydrophobicContact CB-CZ 4.12Å; R34-F116 HydrophobicContact CG-CD2 3.96Å; R34-F116 HydrophobicContact CG-CE2 3.52Å; R34-F116 HydrophobicContact CG-CZ 3.84Å
35	C	97.9	Very high	96.3	Very high	24 Å²	24	36.4 Å²	36.4	16%	0.162	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	147.4	174.3	-63.8	0	0	0	0	109.9	E5 A6 F7 D57 Y96	E5-C35 PolarHBondContact O-N 2.99Å; A6-C35 CarbonylContact C-O 3.44Å; A6-C35 WeakPolarHBondContact CA-O 3.28Å; A6-C35 HydrophobicContact CB-CB 4.07Å; F7-C35 PolarHBondContact N-O 3.42Å; C35-D57 WeakPolarHBondContact CA-OD2 3.5Å; C35-Y96 HydrophobicContact CB-CE1 4.08Å
36	I	98.5	Very high	96.2	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.5	175.3	-46	177	0	0	0	108	A24 L27 R28 T32 F56 D57 E58	A24-I36 HydrophobicContact CB-CG2 4.08Å; L27-I36 HydrophobicContact CB-CD1 3.82Å; L27-I36 HydrophobicContact CD1-CD1 4.29Å; L27-I36 HydrophobicContact CD1-CG1 4.39Å; L27-I36 HydrophobicContact CD1-CG2 4.03Å; R28-I36 HydrophobicContact CG-CD1 3.59Å; T32-I36 HydrophobicContact CG2-CD1 3.92Å; T32-I36 HydrophobicContact CG2-CG1 4.19Å; I36-F56 HydrophobicContact CB-CD1 4.26Å; I36-F56 HydrophobicContact CG2-CD1 3.6Å; I36-F56 HydrophobicContact CG2-CE1 3.6Å; I36-D57 PolarHBondContact N-OD2 3.48Å; I36-D57 PolarHBondContact O-N 2.74Å; I36-E58 PolarHBondContact O-N 3.07Å
37	V	98.6	Very high	96	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.5	-172.5	-176.5	0	0	0	0	109.6	A6 F7 V8 T9 E58 I60 L93 Y96	A6-V37 HydrophobicContact CB-CG2 3.89Å; F7-V37 PolarHBondContact O-N 3.19Å; V8-V37 WeakPolarHBondContact CA-O 3.29Å; V8-V37 HydrophobicContact CG2-CB 4.39Å; T9-V37 PolarHBondContact N-O 2.78Å; V37-E58 WeakPolarHBondContact CA-O 3.15Å; V37-E58 HydrophobicContact CG1-CB 4.25Å; V37-E58 HydrophobicContact CG2-CB 4.25Å; V37-I60 HydrophobicContact CG1-CD1 3.64Å; V37-I60 HydrophobicContact CG1-CG1 4.09Å; V37-L93 HydrophobicContact CG1-CD1 4.41Å; V37-Y96 HydrophobicContact CG2-CE2 3.83Å; V37-Y96 VanDerWaalsContact CG2-OH 3.26Å; V37-Y96 WeakPolarHBondContact CG2-OH 3.19Å
38	V	98.6	Very high	95.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.7	168.7	59.7	0	0	0	0	110.4	T9 A11 A20 V40 L52 F56 E58 V59 I60	T9-V38 HydrophobicContact CG2-CB 3.92Å; T9-V38 HydrophobicContact CG2-CG2 3.91Å; T9-V38 WeakPolarHBondContact O-CA 3.21Å; A11-V38 HydrophobicContact CB-CG2 4.32Å; A20-V38 HydrophobicContact CB-CG2 4.28Å; V38-V40 HydrophobicContact CG1-CG1 4.42Å; V38-V40 HydrophobicContact CG2-CG1 3.89Å; V38-L52 HydrophobicContact CG1-CB 4.28Å; V38-L52 HydrophobicContact CG1-CD1 4.31Å; V38-L52 HydrophobicContact CG2-CD1 4.44Å; V38-F56 HydrophobicContact CB-CD1 3.68Å; V38-F56 HydrophobicContact CB-CD2 4.05Å; V38-F56 HydrophobicContact CB-CE1 3.57Å; V38-F56 HydrophobicContact CB-CE2 3.99Å; V38-F56 HydrophobicContact CB-CG 3.92Å; V38-F56 HydrophobicContact CB-CZ 3.72Å; V38-F56 HydrophobicContact CG1-CB 4.04Å; V38-F56 HydrophobicContact CG1-CD1 3.77Å; V38-F56 HydrophobicContact CG1-CD2 3.53Å; V38-F56 HydrophobicContact CG1-CE1 4.1Å; V38-F56 HydrophobicContact CG1-CE2 3.91Å; V38-F56 HydrophobicContact CG1-CG 3.47Å; V38-F56 VanDerWaalsContact CG1-CG 3.47Å; V38-F56 HydrophobicContact CG1-CZ 4.15Å; V38-F56 HydrophobicContact CG2-CZ 4.31Å; V38-E58 PolarHBondContact N-O 3.41Å; V38-V59 HydrophobicContact CG1-CB 4.17Å; V38-V59 HydrophobicContact CG1-CG1 4.09Å; V38-V59 HydrophobicContact CG1-CG2 3.75Å; V38-I60 PolarHBondContact O-N 3.02Å
39	M	98	Very high	95.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	135.8	164.4	-61.4	-171.9	-53.9	0	0	109	V8 T9 L10 A11 I60 V62 H89 C90 L93 F101	V8-M39 HydrophobicContact CG1-CE 4.33Å; V8-M39 HydrophobicContact CG1-CG 4.29Å; V8-M39 HydrophobicContact CG1-SD 4.45Å; T9-M39 PolarHBondContact O-N 2.98Å; L10-M39 WeakPolarHBondContact CA-O 3.26Å; L10-M39 HydrophobicContact CB-CE 4.35Å; L10-M39 HydrophobicContact CD1-CB 3.87Å; L10-M39 HydrophobicContact CD1-CE 4.41Å; L10-M39 WeakPolarHBondContact CD1-O 3.49Å; A11-M39 PolarHBondContact N-O 2.85Å; M39-I60 CarbonylContact C-O 3.5Å; M39-I60 VanDerWaalsContact CA-O 3.31Å; M39-I60 WeakPolarHBondContact CA-O 3.35Å; M39-V62 HydrophobicContact CB-CG2 3.97Å; M39-V62 HydrophobicContact CG-CG2 4.14Å; M39-V62 HydrophobicContact SD-CG2 4.03Å; M39-H89 HydrophobicContact SD-CB 4.26Å; M39-C90 HydrophobicContact CE-CB 3.7Å; M39-C90 HydrophobicContact SD-CB 4.03Å; M39-C90 PolarHBondContact SD-N 2.86Å; M39-L93 HydrophobicContact CG-CD1 4.49Å; M39-L93 HydrophobicContact SD-CD1 4.25Å; M39-F101 HydrophobicContact CE-CE2 3.97Å
40	V	96	Very high	95.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.1	179.1	-63.7	0	0	0	0	111.1	A11 V38 I44 R49 L52 V59 I60 T61 V62	A11-V40 HydrophobicContact CB-CG1 4.44Å; A11-V40 WeakPolarHBondContact O-CA 3.4Å; V38-V40 HydrophobicContact CG1-CG1 4.42Å; V38-V40 HydrophobicContact CG2-CG1 3.89Å; V40-I44 HydrophobicContact CB-CG1 3.99Å; V40-I44 HydrophobicContact CG1-CG1 4.44Å; V40-R49 VanDerWaalsContact CG2-NH1 3.27Å; V40-L52 HydrophobicContact CG1-CD1 3.6Å; V40-V59 HydrophobicContact CG1-CG1 4.19Å; V40-V59 HydrophobicContact CG2-CG1 3.83Å; V40-I60 PolarHBondContact N-O 3Å; V40-T61 CarbonylContact O-C 3.53Å; V40-T61 VanDerWaalsContact O-CA 3.32Å; V40-T61 WeakPolarHBondContact O-CA 3.09Å; V40-V62 PolarHBondContact O-N 2.66Å
41	T	91.9	Very high	95.7	Very high	13 Å²	13	46.4 Å²	46.4	8%	0.08	26%	0.261	C	S	.	.			trans	-82.8	161.3	172.3	49.6	0	0	0	0	111.4	A11 T12 N43 I44 R49 T86	A11-T41 PolarHBondContact O-N 3.48Å; T12-T41 WeakPolarHBondContact CA-OG1 3.36Å; T12-T41 HydrophobicContact CG2-CG2 3.99Å; T12-T41 PolarHBondContact O-OG1 2.99Å; T41-N43 WeakPolarHBondContact CB-OD1 3.44Å; T41-N43 PolarHBondContact O-N 3.09Å; T41-N43 PolarHBondContact OG1-OD1 2.82Å; T41-I44 WeakPolarHBondContact O-CG1 3.35Å; T41-I44 PolarHBondContact O-N 2.95Å; T41-R49 PolarHBondContact O-NH2 3.09Å; T41-T86 HydrophobicContact CG2-CG2 3.75Å
42	P	89.3	Confident	95.7	Very high	66 Å²	66	44.4 Å²	44.4	43%	0.429	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.4	-177.8	-23.3	34.7	0	0	0	114.6	I44 T61 V62 D63	P42-I44 VanDerWaalsContact C-N 3.33Å; P42-T61 HydrophobicContact CG-CG2 4.11Å; P42-V62 WeakPolarHBondContact CD-O 3.4Å; P42-D63 HydrophobicContact CG-CB 3.69Å
43	N	88.4	Confident	95.7	Very high	113 Å²	113	48.3 Å²	48.3	60%	0.604	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-3.4	-178.8	62.9	-54.4	0	0	0	114.5	T12 T41	T12-N43 PolarHBondContact O-ND2 3.26Å; T12-N43 VanDerWaalsContact O-ND2 3.16Å; T41-N43 WeakPolarHBondContact CB-OD1 3.44Å; T41-N43 PolarHBondContact O-N 3.09Å; T41-N43 PolarHBondContact OG1-OD1 2.82Å
44	I	93.8	Very high	95.6	Very high	6 Å²	6	51 Å²	51	3%	0.031	27%	0.269	C	S	.	.	S	Bend	trans	-63.9	133.3	170.7	-62.6	-52.3	0	0	0	109.6	S13 V40 T41 P42 R49	S13-I44 WeakPolarHBondContact O-CD1 3.29Å; V40-I44 HydrophobicContact CB-CG1 3.99Å; V40-I44 HydrophobicContact CG1-CG1 4.44Å; T41-I44 WeakPolarHBondContact O-CG1 3.35Å; T41-I44 PolarHBondContact O-N 2.95Å; P42-I44 VanDerWaalsContact C-N 3.33Å; I44-R49 HydrophobicContact CG2-CB 4.35Å
45	S	95.7	Very high	95.5	Very high	39 Å²	39	48.9 Å²	48.9	27%	0.273	26%	0.262	S	S	.	.			trans	-64.4	149.2	179.6	65.1	0	0	0	0	112	D14 Q47 S48 R49	D14-S45 VanDerWaalsContact CG-OG 3.3Å; D14-S45 PolarHBondContact OD1-N 2.83Å; D14-S45 PolarHBondContact OD1-OG 3.03Å; D14-S45 WeakPolarHBondContact OD2-CB 3.49Å; D14-S45 PolarHBondContact OD2-OG 3.48Å; S45-Q47 PolarHBondContact O-N 2.88Å; S45-Q47 VanDerWaalsContact O-N 3.15Å; S45-S48 PolarHBondContact O-N 3.43Å; S45-S48 VanDerWaalsContact O-N 3.08Å; S45-S48 PolarHBondContact OG-N 2.99Å; S45-S48 PolarHBondContact OG-OG 3.01Å; S45-S48 VanDerWaalsContact OG-OG 3.11Å; S45-R49 WeakPolarHBondContact O-CB 3.35Å; S45-R49 PolarHBondContact O-N 3.02Å
46	D	95	Very high	95.6	Very high	118 Å²	118	48.2 Å²	48.2	63%	0.631	26%	0.256	S	S	*	.	H	α-helix	trans	-57.1	-32.4	177.5	-70.1	-27.8	0	0	0	112.6	K50	D46-K50 WeakPolarHBondContact O-CB 3.48Å; D46-K50 VanDerWaalsContact O-CG 3.26Å; D46-K50 WeakPolarHBondContact O-CG 3.44Å; D46-K50 PolarHBondContact O-N 3.3Å
47	Q	95.6	Very high	95.5	Very high	161 Å²	161	52 Å²	52	75%	0.752	28%	0.276	S	S	*	.	H	α-helix	trans	-64.3	-50.8	175.8	-178.9	178.7	-2.9	0	0	111.2	S45 R49 K50 A51	S45-Q47 PolarHBondContact O-N 2.88Å; S45-Q47 VanDerWaalsContact O-N 3.15Å; Q47-R49 VanDerWaalsContact C-N 3.35Å; Q47-K50 PolarHBondContact O-N 3.44Å; Q47-A51 PolarHBondContact O-N 3.43Å
48	S	96.1	Very high	95.5	Very high	24 Å²	24	55.5 Å²	55.5	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-42.2	177.8	-64.7	0	0	0	0	111.3	D14 S45 K50 A51 L52	D14-S48 VanDerWaalsContact CG-OG 3.25Å; D14-S48 PolarHBondContact OD1-OG 3.47Å; D14-S48 PolarHBondContact OD2-OG 3.45Å; S45-S48 PolarHBondContact O-N 3.43Å; S45-S48 VanDerWaalsContact O-N 3.08Å; S45-S48 PolarHBondContact OG-N 2.99Å; S45-S48 PolarHBondContact OG-OG 3.01Å; S45-S48 VanDerWaalsContact OG-OG 3.11Å; S48-K50 PolarHBondContact O-N 2.96Å; S48-A51 WeakPolarHBondContact O-CB 3.42Å; S48-A51 PolarHBondContact O-N 3.49Å; S48-A51 VanDerWaalsContact O-N 3.16Å; S48-L52 WeakPolarHBondContact O-CG 3.43Å; S48-L52 PolarHBondContact O-N 2.93Å
49	R	95.9	Very high	95.5	Very high	36 Å²	36	57.1 Å²	57.1	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-49.4	176.4	-177.9	179.7	-66.4	-83.2	-0.5	112.3	V40 T41 I44 S45 Q47 A51 L52 E53 T61	V40-R49 VanDerWaalsContact CG2-NH1 3.27Å; T41-R49 PolarHBondContact O-NH2 3.09Å; I44-R49 HydrophobicContact CG2-CB 4.35Å; S45-R49 WeakPolarHBondContact O-CB 3.35Å; S45-R49 PolarHBondContact O-N 3.02Å; Q47-R49 VanDerWaalsContact C-N 3.35Å; R49-A51 VanDerWaalsContact C-N 3.27Å; R49-A51 PolarHBondContact O-N 2.89Å; R49-L52 WeakPolarHBondContact O-CB 3.47Å; R49-L52 PolarHBondContact O-N 2.95Å; R49-L52 VanDerWaalsContact O-N 3.13Å; R49-E53 WeakPolarHBondContact O-CG 3.27Å; R49-E53 PolarHBondContact O-N 3.05Å; R49-T61 PolarHBondContact NH1-OG1 2.97Å
50	K	95.6	Very high	95.4	Very high	131 Å²	131	59 Å²	59	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-61.3	-36.4	175.6	-74.9	172.6	-176.7	174.8	0	112.3	D46 Q47 S48 L52 E53 N54	D46-K50 WeakPolarHBondContact O-CB 3.48Å; D46-K50 VanDerWaalsContact O-CG 3.26Å; D46-K50 WeakPolarHBondContact O-CG 3.44Å; D46-K50 PolarHBondContact O-N 3.3Å; Q47-K50 PolarHBondContact O-N 3.44Å; S48-K50 PolarHBondContact O-N 2.96Å; K50-L52 VanDerWaalsContact C-N 3.34Å; K50-E53 PolarHBondContact O-N 3.39Å; K50-N54 PolarHBondContact O-N 2.98Å; K50-N54 PolarHBondContact O-ND2 3.43Å
51	A	95.5	Very high	95.3	Very high	48 Å²	48	62.4 Å²	62.4	40%	0.397	33%	0.333	S	S	.	.	H	α-helix	trans	-63.9	-41.8	175.2	0	0	0	0	0	111.5	Q47 S48 R49 N54	Q47-A51 PolarHBondContact O-N 3.43Å; S48-A51 WeakPolarHBondContact O-CB 3.42Å; S48-A51 PolarHBondContact O-N 3.49Å; S48-A51 VanDerWaalsContact O-N 3.16Å; R49-A51 VanDerWaalsContact C-N 3.27Å; R49-A51 PolarHBondContact O-N 2.89Å; A51-N54 PolarHBondContact O-N 2.82Å
52	L	97.2	Very high	95.2	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.6	-42	175.2	-65.7	173.4	0	0	0	112	C17 A20 V38 V40 S48 R49 K50 N54 V55 F56 V59	C17-L52 HydrophobicContact CB-CD1 4.32Å; C17-L52 HydrophobicContact CB-CD2 4.32Å; C17-L52 HydrophobicContact CB-CG 4.47Å; A20-L52 HydrophobicContact CB-CD2 4.2Å; V38-L52 HydrophobicContact CG1-CB 4.28Å; V38-L52 HydrophobicContact CG1-CD1 4.31Å; V38-L52 HydrophobicContact CG2-CD1 4.44Å; V40-L52 HydrophobicContact CG1-CD1 3.6Å; S48-L52 WeakPolarHBondContact O-CG 3.43Å; S48-L52 PolarHBondContact O-N 2.93Å; R49-L52 WeakPolarHBondContact O-CB 3.47Å; R49-L52 PolarHBondContact O-N 2.95Å; R49-L52 VanDerWaalsContact O-N 3.13Å; K50-L52 VanDerWaalsContact C-N 3.34Å; L52-N54 PolarHBondContact O-N 3.13Å; L52-N54 VanDerWaalsContact O-N 3.09Å; L52-V55 WeakPolarHBondContact O-CG2 3.43Å; L52-V55 PolarHBondContact O-N 3.49Å; L52-F56 HydrophobicContact CB-CD2 4.09Å; L52-F56 HydrophobicContact CD2-CD2 3.92Å; L52-F56 HydrophobicContact CD2-CE2 3.51Å; L52-F56 WeakPolarHBondContact O-CD2 3.34Å; L52-F56 PolarHBondContact O-N 3.48Å; L52-V59 HydrophobicContact CB-CG2 4.04Å
53	E	97.1	Very high	94.7	Very high	107 Å²	107	61.5 Å²	61.5	50%	0.5	32%	0.324	S	S	.	.	H	α-helix	trans	-58.1	-24.4	177.3	-72.1	167.9	-179	0	0	113.4	R49 K50 V59	R49-E53 WeakPolarHBondContact O-CG 3.27Å; R49-E53 PolarHBondContact O-N 3.05Å; K50-E53 PolarHBondContact O-N 3.39Å; E53-V59 HydrophobicContact CB-CG2 4.42Å; E53-V59 HydrophobicContact CG-CB 4.26Å; E53-V59 HydrophobicContact CG-CG2 3.82Å
54	N	95.6	Very high	93.6	Very high	128 Å²	128	56.9 Å²	56.9	68%	0.684	30%	0.3	S	S	*	.	H	α-helix	trans	-81.4	-21.6	176.2	-65.5	-47.6	0	0	0	113.6	K50 A51 L52	K50-N54 PolarHBondContact O-N 2.98Å; K50-N54 PolarHBondContact O-ND2 3.43Å; A51-N54 PolarHBondContact O-N 2.82Å; L52-N54 PolarHBondContact O-N 3.13Å; L52-N54 VanDerWaalsContact O-N 3.09Å
55	V	96.2	Very high	91.8	Very high	10 Å²	10	64 Å²	64	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-114.4	-17.7	-172.6	-59.3	0	0	0	0	114	T21 A24 R28 L52	T21-V55 HydrophobicContact CG2-CG2 4.38Å; A24-V55 HydrophobicContact CB-CB 4.43Å; A24-V55 HydrophobicContact CB-CG2 4.37Å; R28-V55 PolarHBondContact NE-O 2.75Å; R28-V55 PolarHBondContact NH1-O 3.2Å; R28-V55 PolarHBondContact NH2-O 3.36Å; R28-V55 VanDerWaalsContact NH2-O 3.15Å; L52-V55 WeakPolarHBondContact O-CG2 3.43Å; L52-V55 PolarHBondContact O-N 3.49Å
56	F	98.1	Very high	89.5	Confident	9 Å²	9	66.6 Å²	66.6	4%	0.039	34%	0.341	C	S	.	.			trans	-102.6	157.7	174.3	-73.4	-89.2	0	0	0	111	T9 A20 A24 I36 V38 L52 V59	T9-F56 HydrophobicContact CG2-CE1 3.57Å; T9-F56 HydrophobicContact CG2-CZ 3.66Å; A20-F56 HydrophobicContact CB-CE2 4.24Å; A20-F56 HydrophobicContact CB-CZ 3.95Å; A20-F56 WeakPolarHBondContact O-CZ 3.43Å; A24-F56 HydrophobicContact CB-CD1 4.21Å; A24-F56 HydrophobicContact CB-CD2 4.26Å; A24-F56 HydrophobicContact CB-CE1 3.78Å; A24-F56 HydrophobicContact CB-CE2 3.81Å; A24-F56 HydrophobicContact CB-CG 4.44Å; A24-F56 HydrophobicContact CB-CZ 3.57Å; I36-F56 HydrophobicContact CB-CD1 4.26Å; I36-F56 HydrophobicContact CG2-CD1 3.6Å; I36-F56 HydrophobicContact CG2-CE1 3.6Å; V38-F56 HydrophobicContact CB-CD1 3.68Å; V38-F56 HydrophobicContact CB-CD2 4.05Å; V38-F56 HydrophobicContact CB-CE1 3.57Å; V38-F56 HydrophobicContact CB-CE2 3.99Å; V38-F56 HydrophobicContact CB-CG 3.92Å; V38-F56 HydrophobicContact CB-CZ 3.72Å; V38-F56 HydrophobicContact CG1-CB 4.04Å; V38-F56 HydrophobicContact CG1-CD1 3.77Å; V38-F56 HydrophobicContact CG1-CD2 3.53Å; V38-F56 HydrophobicContact CG1-CE1 4.1Å; V38-F56 HydrophobicContact CG1-CE2 3.91Å; V38-F56 HydrophobicContact CG1-CG 3.47Å; V38-F56 VanDerWaalsContact CG1-CG 3.47Å; V38-F56 HydrophobicContact CG1-CZ 4.15Å; V38-F56 HydrophobicContact CG2-CZ 4.31Å; L52-F56 HydrophobicContact CB-CD2 4.09Å; L52-F56 HydrophobicContact CD2-CD2 3.92Å; L52-F56 HydrophobicContact CD2-CE2 3.51Å; L52-F56 WeakPolarHBondContact O-CD2 3.34Å; L52-F56 PolarHBondContact O-N 3.48Å; F56-V59 HydrophobicContact CB-CG2 4.16Å
57	D	97.9	Very high	87.2	Confident	83 Å²	83	65.6 Å²	65.6	44%	0.444	34%	0.344	S	S	.	.	S	Bend	trans	-82.5	-32.7	172.5	-53.7	-43.8	0	0	0	110.3	R28 C35 I36	R28-D57 IonicContact CZ-OD1 3.29Å; R28-D57 IonicContact NH2-OD1 3.8Å; R28-D57 PolarHBondContact NH2-OD1 2.86Å; C35-D57 WeakPolarHBondContact CA-OD2 3.5Å; I36-D57 PolarHBondContact N-OD2 3.48Å; I36-D57 PolarHBondContact O-N 2.74Å
58	E	97.7	Very high	85.2	Confident	74 Å²	74	65.7 Å²	65.7	35%	0.346	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	136.9	172.9	-65.9	-179.8	-169.8	0	0	111.6	I36 V37 V38 I60 Q95 Y96	I36-E58 PolarHBondContact O-N 3.07Å; V37-E58 WeakPolarHBondContact CA-O 3.15Å; V37-E58 HydrophobicContact CG1-CB 4.25Å; V37-E58 HydrophobicContact CG2-CB 4.25Å; V38-E58 PolarHBondContact N-O 3.41Å; E58-I60 HydrophobicContact CB-CG1 4.49Å; E58-Q95 PolarHBondContact OE2-NE2 2.98Å; E58-Y96 PolarHBondContact OE1-OH 3.37Å; E58-Y96 VanDerWaalsContact OE1-OH 3.09Å; E58-Y96 PolarHBondContact OE2-OH 3.13Å
59	V	97.9	Very high	83.2	Confident	34 Å²	34	66 Å²	66	21%	0.206	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	112.5	171.6	-179.6	0	0	0	0	108	V38 V40 L52 E53 F56	V38-V59 HydrophobicContact CG1-CB 4.17Å; V38-V59 HydrophobicContact CG1-CG1 4.09Å; V38-V59 HydrophobicContact CG1-CG2 3.75Å; V40-V59 HydrophobicContact CG1-CG1 4.19Å; V40-V59 HydrophobicContact CG2-CG1 3.83Å; L52-V59 HydrophobicContact CB-CG2 4.04Å; E53-V59 HydrophobicContact CB-CG2 4.42Å; E53-V59 HydrophobicContact CG-CB 4.26Å; E53-V59 HydrophobicContact CG-CG2 3.82Å; F56-V59 HydrophobicContact CB-CG2 4.16Å
60	I	96.5	Very high	80.9	Confident	38 Å²	38	69.4 Å²	69.4	20%	0.195	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.8	-173	-59.1	178.8	0	0	0	109.3	V37 V38 M39 V40 E58 V62 L93	V37-I60 HydrophobicContact CG1-CD1 3.64Å; V37-I60 HydrophobicContact CG1-CG1 4.09Å; V38-I60 PolarHBondContact O-N 3.02Å; M39-I60 CarbonylContact C-O 3.5Å; M39-I60 VanDerWaalsContact CA-O 3.31Å; M39-I60 WeakPolarHBondContact CA-O 3.35Å; V40-I60 PolarHBondContact N-O 3Å; E58-I60 HydrophobicContact CB-CG1 4.49Å; I60-V62 HydrophobicContact CG2-CG2 4.46Å; I60-V62 PolarHBondContact O-N 3.42Å; I60-L93 HydrophobicContact CD1-CD2 3.4Å; I60-L93 HydrophobicContact CG2-CD2 4.42Å
61	T	94.4	Very high	78.7	Confident	72 Å²	72	68.3 Å²	68.3	44%	0.442	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	121.6	172.8	-52	0	0	0	0	110.1	V40 P42 R49	V40-T61 CarbonylContact O-C 3.53Å; V40-T61 VanDerWaalsContact O-CA 3.32Å; V40-T61 WeakPolarHBondContact O-CA 3.09Å; P42-T61 HydrophobicContact CG-CG2 4.11Å; R49-T61 PolarHBondContact NH1-OG1 2.97Å
62	V	89	Confident	76.6	Confident	9 Å²	9	69.1 Å²	69.1	6%	0.055	36%	0.357	C	S	.	.			trans	-106.5	107.9	173.4	178.1	0	0	0	0	107.9	M39 V40 P42 I60 V64 T86 H89	M39-V62 HydrophobicContact CB-CG2 3.97Å; M39-V62 HydrophobicContact CG-CG2 4.14Å; M39-V62 HydrophobicContact SD-CG2 4.03Å; V40-V62 PolarHBondContact O-N 2.66Å; P42-V62 WeakPolarHBondContact CD-O 3.4Å; I60-V62 HydrophobicContact CG2-CG2 4.46Å; I60-V62 PolarHBondContact O-N 3.42Å; V62-V64 HydrophobicContact CG1-CG2 4.01Å; V62-T86 HydrophobicContact CB-CG2 4.14Å; V62-T86 HydrophobicContact CG1-CG2 3.91Å; V62-H89 HydrophobicContact CG1-CB 3.7Å; V62-H89 WeakPolarHBondContact CG1-CD2 3.3Å; V62-H89 HydrophobicContact CG2-CB 4.03Å
63	D	79.4	Confident	74.5	Confident	52 Å²	52	71 Å²	71	28%	0.278	37%	0.367	S	S	.	.			trans	-103.7	89.9	177.8	-173.4	8.6	0	0	0	110.9	P42 K65 N66	P42-D63 HydrophobicContact CG-CB 3.69Å; D63-K65 PolarHBondContact O-N 3.18Å; D63-K65 VanDerWaalsContact O-N 3.13Å; D63-K65 WeakPolarHBondContact OD1-CA 3.3Å; D63-K65 VanDerWaalsContact OD1-CB 3.29Å; D63-K65 WeakPolarHBondContact OD1-CB 3.43Å; D63-K65 PolarHBondContact OD1-N 3.01Å; D63-N66 PolarHBondContact O-N 2.99Å; D63-N66 PolarHBondContact O-ND2 2.66Å
64	V	66.4	Low	72.3	Confident	16 Å²	16	70.2 Å²	70.2	10%	0.097	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-4.3	175.5	-155.7	0	0	0	0	111.7	V62 D69 L73 F85 T86	V62-V64 HydrophobicContact CG1-CG2 4.01Å; V64-D69 HydrophobicContact CG1-CB 4.07Å; V64-D69 VanDerWaalsContact O-CB 3.23Å; V64-D69 WeakPolarHBondContact O-CB 3.34Å; V64-L73 HydrophobicContact CB-CD1 4.41Å; V64-L73 HydrophobicContact CG1-CD1 3.57Å; V64-L73 HydrophobicContact CG1-CG 4.44Å; V64-F85 HydrophobicContact CG1-CB 4.23Å; V64-T86 HydrophobicContact CG2-CG2 4.2Å; V64-T86 VanDerWaalsContact CG2-OG1 3.29Å; V64-T86 WeakPolarHBondContact CG2-OG1 3.43Å
65	K	55.4	Low	69.9	Low	155 Å²	155	70.1 Å²	70.1	67%	0.674	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	6.2	174.5	-62.3	-175.8	177.4	-179.6	0	113.4	D63 Q70	D63-K65 PolarHBondContact O-N 3.18Å; D63-K65 VanDerWaalsContact O-N 3.13Å; D63-K65 WeakPolarHBondContact OD1-CA 3.3Å; D63-K65 VanDerWaalsContact OD1-CB 3.29Å; D63-K65 WeakPolarHBondContact OD1-CB 3.43Å; D63-K65 PolarHBondContact OD1-N 3.01Å; K65-Q70 HydrophobicContact CB-CG 4.44Å; K65-Q70 PolarHBondContact O-NE2 2.97Å
66	N	48	Very low	67.8	Low	93 Å²	93	71 Å²	71	50%	0.497	37%	0.374	S	S	.	.	S	Bend	trans	-67.9	152.3	170.6	-80.4	-49.3	0	0	0	111.7	D63 E68 D69 Q70	D63-N66 PolarHBondContact O-N 2.99Å; D63-N66 PolarHBondContact O-ND2 2.66Å; N66-E68 PolarHBondContact O-N 3.03Å; N66-D69 PolarHBondContact O-N 3.19Å; N66-Q70 PolarHBondContact O-N 3.07Å
67	S	45.9	Very low	65.7	Low	97 Å²	97	73.2 Å²	73.2	68%	0.678	40%	0.4	S	S	*	.	H	α-helix	trans	-60.6	-21.5	-162.3	-50.8	0	0	0	0	116.1	L71	S67-L71 PolarHBondContact O-N 3.14Å
68	E	54.1	Low	63.7	Low	164 Å²	164	76 Å²	76	77%	0.766	40%	0.404	S	S	*	.	H	α-helix	trans	-79.3	-41.2	173.5	-66.9	-177.7	165.4	0	0	111.6	N66 L71 H72	N66-E68 PolarHBondContact O-N 3.03Å; E68-L71 PolarHBondContact O-N 3.29Å; E68-H72 PolarHBondContact O-N 3.05Å
69	D	53.2	Low	61.9	Low	31 Å²	31	77.8 Å²	77.8	17%	0.166	42%	0.422	C	S	.	.	H	α-helix	trans	-76.4	-33.7	178.9	-66.7	-31.6	0	0	0	112.1	V64 N66 L71 H72 L73 H89	V64-D69 HydrophobicContact CG1-CB 4.07Å; V64-D69 VanDerWaalsContact O-CB 3.23Å; V64-D69 WeakPolarHBondContact O-CB 3.34Å; N66-D69 PolarHBondContact O-N 3.19Å; D69-L71 VanDerWaalsContact C-N 3.3Å; D69-L71 PolarHBondContact O-N 3.17Å; D69-H72 PolarHBondContact O-N 3.14Å; D69-L73 WeakPolarHBondContact O-CB 3.31Å; D69-L73 WeakPolarHBondContact O-CG 3.34Å; D69-L73 PolarHBondContact O-N 3.46Å; D69-H89 IonicContact OD2-CE1 3.05Å; D69-H89 IonicContact OD2-NE2 2.66Å
70	Q	47.6	Very low	59.9	Low	107 Å²	107	81 Å²	81	50%	0.5	44%	0.435	S	S	.	.	H	α-helix	trans	-63.5	-35.5	170	-92.9	-165.6	64.5	0	0	112.1	K65 N66 S74	K65-Q70 HydrophobicContact CB-CG 4.44Å; K65-Q70 PolarHBondContact O-NE2 2.97Å; N66-Q70 PolarHBondContact O-N 3.07Å; Q70-S74 WeakPolarHBondContact O-CB 3.44Å; Q70-S74 PolarHBondContact O-N 3.5Å; Q70-S74 PolarHBondContact O-OG 2.79Å
71	L	48.9	Very low	58.2	Low	108 Å²	108	79.4 Å²	79.4	57%	0.565	43%	0.427	S	S	*	.	H	α-helix	trans	-65	-43.3	175.7	-131.7	108.5	0	0	0	110.1	S67 E68 D69 S74 M75	S67-L71 PolarHBondContact O-N 3.14Å; E68-L71 PolarHBondContact O-N 3.29Å; D69-L71 VanDerWaalsContact C-N 3.3Å; D69-L71 PolarHBondContact O-N 3.17Å; L71-S74 PolarHBondContact O-OG 3.08Å; L71-M75 HydrophobicContact CB-CE 4.44Å; L71-M75 HydrophobicContact CD2-CE 3.94Å; L71-M75 VanDerWaalsContact O-CB 3.23Å; L71-M75 WeakPolarHBondContact O-CB 3.47Å; L71-M75 WeakPolarHBondContact O-CE 3.38Å; L71-M75 WeakPolarHBondContact O-CG 3.4Å; L71-M75 PolarHBondContact O-N 3.39Å
72	H	53.1	Low	57.1	Low	65 Å²	65	77.2 Å²	77.2	30%	0.301	42%	0.418	S	S	.	.	H	α-helix	trans	-65.1	-47.5	175	-75.2	147	0	0	0	112.9	E68 D69 M75 L76	E68-H72 PolarHBondContact O-N 3.05Å; D69-H72 PolarHBondContact O-N 3.14Å; H72-M75 PolarHBondContact O-N 2.83Å; H72-L76 WeakPolarHBondContact O-CB 3.47Å; H72-L76 VanDerWaalsContact O-CD1 3.3Å; H72-L76 WeakPolarHBondContact O-CD1 3.41Å; H72-L76 VanDerWaalsContact O-CG 3.28Å; H72-L76 WeakPolarHBondContact O-CG 3.29Å; H72-L76 PolarHBondContact O-N 2.93Å
73	L	52.7	Low	56.4	Low	40 Å²	40	80.5 Å²	80.5	21%	0.209	44%	0.438	C	S	.	.	H	α-helix	trans	-66.5	-37.3	179.2	-75.5	174.3	0	0	0	113.4	V64 D69 L76 G77 F85	V64-L73 HydrophobicContact CB-CD1 4.41Å; V64-L73 HydrophobicContact CG1-CD1 3.57Å; V64-L73 HydrophobicContact CG1-CG 4.44Å; D69-L73 WeakPolarHBondContact O-CB 3.31Å; D69-L73 WeakPolarHBondContact O-CG 3.34Å; D69-L73 PolarHBondContact O-N 3.46Å; L73-L76 HydrophobicContact CD2-CD1 4.48Å; L73-L76 WeakPolarHBondContact O-CB 3.47Å; L73-L76 PolarHBondContact O-N 3.22Å; L73-G77 PolarHBondContact O-N 3.2Å; L73-F85 HydrophobicContact CD2-CD2 3.38Å; L73-F85 HydrophobicContact CD2-CE2 3.74Å; L73-F85 HydrophobicContact CD2-CG 4.01Å
74	S	50.1	Low	56.4	Low	89 Å²	89	78.2 Å²	78.2	62%	0.622	43%	0.426	S	S	*	.	H	α-helix	trans	-74.1	-34.4	175.5	61.6	0	0	0	0	112.4	Q70 L71 L76	Q70-S74 WeakPolarHBondContact O-CB 3.44Å; Q70-S74 PolarHBondContact O-N 3.5Å; Q70-S74 PolarHBondContact O-OG 2.79Å; L71-S74 PolarHBondContact O-OG 3.08Å; S74-L76 PolarHBondContact O-N 2.83Å
75	M	45.9	Very low	57.1	Low	126 Å²	126	78 Å²	78	62%	0.621	42%	0.424	S	S	*	.	H	α-helix	trans	-64.9	-28.5	170.2	-80.6	-169.7	-68.6	0	0	112.5	L71 H72	L71-M75 HydrophobicContact CB-CE 4.44Å; L71-M75 HydrophobicContact CD2-CE 3.94Å; L71-M75 VanDerWaalsContact O-CB 3.23Å; L71-M75 WeakPolarHBondContact O-CB 3.47Å; L71-M75 WeakPolarHBondContact O-CE 3.38Å; L71-M75 WeakPolarHBondContact O-CG 3.4Å; L71-M75 PolarHBondContact O-N 3.39Å; H72-M75 PolarHBondContact O-N 2.83Å
76	L	51.9	Low	58.7	Low	29 Å²	29	71 Å²	71	15%	0.152	39%	0.394	C	S	.	.	H	α-helix	trans	-73.2	-34.3	179.8	-85.5	158.1	0	0	0	113.9	H72 L73 S74 R78 F85 L155	H72-L76 WeakPolarHBondContact O-CB 3.47Å; H72-L76 VanDerWaalsContact O-CD1 3.3Å; H72-L76 WeakPolarHBondContact O-CD1 3.41Å; H72-L76 VanDerWaalsContact O-CG 3.28Å; H72-L76 WeakPolarHBondContact O-CG 3.29Å; H72-L76 PolarHBondContact O-N 2.93Å; L73-L76 HydrophobicContact CD2-CD1 4.48Å; L73-L76 WeakPolarHBondContact O-CB 3.47Å; L73-L76 PolarHBondContact O-N 3.22Å; S74-L76 PolarHBondContact O-N 2.83Å; L76-R78 HydrophobicContact CB-CB 4.22Å; L76-R78 HydrophobicContact CB-CG 4.45Å; L76-R78 VanDerWaalsContact O-CG 3.26Å; L76-R78 WeakPolarHBondContact O-CG 3.2Å; L76-R78 PolarHBondContact O-N 3.17Å; L76-F85 HydrophobicContact CD1-CE1 4.25Å; L76-F85 HydrophobicContact CD1-CE2 3.62Å; L76-F85 HydrophobicContact CD1-CZ 3.33Å; L76-L155 HydrophobicContact CD1-CD2 3.61Å; L76-L155 HydrophobicContact CD2-CD2 3.65Å; L76-L155 HydrophobicContact CG-CD2 3.4Å; L76-L155 VanDerWaalsContact CG-CD2 3.4Å
77	G	53.8	Low	61	Low	56 Å²	56	66.7 Å²	66.7	58%	0.577	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	22.4	-171.3	0	0	0	0	0	113.8	L73 P79	L73-G77 PolarHBondContact O-N 3.2Å; G77-P79 WeakPolarHBondContact O-CD 3.34Å
78	R	56.8	Low	63.3	Low	140 Å²	140	62.1 Å²	62.1	53%	0.528	34%	0.339	S	S	.	.			trans	-126.2	69	-171.1	-62	-78.7	174.6	-152	2.6	111.8	L76 E80 L81	L76-R78 HydrophobicContact CB-CB 4.22Å; L76-R78 HydrophobicContact CB-CG 4.45Å; L76-R78 VanDerWaalsContact O-CG 3.26Å; L76-R78 WeakPolarHBondContact O-CG 3.2Å; L76-R78 PolarHBondContact O-N 3.17Å; R78-E80 WeakPolarHBondContact CA-OE2 3.38Å; R78-E80 WeakPolarHBondContact CD-OE1 3.47Å; R78-E80 IonicContact NE-OE1 3.99Å; R78-E80 IonicContact NH1-OE1 2.76Å; R78-E80 PolarHBondContact O-N 2.59Å; R78-E80 VanDerWaalsContact O-N 3.17Å; R78-L81 HydrophobicContact CB-CD1 4.05Å; R78-L81 HydrophobicContact CB-CG 4.38Å; R78-L81 PolarHBondContact O-N 3.18Å
79	P	59.2	Low	65.3	Low	113 Å²	113	55.4 Å²	55.4	73%	0.734	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-60.2	-22.4	-179.1	26	-34.8	0	0	0	113.8	G77 L81 G82	G77-P79 WeakPolarHBondContact O-CD 3.34Å; P79-L81 PolarHBondContact O-N 3.17Å; P79-G82 PolarHBondContact O-N 2.95Å
80	E	56.1	Low	67.4	Low	100 Å²	100	53.9 Å²	53.9	47%	0.467	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-60.7	-25.4	177.5	68.4	-83.3	-161.1	0	0	113.5	R78 G82	R78-E80 WeakPolarHBondContact CA-OE2 3.38Å; R78-E80 WeakPolarHBondContact CD-OE1 3.47Å; R78-E80 IonicContact NE-OE1 3.99Å; R78-E80 IonicContact NH1-OE1 2.76Å; R78-E80 PolarHBondContact O-N 2.59Å; R78-E80 VanDerWaalsContact O-N 3.17Å; E80-G82 VanDerWaalsContact C-N 3.3Å; E80-G82 PolarHBondContact O-N 2.83Å
81	L	60.8	Low	69.8	Low	6 Å²	6	48.8 Å²	48.8	3%	0.031	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-84.1	1.9	-179	-66.6	175.6	0	0	0	113.7	R78 P79 V83 T84 F85 G162	R78-L81 HydrophobicContact CB-CD1 4.05Å; R78-L81 HydrophobicContact CB-CG 4.38Å; R78-L81 PolarHBondContact O-N 3.18Å; P79-L81 PolarHBondContact O-N 3.17Å; L81-V83 VanDerWaalsContact C-N 3.28Å; L81-V83 PolarHBondContact O-N 2.8Å; L81-T84 HydrophobicContact CD2-CG2 4.47Å; L81-T84 WeakPolarHBondContact O-CA 3.47Å; L81-T84 VanDerWaalsContact O-CB 3.27Å; L81-T84 WeakPolarHBondContact O-CB 3.43Å; L81-T84 PolarHBondContact O-N 2.8Å; L81-F85 HydrophobicContact CB-CD2 3.59Å; L81-F85 HydrophobicContact CB-CE2 3.41Å; L81-F85 VanDerWaalsContact CB-CE2 3.41Å; L81-F85 HydrophobicContact CD1-CE2 3.85Å; L81-F85 HydrophobicContact CD1-CZ 4.37Å; L81-F85 HydrophobicContact CG-CE2 4.28Å; L81-F85 WeakPolarHBondContact O-CD2 3.45Å; L81-F85 PolarHBondContact O-N 3.31Å; L81-G162 WeakPolarHBondContact CD2-O 3.47Å
82	G	70.2	Confident	72	Confident	25 Å²	25	45.9 Å²	45.9	26%	0.258	26%	0.26	S	S	.	.	H	α-helix	trans	-55.5	-38.9	-173.6	0	0	0	0	0	114.4	P79 E80 T86	P79-G82 PolarHBondContact O-N 2.95Å; E80-G82 VanDerWaalsContact C-N 3.3Å; E80-G82 PolarHBondContact O-N 2.83Å; G82-T86 PolarHBondContact O-N 3.03Å; G82-T86 VanDerWaalsContact O-N 3.15Å; G82-T86 PolarHBondContact O-OG1 2.77Å
83	V	74.2	Confident	74	Confident	78 Å²	78	43.2 Å²	43.2	47%	0.473	25%	0.249	S	C	.	.	H	α-helix	trans	-70.2	-43.7	175.6	177.4	0	0	0	0	111	T12 L81 F85 T86 K87	T12-V83 HydrophobicContact CG2-CG1 4.22Å; T12-V83 HydrophobicContact CG2-CG2 4.44Å; L81-V83 VanDerWaalsContact C-N 3.28Å; L81-V83 PolarHBondContact O-N 2.8Å; V83-F85 PolarHBondContact O-N 3.32Å; V83-T86 WeakPolarHBondContact O-CB 3.2Å; V83-T86 PolarHBondContact O-N 3.26Å; V83-K87 PolarHBondContact O-N 2.79Å
84	T	79.6	Confident	76.1	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-53.6	-51.9	174.7	-58.4	0	0	0	0	111.1	L81 T86 K87 L88 D164 L167	L81-T84 HydrophobicContact CD2-CG2 4.47Å; L81-T84 WeakPolarHBondContact O-CA 3.47Å; L81-T84 VanDerWaalsContact O-CB 3.27Å; L81-T84 WeakPolarHBondContact O-CB 3.43Å; L81-T84 PolarHBondContact O-N 2.8Å; T84-T86 VanDerWaalsContact C-N 3.34Å; T84-T86 PolarHBondContact O-N 3.05Å; T84-K87 WeakPolarHBondContact O-CB 3.36Å; T84-K87 PolarHBondContact O-N 3.5Å; T84-K87 VanDerWaalsContact O-N 3.1Å; T84-L88 WeakPolarHBondContact O-CG 3.33Å; T84-L88 PolarHBondContact O-N 2.93Å; T84-L88 VanDerWaalsContact O-N 3.11Å; T84-D164 HydrophobicContact CG2-CB 3.77Å; T84-D164 PolarHBondContact OG1-N 2.86Å; T84-D164 VanDerWaalsContact OG1-N 3.14Å; T84-L167 HydrophobicContact CG2-CD2 3.79Å
85	F	82.5	Confident	78.3	Confident	10 Å²	10	45.4 Å²	45.4	4%	0.044	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-42.8	178.6	-78.5	-70	0	0	0	112.3	V64 L73 L76 L81 V83 K87 L88 H89 L151 A154	V64-F85 HydrophobicContact CG1-CB 4.23Å; L73-F85 HydrophobicContact CD2-CD2 3.38Å; L73-F85 HydrophobicContact CD2-CE2 3.74Å; L73-F85 HydrophobicContact CD2-CG 4.01Å; L76-F85 HydrophobicContact CD1-CE1 4.25Å; L76-F85 HydrophobicContact CD1-CE2 3.62Å; L76-F85 HydrophobicContact CD1-CZ 3.33Å; L81-F85 HydrophobicContact CB-CD2 3.59Å; L81-F85 HydrophobicContact CB-CE2 3.41Å; L81-F85 VanDerWaalsContact CB-CE2 3.41Å; L81-F85 HydrophobicContact CD1-CE2 3.85Å; L81-F85 HydrophobicContact CD1-CZ 4.37Å; L81-F85 HydrophobicContact CG-CE2 4.28Å; L81-F85 WeakPolarHBondContact O-CD2 3.45Å; L81-F85 PolarHBondContact O-N 3.31Å; V83-F85 PolarHBondContact O-N 3.32Å; F85-K87 VanDerWaalsContact C-N 3.28Å; F85-K87 PolarHBondContact O-N 2.82Å; F85-L88 HydrophobicContact CD1-CD1 4.2Å; F85-L88 PolarHBondContact O-N 3.04Å; F85-H89 PolarHBondContact O-CD2 2.86Å; F85-H89 VanDerWaalsContact O-CD2 3.22Å; F85-L151 HydrophobicContact CD1-CD2 3.48Å; F85-L151 VanDerWaalsContact CD1-CD2 3.48Å; F85-L151 HydrophobicContact CE1-CD2 3.61Å; F85-A154 HydrophobicContact CE1-CB 3.92Å; F85-A154 HydrophobicContact CZ-CB 3.86Å
86	T	89.3	Confident	80.8	Confident	8 Å²	8	40 Å²	40	5%	0.049	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-41.4	175.8	-49.9	0	0	0	0	111.4	L10 T41 V62 V64 G82 V83 T84 H89	L10-T86 HydrophobicContact CD1-CG2 3.62Å; L10-T86 HydrophobicContact CD2-CG2 4.26Å; T41-T86 HydrophobicContact CG2-CG2 3.75Å; V62-T86 HydrophobicContact CB-CG2 4.14Å; V62-T86 HydrophobicContact CG1-CG2 3.91Å; V64-T86 HydrophobicContact CG2-CG2 4.2Å; V64-T86 VanDerWaalsContact CG2-OG1 3.29Å; V64-T86 WeakPolarHBondContact CG2-OG1 3.43Å; G82-T86 PolarHBondContact O-N 3.03Å; G82-T86 VanDerWaalsContact O-N 3.15Å; G82-T86 PolarHBondContact O-OG1 2.77Å; V83-T86 WeakPolarHBondContact O-CB 3.2Å; V83-T86 PolarHBondContact O-N 3.26Å; T84-T86 VanDerWaalsContact C-N 3.34Å; T84-T86 PolarHBondContact O-N 3.05Å; T86-H89 WeakPolarHBondContact O-CB 3.27Å; T86-H89 PolarHBondContact O-N 3.01Å
87	K	94.9	Very high	82.9	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.013	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-39.5	177.6	-177	164.2	172.1	173.8	0	112.2	L10 V83 T84 F85 H89 C90 F101 D103 S135 D164	L10-K87 HydrophobicContact CD2-CB 3.83Å; V83-K87 PolarHBondContact O-N 2.79Å; T84-K87 WeakPolarHBondContact O-CB 3.36Å; T84-K87 PolarHBondContact O-N 3.5Å; T84-K87 VanDerWaalsContact O-N 3.1Å; F85-K87 VanDerWaalsContact C-N 3.28Å; F85-K87 PolarHBondContact O-N 2.82Å; K87-H89 PolarHBondContact O-N 3.18Å; K87-H89 VanDerWaalsContact O-N 3.14Å; K87-C90 WeakPolarHBondContact O-CB 3.38Å; K87-C90 PolarHBondContact O-N 2.98Å; K87-C90 PolarHBondContact O-SG 3.14Å; K87-F101 HydrophobicContact CD-CE1 3.98Å; K87-F101 HydrophobicContact CD-CZ 3.84Å; K87-F101 HydrophobicContact CG-CE1 4.26Å; K87-F101 HydrophobicContact CG-CE2 3.9Å; K87-F101 HydrophobicContact CG-CZ 3.66Å; K87-D103 IonicContact NZ-OD1 3.4Å; K87-D103 PolarHBondContact NZ-OD1 2.95Å; K87-D103 IonicContact NZ-OD2 3.37Å; K87-D103 PolarHBondContact NZ-OD2 3.16Å; K87-S135 PolarHBondContact NZ-O 3.06Å; K87-D164 HydrophobicContact CD-CB 4.09Å; K87-D164 WeakPolarHBondContact CE-OD2 3.37Å; K87-D164 IonicContact NZ-OD1 3.36Å; K87-D164 IonicContact NZ-OD2 2.61Å; K87-D164 PolarHBondContact NZ-OD2 3.12Å
88	L	94.9	Very high	85	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-24.4	178.5	-60	179.4	0	0	0	113.5	T84 F85 C90 W91 Y147 L150 L151 L167 L168	T84-L88 WeakPolarHBondContact O-CG 3.33Å; T84-L88 PolarHBondContact O-N 2.93Å; T84-L88 VanDerWaalsContact O-N 3.11Å; F85-L88 HydrophobicContact CD1-CD1 4.2Å; F85-L88 PolarHBondContact O-N 3.04Å; L88-C90 PolarHBondContact O-N 2.84Å; L88-W91 HydrophobicContact CD2-CZ3 4.24Å; L88-W91 PolarHBondContact O-N 2.85Å; L88-Y147 HydrophobicContact CB-CD2 4.3Å; L88-Y147 HydrophobicContact CB-CE2 4.16Å; L88-Y147 VanDerWaalsContact O-CD2 3.32Å; L88-Y147 WeakPolarHBondContact O-CD2 3.36Å; L88-L150 HydrophobicContact CD1-CB 4.36Å; L88-L150 HydrophobicContact CD2-CD1 4.3Å; L88-L151 HydrophobicContact CD1-CD2 4.04Å; L88-L167 HydrophobicContact CD1-CD2 3.74Å; L88-L167 HydrophobicContact CD2-CD2 4.24Å; L88-L167 HydrophobicContact CG-CD2 4.45Å; L88-L168 HydrophobicContact CD2-CD2 4.07Å
89	H	94.9	Very high	87	Confident	23 Å²	23	34.6 Å²	34.6	11%	0.106	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-60.8	-12	174.7	-75.6	-98.5	0	0	0	113.4	M39 V62 D69 F85 T86 K87 W91 N92 Y147	M39-H89 HydrophobicContact SD-CB 4.26Å; V62-H89 HydrophobicContact CG1-CB 3.7Å; V62-H89 WeakPolarHBondContact CG1-CD2 3.3Å; V62-H89 HydrophobicContact CG2-CB 4.03Å; D69-H89 IonicContact OD2-CE1 3.05Å; D69-H89 IonicContact OD2-NE2 2.66Å; F85-H89 PolarHBondContact O-CD2 2.86Å; F85-H89 VanDerWaalsContact O-CD2 3.22Å; T86-H89 WeakPolarHBondContact O-CB 3.27Å; T86-H89 PolarHBondContact O-N 3.01Å; K87-H89 PolarHBondContact O-N 3.18Å; K87-H89 VanDerWaalsContact O-N 3.14Å; H89-W91 PolarHBondContact O-N 3.05Å; H89-N92 WeakPolarHBondContact O-CB 3.39Å; H89-N92 PolarHBondContact O-N 3.07Å; H89-Y147 AromaticContact CE1-CZ 3.97Å; H89-Y147 PolarHBondContact CE1-OH 2.76Å; H89-Y147 PolarHBondContact NE2-OH 3.39Å
90	C	97.5	Very high	88.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-58.1	-31.2	170.4	71.9	0	0	0	0	111.8	V8 M39 K87 L88 N92 L93 F101 F140	V8-C90 HydrophobicContact CG1-CB 4.15Å; M39-C90 HydrophobicContact CE-CB 3.7Å; M39-C90 HydrophobicContact SD-CB 4.03Å; M39-C90 PolarHBondContact SD-N 2.86Å; K87-C90 WeakPolarHBondContact O-CB 3.38Å; K87-C90 PolarHBondContact O-N 2.98Å; K87-C90 PolarHBondContact O-SG 3.14Å; L88-C90 PolarHBondContact O-N 2.84Å; C90-N92 PolarHBondContact O-N 2.84Å; C90-L93 WeakPolarHBondContact O-CB 3.43Å; C90-L93 WeakPolarHBondContact O-CG 3.47Å; C90-L93 PolarHBondContact O-N 2.98Å; C90-F101 HydrophobicContact CB-CD2 3.87Å; C90-F101 HydrophobicContact CB-CE2 4.03Å; C90-F140 HydrophobicContact CB-CE1 4.39Å; C90-F140 HydrophobicContact CB-CE2 4.12Å; C90-F140 HydrophobicContact CB-CZ 3.62Å; C90-F140 VanDerWaalsContact O-CE2 3.29Å; C90-F140 WeakPolarHBondContact O-CE2 3.44Å
91	W	98	Very high	91	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-69.3	-16.6	173.3	-86.9	-87.5	0	0	0	113.8	L88 H89 L93 E120 F138 F140 R141 P142 S143 T146 Y147 L150 L168 F172	L88-W91 HydrophobicContact CD2-CZ3 4.24Å; L88-W91 PolarHBondContact O-N 2.85Å; H89-W91 PolarHBondContact O-N 3.05Å; W91-L93 VanDerWaalsContact C-N 3.3Å; W91-E120 PolarHBondContact NE1-OE2 2.93Å; W91-F138 HydrophobicContact CH2-CD2 4.31Å; W91-F138 AromaticContact CH2-CE2 3.45Å; W91-F138 HydrophobicContact CH2-CE2 3.45Å; W91-F138 VanDerWaalsContact CH2-CE2 3.45Å; W91-F138 AromaticContact CH2-CZ 3.86Å; W91-F138 HydrophobicContact CH2-CZ 3.86Å; W91-F138 HydrophobicContact CZ2-CE2 4.06Å; W91-F138 AromaticContact CZ3-CE2 3.98Å; W91-F138 HydrophobicContact CZ3-CE2 3.98Å; W91-F138 HydrophobicContact CZ3-CZ 4.03Å; W91-F140 AromaticContact CD1-CD2 3.87Å; W91-F140 AromaticContact CD2-CD2 3.92Å; W91-F140 HydrophobicContact CD2-CD2 3.92Å; W91-F140 HydrophobicContact CD2-CE2 4.36Å; W91-F140 AromaticContact CE2-CD2 3.69Å; W91-F140 HydrophobicContact CG-CD2 4.05Å; W91-F140 HydrophobicContact CG-CE2 4.34Å; W91-F140 HydrophobicContact CH2-CB 4.5Å; W91-F140 HydrophobicContact CZ2-CB 3.71Å; W91-F140 HydrophobicContact CZ2-CD2 4.18Å; W91-F140 HydrophobicContact CZ2-CG 4.12Å; W91-F140 AromaticContact NE1-CD2 3.64Å; W91-R141 VanDerWaalsContact CD1-O 3.28Å; W91-P142 CarbonylContact O-C 3.54Å; W91-P142 WeakPolarHBondContact O-CA 3.4Å; W91-S143 CarbonylContact O-C 3.54Å; W91-S143 PolarHBondContact O-N 3.2Å; W91-T146 HydrophobicContact CG-CG2 4.37Å; W91-Y147 HydrophobicContact CB-CD2 4.48Å; W91-L150 HydrophobicContact CD2-CD1 3.66Å; W91-L150 HydrophobicContact CE3-CD1 3.66Å; W91-L150 HydrophobicContact CG-CD1 4.23Å; W91-L150 HydrophobicContact CH2-CD1 4.21Å; W91-L150 HydrophobicContact CZ2-CD1 4.19Å; W91-L150 HydrophobicContact CZ3-CD1 3.95Å; W91-L168 HydrophobicContact CH2-CD2 3.59Å; W91-L168 HydrophobicContact CZ3-CD2 3.84Å; W91-F172 HydrophobicContact CH2-CE2 4.18Å; W91-F172 AromaticContact CZ2-CE2 3.84Å; W91-F172 HydrophobicContact CZ2-CE2 3.84Å; W91-F172 AromaticContact CZ2-CZ 3.91Å; W91-F172 HydrophobicContact CZ2-CZ 3.91Å
92	N	95	Very high	92.8	Very high	46 Å²	46	24.2 Å²	24.2	25%	0.246	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-83.1	-4.4	175.5	-81.8	-25.6	0	0	0	113.9	H89 C90 T94 Y147	H89-N92 WeakPolarHBondContact O-CB 3.39Å; H89-N92 PolarHBondContact O-N 3.07Å; C90-N92 PolarHBondContact O-N 2.84Å; N92-T94 PolarHBondContact O-N 2.69Å; N92-Y147 VanDerWaalsContact ND2-CD1 3.28Å; N92-Y147 WeakPolarHBondContact ND2-CD1 3.38Å; N92-Y147 WeakPolarHBondContact ND2-CE1 3.29Å; N92-Y147 VanDerWaalsContact OD1-CD1 3.23Å; N92-Y147 WeakPolarHBondContact OD1-CD1 3.49Å
93	L	96.5	Very high	94.1	Very high	10 Å²	10	24.5 Å²	24.5	5%	0.052	13%	0.13	C	C	.	.			trans	-76.3	53.9	179.4	-55.5	-178.4	0	0	0	112.6	V8 V37 M39 I60 C90 W91 Q95 Y96 P142	V8-L93 HydrophobicContact CG1-CD1 3.82Å; V8-L93 HydrophobicContact CG2-CD1 3.88Å; V37-L93 HydrophobicContact CG1-CD1 4.41Å; M39-L93 HydrophobicContact CG-CD1 4.49Å; M39-L93 HydrophobicContact SD-CD1 4.25Å; I60-L93 HydrophobicContact CD1-CD2 3.4Å; I60-L93 HydrophobicContact CG2-CD2 4.42Å; C90-L93 WeakPolarHBondContact O-CB 3.43Å; C90-L93 WeakPolarHBondContact O-CG 3.47Å; C90-L93 PolarHBondContact O-N 2.98Å; W91-L93 VanDerWaalsContact C-N 3.3Å; L93-Q95 VanDerWaalsContact CA-OE1 3.24Å; L93-Q95 PolarHBondContact O-N 3.39Å; L93-Q95 PolarHBondContact O-OE1 3.44Å; L93-Y96 HydrophobicContact CB-CD2 4.01Å; L93-Y96 PolarHBondContact O-N 3.49Å; L93-P142 HydrophobicContact CB-CB 4.48Å; L93-P142 HydrophobicContact CB-CG 4.45Å; L93-P142 VanDerWaalsContact O-CB 3.24Å; L93-P142 WeakPolarHBondContact O-CB 3.44Å; L93-P142 WeakPolarHBondContact O-CG 3.49Å
94	T	96.5	Very high	95.2	Very high	74 Å²	74	20.9 Å²	20.9	45%	0.454	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-2.6	-173.1	54	0	0	0	0	115.2	N92 Y96 K144	N92-T94 PolarHBondContact O-N 2.69Å; T94-Y96 PolarHBondContact O-N 3.22Å; T94-K144 HydrophobicContact CG2-CG 4.06Å
95	Q	95.9	Very high	96	Very high	100 Å²	100	21 Å²	21	47%	0.467	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.2	164.4	71.5	-87.3	34.9	0	0	112.7	E58 L93	E58-Q95 PolarHBondContact OE2-NE2 2.98Å; L93-Q95 VanDerWaalsContact CA-OE1 3.24Å; L93-Q95 PolarHBondContact O-N 3.39Å; L93-Q95 PolarHBondContact O-OE1 3.44Å
96	Y	97.9	Very high	96.8	Very high	13 Å²	13	20.5 Å²	20.5	5%	0.051	11%	0.107	C	C	.	.			trans	-107.7	144.4	174.5	-54.9	-73	0	0	0	111	G4 A6 C35 V37 E58 L93 T94 C99	G4-Y96 CarbonylContact O-C 3.45Å; G4-Y96 VanDerWaalsContact O-CA 3.28Å; G4-Y96 WeakPolarHBondContact O-CA 3.24Å; G4-Y96 WeakPolarHBondContact O-CB 3.41Å; A6-Y96 HydrophobicContact CB-CD1 3.62Å; A6-Y96 HydrophobicContact CB-CD2 4.14Å; A6-Y96 HydrophobicContact CB-CE1 3.58Å; A6-Y96 HydrophobicContact CB-CE2 4.12Å; A6-Y96 HydrophobicContact CB-CG 3.91Å; C35-Y96 HydrophobicContact CB-CE1 4.08Å; V37-Y96 HydrophobicContact CG2-CE2 3.83Å; V37-Y96 VanDerWaalsContact CG2-OH 3.26Å; V37-Y96 WeakPolarHBondContact CG2-OH 3.19Å; E58-Y96 PolarHBondContact OE1-OH 3.37Å; E58-Y96 VanDerWaalsContact OE1-OH 3.09Å; E58-Y96 PolarHBondContact OE2-OH 3.13Å; L93-Y96 HydrophobicContact CB-CD2 4.01Å; L93-Y96 PolarHBondContact O-N 3.49Å; T94-Y96 PolarHBondContact O-N 3.22Å; Y96-C99 VanDerWaalsContact CB-SG 3.52Å
97	N	97.1	Very high	97.2	Very high	89 Å²	89	20.4 Å²	20.4	48%	0.476	11%	0.106	S	C	.	.	S	Bend	trans	-90.1	-22.5	177.3	66.2	31.3	0	0	0	113.1	G4	G4-N97 VanDerWaalsContact O-CG 3.29Å; G4-N97 PolarHBondContact O-N 3.05Å; G4-N97 PolarHBondContact O-OD1 2.83Å
98	K	98.3	Very high	97.3	Very high	22 Å²	22	20.3 Å²	20.3	10%	0.096	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	136.6	179.6	-173.2	178.7	-61.6	-170.5	0	109.4	E5 A6 F116 R118 V139 F140	E5-K98 WeakPolarHBondContact CA-O 3.43Å; E5-K98 HydrophobicContact CG-CB 4.38Å; A6-K98 PolarHBondContact N-O 2.88Å; K98-F116 HydrophobicContact CD-CB 4.36Å; K98-F116 HydrophobicContact CD-CD1 4.23Å; K98-F116 WeakPolarHBondContact CD-O 3.26Å; K98-F116 WeakPolarHBondContact CE-O 3.27Å; K98-F116 HydrophobicContact CG-CD1 4.18Å; K98-F116 PolarHBondContact NZ-O 2.79Å; K98-R118 WeakPolarHBondContact CE-O 3.37Å; K98-R118 PolarHBondContact NZ-O 3.46Å; K98-V139 HydrophobicContact CD-CG1 4.03Å; K98-V139 HydrophobicContact CG-CG1 4.04Å; K98-F140 WeakPolarHBondContact CA-O 3.36Å
99	C	98.8	Very high	97.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	153.4	179.4	-69	0	0	0	0	110.9	A6 V8 Y96 V139 F140 P142	A6-C99 CarbonylContact O-C 3.14Å; A6-C99 WeakPolarHBondContact O-CA 3.46Å; V8-C99 HydrophobicContact CG2-CB 3.89Å; Y96-C99 VanDerWaalsContact CB-SG 3.52Å; C99-V139 WeakPolarHBondContact O-CA 3.21Å; C99-F140 HydrophobicContact CB-CD1 3.91Å; C99-F140 HydrophobicContact CB-CE1 3.24Å; C99-F140 HydrophobicContact CB-CE2 4.01Å; C99-F140 HydrophobicContact CB-CZ 3.29Å; C99-F140 PolarHBondContact N-O 3Å; C99-F140 WeakPolarHBondContact O-CD1 3.34Å; C99-F140 PolarHBondContact O-N 3.45Å; C99-P142 HydrophobicContact CB-CG 4.36Å
100	V	98.9	Very high	97.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	115.8	165	-179.5	0	0	0	0	107.2	A6 F7 V8 L102 L115 F116 F138 V139	A6-V100 PolarHBondContact O-N 2.96Å; F7-V100 CarbonylContact C-O 3.53Å; F7-V100 WeakPolarHBondContact CA-O 3.43Å; F7-V100 HydrophobicContact CD1-CB 3.62Å; F7-V100 HydrophobicContact CD1-CG1 3.91Å; F7-V100 HydrophobicContact CD1-CG2 4.44Å; F7-V100 HydrophobicContact CE1-CB 3.67Å; F7-V100 HydrophobicContact CE1-CG1 3.78Å; F7-V100 HydrophobicContact CE1-CG2 4.09Å; V8-V100 PolarHBondContact N-O 3.14Å; V100-L102 HydrophobicContact CG1-CD2 4.25Å; V100-L102 HydrophobicContact CG1-CG 4.4Å; V100-L115 HydrophobicContact CG1-CD1 3.94Å; V100-L115 HydrophobicContact CG2-CB 3.85Å; V100-F116 HydrophobicContact CB-CZ 4.2Å; V100-F116 HydrophobicContact CG2-CD1 4.22Å; V100-F116 HydrophobicContact CG2-CD2 4.15Å; V100-F116 HydrophobicContact CG2-CE1 3.88Å; V100-F116 HydrophobicContact CG2-CE2 3.79Å; V100-F116 HydrophobicContact CG2-CG 4.35Å; V100-F116 HydrophobicContact CG2-CZ 3.65Å; V100-F138 CarbonylContact C-O 3.5Å; V100-F138 WeakPolarHBondContact CA-O 3.49Å; V100-V139 HydrophobicContact CG2-CG1 4.45Å; V100-V139 HydrophobicContact CG2-CG2 4.15Å
101	F	98.9	Very high	97.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	136.8	172.9	-163.5	-79.3	0	0	0	109.8	V8 L10 M39 K87 C90 D103 V137 F138 F140	V8-F101 HydrophobicContact CB-CD2 4.31Å; V8-F101 HydrophobicContact CG1-CD2 4.16Å; V8-F101 HydrophobicContact CG1-CE2 4.24Å; V8-F101 CarbonylContact O-C 3.01Å; V8-F101 WeakPolarHBondContact O-CA 3.16Å; L10-F101 HydrophobicContact CB-CZ 3.95Å; M39-F101 HydrophobicContact CE-CE2 3.97Å; K87-F101 HydrophobicContact CD-CE1 3.98Å; K87-F101 HydrophobicContact CD-CZ 3.84Å; K87-F101 HydrophobicContact CG-CE1 4.26Å; K87-F101 HydrophobicContact CG-CE2 3.9Å; K87-F101 HydrophobicContact CG-CZ 3.66Å; C90-F101 HydrophobicContact CB-CD2 3.87Å; C90-F101 HydrophobicContact CB-CE2 4.03Å; F101-D103 VanDerWaalsContact CE1-OD1 3.23Å; F101-D103 WeakPolarHBondContact CE1-OD1 3.47Å; F101-V137 WeakPolarHBondContact O-CA 3.48Å; F101-F138 HydrophobicContact CB-CD1 3.89Å; F101-F138 HydrophobicContact CB-CD2 3.97Å; F101-F138 HydrophobicContact CB-CE1 3.51Å; F101-F138 HydrophobicContact CB-CE2 3.6Å; F101-F138 HydrophobicContact CB-CG 4.11Å; F101-F138 HydrophobicContact CB-CZ 3.36Å; F101-F138 HydrophobicContact CD1-CD1 4.41Å; F101-F138 AromaticContact CD1-CE1 3.7Å; F101-F138 HydrophobicContact CD1-CE1 3.7Å; F101-F138 HydrophobicContact CD1-CZ 4.1Å; F101-F138 HydrophobicContact CD2-CE1 4.44Å; F101-F138 HydrophobicContact CD2-CZ 4Å; F101-F138 HydrophobicContact CG-CD1 4.38Å; F101-F138 AromaticContact CG-CE1 3.6Å; F101-F138 HydrophobicContact CG-CE1 3.6Å; F101-F138 HydrophobicContact CG-CE2 4.25Å; F101-F138 AromaticContact CG-CZ 3.53Å; F101-F138 HydrophobicContact CG-CZ 3.53Å; F101-F138 PolarHBondContact N-O 3.24Å; F101-F138 PolarHBondContact O-N 3.01Å; F101-F140 HydrophobicContact CB-CD1 4.22Å; F101-F140 HydrophobicContact CB-CE1 3.92Å
102	L	98.8	Very high	97.7	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	123.1	174.3	-61.2	170.2	0	0	0	107.8	F7 V8 T9 V23 L27 V100 I108 G136 V137 I211	F7-L102 HydrophobicContact CB-CD1 4.45Å; F7-L102 HydrophobicContact CD1-CD1 3.53Å; F7-L102 HydrophobicContact CD1-CG 4.18Å; F7-L102 HydrophobicContact CE1-CD1 4.15Å; F7-L102 HydrophobicContact CG-CD1 4.28Å; V8-L102 PolarHBondContact O-N 3.25Å; T9-L102 VanDerWaalsContact CA-O 3.3Å; T9-L102 WeakPolarHBondContact CA-O 3.35Å; T9-L102 VanDerWaalsContact CB-O 3.27Å; T9-L102 WeakPolarHBondContact CB-O 3.32Å; T9-L102 PolarHBondContact OG1-O 2.77Å; T9-L102 VanDerWaalsContact OG1-O 3.09Å; V23-L102 HydrophobicContact CG1-CB 4.28Å; V23-L102 HydrophobicContact CG1-CD1 3.94Å; L27-L102 HydrophobicContact CD1-CD1 3.98Å; L27-L102 HydrophobicContact CD2-CD1 4.4Å; V100-L102 HydrophobicContact CG1-CD2 4.25Å; V100-L102 HydrophobicContact CG1-CG 4.4Å; L102-I108 HydrophobicContact CD1-CD1 4.12Å; L102-I108 HydrophobicContact CD1-CG1 4.45Å; L102-G136 CarbonylContact C-O 3.55Å; L102-G136 WeakPolarHBondContact CA-O 3.4Å; L102-V137 HydrophobicContact CD2-CB 4.33Å; L102-V137 HydrophobicContact CD2-CG1 3.82Å; L102-V137 HydrophobicContact CD2-CG2 3.83Å; L102-I211 HydrophobicContact CD2-CD1 3.93Å
103	D	98.1	Very high	97.8	Very high	31 Å²	31	23.1 Å²	23.1	17%	0.166	12%	0.124	C	C	.	.			trans	-62.8	149.1	169.5	-81.8	-21.8	0	0	0	110	K87 F101 D105 T106 G136	K87-D103 IonicContact NZ-OD1 3.4Å; K87-D103 PolarHBondContact NZ-OD1 2.95Å; K87-D103 IonicContact NZ-OD2 3.37Å; K87-D103 PolarHBondContact NZ-OD2 3.16Å; F101-D103 VanDerWaalsContact CE1-OD1 3.23Å; F101-D103 WeakPolarHBondContact CE1-OD1 3.47Å; D103-D105 WeakPolarHBondContact CB-OD1 3.44Å; D103-D105 PolarHBondContact O-N 3.27Å; D103-D105 VanDerWaalsContact O-N 3.13Å; D103-T106 HydrophobicContact CB-CG2 4.4Å; D103-T106 WeakPolarHBondContact O-CB 3.1Å; D103-T106 WeakPolarHBondContact O-CG2 3.49Å; D103-T106 PolarHBondContact O-N 2.99Å; D103-T106 VanDerWaalsContact O-N 3.07Å; D103-T106 PolarHBondContact O-OG1 3.15Å; D103-G136 PolarHBondContact N-O 3.13Å; D103-G136 VanDerWaalsContact OD2-CA 3.22Å; D103-G136 WeakPolarHBondContact OD2-CA 3.39Å
104	A	97.6	Very high	97.9	Very high	3 Å²	3	24.8 Å²	24.8	3%	0.025	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.1	-175.2	0	0	0	0	0	113.7	L10 Y16 G19 A20 T106	L10-A104 WeakPolarHBondContact O-CB 3.41Å; Y16-A104 HydrophobicContact CD1-CB 4.06Å; G19-A104 CarbonylContact C-O 3.45Å; G19-A104 WeakPolarHBondContact CA-O 3.4Å; A20-A104 HydrophobicContact CB-CB 4.24Å; A104-T106 VanDerWaalsContact C-N 3.31Å
105	D	96.2	Very high	98	Very high	7 Å²	7	21.2 Å²	21.2	4%	0.037	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	27.7	171.9	58.1	0.4	0	0	0	112.5	D103 H213 F214 K219 W221	D103-D105 WeakPolarHBondContact CB-OD1 3.44Å; D103-D105 PolarHBondContact O-N 3.27Å; D103-D105 VanDerWaalsContact O-N 3.13Å; D105-H213 IonicContact OD1-CD2 3.69Å; D105-H213 PolarHBondContact OD1-CD2 3.09Å; D105-H213 IonicContact OD1-NE2 3.98Å; D105-H213 PolarHBondContact OD1-NE2 2.79Å; D105-H213 IonicContact OD2-NE2 2.77Å; D105-F214 WeakPolarHBondContact O-CD2 3.44Å; D105-F214 PolarHBondContact O-N 3.36Å; D105-K219 HydrophobicContact CB-CD 4.04Å; D105-K219 VanDerWaalsContact OD2-CE 3.29Å; D105-K219 WeakPolarHBondContact OD2-CE 3.41Å; D105-K219 IonicContact OD2-NZ 3.84Å; D105-K219 PolarHBondContact OD2-NZ 3.03Å; D105-W221 HydrophobicContact CB-CH2 3.84Å; D105-W221 HydrophobicContact CB-CZ3 4.25Å
106	T	98	Very high	98.1	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	156	169.3	62.4	0	0	0	0	112.2	V23 D103 A104 V137 I211 V212 H213	V23-T106 WeakPolarHBondContact CG2-O 3.39Å; V23-T106 WeakPolarHBondContact CG2-OG1 3.46Å; D103-T106 HydrophobicContact CB-CG2 4.4Å; D103-T106 WeakPolarHBondContact O-CB 3.1Å; D103-T106 WeakPolarHBondContact O-CG2 3.49Å; D103-T106 PolarHBondContact O-N 2.99Å; D103-T106 VanDerWaalsContact O-N 3.07Å; D103-T106 PolarHBondContact O-OG1 3.15Å; A104-T106 VanDerWaalsContact C-N 3.31Å; T106-V137 HydrophobicContact CG2-CG2 4.17Å; T106-I211 HydrophobicContact CG2-CG2 4.33Å; T106-V212 CarbonylContact C-O 3.5Å; T106-V212 WeakPolarHBondContact CA-O 3.4Å; T106-H213 HydrophobicContact CG2-CB 4.16Å
107	L	97.7	Very high	98.1	Very high	5 Å²	5	23.5 Å²	23.5	3%	0.026	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.5	173.8	173.2	67.5	0	0	0	110	V22 L109 I211 V212 F214 L239 W240 E243	V22-L107 HydrophobicContact CG1-CD1 3.64Å; L107-L109 HydrophobicContact CD2-CD2 3.89Å; L107-L109 HydrophobicContact CG-CD2 3.98Å; L107-I211 WeakPolarHBondContact O-CA 3.36Å; L107-V212 HydrophobicContact CB-CB 4.49Å; L107-V212 PolarHBondContact N-O 3.27Å; L107-V212 PolarHBondContact O-N 3.01Å; L107-F214 HydrophobicContact CB-CE2 3.81Å; L107-F214 HydrophobicContact CD2-CE2 4.43Å; L107-F214 HydrophobicContact CD2-CZ 4.41Å; L107-L239 HydrophobicContact CD2-CB 3.95Å; L107-W240 HydrophobicContact CD2-CB 4.28Å; L107-E243 HydrophobicContact CD1-CB 4.46Å
108	I	98.4	Very high	98.2	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	124.6	-176.9	-61.9	84.3	0	0	0	109	V23 S26 L27 H30 L102 C110 V112 I211	V23-I108 HydrophobicContact CB-CD1 4.37Å; V23-I108 HydrophobicContact CG1-CD1 3.99Å; V23-I108 HydrophobicContact CG2-CD1 4.43Å; S26-I108 WeakPolarHBondContact CB-O 3.33Å; S26-I108 VanDerWaalsContact OG-CD1 3.29Å; S26-I108 WeakPolarHBondContact OG-CD1 3.36Å; S26-I108 PolarHBondContact OG-N 3.49Å; L27-I108 HydrophobicContact CD2-CD1 4.49Å; L27-I108 HydrophobicContact CD2-CG1 4.06Å; L27-I108 HydrophobicContact CD2-CG2 4.31Å; L27-I108 HydrophobicContact CG-CD1 4.12Å; L27-I108 HydrophobicContact CG-CG1 4.19Å; H30-I108 PolarHBondContact CE1-O 2.73Å; H30-I108 PolarHBondContact ND1-O 3.17Å; L102-I108 HydrophobicContact CD1-CD1 4.12Å; L102-I108 HydrophobicContact CD1-CG1 4.45Å; I108-C110 WeakPolarHBondContact CG2-O 3.46Å; I108-V112 HydrophobicContact CG2-CG2 4.22Å; I108-I211 HydrophobicContact CG1-CG1 4.36Å
109	L	97.1	Very high	98.2	Very high	12 Å²	12	24.3 Å²	24.3	6%	0.063	12%	0.122	C	C	.	.			trans	-103.4	-13.7	-173.9	-58.7	-177	0	0	0	113.7	H30 L107 A209 K210 V212 F236 L239	H30-L109 VanDerWaalsContact CE1-C 3.48Å; H30-L109 PolarHBondContact NE2-O 3Å; H30-L109 VanDerWaalsContact NE2-O 3.11Å; L107-L109 HydrophobicContact CD2-CD2 3.89Å; L107-L109 HydrophobicContact CG-CD2 3.98Å; L109-A209 HydrophobicContact CD1-CB 3.96Å; L109-K210 PolarHBondContact N-O 2.81Å; L109-V212 HydrophobicContact CD1-CG2 3.66Å; L109-V212 HydrophobicContact CG-CG2 4.24Å; L109-F236 HydrophobicContact CD1-CE1 4.1Å; L109-L239 HydrophobicContact CD2-CD1 4.34Å
110	C	98	Very high	98.2	Very high	39 Å²	39	26.1 Å²	26.1	26%	0.264	13%	0.13	S	C	.	.	S	Bend	trans	-156.1	177.5	175.8	70.5	0	0	0	0	110.9	I108 K210	I108-C110 WeakPolarHBondContact CG2-O 3.46Å; C110-K210 WeakPolarHBondContact SG-CG 3.37Å
111	N	98.6	Very high	98.1	Very high	57 Å²	57	26.4 Å²	26.4	31%	0.305	13%	0.132	S	C	.	.			trans	-64.6	138.9	172	-166.8	-71.8	0	0	0	109.5	H30 G31 D113	H30-N111 HydrophobicContact CB-CB 4.5Å; H30-N111 WeakPolarHBondContact O-CB 3.27Å; H30-N111 PolarHBondContact O-ND2 2.86Å; G31-N111 PolarHBondContact O-ND2 3.45Å; N111-D113 VanDerWaalsContact OD1-CB 3.29Å; N111-D113 WeakPolarHBondContact OD1-CB 3.24Å; N111-D113 PolarHBondContact OD1-N 3.22Å
112	V	98.6	Very high	98.1	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	13%	0.132	C	C	.	.			trans	-133.9	21.6	-178.2	-68	0	0	0	0	111.8	F7 L27 I108 E114 L115 Y188 K210 I211	F7-V112 HydrophobicContact CE1-CG2 4.02Å; F7-V112 HydrophobicContact CZ-CG2 3.82Å; L27-V112 HydrophobicContact CD2-CG2 4.28Å; I108-V112 HydrophobicContact CG2-CG2 4.22Å; V112-E114 VanDerWaalsContact C-OE2 3.27Å; V112-E114 WeakPolarHBondContact CA-OE2 3.49Å; V112-E114 PolarHBondContact O-N 3.32Å; V112-E114 VanDerWaalsContact O-N 3.12Å; V112-L115 HydrophobicContact CB-CD1 4.05Å; V112-L115 HydrophobicContact CB-CG 4.38Å; V112-L115 HydrophobicContact CG2-CD1 4.37Å; V112-L115 WeakPolarHBondContact O-CB 3.23Å; V112-L115 WeakPolarHBondContact O-CG 3.06Å; V112-L115 PolarHBondContact O-N 2.91Å; V112-Y188 HydrophobicContact CG1-CD1 4.17Å; V112-Y188 HydrophobicContact CG1-CE1 4.15Å; V112-K210 HydrophobicContact CG1-CB 3.94Å; V112-K210 HydrophobicContact CG1-CD 4.32Å; V112-I211 HydrophobicContact CG1-CD1 4.22Å; V112-I211 HydrophobicContact CG1-CG1 4.1Å; V112-I211 HydrophobicContact CG2-CD1 4.26Å
113	D	98.6	Very high	98.1	Very high	19 Å²	19	26.4 Å²	26.4	10%	0.102	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-62.1	-18.7	179.7	-74.9	5.7	0	0	0	111.8	T32 T33 N111 L115 F116	T32-D113 WeakPolarHBondContact CB-OD1 3.31Å; T32-D113 PolarHBondContact OG1-OD1 2.99Å; T33-D113 PolarHBondContact N-OD2 2.92Å; T33-D113 PolarHBondContact OG1-OD2 3.32Å; N111-D113 VanDerWaalsContact OD1-CB 3.29Å; N111-D113 WeakPolarHBondContact OD1-CB 3.24Å; N111-D113 PolarHBondContact OD1-N 3.22Å; D113-L115 PolarHBondContact O-N 3.35Å; D113-F116 WeakPolarHBondContact O-CD2 3.28Å; D113-F116 PolarHBondContact O-N 3.19Å
114	E	98.4	Very high	98.1	Very high	45 Å²	45	24.9 Å²	24.9	21%	0.21	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-63.9	-17	172.5	69.1	-83.9	-164.3	0	0	113.8	V112 F116 Q117 Y188 K210	V112-E114 VanDerWaalsContact C-OE2 3.27Å; V112-E114 WeakPolarHBondContact CA-OE2 3.49Å; V112-E114 PolarHBondContact O-N 3.32Å; V112-E114 VanDerWaalsContact O-N 3.12Å; E114-F116 PolarHBondContact O-N 3.48Å; E114-Q117 VanDerWaalsContact O-CB 3.29Å; E114-Q117 WeakPolarHBondContact O-CB 3.39Å; E114-Q117 WeakPolarHBondContact O-CG 3.46Å; E114-Q117 PolarHBondContact O-N 3.25Å; E114-Y188 HydrophobicContact CG-CE1 4.47Å; E114-Y188 WeakPolarHBondContact OE1-CE1 3.5Å; E114-Y188 PolarHBondContact OE1-OH 2.58Å; E114-K210 IonicContact OE1-NZ 3.97Å; E114-K210 PolarHBondContact OE1-NZ 3.39Å
115	L	98.6	Very high	98.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-60.4	-28.2	173.6	-72.2	176.8	0	0	0	112.1	V100 V112 D113 Q117 R118 V139 L184 Y188 I211	V100-L115 HydrophobicContact CG1-CD1 3.94Å; V100-L115 HydrophobicContact CG2-CB 3.85Å; V112-L115 HydrophobicContact CB-CD1 4.05Å; V112-L115 HydrophobicContact CB-CG 4.38Å; V112-L115 HydrophobicContact CG2-CD1 4.37Å; V112-L115 WeakPolarHBondContact O-CB 3.23Å; V112-L115 WeakPolarHBondContact O-CG 3.06Å; V112-L115 PolarHBondContact O-N 2.91Å; D113-L115 PolarHBondContact O-N 3.35Å; L115-Q117 PolarHBondContact O-N 3.31Å; L115-Q117 VanDerWaalsContact O-N 3.13Å; L115-R118 WeakPolarHBondContact O-CB 3.33Å; L115-R118 WeakPolarHBondContact O-CG 3.28Å; L115-R118 PolarHBondContact O-N 2.96Å; L115-V139 HydrophobicContact CB-CG2 4.26Å; L115-L184 HydrophobicContact CD2-CD1 3.99Å; L115-L184 HydrophobicContact CD2-CD2 3.87Å; L115-Y188 HydrophobicContact CD1-CD1 4.04Å; L115-Y188 HydrophobicContact CD2-CD1 3.62Å; L115-Y188 HydrophobicContact CD2-CE1 3.88Å; L115-Y188 HydrophobicContact CD2-CG 4.01Å; L115-Y188 HydrophobicContact CG-CD1 3.94Å; L115-Y188 HydrophobicContact CG-CE1 4.08Å; L115-I211 HydrophobicContact CD1-CD1 4.18Å
116	F	98.4	Very high	98	Very high	6 Å²	6	27.3 Å²	27.3	3%	0.026	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-68.7	-8.6	176.2	-68.4	-87	0	0	0	113.6	E5 A6 F7 R34 K98 V100 D113 E114 R118	E5-F116 HydrophobicContact CB-CD1 3.72Å; E5-F116 HydrophobicContact CB-CE1 3.71Å; E5-F116 HydrophobicContact CB-CG 4.49Å; E5-F116 HydrophobicContact CB-CZ 4.48Å; E5-F116 HydrophobicContact CG-CD1 3.77Å; E5-F116 HydrophobicContact CG-CE1 4.24Å; A6-F116 WeakPolarHBondContact O-CE1 3.36Å; A6-F116 WeakPolarHBondContact O-CZ 3.43Å; F7-F116 HydrophobicContact CD1-CZ 4.49Å; F7-F116 HydrophobicContact CD2-CE2 4.08Å; F7-F116 HydrophobicContact CD2-CZ 4.13Å; F7-F116 HydrophobicContact CE1-CE2 4.04Å; F7-F116 HydrophobicContact CE1-CZ 4.4Å; F7-F116 AromaticContact CE2-CE2 3.51Å; F7-F116 HydrophobicContact CE2-CE2 3.51Å; F7-F116 HydrophobicContact CE2-CZ 4.03Å; F7-F116 HydrophobicContact CG-CZ 4.36Å; F7-F116 HydrophobicContact CZ-CD2 4.46Å; F7-F116 AromaticContact CZ-CE2 3.49Å; F7-F116 HydrophobicContact CZ-CE2 3.49Å; F7-F116 VanDerWaalsContact CZ-CE2 3.49Å; F7-F116 HydrophobicContact CZ-CZ 4.18Å; R34-F116 HydrophobicContact CB-CE2 4.18Å; R34-F116 HydrophobicContact CB-CZ 4.12Å; R34-F116 HydrophobicContact CG-CD2 3.96Å; R34-F116 HydrophobicContact CG-CE2 3.52Å; R34-F116 HydrophobicContact CG-CZ 3.84Å; K98-F116 HydrophobicContact CD-CB 4.36Å; K98-F116 HydrophobicContact CD-CD1 4.23Å; K98-F116 WeakPolarHBondContact CD-O 3.26Å; K98-F116 WeakPolarHBondContact CE-O 3.27Å; K98-F116 HydrophobicContact CG-CD1 4.18Å; K98-F116 PolarHBondContact NZ-O 2.79Å; V100-F116 HydrophobicContact CB-CZ 4.2Å; V100-F116 HydrophobicContact CG2-CD1 4.22Å; V100-F116 HydrophobicContact CG2-CD2 4.15Å; V100-F116 HydrophobicContact CG2-CE1 3.88Å; V100-F116 HydrophobicContact CG2-CE2 3.79Å; V100-F116 HydrophobicContact CG2-CG 4.35Å; V100-F116 HydrophobicContact CG2-CZ 3.65Å; D113-F116 WeakPolarHBondContact O-CD2 3.28Å; D113-F116 PolarHBondContact O-N 3.19Å; E114-F116 PolarHBondContact O-N 3.48Å; F116-R118 PolarHBondContact O-N 3.45Å
117	Q	97.7	Very high	97.7	Very high	154 Å²	154	30 Å²	30	72%	0.72	16%	0.155	S	C	*	.	G	3₁₀ helix	trans	-76.5	-12.4	170.7	-59.4	175	8	0	0	112.5	E114 L115	E114-Q117 VanDerWaalsContact O-CB 3.29Å; E114-Q117 WeakPolarHBondContact O-CB 3.39Å; E114-Q117 WeakPolarHBondContact O-CG 3.46Å; E114-Q117 PolarHBondContact O-N 3.25Å; L115-Q117 PolarHBondContact O-N 3.31Å; L115-Q117 VanDerWaalsContact O-N 3.13Å
118	R	98.2	Very high	97.3	Very high	60 Å²	60	32.8 Å²	32.8	23%	0.226	19%	0.185	C	C	.	.	S	Bend	trans	-86.8	158.9	-178	-52.3	-65.1	163.1	88.7	5.2	112.3	K98 L115 F116 S122 V139 L184	K98-R118 WeakPolarHBondContact CE-O 3.37Å; K98-R118 PolarHBondContact NZ-O 3.46Å; L115-R118 WeakPolarHBondContact O-CB 3.33Å; L115-R118 WeakPolarHBondContact O-CG 3.28Å; L115-R118 PolarHBondContact O-N 2.96Å; F116-R118 PolarHBondContact O-N 3.45Å; R118-S122 WeakPolarHBondContact CB-OG 3.32Å; R118-V139 HydrophobicContact CB-CB 4.35Å; R118-V139 HydrophobicContact CB-CG1 4.35Å; R118-V139 HydrophobicContact CB-CG2 4.12Å; R118-L184 HydrophobicContact CG-CD2 3.86Å; R118-L184 VanDerWaalsContact NH1-CD2 3.33Å
119	D	98.1	Very high	97.1	Very high	69 Å²	69	40.9 Å²	40.9	37%	0.369	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-99.2	168	178	-79	-41.4	0	0	0	112.3	S122 R141	D119-S122 WeakPolarHBondContact O-CB 3.43Å; D119-S122 PolarHBondContact O-N 2.78Å; D119-S122 VanDerWaalsContact O-N 3.17Å; D119-S122 PolarHBondContact O-OG 3.44Å; D119-R141 IonicContact OD1-CZ 2.96Å; D119-R141 VanDerWaalsContact OD1-CZ 3.25Å; D119-R141 IonicContact OD1-NH1 3.25Å; D119-R141 PolarHBondContact OD1-NH1 2.9Å; D119-R141 IonicContact OD1-NH2 3.88Å; D119-R141 PolarHBondContact OD1-NH2 3.42Å
120	E	98.4	Very high	97	Very high	38 Å²	38	43.9 Å²	43.9	18%	0.178	24%	0.236	C	C	.	.	S	Bend	trans	-77	140.6	174	-178.9	177.5	79.3	0	0	111.4	W91 F140 R141 F172 K182	W91-E120 PolarHBondContact NE1-OE2 2.93Å; E120-F140 HydrophobicContact CG-CB 4.38Å; E120-F140 WeakPolarHBondContact OE2-CB 2.95Å; E120-R141 HydrophobicContact CB-CB 4.49Å; E120-R141 HydrophobicContact CB-CG 4.28Å; E120-R141 PolarHBondContact OE2-N 3.14Å; E120-F172 HydrophobicContact CG-CE1 4.25Å; E120-F172 HydrophobicContact CG-CZ 4.43Å; E120-K182 WeakPolarHBondContact O-CE 3.16Å; E120-K182 PolarHBondContact O-NZ 3.34Å
121	L	98.4	Very high	97	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.031	25%	0.248	C	C	.	.	S	Bend	cis	-93.2	121.3	-17	-179	-75.6	0	0	0	107.4	A123 F133 F138 V139 F140 F172 K182	L121-A123 HydrophobicContact CD1-CB 3.75Å; L121-F133 HydrophobicContact CD1-CD1 4.23Å; L121-F133 HydrophobicContact CD1-CD2 4.19Å; L121-F133 HydrophobicContact CD1-CE1 3.93Å; L121-F133 HydrophobicContact CD1-CE2 3.9Å; L121-F133 HydrophobicContact CD1-CG 4.34Å; L121-F133 HydrophobicContact CD1-CZ 3.75Å; L121-F133 HydrophobicContact CG-CZ 4.36Å; L121-F138 HydrophobicContact CD2-CB 3.78Å; L121-F138 HydrophobicContact CD2-CD2 3.56Å; L121-F138 HydrophobicContact CD2-CE2 4.45Å; L121-F138 HydrophobicContact CD2-CG 3.94Å; L121-V139 WeakPolarHBondContact CD2-O 3.32Å; L121-F140 HydrophobicContact CD2-CB 4.46Å; L121-F172 HydrophobicContact CB-CB 4.29Å; L121-F172 HydrophobicContact CB-CD1 3.7Å; L121-F172 HydrophobicContact CB-CD2 4.07Å; L121-F172 HydrophobicContact CB-CE1 3.96Å; L121-F172 HydrophobicContact CB-CE2 4.31Å; L121-F172 HydrophobicContact CB-CG 3.76Å; L121-F172 HydrophobicContact CB-CZ 4.25Å; L121-F172 HydrophobicContact CG-CB 4.43Å; L121-F172 HydrophobicContact CG-CD1 4.39Å; L121-F172 HydrophobicContact CG-CD2 3.83Å; L121-F172 HydrophobicContact CG-CE2 4.13Å; L121-F172 HydrophobicContact CG-CG 3.97Å; L121-K182 WeakPolarHBondContact O-CB 3.21Å
122	S	98.8	Very high	96.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.2	173.7	-60.4	0	0	0	0	111	R118 D119 F138 V139 K182	R118-S122 WeakPolarHBondContact CB-OG 3.32Å; D119-S122 WeakPolarHBondContact O-CB 3.43Å; D119-S122 PolarHBondContact O-N 2.78Å; D119-S122 VanDerWaalsContact O-N 3.17Å; D119-S122 PolarHBondContact O-OG 3.44Å; S122-F138 CarbonylContact O-C 3.56Å; S122-F138 WeakPolarHBondContact O-CA 3.37Å; S122-V139 PolarHBondContact N-O 3.04Å; S122-V139 PolarHBondContact O-N 3Å; S122-K182 CarbonylContact C-O 3.56Å; S122-K182 WeakPolarHBondContact CA-O 3.35Å; S122-K182 WeakPolarHBondContact OG-CA 3.34Å
123	A	98.8	Very high	96.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	165.2	-177.5	0	0	0	0	0	110.5	L121 F133 F138 W175 K182 L184	L121-A123 HydrophobicContact CD1-CB 3.75Å; A123-F133 HydrophobicContact CB-CB 3.59Å; A123-F133 HydrophobicContact CB-CD2 3.68Å; A123-F133 HydrophobicContact CB-CG 3.76Å; A123-F138 HydrophobicContact CB-CB 3.9Å; A123-W175 WeakPolarHBondContact O-CZ2 3.47Å; A123-W175 PolarHBondContact O-NE1 2.91Å; A123-K182 PolarHBondContact N-O 3.22Å; A123-L184 PolarHBondContact O-N 3.39Å
124	A	98.1	Very high	96.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	151.6	176	0	0	0	0	0	110.8	F133 N134 L184 N189	A124-F133 CarbonylContact O-C 3.39Å; A124-F133 VanDerWaalsContact O-CA 3.29Å; A124-F133 WeakPolarHBondContact O-CA 3.47Å; A124-F133 WeakPolarHBondContact O-CB 3.45Å; A124-N134 PolarHBondContact O-N 2.97Å; A124-L184 HydrophobicContact CB-CB 4.16Å; A124-N189 HydrophobicContact CB-CB 3.5Å; A124-N189 VanDerWaalsContact CB-CB 3.5Å
125	P	96.8	Very high	96.8	Very high	33 Å²	33	42.4 Å²	42.4	21%	0.214	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	143.2	176	25.3	-33.5	0	0	0	112	W175 L184 F186	P125-W175 HydrophobicContact CB-CH2 3.96Å; P125-L184 WeakPolarHBondContact CD-O 3.46Å; P125-F186 HydrophobicContact CG-CD2 4.34Å
126	D	94.9	Very high	96.8	Very high	27 Å²	27	42.4 Å²	42.4	14%	0.144	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-72.4	134.6	168.1	-175.4	82.2	0	0	0	110.1	G128 W129 P130 C132 N134 Q165	D126-G128 VanDerWaalsContact C-N 3.28Å; D126-G128 PolarHBondContact O-N 2.9Å; D126-G128 WeakPolarHBondContact OD2-CA 3.31Å; D126-G128 PolarHBondContact OD2-N 3.32Å; D126-W129 CarbonylContact O-C 3.55Å; D126-W129 PolarHBondContact OD2-N 3.42Å; D126-W129 VanDerWaalsContact OD2-N 3.11Å; D126-P130 WeakPolarHBondContact O-CA 3.47Å; D126-C132 HydrophobicContact CB-CB 4.48Å; D126-C132 WeakPolarHBondContact CB-O 3.23Å; D126-C132 PolarHBondContact N-O 3.09Å; D126-N134 HydrophobicContact CB-CB 4.25Å; D126-N134 PolarHBondContact OD1-ND2 3.22Å; D126-Q165 PolarHBondContact OD1-NE2 2.93Å; D126-Q165 VanDerWaalsContact OD1-NE2 3.08Å
127	P	90.6	Very high	96.8	Very high	57 Å²	57	42.1 Å²	42.1	37%	0.37	23%	0.227	S	C	.	.	S	Bend	trans	-70.9	-21.6	-178.6	29.2	-36.8	0	0	0	113.6	F186 C191	P127-F186 HydrophobicContact CB-CE2 4.28Å; P127-F186 HydrophobicContact CB-CZ 4.17Å; P127-C191 HydrophobicContact CG-CB 3.81Å
128	G	90.5	Very high	96.9	Very high	63 Å²	63	34.8 Å²	34.8	65%	0.649	19%	0.193	S	C	*	.	S	Bend	trans	-79.6	-55.1	178.2	0	0	0	0	0	111.6	D126	D126-G128 VanDerWaalsContact C-N 3.28Å; D126-G128 PolarHBondContact O-N 2.9Å; D126-G128 WeakPolarHBondContact OD2-CA 3.31Å; D126-G128 PolarHBondContact OD2-N 3.32Å
129	W	94.3	Very high	96.9	Very high	172 Å²	172	32 Å²	32	65%	0.652	18%	0.183	S	C	*	.	S	Bend	trans	-124.1	96.7	176.7	-167.2	-85.7	0	0	0	110.4	D126 D131 C132	D126-W129 CarbonylContact O-C 3.55Å; D126-W129 PolarHBondContact OD2-N 3.42Å; D126-W129 VanDerWaalsContact OD2-N 3.11Å; W129-D131 PolarHBondContact O-N 3.08Å; W129-D131 VanDerWaalsContact O-N 3.11Å; W129-C132 WeakPolarHBondContact O-CA 3.48Å; W129-C132 WeakPolarHBondContact O-CB 3.22Å; W129-C132 PolarHBondContact O-N 3.28Å
130	P	94.1	Very high	96.9	Very high	76 Å²	76	28.7 Å²	28.7	49%	0.494	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-8.8	-166.7	28	-36.3	0	0	0	115.5	D126 C132 R183	D126-P130 WeakPolarHBondContact O-CA 3.47Å; P130-C132 VanDerWaalsContact C-N 3.29Å; P130-R183 PolarHBondContact O-NH2 3.25Å
131	D	97.3	Very high	96.9	Very high	94 Å²	94	31.7 Å²	31.7	50%	0.503	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-9.5	168.5	-73.5	-14.3	0	0	0	112.7	W129 S176 R183	W129-D131 PolarHBondContact O-N 3.08Å; W129-D131 VanDerWaalsContact O-N 3.11Å; D131-S176 WeakPolarHBondContact O-CB 3.29Å; D131-R183 IonicContact OD1-NH2 3.42Å
132	C	97.9	Very high	96.9	Very high	22 Å²	22	32.2 Å²	32.2	15%	0.149	18%	0.178	C	C	.	.	S	Bend	trans	-95.7	146.2	163.6	-67.4	0	0	0	0	109.2	D126 W129 P130 N169	D126-C132 HydrophobicContact CB-CB 4.48Å; D126-C132 WeakPolarHBondContact CB-O 3.23Å; D126-C132 PolarHBondContact N-O 3.09Å; W129-C132 WeakPolarHBondContact O-CA 3.48Å; W129-C132 WeakPolarHBondContact O-CB 3.22Å; W129-C132 PolarHBondContact O-N 3.28Å; P130-C132 VanDerWaalsContact C-N 3.29Å; C132-N169 WeakPolarHBondContact CA-OD1 3.45Å; C132-N169 WeakPolarHBondContact CB-OD1 3.29Å
133	F	98.3	Very high	96.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	151.8	166.1	59	-96.2	0	0	0	111.2	L121 A123 A124 L168 N169 F172 W175	L121-F133 HydrophobicContact CD1-CD1 4.23Å; L121-F133 HydrophobicContact CD1-CD2 4.19Å; L121-F133 HydrophobicContact CD1-CE1 3.93Å; L121-F133 HydrophobicContact CD1-CE2 3.9Å; L121-F133 HydrophobicContact CD1-CG 4.34Å; L121-F133 HydrophobicContact CD1-CZ 3.75Å; L121-F133 HydrophobicContact CG-CZ 4.36Å; A123-F133 HydrophobicContact CB-CB 3.59Å; A123-F133 HydrophobicContact CB-CD2 3.68Å; A123-F133 HydrophobicContact CB-CG 3.76Å; A124-F133 CarbonylContact O-C 3.39Å; A124-F133 VanDerWaalsContact O-CA 3.29Å; A124-F133 WeakPolarHBondContact O-CA 3.47Å; A124-F133 WeakPolarHBondContact O-CB 3.45Å; F133-L168 HydrophobicContact CE2-CB 3.88Å; F133-L168 HydrophobicContact CZ-CB 3.83Å; F133-L168 WeakPolarHBondContact CZ-O 3.22Å; F133-N169 WeakPolarHBondContact CD1-OD1 3.45Å; F133-N169 HydrophobicContact CE1-CB 4.35Å; F133-N169 WeakPolarHBondContact CE1-OD1 3.4Å; F133-N169 PolarHBondContact N-OD1 3.13Å; F133-N169 PolarHBondContact O-ND2 2.96Å; F133-F172 HydrophobicContact CE1-CB 4.03Å; F133-F172 HydrophobicContact CZ-CB 4.2Å; F133-F172 HydrophobicContact CZ-CD2 4.43Å; F133-W175 HydrophobicContact CB-CD2 3.77Å; F133-W175 HydrophobicContact CB-CE3 3.91Å; F133-W175 HydrophobicContact CB-CG 4.45Å; F133-W175 HydrophobicContact CB-CH2 3.88Å; F133-W175 HydrophobicContact CB-CZ2 3.71Å; F133-W175 HydrophobicContact CB-CZ3 3.97Å; F133-W175 HydrophobicContact CD1-CB 3.83Å; F133-W175 AromaticContact CD1-CD2 3.58Å; F133-W175 HydrophobicContact CD1-CD2 3.58Å; F133-W175 AromaticContact CD1-CE3 3.88Å; F133-W175 HydrophobicContact CD1-CE3 3.88Å; F133-W175 AromaticContact CD1-CG 3.52Å; F133-W175 HydrophobicContact CD1-CG 3.52Å; F133-W175 HydrophobicContact CE1-CB 4.04Å; F133-W175 HydrophobicContact CE1-CG 4.16Å; F133-W175 HydrophobicContact CG-CD2 4.13Å; F133-W175 HydrophobicContact CG-CE3 4.42Å; F133-W175 HydrophobicContact CG-CG 4.35Å
134	N	97.7	Very high	96.7	Very high	9 Å²	9	40.2 Å²	40.2	5%	0.048	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	126.1	171	-174.1	-83.7	0	0	0	110.2	A124 D126 G136 Q165 N189 H213	A124-N134 PolarHBondContact O-N 2.97Å; D126-N134 HydrophobicContact CB-CB 4.25Å; D126-N134 PolarHBondContact OD1-ND2 3.22Å; N134-G136 PolarHBondContact O-N 2.91Å; N134-G136 WeakPolarHBondContact OD1-CA 3.16Å; N134-G136 PolarHBondContact OD1-N 3.12Å; N134-Q165 VanDerWaalsContact CA-OE1 3.26Å; N134-Q165 PolarHBondContact ND2-OE1 3.36Å; N134-N189 WeakPolarHBondContact CB-ND2 3.48Å; N134-N189 PolarHBondContact OD1-ND2 3.39Å; N134-H213 PolarHBondContact OD1-CE1 2.68Å; N134-H213 VanDerWaalsContact OD1-CE1 3.3Å; N134-H213 PolarHBondContact OD1-ND1 3.48Å
135	S	98	Very high	96.7	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.028	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	5.2	-175.9	64.5	0	0	0	0	114.4	K87 V137 F138 D164 Q165	K87-S135 PolarHBondContact NZ-O 3.06Å; S135-V137 VanDerWaalsContact C-N 3.32Å; S135-F138 VanDerWaalsContact O-CD1 3.28Å; S135-F138 WeakPolarHBondContact O-CD1 3.4Å; S135-F138 WeakPolarHBondContact O-CE1 3.44Å; S135-D164 VanDerWaalsContact CB-OD2 3.22Å; S135-D164 WeakPolarHBondContact CB-OD2 3.15Å; S135-D164 PolarHBondContact OG-OD2 3.13Å; S135-Q165 VanDerWaalsContact N-OE1 3.15Å; S135-Q165 WeakPolarHBondContact OG-CA 3.09Å; S135-Q165 WeakPolarHBondContact OG-CB 3.35Å
136	G	97.6	Very high	96.8	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	-25.3	176.7	0	0	0	0	0	114.3	L102 D103 N134	L102-G136 CarbonylContact C-O 3.55Å; L102-G136 WeakPolarHBondContact CA-O 3.4Å; D103-G136 PolarHBondContact N-O 3.13Å; D103-G136 VanDerWaalsContact OD2-CA 3.22Å; D103-G136 WeakPolarHBondContact OD2-CA 3.39Å; N134-G136 PolarHBondContact O-N 2.91Å; N134-G136 WeakPolarHBondContact OD1-CA 3.16Å; N134-G136 PolarHBondContact OD1-N 3.12Å
137	V	98.8	Very high	96.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	119.2	174.3	-178.5	0	0	0	0	109.8	F101 L102 T106 S135 N189 I211	F101-V137 WeakPolarHBondContact O-CA 3.48Å; L102-V137 HydrophobicContact CD2-CB 4.33Å; L102-V137 HydrophobicContact CD2-CG1 3.82Å; L102-V137 HydrophobicContact CD2-CG2 3.83Å; T106-V137 HydrophobicContact CG2-CG2 4.17Å; S135-V137 VanDerWaalsContact C-N 3.32Å; V137-N189 HydrophobicContact CB-CB 3.99Å; V137-N189 HydrophobicContact CG2-CB 3.98Å; V137-N189 PolarHBondContact N-ND2 3.44Å; V137-I211 HydrophobicContact CG1-CD1 4.19Å; V137-I211 HydrophobicContact CG2-CG2 4.09Å
138	F	98.9	Very high	96.9	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	152.9	175.4	63.3	-93.1	0	0	0	113.6	W91 V100 F101 L121 S122 A123 S135 F140 L168	W91-F138 HydrophobicContact CH2-CD2 4.31Å; W91-F138 AromaticContact CH2-CE2 3.45Å; W91-F138 HydrophobicContact CH2-CE2 3.45Å; W91-F138 VanDerWaalsContact CH2-CE2 3.45Å; W91-F138 AromaticContact CH2-CZ 3.86Å; W91-F138 HydrophobicContact CH2-CZ 3.86Å; W91-F138 HydrophobicContact CZ2-CE2 4.06Å; W91-F138 AromaticContact CZ3-CE2 3.98Å; W91-F138 HydrophobicContact CZ3-CE2 3.98Å; W91-F138 HydrophobicContact CZ3-CZ 4.03Å; V100-F138 CarbonylContact C-O 3.5Å; V100-F138 WeakPolarHBondContact CA-O 3.49Å; F101-F138 HydrophobicContact CB-CD1 3.89Å; F101-F138 HydrophobicContact CB-CD2 3.97Å; F101-F138 HydrophobicContact CB-CE1 3.51Å; F101-F138 HydrophobicContact CB-CE2 3.6Å; F101-F138 HydrophobicContact CB-CG 4.11Å; F101-F138 HydrophobicContact CB-CZ 3.36Å; F101-F138 HydrophobicContact CD1-CD1 4.41Å; F101-F138 AromaticContact CD1-CE1 3.7Å; F101-F138 HydrophobicContact CD1-CE1 3.7Å; F101-F138 HydrophobicContact CD1-CZ 4.1Å; F101-F138 HydrophobicContact CD2-CE1 4.44Å; F101-F138 HydrophobicContact CD2-CZ 4Å; F101-F138 HydrophobicContact CG-CD1 4.38Å; F101-F138 AromaticContact CG-CE1 3.6Å; F101-F138 HydrophobicContact CG-CE1 3.6Å; F101-F138 HydrophobicContact CG-CE2 4.25Å; F101-F138 AromaticContact CG-CZ 3.53Å; F101-F138 HydrophobicContact CG-CZ 3.53Å; F101-F138 PolarHBondContact N-O 3.24Å; F101-F138 PolarHBondContact O-N 3.01Å; L121-F138 HydrophobicContact CD2-CB 3.78Å; L121-F138 HydrophobicContact CD2-CD2 3.56Å; L121-F138 HydrophobicContact CD2-CE2 4.45Å; L121-F138 HydrophobicContact CD2-CG 3.94Å; S122-F138 CarbonylContact O-C 3.56Å; S122-F138 WeakPolarHBondContact O-CA 3.37Å; A123-F138 HydrophobicContact CB-CB 3.9Å; S135-F138 VanDerWaalsContact O-CD1 3.28Å; S135-F138 WeakPolarHBondContact O-CD1 3.4Å; S135-F138 WeakPolarHBondContact O-CE1 3.44Å; F138-F140 HydrophobicContact CD2-CB 3.96Å; F138-F140 AromaticContact CD2-CD1 3.78Å; F138-F140 HydrophobicContact CD2-CD1 3.78Å; F138-F140 HydrophobicContact CD2-CG 4.19Å; F138-F140 HydrophobicContact CE2-CB 3.99Å; F138-F140 AromaticContact CE2-CD1 3.46Å; F138-F140 HydrophobicContact CE2-CD1 3.46Å; F138-F140 VanDerWaalsContact CE2-CD1 3.46Å; F138-F140 HydrophobicContact CE2-CE1 4.12Å; F138-F140 AromaticContact CE2-CG 3.83Å; F138-F140 HydrophobicContact CE2-CG 3.83Å; F138-L168 HydrophobicContact CE1-CD1 4.2Å; F138-L168 HydrophobicContact CZ-CD1 4.4Å
139	V	98.9	Very high	97.2	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.2	175	-169.4	0	0	0	0	108.9	K98 C99 V100 L115 R118 L121 S122 L184	K98-V139 HydrophobicContact CD-CG1 4.03Å; K98-V139 HydrophobicContact CG-CG1 4.04Å; C99-V139 WeakPolarHBondContact O-CA 3.21Å; V100-V139 HydrophobicContact CG2-CG1 4.45Å; V100-V139 HydrophobicContact CG2-CG2 4.15Å; L115-V139 HydrophobicContact CB-CG2 4.26Å; R118-V139 HydrophobicContact CB-CB 4.35Å; R118-V139 HydrophobicContact CB-CG1 4.35Å; R118-V139 HydrophobicContact CB-CG2 4.12Å; L121-V139 WeakPolarHBondContact CD2-O 3.32Å; S122-V139 PolarHBondContact N-O 3.04Å; S122-V139 PolarHBondContact O-N 3Å; V139-L184 HydrophobicContact CG2-CD1 4.47Å
140	F	98.8	Very high	97.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	169.5	-176.5	74.4	-78.6	0	0	0	112.1	V8 C90 W91 K98 C99 F101 E120 L121 F138 P142	V8-F140 HydrophobicContact CG2-CZ 4.5Å; C90-F140 HydrophobicContact CB-CE1 4.39Å; C90-F140 HydrophobicContact CB-CE2 4.12Å; C90-F140 HydrophobicContact CB-CZ 3.62Å; C90-F140 VanDerWaalsContact O-CE2 3.29Å; C90-F140 WeakPolarHBondContact O-CE2 3.44Å; W91-F140 AromaticContact CD1-CD2 3.87Å; W91-F140 AromaticContact CD2-CD2 3.92Å; W91-F140 HydrophobicContact CD2-CD2 3.92Å; W91-F140 HydrophobicContact CD2-CE2 4.36Å; W91-F140 AromaticContact CE2-CD2 3.69Å; W91-F140 HydrophobicContact CG-CD2 4.05Å; W91-F140 HydrophobicContact CG-CE2 4.34Å; W91-F140 HydrophobicContact CH2-CB 4.5Å; W91-F140 HydrophobicContact CZ2-CB 3.71Å; W91-F140 HydrophobicContact CZ2-CD2 4.18Å; W91-F140 HydrophobicContact CZ2-CG 4.12Å; W91-F140 AromaticContact NE1-CD2 3.64Å; K98-F140 WeakPolarHBondContact CA-O 3.36Å; C99-F140 HydrophobicContact CB-CD1 3.91Å; C99-F140 HydrophobicContact CB-CE1 3.24Å; C99-F140 HydrophobicContact CB-CE2 4.01Å; C99-F140 HydrophobicContact CB-CZ 3.29Å; C99-F140 PolarHBondContact N-O 3Å; C99-F140 WeakPolarHBondContact O-CD1 3.34Å; C99-F140 PolarHBondContact O-N 3.45Å; F101-F140 HydrophobicContact CB-CD1 4.22Å; F101-F140 HydrophobicContact CB-CE1 3.92Å; E120-F140 HydrophobicContact CG-CB 4.38Å; E120-F140 WeakPolarHBondContact OE2-CB 2.95Å; L121-F140 HydrophobicContact CD2-CB 4.46Å; F138-F140 HydrophobicContact CD2-CB 3.96Å; F138-F140 AromaticContact CD2-CD1 3.78Å; F138-F140 HydrophobicContact CD2-CD1 3.78Å; F138-F140 HydrophobicContact CD2-CG 4.19Å; F138-F140 HydrophobicContact CE2-CB 3.99Å; F138-F140 AromaticContact CE2-CD1 3.46Å; F138-F140 HydrophobicContact CE2-CD1 3.46Å; F138-F140 VanDerWaalsContact CE2-CD1 3.46Å; F138-F140 HydrophobicContact CE2-CE1 4.12Å; F138-F140 AromaticContact CE2-CG 3.83Å; F138-F140 HydrophobicContact CE2-CG 3.83Å; F140-P142 HydrophobicContact CD2-CG 4.36Å; F140-P142 HydrophobicContact CE2-CB 4.46Å; F140-P142 HydrophobicContact CE2-CG 3.76Å; F140-P142 HydrophobicContact CZ-CG 4.41Å
141	R	98.5	Very high	97	Very high	102 Å²	102	34.3 Å²	34.3	39%	0.385	18%	0.179	S	C	.	.			trans	-117.1	111.8	175.8	-72.5	-173.6	166.1	109	3.8	109.3	W91 D119 E120 S143	W91-R141 VanDerWaalsContact CD1-O 3.28Å; D119-R141 IonicContact OD1-CZ 2.96Å; D119-R141 VanDerWaalsContact OD1-CZ 3.25Å; D119-R141 IonicContact OD1-NH1 3.25Å; D119-R141 PolarHBondContact OD1-NH1 2.9Å; D119-R141 IonicContact OD1-NH2 3.88Å; D119-R141 PolarHBondContact OD1-NH2 3.42Å; E120-R141 HydrophobicContact CB-CB 4.49Å; E120-R141 HydrophobicContact CB-CG 4.28Å; E120-R141 PolarHBondContact OE2-N 3.14Å; R141-S143 PolarHBondContact O-N 3.3Å
142	P	98.3	Very high	96.7	Very high	16 Å²	16	33 Å²	33	10%	0.104	17%	0.172	C	C	.	.			trans	-52.5	126.4	173.2	-25.5	33.7	0	0	0	111.7	W91 L93 C99 F140	W91-P142 CarbonylContact O-C 3.54Å; W91-P142 WeakPolarHBondContact O-CA 3.4Å; L93-P142 HydrophobicContact CB-CB 4.48Å; L93-P142 HydrophobicContact CB-CG 4.45Å; L93-P142 VanDerWaalsContact O-CB 3.24Å; L93-P142 WeakPolarHBondContact O-CB 3.44Å; L93-P142 WeakPolarHBondContact O-CG 3.49Å; C99-P142 HydrophobicContact CB-CG 4.36Å; F140-P142 HydrophobicContact CD2-CG 4.36Å; F140-P142 HydrophobicContact CE2-CB 4.46Å; F140-P142 HydrophobicContact CE2-CG 3.76Å; F140-P142 HydrophobicContact CZ-CG 4.41Å
143	S	97.8	Very high	96.4	Very high	31 Å²	31	33.7 Å²	33.7	22%	0.217	17%	0.173	C	C	.	.			trans	-159.2	120.3	-173.1	168	0	0	0	0	108.7	W91 R141 I145 T146 Y147	W91-S143 CarbonylContact O-C 3.54Å; W91-S143 PolarHBondContact O-N 3.2Å; R141-S143 PolarHBondContact O-N 3.3Å; S143-I145 PolarHBondContact O-N 3.33Å; S143-I145 PolarHBondContact OG-N 3.45Å; S143-T146 VanDerWaalsContact CB-OG1 3.31Å; S143-T146 WeakPolarHBondContact CB-OG1 3.47Å; S143-T146 PolarHBondContact O-N 3.09Å; S143-T146 PolarHBondContact OG-N 2.81Å; S143-T146 PolarHBondContact OG-OG1 2.84Å; S143-T146 VanDerWaalsContact OG-OG1 3.14Å; S143-Y147 WeakPolarHBondContact O-CB 3.34Å; S143-Y147 PolarHBondContact O-N 2.9Å
144	K	95.5	Very high	95.9	Very high	137 Å²	137	33.7 Å²	33.7	60%	0.596	17%	0.173	S	C	*	.	H	α-helix	trans	-58.7	-34.4	174	-71.8	-173.7	178.1	-172.8	0	111.9	T94 Y147 T148	T94-K144 HydrophobicContact CG2-CG 4.06Å; K144-Y147 PolarHBondContact O-N 2.84Å; K144-T148 PolarHBondContact O-N 3.33Å; K144-T148 PolarHBondContact O-OG1 2.81Å; K144-T148 VanDerWaalsContact O-OG1 3.09Å
145	I	97.4	Very high	95.3	Very high	131 Å²	131	36.2 Å²	36.2	67%	0.672	19%	0.186	S	C	*	.	H	α-helix	trans	-64.6	-50.7	178.1	-60.7	172.9	0	0	0	109.4	S143 Y147 T148 S149	S143-I145 PolarHBondContact O-N 3.33Å; S143-I145 PolarHBondContact OG-N 3.45Å; I145-Y147 VanDerWaalsContact C-N 3.31Å; I145-Y147 PolarHBondContact O-N 2.95Å; I145-T148 PolarHBondContact O-N 2.85Å; I145-S149 PolarHBondContact O-N 2.88Å; I145-S149 PolarHBondContact O-OG 2.77Å; I145-S149 VanDerWaalsContact O-OG 3.08Å
146	T	97.8	Very high	94.8	Very high	23 Å²	23	42.7 Å²	42.7	14%	0.141	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-41	178.9	-50.4	0	0	0	0	111	W91 S143 S149 L150 F171 F172	W91-T146 HydrophobicContact CG-CG2 4.37Å; S143-T146 VanDerWaalsContact CB-OG1 3.31Å; S143-T146 WeakPolarHBondContact CB-OG1 3.47Å; S143-T146 PolarHBondContact O-N 3.09Å; S143-T146 PolarHBondContact OG-N 2.81Å; S143-T146 PolarHBondContact OG-OG1 2.84Å; S143-T146 VanDerWaalsContact OG-OG1 3.14Å; T146-S149 PolarHBondContact O-N 3.07Å; T146-L150 HydrophobicContact CG2-CD1 4.01Å; T146-L150 HydrophobicContact CG2-CG 4.5Å; T146-L150 WeakPolarHBondContact O-CB 3.49Å; T146-L150 WeakPolarHBondContact O-CG 3.34Å; T146-L150 PolarHBondContact O-N 3.08Å; T146-F171 HydrophobicContact CG2-CE1 4.2Å; T146-F171 HydrophobicContact CG2-CZ 4.46Å; T146-F172 HydrophobicContact CG2-CZ 4.27Å
147	Y	95.3	Very high	94.4	Very high	17 Å²	17	48.5 Å²	48.5	7%	0.067	24%	0.243	C	C	.	.	H	α-helix	trans	-57.8	-53	174.6	173.9	-105.9	0	0	0	112.2	L88 H89 W91 N92 S143 K144 I145 S149 L150 L151	L88-Y147 HydrophobicContact CB-CD2 4.3Å; L88-Y147 HydrophobicContact CB-CE2 4.16Å; L88-Y147 VanDerWaalsContact O-CD2 3.32Å; L88-Y147 WeakPolarHBondContact O-CD2 3.36Å; H89-Y147 AromaticContact CE1-CZ 3.97Å; H89-Y147 PolarHBondContact CE1-OH 2.76Å; H89-Y147 PolarHBondContact NE2-OH 3.39Å; W91-Y147 HydrophobicContact CB-CD2 4.48Å; N92-Y147 VanDerWaalsContact ND2-CD1 3.28Å; N92-Y147 WeakPolarHBondContact ND2-CD1 3.38Å; N92-Y147 WeakPolarHBondContact ND2-CE1 3.29Å; N92-Y147 VanDerWaalsContact OD1-CD1 3.23Å; N92-Y147 WeakPolarHBondContact OD1-CD1 3.49Å; S143-Y147 WeakPolarHBondContact O-CB 3.34Å; S143-Y147 PolarHBondContact O-N 2.9Å; K144-Y147 PolarHBondContact O-N 2.84Å; I145-Y147 VanDerWaalsContact C-N 3.31Å; I145-Y147 PolarHBondContact O-N 2.95Å; Y147-S149 VanDerWaalsContact C-N 3.32Å; Y147-S149 PolarHBondContact O-N 3.13Å; Y147-L150 WeakPolarHBondContact O-CB 3.5Å; Y147-L150 PolarHBondContact O-N 3.15Å; Y147-L151 HydrophobicContact CD1-CD1 4.17Å; Y147-L151 HydrophobicContact CE1-CD1 3.48Å; Y147-L151 VanDerWaalsContact CE1-CD1 3.48Å; Y147-L151 HydrophobicContact CE1-CG 4.19Å; Y147-L151 HydrophobicContact CE2-CD1 4.24Å; Y147-L151 HydrophobicContact CE2-CD2 4.21Å; Y147-L151 HydrophobicContact CE2-CG 4.2Å; Y147-L151 WeakPolarHBondContact O-CG 3.28Å; Y147-L151 PolarHBondContact O-N 3.31Å
148	T	93.6	Very high	93.8	Very high	69 Å²	69	49.6 Å²	49.6	42%	0.423	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-41.5	178.5	-58	0	0	0	0	111.4	K144 I145 L150 L151 D152	K144-T148 PolarHBondContact O-N 3.33Å; K144-T148 PolarHBondContact O-OG1 2.81Å; K144-T148 VanDerWaalsContact O-OG1 3.09Å; I145-T148 PolarHBondContact O-N 2.85Å; T148-L150 VanDerWaalsContact C-N 3.34Å; T148-L150 PolarHBondContact O-N 2.88Å; T148-L151 WeakPolarHBondContact O-CB 3.43Å; T148-L151 PolarHBondContact O-N 2.94Å; T148-D152 PolarHBondContact O-N 3.03Å
149	S	96.3	Very high	93.3	Very high	49 Å²	49	50.6 Å²	50.6	34%	0.343	26%	0.261	S	S	.	.	H	α-helix	trans	-63.8	-36.7	176	-60.2	0	0	0	0	113.1	I145 T146 Y147 D152 H153	I145-S149 PolarHBondContact O-N 2.88Å; I145-S149 PolarHBondContact O-OG 2.77Å; I145-S149 VanDerWaalsContact O-OG 3.08Å; T146-S149 PolarHBondContact O-N 3.07Å; Y147-S149 VanDerWaalsContact C-N 3.32Å; Y147-S149 PolarHBondContact O-N 3.13Å; S149-D152 PolarHBondContact O-N 3.29Å; S149-H153 VanDerWaalsContact O-CB 3.28Å; S149-H153 WeakPolarHBondContact O-CB 3.42Å; S149-H153 PolarHBondContact O-N 2.88Å
150	L	94.9	Very high	92.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.3	-41	173.7	-80.8	162.8	0	0	0	111.6	L88 W91 T146 Y147 T148 H153 A154 L168 F171 F172	L88-L150 HydrophobicContact CD1-CB 4.36Å; L88-L150 HydrophobicContact CD2-CD1 4.3Å; W91-L150 HydrophobicContact CD2-CD1 3.66Å; W91-L150 HydrophobicContact CE3-CD1 3.66Å; W91-L150 HydrophobicContact CG-CD1 4.23Å; W91-L150 HydrophobicContact CH2-CD1 4.21Å; W91-L150 HydrophobicContact CZ2-CD1 4.19Å; W91-L150 HydrophobicContact CZ3-CD1 3.95Å; T146-L150 HydrophobicContact CG2-CD1 4.01Å; T146-L150 HydrophobicContact CG2-CG 4.5Å; T146-L150 WeakPolarHBondContact O-CB 3.49Å; T146-L150 WeakPolarHBondContact O-CG 3.34Å; T146-L150 PolarHBondContact O-N 3.08Å; Y147-L150 WeakPolarHBondContact O-CB 3.5Å; Y147-L150 PolarHBondContact O-N 3.15Å; T148-L150 VanDerWaalsContact C-N 3.34Å; T148-L150 PolarHBondContact O-N 2.88Å; L150-H153 PolarHBondContact O-N 2.92Å; L150-A154 WeakPolarHBondContact O-CB 3.18Å; L150-A154 PolarHBondContact O-N 3.34Å; L150-L168 HydrophobicContact CD2-CD2 3.88Å; L150-F171 HydrophobicContact CD2-CB 3.74Å; L150-F171 HydrophobicContact CD2-CD1 3.54Å; L150-F171 HydrophobicContact CD2-CD2 3.83Å; L150-F171 HydrophobicContact CD2-CE1 4.03Å; L150-F171 HydrophobicContact CD2-CE2 4.29Å; L150-F171 HydrophobicContact CD2-CG 3.41Å; L150-F171 VanDerWaalsContact CD2-CG 3.41Å; L150-F171 HydrophobicContact CD2-CZ 4.38Å; L150-F171 HydrophobicContact CG-CD1 4.1Å; L150-F171 HydrophobicContact CG-CD2 4.27Å; L150-F171 HydrophobicContact CG-CE1 4.06Å; L150-F171 HydrophobicContact CG-CE2 4.24Å; L150-F171 HydrophobicContact CG-CG 4.19Å; L150-F171 HydrophobicContact CG-CZ 4.13Å; L150-F172 HydrophobicContact CD2-CE2 4.37Å
151	L	89.6	Confident	92.4	Very high	15 Å²	15	60.8 Å²	60.8	8%	0.079	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-48.2	174.3	-66.9	-174.6	0	0	0	111.4	F85 L88 Y147 T148 H153 A154 L155	F85-L151 HydrophobicContact CD1-CD2 3.48Å; F85-L151 VanDerWaalsContact CD1-CD2 3.48Å; F85-L151 HydrophobicContact CE1-CD2 3.61Å; L88-L151 HydrophobicContact CD1-CD2 4.04Å; Y147-L151 HydrophobicContact CD1-CD1 4.17Å; Y147-L151 HydrophobicContact CE1-CD1 3.48Å; Y147-L151 VanDerWaalsContact CE1-CD1 3.48Å; Y147-L151 HydrophobicContact CE1-CG 4.19Å; Y147-L151 HydrophobicContact CE2-CD1 4.24Å; Y147-L151 HydrophobicContact CE2-CD2 4.21Å; Y147-L151 HydrophobicContact CE2-CG 4.2Å; Y147-L151 WeakPolarHBondContact O-CG 3.28Å; Y147-L151 PolarHBondContact O-N 3.31Å; T148-L151 WeakPolarHBondContact O-CB 3.43Å; T148-L151 PolarHBondContact O-N 2.94Å; L151-H153 VanDerWaalsContact C-N 3.28Å; L151-H153 PolarHBondContact O-N 2.93Å; L151-A154 WeakPolarHBondContact O-CB 3.4Å; L151-A154 PolarHBondContact O-N 3.13Å; L151-A154 VanDerWaalsContact O-N 3.14Å; L151-L155 VanDerWaalsContact O-CG 3.31Å; L151-L155 WeakPolarHBondContact O-CG 3.47Å; L151-L155 PolarHBondContact O-N 2.95Å
152	D	90.7	Very high	91.8	Very high	68 Å²	68	57.5 Å²	57.5	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-59.9	-40.6	178	-71.1	-22.6	0	0	0	111.5	T148 S149 L155 Q156	T148-D152 PolarHBondContact O-N 3.03Å; S149-D152 PolarHBondContact O-N 3.29Å; D152-L155 WeakPolarHBondContact O-CB 3.46Å; D152-L155 PolarHBondContact O-N 2.83Å; D152-Q156 WeakPolarHBondContact O-CB 3.32Å; D152-Q156 VanDerWaalsContact O-CG 3.29Å; D152-Q156 WeakPolarHBondContact O-CG 3.35Å; D152-Q156 PolarHBondContact O-N 2.85Å
153	H	92.8	Very high	91.2	Very high	35 Å²	35	57.7 Å²	57.7	16%	0.162	31%	0.313	C	S	.	.	H	α-helix	trans	-65	-42.2	175.4	-167.2	96.7	0	0	0	111.7	S149 L150 L151 L155 Q156 H157 S170 F171	S149-H153 VanDerWaalsContact O-CB 3.28Å; S149-H153 WeakPolarHBondContact O-CB 3.42Å; S149-H153 PolarHBondContact O-N 2.88Å; L150-H153 PolarHBondContact O-N 2.92Å; L151-H153 VanDerWaalsContact C-N 3.28Å; L151-H153 PolarHBondContact O-N 2.93Å; H153-L155 VanDerWaalsContact C-N 3.31Å; H153-L155 PolarHBondContact O-N 2.92Å; H153-Q156 PolarHBondContact O-N 3.35Å; H153-H157 AromaticContact CE1-CD2 3.5Å; H153-H157 PolarHBondContact CE1-CD2 3.25Å; H153-H157 VanDerWaalsContact CE1-CD2 3.5Å; H153-H157 AromaticContact CG-CD2 3.9Å; H153-H157 AromaticContact ND1-CD2 3.56Å; H153-H157 AromaticContact NE2-CD2 3.79Å; H153-H157 WeakPolarHBondContact O-CB 3.45Å; H153-H157 PolarHBondContact O-N 3.33Å; H153-S170 PolarHBondContact NE2-OG 2.88Å; H153-F171 HydrophobicContact CB-CD2 3.76Å; H153-F171 HydrophobicContact CB-CE2 4.36Å; H153-F171 AromaticContact CG-CD2 3.83Å; H153-F171 AromaticContact ND1-CD2 3.96Å
154	A	87.8	Confident	91	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-38	174.9	0	0	0	0	0	112	F85 L150 L151 G158 L167	F85-A154 HydrophobicContact CE1-CB 3.92Å; F85-A154 HydrophobicContact CZ-CB 3.86Å; L150-A154 WeakPolarHBondContact O-CB 3.18Å; L150-A154 PolarHBondContact O-N 3.34Å; L151-A154 WeakPolarHBondContact O-CB 3.4Å; L151-A154 PolarHBondContact O-N 3.13Å; L151-A154 VanDerWaalsContact O-N 3.14Å; A154-G158 WeakPolarHBondContact O-CA 3.35Å; A154-G158 PolarHBondContact O-N 3.34Å; A154-L167 HydrophobicContact CB-CD1 3.65Å; A154-L167 HydrophobicContact CB-CD2 3.77Å; A154-L167 HydrophobicContact CB-CG 4.39Å
155	L	83.8	Confident	91	Very high	61 Å²	61	52.6 Å²	52.6	32%	0.319	29%	0.288	S	S	.	.	H	α-helix	trans	-63.9	-41.3	175.2	-70.7	170.2	0	0	0	112.3	L76 L151 D152 H153	L76-L155 HydrophobicContact CD1-CD2 3.61Å; L76-L155 HydrophobicContact CD2-CD2 3.65Å; L76-L155 HydrophobicContact CG-CD2 3.4Å; L76-L155 VanDerWaalsContact CG-CD2 3.4Å; L151-L155 VanDerWaalsContact O-CG 3.31Å; L151-L155 WeakPolarHBondContact O-CG 3.47Å; L151-L155 PolarHBondContact O-N 2.95Å; D152-L155 WeakPolarHBondContact O-CB 3.46Å; D152-L155 PolarHBondContact O-N 2.83Å; H153-L155 VanDerWaalsContact C-N 3.31Å; H153-L155 PolarHBondContact O-N 2.92Å
156	Q	88.1	Confident	90.9	Very high	141 Å²	141	46.4 Å²	46.4	66%	0.659	26%	0.256	S	S	*	.	H	α-helix	trans	-84.2	-38.2	-174.5	-69.6	174.1	42.7	0	0	113.2	D152 H153	D152-Q156 WeakPolarHBondContact O-CB 3.32Å; D152-Q156 VanDerWaalsContact O-CG 3.29Å; D152-Q156 WeakPolarHBondContact O-CG 3.35Å; D152-Q156 PolarHBondContact O-N 2.85Å; H153-Q156 PolarHBondContact O-N 3.35Å
157	H	89	Confident	90.8	Very high	122 Å²	122	45.4 Å²	45.4	57%	0.565	25%	0.25	S	S	*	.	H	α-helix	trans	-118.7	-13.9	-168.8	-58.8	-60.3	0	0	0	113.8	H153	H153-H157 AromaticContact CE1-CD2 3.5Å; H153-H157 PolarHBondContact CE1-CD2 3.25Å; H153-H157 VanDerWaalsContact CE1-CD2 3.5Å; H153-H157 AromaticContact CG-CD2 3.9Å; H153-H157 AromaticContact ND1-CD2 3.56Å; H153-H157 AromaticContact NE2-CD2 3.79Å; H153-H157 WeakPolarHBondContact O-CB 3.45Å; H153-H157 PolarHBondContact O-N 3.33Å
158	G	86.1	Confident	90.9	Very high	22 Å²	22	44.6 Å²	44.6	23%	0.227	25%	0.247	C	C	.	.			trans	61.9	-154.8	-173.4	0	0	0	0	0	112.5	A154 L167	A154-G158 WeakPolarHBondContact O-CA 3.35Å; A154-G158 PolarHBondContact O-N 3.34Å; G158-L167 WeakPolarHBondContact O-CD1 3.45Å
159	S	88.9	Confident	91.2	Very high	22 Å²	22	42 Å²	42	15%	0.154	23%	0.23	C	C	.	.			trans	-122.7	132.8	170.1	-177.2	0	0	0	0	109.7	D161 G162 G163 G166 L167	S159-D161 VanDerWaalsContact C-N 3.26Å; S159-D161 PolarHBondContact O-N 3.4Å; S159-D161 PolarHBondContact OG-OD1 3.11Å; S159-G162 PolarHBondContact O-N 2.62Å; S159-G163 WeakPolarHBondContact CB-O 3.43Å; S159-G163 PolarHBondContact OG-O 3.38Å; S159-G166 WeakPolarHBondContact OG-CA 3.44Å; S159-L167 PolarHBondContact OG-N 3.24Å
160	F	90.7	Very high	91.2	Very high	138 Å²	138	41.8 Å²	41.8	61%	0.605	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-21.4	-178.1	65	-108.8	0	0	0	113.5	G166 N169	F160-G166 WeakPolarHBondContact CD1-O 3.29Å; F160-G166 WeakPolarHBondContact CE1-O 3.47Å; F160-G166 VanDerWaalsContact CZ-CA 3.41Å; F160-N169 HydrophobicContact CE1-CB 4.12Å; F160-N169 HydrophobicContact CZ-CB 4.26Å
161	D	87.8	Confident	91.4	Very high	76 Å²	76	44.4 Å²	44.4	41%	0.406	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	2.7	176.3	69	-3.2	0	0	0	112.8	S159 G163 Q165 G166	S159-D161 VanDerWaalsContact C-N 3.26Å; S159-D161 PolarHBondContact O-N 3.4Å; S159-D161 PolarHBondContact OG-OD1 3.11Å; D161-G163 PolarHBondContact O-N 3.33Å; D161-G163 WeakPolarHBondContact OD1-CA 3.33Å; D161-G163 PolarHBondContact OD1-N 3.36Å; D161-Q165 WeakPolarHBondContact OD2-CB 3.18Å; D161-G166 VanDerWaalsContact OD1-CA 3.31Å; D161-G166 WeakPolarHBondContact OD1-CA 3.41Å; D161-G166 PolarHBondContact OD1-N 3.04Å; D161-G166 PolarHBondContact OD2-N 3.43Å
162	G	84.9	Confident	91.8	Very high	34 Å²	34	45.1 Å²	45.1	35%	0.351	24%	0.243	S	C	.	.	S	Bend	trans	71.3	1.4	-175.3	0	0	0	0	0	114.9	L81 S159	L81-G162 WeakPolarHBondContact CD2-O 3.47Å; S159-G162 PolarHBondContact O-N 2.62Å
163	G	87.2	Confident	92.1	Very high	20 Å²	20	46 Å²	46	21%	0.206	26%	0.255	C	S	.	.	S	Bend	trans	-116.2	-170.9	179.9	0	0	0	0	0	113.1	S159 D161	S159-G163 WeakPolarHBondContact CB-O 3.43Å; S159-G163 PolarHBondContact OG-O 3.38Å; D161-G163 PolarHBondContact O-N 3.33Å; D161-G163 WeakPolarHBondContact OD1-CA 3.33Å; D161-G163 PolarHBondContact OD1-N 3.36Å
164	D	92.8	Very high	92.4	Very high	26 Å²	26	46.2 Å²	46.2	14%	0.139	26%	0.26	C	S	.	.	H	α-helix	trans	-74.7	-30.9	176.7	58.8	-78.5	0	0	0	112.8	T84 K87 S135 G166 L167 L168	T84-D164 HydrophobicContact CG2-CB 3.77Å; T84-D164 PolarHBondContact OG1-N 2.86Å; T84-D164 VanDerWaalsContact OG1-N 3.14Å; K87-D164 HydrophobicContact CD-CB 4.09Å; K87-D164 WeakPolarHBondContact CE-OD2 3.37Å; K87-D164 IonicContact NZ-OD1 3.36Å; K87-D164 IonicContact NZ-OD2 2.61Å; K87-D164 PolarHBondContact NZ-OD2 3.12Å; S135-D164 VanDerWaalsContact CB-OD2 3.22Å; S135-D164 WeakPolarHBondContact CB-OD2 3.15Å; S135-D164 PolarHBondContact OG-OD2 3.13Å; D164-G166 PolarHBondContact O-N 2.86Å; D164-L167 PolarHBondContact O-N 3.39Å; D164-L168 HydrophobicContact CB-CD1 4.49Å; D164-L168 WeakPolarHBondContact O-CB 3.47Å; D164-L168 VanDerWaalsContact O-CG 3.23Å; D164-L168 WeakPolarHBondContact O-CG 3.23Å; D164-L168 PolarHBondContact O-N 3.25Å
165	Q	95.7	Very high	92.9	Very high	35 Å²	35	46.6 Å²	46.6	16%	0.164	26%	0.261	C	S	.	.	H	α-helix	trans	-60.7	-48.1	-179.2	-177.2	163.9	-63.3	0	0	111.4	D126 N134 S135 D161 L167 L168 N169	D126-Q165 PolarHBondContact OD1-NE2 2.93Å; D126-Q165 VanDerWaalsContact OD1-NE2 3.08Å; N134-Q165 VanDerWaalsContact CA-OE1 3.26Å; N134-Q165 PolarHBondContact ND2-OE1 3.36Å; S135-Q165 VanDerWaalsContact N-OE1 3.15Å; S135-Q165 WeakPolarHBondContact OG-CA 3.09Å; S135-Q165 WeakPolarHBondContact OG-CB 3.35Å; D161-Q165 WeakPolarHBondContact OD2-CB 3.18Å; Q165-L167 PolarHBondContact O-N 3.03Å; Q165-L168 PolarHBondContact O-N 2.9Å; Q165-N169 WeakPolarHBondContact CG-ND2 3.41Å; Q165-N169 WeakPolarHBondContact O-CB 3.22Å; Q165-N169 PolarHBondContact O-N 3.29Å; Q165-N169 PolarHBondContact O-ND2 2.88Å
166	G	95.6	Very high	93.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-39.1	178.8	0	0	0	0	0	113.4	S159 F160 D161 D164 S170	S159-G166 WeakPolarHBondContact OG-CA 3.44Å; F160-G166 WeakPolarHBondContact CD1-O 3.29Å; F160-G166 WeakPolarHBondContact CE1-O 3.47Å; F160-G166 VanDerWaalsContact CZ-CA 3.41Å; D161-G166 VanDerWaalsContact OD1-CA 3.31Å; D161-G166 WeakPolarHBondContact OD1-CA 3.41Å; D161-G166 PolarHBondContact OD1-N 3.04Å; D161-G166 PolarHBondContact OD2-N 3.43Å; D164-G166 PolarHBondContact O-N 2.86Å; G166-S170 VanDerWaalsContact O-CB 3.3Å; G166-S170 WeakPolarHBondContact O-CB 3.29Å; G166-S170 PolarHBondContact O-N 3.42Å
167	L	95.6	Very high	93.7	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-50.6	176.2	176.7	63.7	0	0	0	111.1	T84 L88 A154 G158 S159 D164 Q165 N169 S170 F171	T84-L167 HydrophobicContact CG2-CD2 3.79Å; L88-L167 HydrophobicContact CD1-CD2 3.74Å; L88-L167 HydrophobicContact CD2-CD2 4.24Å; L88-L167 HydrophobicContact CG-CD2 4.45Å; A154-L167 HydrophobicContact CB-CD1 3.65Å; A154-L167 HydrophobicContact CB-CD2 3.77Å; A154-L167 HydrophobicContact CB-CG 4.39Å; G158-L167 WeakPolarHBondContact O-CD1 3.45Å; S159-L167 PolarHBondContact OG-N 3.24Å; D164-L167 PolarHBondContact O-N 3.39Å; Q165-L167 PolarHBondContact O-N 3.03Å; L167-N169 PolarHBondContact O-N 2.72Å; L167-S170 PolarHBondContact O-N 3.37Å; L167-F171 PolarHBondContact O-N 3.22Å
168	L	98.2	Very high	93.9	Very high	1 Å²	1	45 Å²	45	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-39.7	-177.8	-69.6	173.7	0	0	0	111.6	L88 W91 F133 F138 L150 D164 Q165 S170 F171 F172	L88-L168 HydrophobicContact CD2-CD2 4.07Å; W91-L168 HydrophobicContact CH2-CD2 3.59Å; W91-L168 HydrophobicContact CZ3-CD2 3.84Å; F133-L168 HydrophobicContact CE2-CB 3.88Å; F133-L168 HydrophobicContact CZ-CB 3.83Å; F133-L168 WeakPolarHBondContact CZ-O 3.22Å; F138-L168 HydrophobicContact CE1-CD1 4.2Å; F138-L168 HydrophobicContact CZ-CD1 4.4Å; L150-L168 HydrophobicContact CD2-CD2 3.88Å; D164-L168 HydrophobicContact CB-CD1 4.49Å; D164-L168 WeakPolarHBondContact O-CB 3.47Å; D164-L168 VanDerWaalsContact O-CG 3.23Å; D164-L168 WeakPolarHBondContact O-CG 3.23Å; D164-L168 PolarHBondContact O-N 3.25Å; Q165-L168 PolarHBondContact O-N 2.9Å; L168-S170 VanDerWaalsContact C-N 3.34Å; L168-F171 PolarHBondContact O-N 3.17Å; L168-F172 HydrophobicContact CD2-CD2 4.38Å; L168-F172 HydrophobicContact CD2-CE2 4.08Å; L168-F172 WeakPolarHBondContact O-CB 3.32Å; L168-F172 WeakPolarHBondContact O-CD2 3.32Å; L168-F172 PolarHBondContact O-N 3.43Å
169	N	98.5	Very high	94.3	Very high	14 Å²	14	46.9 Å²	46.9	8%	0.075	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-37	175	-83.7	-82.5	0	0	0	112.1	C132 F133 F160 Q165 L167 F172 S173	C132-N169 WeakPolarHBondContact CA-OD1 3.45Å; C132-N169 WeakPolarHBondContact CB-OD1 3.29Å; F133-N169 WeakPolarHBondContact CD1-OD1 3.45Å; F133-N169 HydrophobicContact CE1-CB 4.35Å; F133-N169 WeakPolarHBondContact CE1-OD1 3.4Å; F133-N169 PolarHBondContact N-OD1 3.13Å; F133-N169 PolarHBondContact O-ND2 2.96Å; F160-N169 HydrophobicContact CE1-CB 4.12Å; F160-N169 HydrophobicContact CZ-CB 4.26Å; Q165-N169 WeakPolarHBondContact CG-ND2 3.41Å; Q165-N169 WeakPolarHBondContact O-CB 3.22Å; Q165-N169 PolarHBondContact O-N 3.29Å; Q165-N169 PolarHBondContact O-ND2 2.88Å; L167-N169 PolarHBondContact O-N 2.72Å; N169-F172 CarbonylContact O-C 3.58Å; N169-S173 WeakPolarHBondContact O-CA 3Å; N169-S173 PolarHBondContact O-N 3.06Å
170	S	97.8	Very high	94.7	Very high	44 Å²	44	52.3 Å²	52.3	31%	0.308	30%	0.295	S	S	.	.	H	α-helix	trans	-66.1	-41	175.6	-175.6	0	0	0	0	111.9	H153 G166 L167 L168 S173	H153-S170 PolarHBondContact NE2-OG 2.88Å; G166-S170 VanDerWaalsContact O-CB 3.3Å; G166-S170 WeakPolarHBondContact O-CB 3.29Å; G166-S170 PolarHBondContact O-N 3.42Å; L167-S170 PolarHBondContact O-N 3.37Å; L168-S170 VanDerWaalsContact C-N 3.34Å; S170-S173 WeakPolarHBondContact O-CB 3.43Å
171	F	98.4	Very high	95	Very high	55 Å²	55	48.5 Å²	48.5	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-72	-48.9	178.2	-174	-93.2	0	0	0	112.6	T146 L150 H153 L167 L168 S173	T146-F171 HydrophobicContact CG2-CE1 4.2Å; T146-F171 HydrophobicContact CG2-CZ 4.46Å; L150-F171 HydrophobicContact CD2-CB 3.74Å; L150-F171 HydrophobicContact CD2-CD1 3.54Å; L150-F171 HydrophobicContact CD2-CD2 3.83Å; L150-F171 HydrophobicContact CD2-CE1 4.03Å; L150-F171 HydrophobicContact CD2-CE2 4.29Å; L150-F171 HydrophobicContact CD2-CG 3.41Å; L150-F171 VanDerWaalsContact CD2-CG 3.41Å; L150-F171 HydrophobicContact CD2-CZ 4.38Å; L150-F171 HydrophobicContact CG-CD1 4.1Å; L150-F171 HydrophobicContact CG-CD2 4.27Å; L150-F171 HydrophobicContact CG-CE1 4.06Å; L150-F171 HydrophobicContact CG-CE2 4.24Å; L150-F171 HydrophobicContact CG-CG 4.19Å; L150-F171 HydrophobicContact CG-CZ 4.13Å; H153-F171 HydrophobicContact CB-CD2 3.76Å; H153-F171 HydrophobicContact CB-CE2 4.36Å; H153-F171 AromaticContact CG-CD2 3.83Å; H153-F171 AromaticContact ND1-CD2 3.96Å; L167-F171 PolarHBondContact O-N 3.22Å; L168-F171 PolarHBondContact O-N 3.17Å; F171-S173 VanDerWaalsContact C-N 3.27Å; F171-S173 PolarHBondContact O-N 3.21Å
172	F	98.3	Very high	95.5	Very high	31 Å²	31	47.2 Å²	47.2	14%	0.136	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	46.4	177.4	-61.4	-73.2	0	0	0	111.6	W91 E120 L121 F133 T146 L150 L168 N169 S174 W175	W91-F172 HydrophobicContact CH2-CE2 4.18Å; W91-F172 AromaticContact CZ2-CE2 3.84Å; W91-F172 HydrophobicContact CZ2-CE2 3.84Å; W91-F172 AromaticContact CZ2-CZ 3.91Å; W91-F172 HydrophobicContact CZ2-CZ 3.91Å; E120-F172 HydrophobicContact CG-CE1 4.25Å; E120-F172 HydrophobicContact CG-CZ 4.43Å; L121-F172 HydrophobicContact CB-CB 4.29Å; L121-F172 HydrophobicContact CB-CD1 3.7Å; L121-F172 HydrophobicContact CB-CD2 4.07Å; L121-F172 HydrophobicContact CB-CE1 3.96Å; L121-F172 HydrophobicContact CB-CE2 4.31Å; L121-F172 HydrophobicContact CB-CG 3.76Å; L121-F172 HydrophobicContact CB-CZ 4.25Å; L121-F172 HydrophobicContact CG-CB 4.43Å; L121-F172 HydrophobicContact CG-CD1 4.39Å; L121-F172 HydrophobicContact CG-CD2 3.83Å; L121-F172 HydrophobicContact CG-CE2 4.13Å; L121-F172 HydrophobicContact CG-CG 3.97Å; F133-F172 HydrophobicContact CE1-CB 4.03Å; F133-F172 HydrophobicContact CZ-CB 4.2Å; F133-F172 HydrophobicContact CZ-CD2 4.43Å; T146-F172 HydrophobicContact CG2-CZ 4.27Å; L150-F172 HydrophobicContact CD2-CE2 4.37Å; L168-F172 HydrophobicContact CD2-CD2 4.38Å; L168-F172 HydrophobicContact CD2-CE2 4.08Å; L168-F172 WeakPolarHBondContact O-CB 3.32Å; L168-F172 WeakPolarHBondContact O-CD2 3.32Å; L168-F172 PolarHBondContact O-N 3.43Å; N169-F172 CarbonylContact O-C 3.58Å; F172-S174 PolarHBondContact O-N 3.29Å; F172-W175 WeakPolarHBondContact O-CB 3.44Å; F172-W175 PolarHBondContact O-N 3.19Å; F172-W175 VanDerWaalsContact O-N 3.12Å
173	S	97.4	Very high	96.1	Very high	87 Å²	87	49 Å²	49	61%	0.608	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-16.5	-170.8	52.4	0	0	0	0	115.2	N169 S170 F171 W175	N169-S173 WeakPolarHBondContact O-CA 3Å; N169-S173 PolarHBondContact O-N 3.06Å; S170-S173 WeakPolarHBondContact O-CB 3.43Å; F171-S173 VanDerWaalsContact C-N 3.27Å; F171-S173 PolarHBondContact O-N 3.21Å; S173-W175 VanDerWaalsContact C-N 3.34Å
174	S	97.3	Very high	96.7	Very high	39 Å²	39	48.1 Å²	48.1	27%	0.273	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-6	178.7	75.7	0	0	0	0	114.7	F172 S176 V177 E178	F172-S174 PolarHBondContact O-N 3.29Å; S174-S176 PolarHBondContact O-N 2.86Å; S174-S176 VanDerWaalsContact O-N 3.13Å; S174-V177 PolarHBondContact O-N 3.49Å; S174-V177 VanDerWaalsContact O-N 3.12Å; S174-E178 VanDerWaalsContact CB-OE1 3.31Å; S174-E178 WeakPolarHBondContact CB-OE1 3.39Å; S174-E178 VanDerWaalsContact CB-OE2 3.24Å; S174-E178 WeakPolarHBondContact CB-OE2 3.45Å; S174-E178 PolarHBondContact O-N 2.98Å; S174-E178 PolarHBondContact OG-OE2 3.12Å
175	W	98.3	Very high	96.9	Very high	8 Å²	8	49.8 Å²	49.8	3%	0.03	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-36.1	-175.4	171.6	86.7	0	0	0	114	A123 P125 F133 F172 S173 K182 R183	A123-W175 WeakPolarHBondContact O-CZ2 3.47Å; A123-W175 PolarHBondContact O-NE1 2.91Å; P125-W175 HydrophobicContact CB-CH2 3.96Å; F133-W175 HydrophobicContact CB-CD2 3.77Å; F133-W175 HydrophobicContact CB-CE3 3.91Å; F133-W175 HydrophobicContact CB-CG 4.45Å; F133-W175 HydrophobicContact CB-CH2 3.88Å; F133-W175 HydrophobicContact CB-CZ2 3.71Å; F133-W175 HydrophobicContact CB-CZ3 3.97Å; F133-W175 HydrophobicContact CD1-CB 3.83Å; F133-W175 AromaticContact CD1-CD2 3.58Å; F133-W175 HydrophobicContact CD1-CD2 3.58Å; F133-W175 AromaticContact CD1-CE3 3.88Å; F133-W175 HydrophobicContact CD1-CE3 3.88Å; F133-W175 AromaticContact CD1-CG 3.52Å; F133-W175 HydrophobicContact CD1-CG 3.52Å; F133-W175 HydrophobicContact CE1-CB 4.04Å; F133-W175 HydrophobicContact CE1-CG 4.16Å; F133-W175 HydrophobicContact CG-CD2 4.13Å; F133-W175 HydrophobicContact CG-CE3 4.42Å; F133-W175 HydrophobicContact CG-CG 4.35Å; F172-W175 WeakPolarHBondContact O-CB 3.44Å; F172-W175 PolarHBondContact O-N 3.19Å; F172-W175 VanDerWaalsContact O-N 3.12Å; S173-W175 VanDerWaalsContact C-N 3.34Å; W175-K182 PolarHBondContact NE1-O 3.17Å; W175-R183 HydrophobicContact CH2-CG 4.22Å; W175-R183 HydrophobicContact CZ2-CB 4.24Å; W175-R183 HydrophobicContact CZ2-CG 3.69Å
176	S	94.6	Very high	96.9	Very high	34 Å²	34	50.7 Å²	50.7	24%	0.238	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-21.1	-175.8	53.1	0	0	0	0	114.5	D131 S174 R183	D131-S176 WeakPolarHBondContact O-CB 3.29Å; S174-S176 PolarHBondContact O-N 2.86Å; S174-S176 VanDerWaalsContact O-N 3.13Å; S176-R183 VanDerWaalsContact CB-NH2 3.33Å
177	V	94.9	Very high	97	Very high	119 Å²	119	52.4 Å²	52.4	72%	0.721	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	-27.5	-166	-65.7	0	0	0	0	114.9	S174	S174-V177 PolarHBondContact O-N 3.49Å; S174-V177 VanDerWaalsContact O-N 3.12Å
178	E	92.8	Very high	97.1	Very high	139 Å²	139	53.1 Å²	53.1	65%	0.65	29%	0.29	S	S	*	.	S	Bend	trans	-83.2	-54.4	-169.4	-81.2	-178	175.3	0	0	114.5	S174	S174-E178 VanDerWaalsContact CB-OE1 3.31Å; S174-E178 WeakPolarHBondContact CB-OE1 3.39Å; S174-E178 VanDerWaalsContact CB-OE2 3.24Å; S174-E178 WeakPolarHBondContact CB-OE2 3.45Å; S174-E178 PolarHBondContact O-N 2.98Å; S174-E178 PolarHBondContact OG-OE2 3.12Å
179	D	95.5	Very high	97.1	Very high	61 Å²	61	53.1 Å²	53.1	33%	0.326	29%	0.29	S	S	.	.			trans	-138.6	110.4	-167.6	-176.5	-0.5	0	0	0	111.7	S181 K182	D179-S181 PolarHBondContact O-N 3.49Å; D179-S181 WeakPolarHBondContact OD1-CB 3.3Å; D179-S181 PolarHBondContact OD1-N 2.94Å; D179-S181 PolarHBondContact OD1-OG 3.39Å; D179-S181 PolarHBondContact OD2-OG 2.84Å; D179-K182 HydrophobicContact CB-CD 4.22Å; D179-K182 HydrophobicContact CB-CG 4.16Å; D179-K182 WeakPolarHBondContact O-CB 3.22Å; D179-K182 PolarHBondContact O-N 3.2Å; D179-K182 VanDerWaalsContact O-N 3.08Å
180	I	96.6	Very high	96.8	Very high	136 Å²	136	52.8 Å²	52.8	70%	0.697	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-60.8	-25.8	178.2	-168.6	63	0	0	0	112.5	K182 R183	I180-K182 PolarHBondContact O-N 3.01Å; I180-R183 HydrophobicContact CD1-CB 4.19Å; I180-R183 HydrophobicContact CD1-CG 4.38Å; I180-R183 PolarHBondContact O-N 3.13Å
181	S	97.1	Very high	96.4	Very high	57 Å²	57	51.1 Å²	51.1	40%	0.399	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-64.7	-23	178.7	84.3	0	0	0	0	112.6	D179	D179-S181 PolarHBondContact O-N 3.49Å; D179-S181 WeakPolarHBondContact OD1-CB 3.3Å; D179-S181 PolarHBondContact OD1-N 2.94Å; D179-S181 PolarHBondContact OD1-OG 3.39Å; D179-S181 PolarHBondContact OD2-OG 2.84Å
182	K	98	Very high	95.1	Very high	49 Å²	49	49.1 Å²	49.1	21%	0.213	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-83.9	-10.7	175.9	-62.3	-174.2	-173.6	-171.4	0	113.9	E120 L121 S122 A123 W175 D179 I180 L184	E120-K182 WeakPolarHBondContact O-CE 3.16Å; E120-K182 PolarHBondContact O-NZ 3.34Å; L121-K182 WeakPolarHBondContact O-CB 3.21Å; S122-K182 CarbonylContact C-O 3.56Å; S122-K182 WeakPolarHBondContact CA-O 3.35Å; S122-K182 WeakPolarHBondContact OG-CA 3.34Å; A123-K182 PolarHBondContact N-O 3.22Å; W175-K182 PolarHBondContact NE1-O 3.17Å; D179-K182 HydrophobicContact CB-CD 4.22Å; D179-K182 HydrophobicContact CB-CG 4.16Å; D179-K182 WeakPolarHBondContact O-CB 3.22Å; D179-K182 PolarHBondContact O-N 3.2Å; D179-K182 VanDerWaalsContact O-N 3.08Å; I180-K182 PolarHBondContact O-N 3.01Å; K182-L184 PolarHBondContact O-N 3.29Å
183	R	98.2	Very high	93.6	Very high	71 Å²	71	48.6 Å²	48.6	27%	0.268	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-85.5	98.1	172.5	-66.9	-166.5	146.4	-157.8	-7	109.5	P130 D131 W175 S176 I180	P130-R183 PolarHBondContact O-NH2 3.25Å; D131-R183 IonicContact OD1-NH2 3.42Å; W175-R183 HydrophobicContact CH2-CG 4.22Å; W175-R183 HydrophobicContact CZ2-CB 4.24Å; W175-R183 HydrophobicContact CZ2-CG 3.69Å; S176-R183 VanDerWaalsContact CB-NH2 3.33Å; I180-R183 HydrophobicContact CD1-CB 4.19Å; I180-R183 HydrophobicContact CD1-CG 4.38Å; I180-R183 PolarHBondContact O-N 3.13Å
184	L	98.3	Very high	91.3	Very high	3 Å²	3	50 Å²	50	2%	0.016	28%	0.28	C	S	.	.			trans	-63.2	138.6	173.7	-57.4	-177.5	0	0	0	109.5	L115 R118 A123 A124 P125 V139 K182 F186	L115-L184 HydrophobicContact CD2-CD1 3.99Å; L115-L184 HydrophobicContact CD2-CD2 3.87Å; R118-L184 HydrophobicContact CG-CD2 3.86Å; R118-L184 VanDerWaalsContact NH1-CD2 3.33Å; A123-L184 PolarHBondContact O-N 3.39Å; A124-L184 HydrophobicContact CB-CB 4.16Å; P125-L184 WeakPolarHBondContact CD-O 3.46Å; V139-L184 HydrophobicContact CG2-CD1 4.47Å; K182-L184 PolarHBondContact O-N 3.29Å; L184-F186 PolarHBondContact O-N 2.86Å
185	P	97.8	Very high	89.1	Confident	61 Å²	61	53.1 Å²	53.1	40%	0.396	30%	0.297	S	S	.	.			trans	-55	142	170.4	-26.6	34.6	0	0	0	111.3	I187 Y188	P185-I187 HydrophobicContact CB-CG1 3.92Å; P185-I187 PolarHBondContact O-N 3.11Å; P185-Y188 HydrophobicContact CB-CD2 3.91Å; P185-Y188 HydrophobicContact CB-CE2 4.13Å; P185-Y188 HydrophobicContact CG-CD2 4.03Å; P185-Y188 HydrophobicContact CG-CE2 3.9Å; P185-Y188 PolarHBondContact O-N 2.84Å
186	F	96.3	Very high	87.4	Confident	54 Å²	54	55.6 Å²	55.6	24%	0.237	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-55.4	-28	-175.6	-170.7	-120	0	0	0	113.7	P125 P127 L184 Y188 N189 L190 C191 Y196	P125-F186 HydrophobicContact CG-CD2 4.34Å; P127-F186 HydrophobicContact CB-CE2 4.28Å; P127-F186 HydrophobicContact CB-CZ 4.17Å; L184-F186 PolarHBondContact O-N 2.86Å; F186-Y188 PolarHBondContact O-N 2.76Å; F186-Y188 VanDerWaalsContact O-N 3.14Å; F186-N189 CarbonylContact O-C 3.58Å; F186-N189 PolarHBondContact O-N 3.1Å; F186-L190 HydrophobicContact CD1-CD1 3.72Å; F186-L190 HydrophobicContact CE1-CD1 3.29Å; F186-L190 HydrophobicContact CZ-CD1 4.08Å; F186-L190 WeakPolarHBondContact O-CA 3.43Å; F186-L190 PolarHBondContact O-N 2.89Å; F186-L190 VanDerWaalsContact O-N 3.07Å; F186-C191 HydrophobicContact CZ-CB 4.31Å; F186-Y196 HydrophobicContact CE1-CD2 4.17Å; F186-Y196 AromaticContact CE1-CE2 3.63Å; F186-Y196 HydrophobicContact CE1-CE2 3.63Å; F186-Y196 HydrophobicContact CZ-CD2 4.18Å; F186-Y196 HydrophobicContact CZ-CE2 4Å
187	I	96.6	Very high	86.1	Confident	36 Å²	36	60 Å²	60	19%	0.185	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-62.4	-16.4	175.3	59.3	170.2	0	0	0	114.8	P185 Q208 K210 I211	P185-I187 HydrophobicContact CB-CG1 3.92Å; P185-I187 PolarHBondContact O-N 3.11Å; I187-Q208 WeakPolarHBondContact CD1-O 3.29Å; I187-Q208 HydrophobicContact CG2-CB 4.28Å; I187-K210 HydrophobicContact CD1-CD 4.4Å; I187-K210 HydrophobicContact CD1-CG 4.27Å; I187-K210 PolarHBondContact O-N 2.89Å; I187-I211 PolarHBondContact O-N 2.82Å
188	Y	98.4	Very high	85.6	Confident	16 Å²	16	61.4 Å²	61.4	6%	0.063	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-88.1	-1.3	173.1	-68.3	-84.6	0	0	0	113.2	V112 E114 L115 P185 F186 K210 I211	V112-Y188 HydrophobicContact CG1-CD1 4.17Å; V112-Y188 HydrophobicContact CG1-CE1 4.15Å; E114-Y188 HydrophobicContact CG-CE1 4.47Å; E114-Y188 WeakPolarHBondContact OE1-CE1 3.5Å; E114-Y188 PolarHBondContact OE1-OH 2.58Å; L115-Y188 HydrophobicContact CD1-CD1 4.04Å; L115-Y188 HydrophobicContact CD2-CD1 3.62Å; L115-Y188 HydrophobicContact CD2-CE1 3.88Å; L115-Y188 HydrophobicContact CD2-CG 4.01Å; L115-Y188 HydrophobicContact CG-CD1 3.94Å; L115-Y188 HydrophobicContact CG-CE1 4.08Å; P185-Y188 HydrophobicContact CB-CD2 3.91Å; P185-Y188 HydrophobicContact CB-CE2 4.13Å; P185-Y188 HydrophobicContact CG-CD2 4.03Å; P185-Y188 HydrophobicContact CG-CE2 3.9Å; P185-Y188 PolarHBondContact O-N 2.84Å; F186-Y188 PolarHBondContact O-N 2.76Å; F186-Y188 VanDerWaalsContact O-N 3.14Å; Y188-K210 HydrophobicContact CD1-CB 4.27Å; Y188-K210 HydrophobicContact CD1-CD 3.94Å; Y188-K210 HydrophobicContact CE1-CB 4.48Å; Y188-K210 HydrophobicContact CE1-CD 3.36Å; Y188-K210 HydrophobicContact CE1-CG 4.5Å; Y188-K210 HydrophobicContact CE2-CD 4.25Å; Y188-K210 PolarHBondContact OH-NZ 3.11Å; Y188-I211 WeakPolarHBondContact O-CB 3.31Å; Y188-I211 WeakPolarHBondContact O-CD1 3.43Å
189	N	97.3	Very high	85.2	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	32%	0.318	C	S	.	.	S	Bend	trans	-156.5	56.8	171.7	-166.3	-3.3	0	0	0	108.4	A124 N134 V137 F186 C191 H213	A124-N189 HydrophobicContact CB-CB 3.5Å; A124-N189 VanDerWaalsContact CB-CB 3.5Å; N134-N189 WeakPolarHBondContact CB-ND2 3.48Å; N134-N189 PolarHBondContact OD1-ND2 3.39Å; V137-N189 HydrophobicContact CB-CB 3.99Å; V137-N189 HydrophobicContact CG2-CB 3.98Å; V137-N189 PolarHBondContact N-ND2 3.44Å; F186-N189 CarbonylContact O-C 3.58Å; F186-N189 PolarHBondContact O-N 3.1Å; N189-C191 PolarHBondContact O-N 2.97Å; N189-H213 WeakPolarHBondContact OD1-CB 3.27Å; N189-H213 PolarHBondContact OD1-ND1 3.34Å
190	L	94.1	Very high	84.9	Confident	8 Å²	8	60.2 Å²	60.2	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	102.3	-176.5	177.3	60	0	0	0	108.3	F186 A192 F202 A209 I211 V212 H213	F186-L190 HydrophobicContact CD1-CD1 3.72Å; F186-L190 HydrophobicContact CE1-CD1 3.29Å; F186-L190 HydrophobicContact CZ-CD1 4.08Å; F186-L190 WeakPolarHBondContact O-CA 3.43Å; F186-L190 PolarHBondContact O-N 2.89Å; F186-L190 VanDerWaalsContact O-N 3.07Å; L190-A192 PolarHBondContact O-N 3.15Å; L190-F202 HydrophobicContact CD2-CD2 4.36Å; L190-F202 HydrophobicContact CD2-CE2 3.95Å; L190-A209 HydrophobicContact CD2-CB 3.48Å; L190-A209 VanDerWaalsContact CD2-CB 3.48Å; L190-I211 WeakPolarHBondContact CB-O 3.37Å; L190-I211 PolarHBondContact N-O 3.19Å; L190-V212 WeakPolarHBondContact O-CA 3.15Å; L190-H213 PolarHBondContact O-N 2.78Å
191	C	87.5	Confident	84.6	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.054	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	97.7	178.7	-178.6	0	0	0	0	110	P127 F186 N189 S193 A215	P127-C191 HydrophobicContact CG-CB 3.81Å; F186-C191 HydrophobicContact CZ-CB 4.31Å; N189-C191 PolarHBondContact O-N 2.97Å; C191-S193 PolarHBondContact O-N 3.08Å; C191-S193 VanDerWaalsContact O-N 3.08Å; C191-A215 WeakPolarHBondContact SG-CB 3.32Å
192	A	71.2	Confident	84.1	Confident	13 Å²	13	53 Å²	53	11%	0.107	29%	0.287	C	S	.	.			trans	-82	73.7	169.3	0	0	0	0	0	108.3	L190 V212 H213 F236	L190-A192 PolarHBondContact O-N 3.15Å; A192-V212 HydrophobicContact CB-CG1 3.53Å; A192-H213 PolarHBondContact N-O 3.4Å; A192-F236 HydrophobicContact CB-CD2 4.25Å
193	S	67.4	Low	83.6	Confident	21 Å²	21	57 Å²	57	15%	0.147	31%	0.306	C	S	.	.	S	Bend	trans	-107.3	159.4	170.9	70	0	0	0	0	110.5	C191 V195 Y196	C191-S193 PolarHBondContact O-N 3.08Å; C191-S193 VanDerWaalsContact O-N 3.08Å; S193-V195 PolarHBondContact O-N 3.29Å; S193-V195 WeakPolarHBondContact OG-CB 3.5Å; S193-V195 PolarHBondContact OG-N 3.21Å; S193-V195 VanDerWaalsContact OG-N 3.15Å; S193-Y196 PolarHBondContact O-N 3.3Å; S193-Y196 VanDerWaalsContact O-N 3.12Å; S193-Y196 PolarHBondContact OG-N 3.18Å
194	S	49.8	Very low	83.2	Confident	115 Å²	115	59.8 Å²	59.8	80%	0.804	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-8.7	164.8	51.7	0	0	0	0	113.4
195	V	50.3	Low	82.9	Confident	105 Å²	105	65.1 Å²	65.1	64%	0.636	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-7.4	-179	-164	0	0	0	0	112.1	S193 T197	S193-V195 PolarHBondContact O-N 3.29Å; S193-V195 WeakPolarHBondContact OG-CB 3.5Å; S193-V195 PolarHBondContact OG-N 3.21Å; S193-V195 VanDerWaalsContact OG-N 3.15Å; V195-T197 VanDerWaalsContact C-N 3.25Å; V195-T197 WeakPolarHBondContact O-CG2 3.4Å; V195-T197 PolarHBondContact O-N 3.29Å
196	Y	62.4	Low	82.4	Confident	61 Å²	61	62.5 Å²	62.5	24%	0.239	33%	0.329	C	S	.	.			trans	-72.9	88.8	171.1	-168	-91.5	0	0	0	109.6	F186 S193 Y198 A201 F202	F186-Y196 HydrophobicContact CE1-CD2 4.17Å; F186-Y196 AromaticContact CE1-CE2 3.63Å; F186-Y196 HydrophobicContact CE1-CE2 3.63Å; F186-Y196 HydrophobicContact CZ-CD2 4.18Å; F186-Y196 HydrophobicContact CZ-CE2 4Å; S193-Y196 PolarHBondContact O-N 3.3Å; S193-Y196 VanDerWaalsContact O-N 3.12Å; S193-Y196 PolarHBondContact OG-N 3.18Å; Y196-Y198 VanDerWaalsContact C-N 3.32Å; Y196-Y198 VanDerWaalsContact CE1-O 3.22Å; Y196-Y198 WeakPolarHBondContact CE1-O 3.31Å; Y196-A201 WeakPolarHBondContact OH-CB 3.4Å; Y196-F202 HydrophobicContact CD1-CB 4.22Å; Y196-F202 HydrophobicContact CE1-CB 3.64Å
197	T	68.1	Low	82.1	Confident	126 Å²	126	62.7 Å²	62.7	77%	0.773	34%	0.336	S	S	*	.			trans	-81.3	-12.8	-174	51	0	0	0	0	112.7	V195 L199	V195-T197 VanDerWaalsContact C-N 3.25Å; V195-T197 WeakPolarHBondContact O-CG2 3.4Å; V195-T197 PolarHBondContact O-N 3.29Å; T197-L199 VanDerWaalsContact C-N 3.32Å; T197-L199 PolarHBondContact O-N 3.47Å
198	Y	84.4	Confident	82	Confident	149 Å²	149	66.3 Å²	66.3	58%	0.584	35%	0.352	S	S	*	.			trans	-90.2	60.2	-169.5	-160	-171.5	0	0	0	113.8	Y196 P200 A201 F202	Y196-Y198 VanDerWaalsContact C-N 3.32Å; Y196-Y198 VanDerWaalsContact CE1-O 3.22Å; Y196-Y198 WeakPolarHBondContact CE1-O 3.31Å; Y198-P200 HydrophobicContact CD2-CG 4.41Å; Y198-P200 HydrophobicContact CE2-CB 4.24Å; Y198-P200 HydrophobicContact CE2-CG 4.32Å; Y198-A201 HydrophobicContact CD1-CB 3.52Å; Y198-A201 HydrophobicContact CD2-CB 4.2Å; Y198-A201 HydrophobicContact CE1-CB 3.76Å; Y198-A201 HydrophobicContact CE2-CB 4.39Å; Y198-A201 HydrophobicContact CG-CB 3.75Å; Y198-A201 PolarHBondContact O-N 2.55Å; Y198-F202 PolarHBondContact O-N 3.2Å; Y198-F202 VanDerWaalsContact O-N 3.13Å
199	L	84.3	Confident	81.8	Confident	92 Å²	92	65.7 Å²	65.7	48%	0.482	35%	0.35	S	S	.	.	H	α-helix	trans	-50.3	-43.4	-175	-178.7	64.1	0	0	0	114.9	T197 A201 F202 Q203	T197-L199 VanDerWaalsContact C-N 3.32Å; T197-L199 PolarHBondContact O-N 3.47Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 3.24Å; L199-F202 HydrophobicContact CD1-CD1 4.5Å; L199-F202 WeakPolarHBondContact O-CB 3.44Å; L199-F202 PolarHBondContact O-N 3.4Å; L199-F202 VanDerWaalsContact O-N 3.12Å; L199-Q203 HydrophobicContact CD1-CG 4.2Å; L199-Q203 HydrophobicContact CG-CG 4.36Å; L199-Q203 WeakPolarHBondContact O-CG 3.3Å; L199-Q203 PolarHBondContact O-N 3.42Å
200	P	89.1	Confident	81.9	Confident	83 Å²	83	67.9 Å²	67.9	54%	0.539	36%	0.36	S	S	.	.	H	α-helix	trans	-56.8	-42.8	175.9	-27.7	35.1	0	0	0	113.9	Y198 F202 Q203 H204	Y198-P200 HydrophobicContact CD2-CG 4.41Å; Y198-P200 HydrophobicContact CE2-CB 4.24Å; Y198-P200 HydrophobicContact CE2-CG 4.32Å; P200-F202 VanDerWaalsContact C-N 3.35Å; P200-Q203 PolarHBondContact O-N 2.61Å; P200-H204 PolarHBondContact O-N 3.11Å; P200-H204 VanDerWaalsContact O-N 3.15Å
201	A	89.6	Confident	82.1	Confident	13 Å²	13	67.5 Å²	67.5	11%	0.107	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-38.2	176.6	0	0	0	0	0	111.1	Y196 Y198 L199 H204 F205	Y196-A201 WeakPolarHBondContact OH-CB 3.4Å; Y198-A201 HydrophobicContact CD1-CB 3.52Å; Y198-A201 HydrophobicContact CD2-CB 4.2Å; Y198-A201 HydrophobicContact CE1-CB 3.76Å; Y198-A201 HydrophobicContact CE2-CB 4.39Å; Y198-A201 HydrophobicContact CG-CB 3.75Å; Y198-A201 PolarHBondContact O-N 2.55Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 3.24Å; A201-H204 PolarHBondContact O-N 3.35Å; A201-F205 HydrophobicContact CB-CD2 4.24Å; A201-F205 WeakPolarHBondContact O-CB 3.43Å; A201-F205 VanDerWaalsContact O-CD2 3.27Å; A201-F205 WeakPolarHBondContact O-CD2 3.19Å; A201-F205 PolarHBondContact O-N 3.1Å
202	F	87.6	Confident	82.5	Confident	28 Å²	28	67.1 Å²	67.1	12%	0.123	36%	0.355	C	S	.	.	H	α-helix	trans	-63.2	-43.6	173.7	-179.8	-92.2	0	0	0	112.3	L190 Y196 Y198 L199 P200 H204 G206 S232 F236	L190-F202 HydrophobicContact CD2-CD2 4.36Å; L190-F202 HydrophobicContact CD2-CE2 3.95Å; Y196-F202 HydrophobicContact CD1-CB 4.22Å; Y196-F202 HydrophobicContact CE1-CB 3.64Å; Y198-F202 PolarHBondContact O-N 3.2Å; Y198-F202 VanDerWaalsContact O-N 3.13Å; L199-F202 HydrophobicContact CD1-CD1 4.5Å; L199-F202 WeakPolarHBondContact O-CB 3.44Å; L199-F202 PolarHBondContact O-N 3.4Å; L199-F202 VanDerWaalsContact O-N 3.12Å; P200-F202 VanDerWaalsContact C-N 3.35Å; F202-H204 PolarHBondContact O-N 3.26Å; F202-G206 WeakPolarHBondContact O-CA 3.39Å; F202-G206 PolarHBondContact O-N 3.16Å; F202-S232 WeakPolarHBondContact CE1-OG 3.16Å; F202-F236 AromaticContact CE2-CE2 3.7Å; F202-F236 HydrophobicContact CE2-CE2 3.7Å; F202-F236 HydrophobicContact CE2-CZ 4.02Å; F202-F236 AromaticContact CZ-CE2 3.58Å; F202-F236 HydrophobicContact CZ-CE2 3.58Å; F202-F236 AromaticContact CZ-CZ 3.81Å; F202-F236 HydrophobicContact CZ-CZ 3.81Å
203	Q	87.5	Confident	83.7	Confident	133 Å²	133	67 Å²	67	62%	0.621	35%	0.352	S	S	*	.	H	α-helix	trans	-61	-33.8	177.9	-72.9	176.2	-17.1	0	0	112.1	L199 P200	L199-Q203 HydrophobicContact CD1-CG 4.2Å; L199-Q203 HydrophobicContact CG-CG 4.36Å; L199-Q203 WeakPolarHBondContact O-CG 3.3Å; L199-Q203 PolarHBondContact O-N 3.42Å; P200-Q203 PolarHBondContact O-N 2.61Å
204	H	89.8	Confident	84.9	Confident	130 Å²	130	66 Å²	66	60%	0.602	35%	0.346	S	S	*	.	H	α-helix	trans	-82.8	-47.4	-179.7	-167.9	84	0	0	0	113.5	P200 A201 F202	P200-H204 PolarHBondContact O-N 3.11Å; P200-H204 VanDerWaalsContact O-N 3.15Å; A201-H204 PolarHBondContact O-N 3.35Å; F202-H204 PolarHBondContact O-N 3.26Å
205	F	90.7	Very high	86.5	Confident	114 Å²	114	61.6 Å²	61.6	50%	0.5	32%	0.316	S	S	.	.	H	α-helix	trans	-102.8	-22.2	-172.8	-58.4	-71.2	0	0	0	114.1	A201 P207 Q208	A201-F205 HydrophobicContact CB-CD2 4.24Å; A201-F205 WeakPolarHBondContact O-CB 3.43Å; A201-F205 VanDerWaalsContact O-CD2 3.27Å; A201-F205 WeakPolarHBondContact O-CD2 3.19Å; A201-F205 PolarHBondContact O-N 3.1Å; F205-P207 VanDerWaalsContact C-CD 3.46Å; F205-Q208 WeakPolarHBondContact O-CB 3.23Å; F205-Q208 PolarHBondContact O-N 2.96Å
206	G	88.9	Confident	88	Confident	6 Å²	6	58.9 Å²	58.9	6%	0.062	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-56.9	-36.2	-178.4	0	0	0	0	0	114.8	F202 Q208 A209	F202-G206 WeakPolarHBondContact O-CA 3.39Å; F202-G206 PolarHBondContact O-N 3.16Å; G206-Q208 PolarHBondContact O-N 3.08Å; G206-A209 WeakPolarHBondContact O-CB 3.44Å; G206-A209 PolarHBondContact O-N 2.83Å
207	P	89.9	Confident	88.8	Confident	59 Å²	59	63 Å²	63	38%	0.383	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-60.8	-14.4	172	-26	35.9	0	0	0	114.5	F205 L285	F205-P207 VanDerWaalsContact C-CD 3.46Å; P207-L285 WeakPolarHBondContact O-CD1 3.37Å
208	Q	94.1	Very high	89.5	Confident	111 Å²	111	61.9 Å²	61.9	52%	0.519	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-94.7	5.2	176.5	-54.9	176.7	44.1	0	0	112.6	I187 F205 G206 K210	I187-Q208 WeakPolarHBondContact CD1-O 3.29Å; I187-Q208 HydrophobicContact CG2-CB 4.28Å; F205-Q208 WeakPolarHBondContact O-CB 3.23Å; F205-Q208 PolarHBondContact O-N 2.96Å; G206-Q208 PolarHBondContact O-N 3.08Å; Q208-K210 PolarHBondContact O-N 3.34Å
209	A	94.8	Very high	89.8	Confident	3 Å²	3	56.2 Å²	56.2	3%	0.025	30%	0.3	C	S	.	.			trans	-55.4	131.8	178.4	0	0	0	0	0	111.5	L109 L190 G206	L109-A209 HydrophobicContact CD1-CB 3.96Å; L190-A209 HydrophobicContact CD2-CB 3.48Å; L190-A209 VanDerWaalsContact CD2-CB 3.48Å; G206-A209 WeakPolarHBondContact O-CB 3.44Å; G206-A209 PolarHBondContact O-N 2.83Å
210	K	98.1	Very high	90	Very high	47 Å²	47	52.2 Å²	52.2	20%	0.204	28%	0.28	C	S	.	.	S	Bend	trans	-106.9	-38.5	176.9	-62.4	-166.7	161	-167.2	0	111.9	L109 C110 V112 E114 I187 Y188 Q208	L109-K210 PolarHBondContact N-O 2.81Å; C110-K210 WeakPolarHBondContact SG-CG 3.37Å; V112-K210 HydrophobicContact CG1-CB 3.94Å; V112-K210 HydrophobicContact CG1-CD 4.32Å; E114-K210 IonicContact OE1-NZ 3.97Å; E114-K210 PolarHBondContact OE1-NZ 3.39Å; I187-K210 HydrophobicContact CD1-CD 4.4Å; I187-K210 HydrophobicContact CD1-CG 4.27Å; I187-K210 PolarHBondContact O-N 2.89Å; Y188-K210 HydrophobicContact CD1-CB 4.27Å; Y188-K210 HydrophobicContact CD1-CD 3.94Å; Y188-K210 HydrophobicContact CE1-CB 4.48Å; Y188-K210 HydrophobicContact CE1-CD 3.36Å; Y188-K210 HydrophobicContact CE1-CG 4.5Å; Y188-K210 HydrophobicContact CE2-CD 4.25Å; Y188-K210 PolarHBondContact OH-NZ 3.11Å; Q208-K210 PolarHBondContact O-N 3.34Å
211	I	98.1	Very high	90.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	127.4	175.9	-54.5	174	0	0	0	107.7	L102 T106 L107 I108 V112 L115 V137 I187 Y188 L190	L102-I211 HydrophobicContact CD2-CD1 3.93Å; T106-I211 HydrophobicContact CG2-CG2 4.33Å; L107-I211 WeakPolarHBondContact O-CA 3.36Å; I108-I211 HydrophobicContact CG1-CG1 4.36Å; V112-I211 HydrophobicContact CG1-CD1 4.22Å; V112-I211 HydrophobicContact CG1-CG1 4.1Å; V112-I211 HydrophobicContact CG2-CD1 4.26Å; L115-I211 HydrophobicContact CD1-CD1 4.18Å; V137-I211 HydrophobicContact CG1-CD1 4.19Å; V137-I211 HydrophobicContact CG2-CG2 4.09Å; I187-I211 PolarHBondContact O-N 2.82Å; Y188-I211 WeakPolarHBondContact O-CB 3.31Å; Y188-I211 WeakPolarHBondContact O-CD1 3.43Å; L190-I211 WeakPolarHBondContact CB-O 3.37Å; L190-I211 PolarHBondContact N-O 3.19Å
212	V	96.1	Very high	90	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.1	173.3	176.8	0	0	0	0	108.2	T106 L107 L109 L190 A192 F214 F236	T106-V212 CarbonylContact C-O 3.5Å; T106-V212 WeakPolarHBondContact CA-O 3.4Å; L107-V212 HydrophobicContact CB-CB 4.49Å; L107-V212 PolarHBondContact N-O 3.27Å; L107-V212 PolarHBondContact O-N 3.01Å; L109-V212 HydrophobicContact CD1-CG2 3.66Å; L109-V212 HydrophobicContact CG-CG2 4.24Å; L190-V212 WeakPolarHBondContact O-CA 3.15Å; A192-V212 HydrophobicContact CB-CG1 3.53Å; V212-F214 HydrophobicContact CG1-CE1 4.33Å; V212-F214 HydrophobicContact CG1-CE2 4.15Å; V212-F214 HydrophobicContact CG1-CZ 4.06Å; V212-F236 HydrophobicContact CG1-CB 4.3Å; V212-F236 HydrophobicContact CG1-CD2 4.13Å; V212-F236 HydrophobicContact CG1-CG 4.09Å; V212-F236 HydrophobicContact CG2-CD1 3.8Å; V212-F236 HydrophobicContact CG2-CD2 4.43Å; V212-F236 HydrophobicContact CG2-CE1 3.7Å; V212-F236 HydrophobicContact CG2-CE2 4.33Å; V212-F236 HydrophobicContact CG2-CG 4.19Å; V212-F236 HydrophobicContact CG2-CZ 3.98Å
213	H	95.8	Very high	89.3	Confident	10 Å²	10	54.5 Å²	54.5	5%	0.046	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	115.2	177.1	179.8	-173.8	0	0	0	109	D105 T106 N134 N189 L190 A192 A215	D105-H213 IonicContact OD1-CD2 3.69Å; D105-H213 PolarHBondContact OD1-CD2 3.09Å; D105-H213 IonicContact OD1-NE2 3.98Å; D105-H213 PolarHBondContact OD1-NE2 2.79Å; D105-H213 IonicContact OD2-NE2 2.77Å; T106-H213 HydrophobicContact CG2-CB 4.16Å; N134-H213 PolarHBondContact OD1-CE1 2.68Å; N134-H213 VanDerWaalsContact OD1-CE1 3.3Å; N134-H213 PolarHBondContact OD1-ND1 3.48Å; N189-H213 WeakPolarHBondContact OD1-CB 3.27Å; N189-H213 PolarHBondContact OD1-ND1 3.34Å; L190-H213 PolarHBondContact O-N 2.78Å; A192-H213 PolarHBondContact N-O 3.4Å; H213-A215 PolarHBondContact O-N 2.85Å
214	F	92.8	Very high	88.1	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.009	30%	0.298	C	S	.	.			trans	-80.7	63.8	178.3	-61.2	-86.4	0	0	0	110.5	D105 L107 V212 P220 F236 E237 W240	D105-F214 WeakPolarHBondContact O-CD2 3.44Å; D105-F214 PolarHBondContact O-N 3.36Å; L107-F214 HydrophobicContact CB-CE2 3.81Å; L107-F214 HydrophobicContact CD2-CE2 4.43Å; L107-F214 HydrophobicContact CD2-CZ 4.41Å; V212-F214 HydrophobicContact CG1-CE1 4.33Å; V212-F214 HydrophobicContact CG1-CE2 4.15Å; V212-F214 HydrophobicContact CG1-CZ 4.06Å; F214-P220 HydrophobicContact CB-CG 3.85Å; F214-P220 HydrophobicContact CD1-CG 3.8Å; F214-P220 HydrophobicContact CD2-CG 3.57Å; F214-P220 HydrophobicContact CE1-CG 4.19Å; F214-P220 HydrophobicContact CE2-CG 4.01Å; F214-P220 HydrophobicContact CG-CG 3.46Å; F214-P220 VanDerWaalsContact CG-CG 3.46Å; F214-P220 HydrophobicContact CZ-CG 4.29Å; F214-F236 HydrophobicContact CE1-CB 3.77Å; F214-F236 HydrophobicContact CZ-CB 3.8Å; F214-E237 HydrophobicContact CE1-CG 4.07Å; F214-W240 HydrophobicContact CE2-CB 4.23Å; F214-W240 AromaticContact CE2-CD1 3.68Å; F214-W240 HydrophobicContact CE2-CG 4.23Å; F214-W240 HydrophobicContact CZ-CB 4.05Å; F214-W240 HydrophobicContact CZ-CG 4.47Å
215	A	83.8	Confident	86.4	Confident	21 Å²	21	58.7 Å²	58.7	17%	0.174	31%	0.305	C	S	.	.			trans	-68.4	148.1	-179.5	0	0	0	0	0	111.3	C191 H213	C191-A215 WeakPolarHBondContact SG-CB 3.32Å; H213-A215 PolarHBondContact O-N 2.85Å
216	G	81.5	Confident	84.2	Confident	48 Å²	48	61.7 Å²	61.7	50%	0.495	33%	0.326	S	S	.	.	S	Bend	trans	111.3	-179.1	-177.6	0	0	0	0	0	113.5	K219	G216-K219 VanDerWaalsContact O-CE 3.3Å; G216-K219 WeakPolarHBondContact O-CE 3.37Å; G216-K219 PolarHBondContact O-NZ 2.9Å
217	V	79.5	Confident	82.4	Confident	147 Å²	147	64.1 Å²	64.1	89%	0.891	35%	0.351	S	S	*	.	S	Bend	trans	-72.8	-33.4	-171.5	-174.3	0	0	0	0	111.9	K219	V217-K219 PolarHBondContact O-N 3.37Å
218	R	83.6	Confident	80.4	Confident	104 Å²	104	67.9 Å²	67.9	39%	0.392	38%	0.377	S	S	.	.			trans	-86.6	108.9	178.3	-81	-176.1	156.5	-92.2	-14.4	110.1	P223	R218-P223 PolarHBondContact NH1-O 3.26Å
219	K	90.6	Very high	78.5	Confident	29 Å²	29	64.8 Å²	64.8	13%	0.126	36%	0.362	C	S	.	.			trans	-87.7	156.4	171.7	-53.2	-52.3	-174.6	-172.6	0	111	Y16 D105 G216 V217 W221 S222	Y16-K219 WeakPolarHBondContact OH-CE 3.35Å; D105-K219 HydrophobicContact CB-CD 4.04Å; D105-K219 VanDerWaalsContact OD2-CE 3.29Å; D105-K219 WeakPolarHBondContact OD2-CE 3.41Å; D105-K219 IonicContact OD2-NZ 3.84Å; D105-K219 PolarHBondContact OD2-NZ 3.03Å; G216-K219 VanDerWaalsContact O-CE 3.3Å; G216-K219 WeakPolarHBondContact O-CE 3.37Å; G216-K219 PolarHBondContact O-NZ 2.9Å; V217-K219 PolarHBondContact O-N 3.37Å; K219-W221 HydrophobicContact CB-CD2 3.76Å; K219-W221 VanDerWaalsContact CB-CE2 3.41Å; K219-W221 HydrophobicContact CB-CE3 4.1Å; K219-W221 HydrophobicContact CB-CG 4.35Å; K219-W221 HydrophobicContact CB-CH2 3.98Å; K219-W221 HydrophobicContact CB-CZ2 3.56Å; K219-W221 HydrophobicContact CB-CZ3 4.21Å; K219-W221 HydrophobicContact CD-CZ2 4.45Å; K219-W221 HydrophobicContact CG-CH2 4.22Å; K219-W221 HydrophobicContact CG-CZ2 3.67Å; K219-W221 PolarHBondContact O-N 2.92Å; K219-W221 VanDerWaalsContact O-N 3.09Å; K219-S222 PolarHBondContact N-OG 3.02Å; K219-S222 WeakPolarHBondContact O-CB 3.41Å; K219-S222 PolarHBondContact O-N 3.14Å; K219-S222 PolarHBondContact O-OG 3.32Å
220	P	89.1	Confident	77.1	Confident	8 Å²	8	68.3 Å²	68.3	5%	0.052	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.6	-179	-29.4	36.7	0	0	0	115.1	F214 S222 W240 W241	F214-P220 HydrophobicContact CB-CG 3.85Å; F214-P220 HydrophobicContact CD1-CG 3.8Å; F214-P220 HydrophobicContact CD2-CG 3.57Å; F214-P220 HydrophobicContact CE1-CG 4.19Å; F214-P220 HydrophobicContact CE2-CG 4.01Å; F214-P220 HydrophobicContact CG-CG 3.46Å; F214-P220 VanDerWaalsContact CG-CG 3.46Å; F214-P220 HydrophobicContact CZ-CG 4.29Å; P220-S222 VanDerWaalsContact C-N 3.31Å; P220-W240 HydrophobicContact CB-CB 4.38Å; P220-W240 HydrophobicContact CB-CD2 3.35Å; P220-W240 HydrophobicContact CB-CE3 3.54Å; P220-W240 HydrophobicContact CB-CG 3.7Å; P220-W240 HydrophobicContact CB-CH2 4.45Å; P220-W240 HydrophobicContact CB-CZ2 4.27Å; P220-W240 HydrophobicContact CB-CZ3 4.09Å; P220-W240 HydrophobicContact CG-CD2 4.05Å; P220-W240 HydrophobicContact CG-CG 3.99Å; P220-W241 WeakPolarHBondContact O-CZ2 3.47Å; P220-W241 PolarHBondContact O-NE1 3.5Å
221	W	90.8	Very high	75.8	Confident	29 Å²	29	73 Å²	73	11%	0.11	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	3.8	177.5	56.5	83.6	0	0	0	114.2	Y16 Q18 G19 D105 K219 W240	Y16-W221 HydrophobicContact CD1-CH2 4.12Å; Y16-W221 AromaticContact CD1-CZ2 3.81Å; Y16-W221 HydrophobicContact CD1-CZ2 3.81Å; Y16-W221 HydrophobicContact CD2-CZ2 4.21Å; Y16-W221 HydrophobicContact CE1-CH2 4.29Å; Y16-W221 AromaticContact CE1-CZ2 3.93Å; Y16-W221 HydrophobicContact CE1-CZ2 3.93Å; Y16-W221 HydrophobicContact CE2-CZ2 4.34Å; Y16-W221 AromaticContact CG-CZ2 3.96Å; Y16-W221 HydrophobicContact CG-CZ2 3.96Å; Q18-W221 HydrophobicContact CB-CB 4.48Å; G19-W221 VanDerWaalsContact CA-CZ3 3.44Å; D105-W221 HydrophobicContact CB-CH2 3.84Å; D105-W221 HydrophobicContact CB-CZ3 4.25Å; K219-W221 HydrophobicContact CB-CD2 3.76Å; K219-W221 VanDerWaalsContact CB-CE2 3.41Å; K219-W221 HydrophobicContact CB-CE3 4.1Å; K219-W221 HydrophobicContact CB-CG 4.35Å; K219-W221 HydrophobicContact CB-CH2 3.98Å; K219-W221 HydrophobicContact CB-CZ2 3.56Å; K219-W221 HydrophobicContact CB-CZ3 4.21Å; K219-W221 HydrophobicContact CD-CZ2 4.45Å; K219-W221 HydrophobicContact CG-CH2 4.22Å; K219-W221 HydrophobicContact CG-CZ2 3.67Å; K219-W221 PolarHBondContact O-N 2.92Å; K219-W221 VanDerWaalsContact O-N 3.09Å; W221-W240 HydrophobicContact CB-CH2 3.92Å; W221-W240 HydrophobicContact CB-CZ3 4.41Å; W221-W240 HydrophobicContact CD2-CZ2 4.48Å; W221-W240 AromaticContact CE3-CH2 3.88Å; W221-W240 HydrophobicContact CE3-CH2 3.88Å; W221-W240 AromaticContact CE3-CZ2 3.42Å; W221-W240 HydrophobicContact CE3-CZ2 3.42Å; W221-W240 VanDerWaalsContact CE3-CZ2 3.42Å; W221-W240 AromaticContact CZ3-CZ2 3.97Å; W221-W240 HydrophobicContact CZ3-CZ2 3.97Å
222	S	86.6	Confident	74.5	Confident	33 Å²	33	74.4 Å²	74.4	23%	0.231	42%	0.42	C	S	.	.	S	Bend	trans	-74.9	149.8	177.3	-50	0	0	0	0	110.3	K219 P220 Q224	K219-S222 PolarHBondContact N-OG 3.02Å; K219-S222 WeakPolarHBondContact O-CB 3.41Å; K219-S222 PolarHBondContact O-N 3.14Å; K219-S222 PolarHBondContact O-OG 3.32Å; P220-S222 VanDerWaalsContact C-N 3.31Å; S222-Q224 PolarHBondContact O-N 3.47Å
223	P	73.8	Confident	73.6	Confident	111 Å²	111	75.5 Å²	75.5	72%	0.721	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-55.1	129	175.6	-22.5	31.7	0	0	0	111.7	R218 R225	R218-P223 PolarHBondContact NH1-O 3.26Å; P223-R225 PolarHBondContact O-N 3.38Å
224	Q	62.9	Low	72.9	Confident	152 Å²	152	79.7 Å²	79.7	71%	0.71	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-60.9	128.7	171.4	-91.9	164.6	-21.4	0	0	109.2	S222	S222-Q224 PolarHBondContact O-N 3.47Å
225	R	53.2	Low	72.5	Confident	199 Å²	199	82.7 Å²	82.7	75%	0.751	46%	0.459	S	S	*	.			trans	-111.4	138.1	158.3	-75.8	-172.2	173.7	-179.7	-2.7	105.6	P223 G227	P223-R225 PolarHBondContact O-N 3.38Å; R225-G227 PolarHBondContact O-N 2.88Å
226	D	44.8	Very low	72.7	Confident	176 Å²	176	82 Å²	82	94%	0.941	45%	0.452	S	S	*	.	S	Bend	trans	-59	120	175.8	-61.6	-47.6	0	0	0	109.8
227	G	51.4	Low	73.1	Confident	57 Å²	57	80.8 Å²	80.8	59%	0.588	43%	0.433	S	S	*	.	S	Bend	trans	145.3	120.4	169	0	0	0	0	0	116.7	R225	R225-G227 PolarHBondContact O-N 2.88Å
228	C	47.1	Very low	73.7	Confident	138 Å²	138	77.5 Å²	77.5	93%	0.932	42%	0.417	S	S	*	.			trans	55.7	64	157.9	-154.8	0	0	0	0	117.5
229	H	55.2	Low	74.1	Confident	46 Å²	46	74 Å²	74	21%	0.213	41%	0.405	C	S	.	.			trans	-95.9	141.7	157.6	-68.3	-90.5	0	0	0	109.3	E234 E237	H229-E234 HydrophobicContact CB-CG 3.59Å; H229-E237 IonicContact CE1-OE1 3.97Å; H229-E237 PolarHBondContact CE1-OE1 3.02Å; H229-E237 IonicContact ND1-OE1 3.73Å; H229-E237 PolarHBondContact ND1-OE1 2.99Å
230	S	64.4	Low	74.3	Confident	77 Å²	77	72.6 Å²	72.6	54%	0.538	40%	0.399	S	S	.	.			trans	-67.4	143.7	167.1	67.7	0	0	0	0	108.4	S232 M233 E234	S230-S232 PolarHBondContact O-N 3.38Å; S230-M233 WeakPolarHBondContact O-CA 3.43Å; S230-M233 WeakPolarHBondContact O-CB 3.45Å; S230-M233 PolarHBondContact O-N 2.96Å; S230-M233 WeakPolarHBondContact OG-CB 3.37Å; S230-M233 PolarHBondContact OG-N 3.24Å; S230-E234 PolarHBondContact O-N 3.01Å; S230-E234 VanDerWaalsContact O-N 3.13Å
231	Q	70.3	Confident	74.6	Confident	146 Å²	146	75.9 Å²	75.9	68%	0.682	41%	0.411	S	S	*	.	H	α-helix	trans	-52.3	-33.1	-178.9	-171.9	179.3	23.6	0	0	112.6	Q235	Q231-Q235 WeakPolarHBondContact O-CG 3.3Å; Q231-Q235 PolarHBondContact O-N 3.3Å
232	S	71.3	Confident	74.8	Confident	30 Å²	30	79.8 Å²	79.8	21%	0.21	43%	0.428	C	S	.	.	H	α-helix	trans	-69.9	-36.2	176.3	-55.8	0	0	0	0	113.2	F202 S230 Q235 F236	F202-S232 WeakPolarHBondContact CE1-OG 3.16Å; S230-S232 PolarHBondContact O-N 3.38Å; S232-Q235 PolarHBondContact O-N 3.05Å; S232-F236 WeakPolarHBondContact O-CD2 3.2Å; S232-F236 PolarHBondContact O-N 3.46Å
233	M	76.6	Confident	75.2	Confident	23 Å²	23	78.7 Å²	78.7	11%	0.113	42%	0.42	C	S	.	.	H	α-helix	trans	-68.7	-41.2	176.1	-168.7	167.2	-172.4	0	0	111.1	S230 Q235 F236 E237	S230-M233 WeakPolarHBondContact O-CA 3.43Å; S230-M233 WeakPolarHBondContact O-CB 3.45Å; S230-M233 PolarHBondContact O-N 2.96Å; S230-M233 WeakPolarHBondContact OG-CB 3.37Å; S230-M233 PolarHBondContact OG-N 3.24Å; M233-Q235 PolarHBondContact O-N 2.91Å; M233-F236 PolarHBondContact O-N 2.73Å; M233-F236 VanDerWaalsContact O-N 3.17Å; M233-E237 WeakPolarHBondContact O-CG 3.19Å; M233-E237 PolarHBondContact O-N 3.34Å
234	E	80.9	Confident	76.2	Confident	97 Å²	97	76.7 Å²	76.7	45%	0.453	40%	0.398	S	S	.	.	H	α-helix	trans	-59	-36.4	174.6	-64.8	179.3	171.8	0	0	112.1	H229 S230 S238	H229-E234 HydrophobicContact CB-CG 3.59Å; S230-E234 PolarHBondContact O-N 3.01Å; S230-E234 VanDerWaalsContact O-N 3.13Å; E234-S238 VanDerWaalsContact O-CB 3.27Å; E234-S238 WeakPolarHBondContact O-CB 3.23Å; E234-S238 PolarHBondContact O-N 3.45Å; E234-S238 PolarHBondContact O-OG 2.87Å
235	Q	84.8	Confident	77.6	Confident	66 Å²	66	74.9 Å²	74.9	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-65.4	-46.6	175.7	-72.4	170	0.4	0	0	111.8	Q231 S232 M233 S238 L239	Q231-Q235 WeakPolarHBondContact O-CG 3.3Å; Q231-Q235 PolarHBondContact O-N 3.3Å; S232-Q235 PolarHBondContact O-N 3.05Å; M233-Q235 PolarHBondContact O-N 2.91Å; Q235-S238 WeakPolarHBondContact O-CB 3.28Å; Q235-S238 PolarHBondContact O-N 2.83Å; Q235-L239 WeakPolarHBondContact O-CG 3.46Å; Q235-L239 PolarHBondContact O-N 2.93Å
236	F	89.5	Confident	79.2	Confident	7 Å²	7	67 Å²	67	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-66.7	-39.5	177.5	-67.3	-47.6	0	0	0	112.4	L109 A192 F202 V212 F214 S232 M233 S238 L239 W240	L109-F236 HydrophobicContact CD1-CE1 4.1Å; A192-F236 HydrophobicContact CB-CD2 4.25Å; F202-F236 AromaticContact CE2-CE2 3.7Å; F202-F236 HydrophobicContact CE2-CE2 3.7Å; F202-F236 HydrophobicContact CE2-CZ 4.02Å; F202-F236 AromaticContact CZ-CE2 3.58Å; F202-F236 HydrophobicContact CZ-CE2 3.58Å; F202-F236 AromaticContact CZ-CZ 3.81Å; F202-F236 HydrophobicContact CZ-CZ 3.81Å; V212-F236 HydrophobicContact CG1-CB 4.3Å; V212-F236 HydrophobicContact CG1-CD2 4.13Å; V212-F236 HydrophobicContact CG1-CG 4.09Å; V212-F236 HydrophobicContact CG2-CD1 3.8Å; V212-F236 HydrophobicContact CG2-CD2 4.43Å; V212-F236 HydrophobicContact CG2-CE1 3.7Å; V212-F236 HydrophobicContact CG2-CE2 4.33Å; V212-F236 HydrophobicContact CG2-CG 4.19Å; V212-F236 HydrophobicContact CG2-CZ 3.98Å; F214-F236 HydrophobicContact CE1-CB 3.77Å; F214-F236 HydrophobicContact CZ-CB 3.8Å; S232-F236 WeakPolarHBondContact O-CD2 3.2Å; S232-F236 PolarHBondContact O-N 3.46Å; M233-F236 PolarHBondContact O-N 2.73Å; M233-F236 VanDerWaalsContact O-N 3.17Å; F236-S238 VanDerWaalsContact C-N 3.32Å; F236-S238 PolarHBondContact O-N 3.49Å; F236-L239 HydrophobicContact CD1-CD1 4.28Å; F236-L239 PolarHBondContact O-N 2.99Å; F236-W240 WeakPolarHBondContact O-CB 3.47Å; F236-W240 PolarHBondContact O-N 2.88Å
237	E	89.8	Confident	80.4	Confident	21 Å²	21	66.8 Å²	66.8	10%	0.098	36%	0.358	C	S	.	.	H	α-helix	trans	-62.1	-40.9	173.2	-72.5	179.7	-172.1	0	0	111.5	F214 H229 M233 L239 W240 W241	F214-E237 HydrophobicContact CE1-CG 4.07Å; H229-E237 IonicContact CE1-OE1 3.97Å; H229-E237 PolarHBondContact CE1-OE1 3.02Å; H229-E237 IonicContact ND1-OE1 3.73Å; H229-E237 PolarHBondContact ND1-OE1 2.99Å; M233-E237 WeakPolarHBondContact O-CG 3.19Å; M233-E237 PolarHBondContact O-N 3.34Å; E237-L239 VanDerWaalsContact C-N 3.34Å; E237-L239 PolarHBondContact O-N 3.48Å; E237-W240 WeakPolarHBondContact O-CB 3.36Å; E237-W240 PolarHBondContact O-N 3.01Å; E237-W241 VanDerWaalsContact O-CD1 3.27Å; E237-W241 PolarHBondContact O-N 2.83Å
238	S	91	Very high	80.7	Confident	78 Å²	78	68.2 Å²	68.2	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-41.1	175	-63.1	0	0	0	0	111.9	E234 Q235 F236 K242	E234-S238 VanDerWaalsContact O-CB 3.27Å; E234-S238 WeakPolarHBondContact O-CB 3.23Å; E234-S238 PolarHBondContact O-N 3.45Å; E234-S238 PolarHBondContact O-OG 2.87Å; Q235-S238 WeakPolarHBondContact O-CB 3.28Å; Q235-S238 PolarHBondContact O-N 2.83Å; F236-S238 VanDerWaalsContact C-N 3.32Å; F236-S238 PolarHBondContact O-N 3.49Å; S238-K242 VanDerWaalsContact O-CB 3.3Å; S238-K242 WeakPolarHBondContact O-CB 2.82Å; S238-K242 PolarHBondContact O-N 2.95Å
239	L	92.5	Very high	80.6	Confident	30 Å²	30	67.2 Å²	67.2	16%	0.157	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-41.5	174.2	-70.3	174.6	0	0	0	111.6	L107 L109 Q235 F236 E237 K242 E243 L284	L107-L239 HydrophobicContact CD2-CB 3.95Å; L109-L239 HydrophobicContact CD2-CD1 4.34Å; Q235-L239 WeakPolarHBondContact O-CG 3.46Å; Q235-L239 PolarHBondContact O-N 2.93Å; F236-L239 HydrophobicContact CD1-CD1 4.28Å; F236-L239 PolarHBondContact O-N 2.99Å; E237-L239 VanDerWaalsContact C-N 3.34Å; E237-L239 PolarHBondContact O-N 3.48Å; L239-K242 WeakPolarHBondContact O-CB 3.14Å; L239-K242 PolarHBondContact O-N 3.14Å; L239-E243 PolarHBondContact O-N 2.69Å; L239-L284 HydrophobicContact CD2-CB 4.31Å; L239-L284 HydrophobicContact CD2-CD1 4.45Å; L239-L284 HydrophobicContact CD2-CD2 4.18Å
240	W	95.3	Very high	79.8	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-59.7	-49.3	176.4	-172.5	96.7	0	0	0	111.2	Q18 V22 L107 F214 P220 W221 F236 E237 K242 E243 Y244	Q18-W240 HydrophobicContact CB-CH2 4.22Å; V22-W240 HydrophobicContact CB-CZ2 4.27Å; V22-W240 HydrophobicContact CG1-CG 4.3Å; V22-W240 HydrophobicContact CG2-CD2 4.12Å; V22-W240 HydrophobicContact CG2-CH2 4.19Å; V22-W240 HydrophobicContact CG2-CZ2 3.56Å; L107-W240 HydrophobicContact CD2-CB 4.28Å; F214-W240 HydrophobicContact CE2-CB 4.23Å; F214-W240 AromaticContact CE2-CD1 3.68Å; F214-W240 HydrophobicContact CE2-CG 4.23Å; F214-W240 HydrophobicContact CZ-CB 4.05Å; F214-W240 HydrophobicContact CZ-CG 4.47Å; P220-W240 HydrophobicContact CB-CB 4.38Å; P220-W240 HydrophobicContact CB-CD2 3.35Å; P220-W240 HydrophobicContact CB-CE3 3.54Å; P220-W240 HydrophobicContact CB-CG 3.7Å; P220-W240 HydrophobicContact CB-CH2 4.45Å; P220-W240 HydrophobicContact CB-CZ2 4.27Å; P220-W240 HydrophobicContact CB-CZ3 4.09Å; P220-W240 HydrophobicContact CG-CD2 4.05Å; P220-W240 HydrophobicContact CG-CG 3.99Å; W221-W240 HydrophobicContact CB-CH2 3.92Å; W221-W240 HydrophobicContact CB-CZ3 4.41Å; W221-W240 HydrophobicContact CD2-CZ2 4.48Å; W221-W240 AromaticContact CE3-CH2 3.88Å; W221-W240 HydrophobicContact CE3-CH2 3.88Å; W221-W240 AromaticContact CE3-CZ2 3.42Å; W221-W240 HydrophobicContact CE3-CZ2 3.42Å; W221-W240 VanDerWaalsContact CE3-CZ2 3.42Å; W221-W240 AromaticContact CZ3-CZ2 3.97Å; W221-W240 HydrophobicContact CZ3-CZ2 3.97Å; F236-W240 WeakPolarHBondContact O-CB 3.47Å; F236-W240 PolarHBondContact O-N 2.88Å; E237-W240 WeakPolarHBondContact O-CB 3.36Å; E237-W240 PolarHBondContact O-N 3.01Å; W240-K242 PolarHBondContact O-N 3.18Å; W240-E243 PolarHBondContact O-N 3.11Å; W240-Y244 HydrophobicContact CH2-CD2 4.2Å; W240-Y244 HydrophobicContact CH2-CG 4.12Å; W240-Y244 HydrophobicContact CZ3-CG 4.21Å; W240-Y244 PolarHBondContact O-N 3.45Å
241	W	94.5	Very high	78.5	Confident	77 Å²	77	70.9 Å²	70.9	29%	0.292	38%	0.384	S	S	.	.	H	α-helix	trans	-65.1	-37.3	177.3	-81.1	114.3	0	0	0	112.8	P220 E237 E243 Y244 H245	P220-W241 WeakPolarHBondContact O-CZ2 3.47Å; P220-W241 PolarHBondContact O-NE1 3.5Å; E237-W241 VanDerWaalsContact O-CD1 3.27Å; E237-W241 PolarHBondContact O-N 2.83Å; W241-E243 VanDerWaalsContact C-N 3.28Å; W241-E243 PolarHBondContact O-N 3.12Å; W241-Y244 AromaticContact CE3-CD1 3.88Å; W241-Y244 HydrophobicContact CE3-CD1 3.88Å; W241-Y244 HydrophobicContact CE3-CG 4.48Å; W241-Y244 AromaticContact CZ3-CD1 3.69Å; W241-Y244 HydrophobicContact CZ3-CD1 3.69Å; W241-Y244 HydrophobicContact CZ3-CE1 4.09Å; W241-Y244 PolarHBondContact O-N 3.02Å; W241-H245 AromaticContact CE3-CE1 3.25Å; W241-H245 AromaticContact CE3-ND1 3.75Å; W241-H245 AromaticContact CZ3-CE1 3.74Å; W241-H245 PolarHBondContact O-N 2.8Å; W241-H245 PolarHBondContact O-ND1 3.31Å
242	K	94.8	Very high	76.9	Confident	111 Å²	111	69.2 Å²	69.2	48%	0.483	39%	0.385	S	S	.	.	H	α-helix	trans	-59.7	-42	174.1	-178.6	-179.8	-179.9	179.2	0	111.2	S238 L239 W240 S246	S238-K242 VanDerWaalsContact O-CB 3.3Å; S238-K242 WeakPolarHBondContact O-CB 2.82Å; S238-K242 PolarHBondContact O-N 2.95Å; L239-K242 WeakPolarHBondContact O-CB 3.14Å; L239-K242 PolarHBondContact O-N 3.14Å; W240-K242 PolarHBondContact O-N 3.18Å; K242-S246 PolarHBondContact O-N 3.31Å; K242-S246 VanDerWaalsContact O-N 3.14Å
243	E	95.4	Very high	75.3	Confident	10 Å²	10	75.3 Å²	75.3	5%	0.047	42%	0.416	C	S	.	.	H	α-helix	trans	-71.8	-39.5	178.5	-161.5	63	-160.3	0	0	111.7	V22 R25 S26 R29 L107 L239 W240 W241 H245 S246	V22-E243 HydrophobicContact CG1-CB 4.16Å; V22-E243 HydrophobicContact CG1-CG 4.21Å; R25-E243 HydrophobicContact CB-CG 4.22Å; S26-E243 PolarHBondContact N-OE1 3.31Å; R29-E243 WeakPolarHBondContact CD-OE2 3.34Å; R29-E243 IonicContact CZ-OE2 2.87Å; R29-E243 IonicContact NE-OE2 3.8Å; R29-E243 IonicContact NH1-OE2 2.58Å; R29-E243 PolarHBondContact NH1-OE2 3.22Å; L107-E243 HydrophobicContact CD1-CB 4.46Å; L239-E243 PolarHBondContact O-N 2.69Å; W240-E243 PolarHBondContact O-N 3.11Å; W241-E243 VanDerWaalsContact C-N 3.28Å; W241-E243 PolarHBondContact O-N 3.12Å; E243-H245 VanDerWaalsContact C-N 3.34Å; E243-H245 PolarHBondContact O-N 3.15Å; E243-S246 WeakPolarHBondContact O-CB 3.26Å; E243-S246 PolarHBondContact O-N 3.02Å; E243-S246 PolarHBondContact O-OG 3.23Å
244	Y	94.3	Very high	73.3	Confident	69 Å²	69	80.1 Å²	80.1	27%	0.271	45%	0.446	S	S	.	.	H	α-helix	trans	-63.2	-36	175.6	-175.6	-107.3	0	0	0	113.5	Q18 V22 R25 W240 W241	Q18-Y244 HydrophobicContact CB-CD2 4.28Å; Q18-Y244 HydrophobicContact CB-CE2 3.65Å; Q18-Y244 HydrophobicContact CG-CE2 3.96Å; V22-Y244 HydrophobicContact CG2-CD2 3.9Å; V22-Y244 HydrophobicContact CG2-CG 4.24Å; R25-Y244 PolarHBondContact NH1-O 3.49Å; W240-Y244 HydrophobicContact CH2-CD2 4.2Å; W240-Y244 HydrophobicContact CH2-CG 4.12Å; W240-Y244 HydrophobicContact CZ3-CG 4.21Å; W240-Y244 PolarHBondContact O-N 3.45Å; W241-Y244 AromaticContact CE3-CD1 3.88Å; W241-Y244 HydrophobicContact CE3-CD1 3.88Å; W241-Y244 HydrophobicContact CE3-CG 4.48Å; W241-Y244 AromaticContact CZ3-CD1 3.69Å; W241-Y244 HydrophobicContact CZ3-CD1 3.69Å; W241-Y244 HydrophobicContact CZ3-CE1 4.09Å; W241-Y244 PolarHBondContact O-N 3.02Å
245	H	92.3	Very high	71	Confident	115 Å²	115	83.1 Å²	83.1	53%	0.532	46%	0.46	S	S	.	.	H	α-helix	trans	-86	-8.4	176.9	-67.3	96.4	0	0	0	113.6	W241 E243 H247	W241-H245 AromaticContact CE3-CE1 3.25Å; W241-H245 AromaticContact CE3-ND1 3.75Å; W241-H245 AromaticContact CZ3-CE1 3.74Å; W241-H245 PolarHBondContact O-N 2.8Å; W241-H245 PolarHBondContact O-ND1 3.31Å; E243-H245 VanDerWaalsContact C-N 3.34Å; E243-H245 PolarHBondContact O-N 3.15Å; H245-H247 PolarHBondContact O-N 2.93Å; H245-H247 PolarHBondContact O-ND1 2.84Å
246	S	87.1	Confident	68.5	Low	33 Å²	33	86.2 Å²	86.2	23%	0.231	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-64.6	126.1	177.9	74.3	0	0	0	0	110.1	R25 K242 E243	R25-S246 VanDerWaalsContact CZ-O 3.24Å; R25-S246 PolarHBondContact NH1-O 3.34Å; K242-S246 PolarHBondContact O-N 3.31Å; K242-S246 VanDerWaalsContact O-N 3.14Å; E243-S246 WeakPolarHBondContact O-CB 3.26Å; E243-S246 PolarHBondContact O-N 3.02Å; E243-S246 PolarHBondContact O-OG 3.23Å
247	H	70.7	Confident	65.8	Low	171 Å²	171	91.8 Å²	91.8	79%	0.792	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-90.1	124.8	172.8	-70.5	60.8	0	0	0	107.6	H245 P249	H245-H247 PolarHBondContact O-N 2.93Å; H245-H247 PolarHBondContact O-ND1 2.84Å; H247-P249 VanDerWaalsContact O-CD 3.24Å; H247-P249 WeakPolarHBondContact O-CD 3.12Å
248	T	56.8	Low	63.1	Low	87 Å²	87	96.7 Å²	96.7	53%	0.534	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-66.7	118	166.2	-14.6	0	0	0	0	107.2	S250	T248-S250 PolarHBondContact O-N 3.29Å; T248-S250 VanDerWaalsContact O-N 3.13Å
249	P	46	Very low	60.3	Low	118 Å²	118	105 Å²	105	77%	0.766	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-62	120.5	167.9	-14.9	29.6	0	0	0	106.7	H247 A251	H247-P249 VanDerWaalsContact O-CD 3.24Å; H247-P249 WeakPolarHBondContact O-CD 3.12Å; P249-A251 PolarHBondContact O-N 3.45Å
250	S	37.6	Very low	57.3	Low	112 Å²	112	115 Å²	115	78%	0.783	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-50.7	127.7	168.7	-49.2	0	0	0	0	107.9	T248	T248-S250 PolarHBondContact O-N 3.29Å; T248-S250 VanDerWaalsContact O-N 3.13Å
251	A	37.4	Very low	54.2	Low	88 Å²	88	120.9 Å²	120.9	73%	0.727	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-51.3	133.5	171.6	0	0	0	0	0	108.2	P249 D253	P249-A251 PolarHBondContact O-N 3.45Å; A251-D253 PolarHBondContact O-N 3.03Å; A251-D253 VanDerWaalsContact O-N 3.14Å
252	P	37.4	Very low	51.3	Low	111 Å²	111	127.1 Å²	127.1	72%	0.721	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-59.8	125.2	179.2	22.1	-30.4	0	0	0	108.7	T254	P252-T254 VanDerWaalsContact C-N 3.3Å; P252-T254 PolarHBondContact O-N 3.38Å; P252-T254 PolarHBondContact O-OG1 3.22Å
253	D	35.9	Very low	48.1	Very low	158 Å²	158	130.6 Å²	130.6	85%	0.845	70%	0.695	S	S	*	*			trans	-55.7	91.5	178.8	-153.6	6.9	0	0	0	108.9	A251 Q255	A251-D253 PolarHBondContact O-N 3.03Å; A251-D253 VanDerWaalsContact O-N 3.14Å; D253-Q255 PolarHBondContact O-N 2.63Å
254	T	35.5	Very low	44.9	Very low	124 Å²	124	136.4 Å²	136.4	76%	0.761	73%	0.734	S	S	*	*			trans	-87.1	95.4	-178.4	-47.6	0	0	0	0	106.4	P252	P252-T254 VanDerWaalsContact C-N 3.3Å; P252-T254 PolarHBondContact O-N 3.38Å; P252-T254 PolarHBondContact O-OG1 3.22Å
255	Q	31.5	Very low	41.7	Very low	159 Å²	159	142.4 Å²	142.4	74%	0.743	76%	0.762	S	S	*	*			trans	-47.8	140.2	170.1	-75.3	-166.1	-11.1	0	0	110.9	D253 T257	D253-Q255 PolarHBondContact O-N 2.63Å; Q255-T257 PolarHBondContact O-N 3.3Å
256	P	34.1	Very low	38.6	Very low	131 Å²	131	144.9 Å²	144.9	85%	0.851	77%	0.773	S	S	*	*			trans	-70.2	107.4	-178.9	26.5	-30.5	0	0	0	110
257	T	32.4	Very low	35.9	Very low	124 Å²	124	152.8 Å²	152.8	76%	0.761	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-79.8	144.8	167.1	36.6	0	0	0	0	110.4	Q255 R259	Q255-T257 PolarHBondContact O-N 3.3Å; T257-R259 PolarHBondContact O-N 2.94Å
258	P	32.9	Very low	33.8	Very low	125 Å²	125	153 Å²	153	81%	0.812	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.4	133.1	-170.7	-13.5	29.1	0	0	0	112.1	R260	P258-R260 PolarHBondContact O-N 3.47Å
259	R	31.7	Very low	32.6	Very low	252 Å²	252	158.4 Å²	158.4	95%	0.951	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-56.9	125.9	176.7	-69.4	178.1	173.6	-176.8	-1.5	111.8	T257	T257-R259 PolarHBondContact O-N 2.94Å
260	R	29.1	Very low	31.6	Very low	240 Å²	240	158.3 Å²	158.3	91%	0.906	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-94.5	145.2	160.4	-113.6	-177.6	175.9	-171.3	-0.6	110.1	P258	P258-R260 PolarHBondContact O-N 3.47Å
261	P	31.2	Very low	31.2	Very low	124 Å²	124	162.8 Å²	162.8	81%	0.805	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-76.6	146.5	-166.8	30	-31.9	0	0	0	113
262	K	32.3	Very low	30.6	Very low	208 Å²	208	166 Å²	166	90%	0.904	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-68.9	133.2	-178.8	-63.4	179.3	176.5	-177.1	0	111.5
263	Q	28.5	Very low	30.2	Very low	184 Å²	184	166.2 Å²	166.2	86%	0.86	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-103.1	148.5	156.6	-79.2	-173.1	-14.4	0	0	109.4
264	P	29.1	Very low	30	Very low	132 Å²	132	168.2 Å²	168.2	86%	0.857	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-81.7	132.7	-174.4	32.4	-30.7	0	0	0	110.6
265	F	27.1	Very low	29.7	Very low	194 Å²	194	168.5 Å²	168.5	85%	0.851	84%	0.836	S	S	*	*			trans	-116.7	134.3	168.7	-162.6	-97.6	0	0	0	109.9
266	Q	26.6	Very low	29.4	Very low	167 Å²	167	164.5 Å²	164.5	78%	0.78	84%	0.837	S	S	*	*			trans	-65.7	146.3	-172.6	-76.5	164.3	-52.1	0	0	113	Q268	Q266-Q268 PolarHBondContact O-N 2.84Å
267	E	29.8	Very low	29.2	Very low	200 Å²	200	166.3 Å²	166.3	94%	0.935	84%	0.84	S	S	*	*			trans	-60.8	121.9	163.9	-80.8	176.7	139.1	0	0	110.6
268	Q	26.7	Very low	29.2	Very low	175 Å²	175	168.6 Å²	168.6	82%	0.818	85%	0.847	S	S	*	*			trans	-119.7	115.3	154.2	-94.2	180	-20.7	0	0	108.5	Q266 V270	Q266-Q268 PolarHBondContact O-N 2.84Å; Q268-V270 PolarHBondContact O-N 3.46Å
269	Q	30.9	Very low	29	Very low	201 Å²	201	169.2 Å²	169.2	94%	0.939	84%	0.843	S	S	*	*			trans	-55.1	120.4	166.6	-81.4	176.4	-4.1	0	0	109.7
270	V	25.3	Very low	29	Very low	115 Å²	115	162.1 Å²	162.1	70%	0.697	83%	0.832	S	S	*	*			trans	-116.4	108.1	160.6	-175.9	0	0	0	0	107.8	Q268 M272	Q268-V270 PolarHBondContact O-N 3.46Å; V270-M272 HydrophobicContact CG1-CG 4.05Å; V270-M272 HydrophobicContact CG1-SD 4.15Å
271	K	29	Very low	29.1	Very low	206 Å²	206	155.7 Å²	155.7	90%	0.896	82%	0.824	S	S	*	*			trans	-74.4	118.3	170.4	-157.7	178	-170.4	-179.8	0	106.8
272	M	26.2	Very low	29.5	Very low	156 Å²	156	154.9 Å²	154.9	77%	0.768	82%	0.821	S	S	*	*			trans	-115.6	142.3	172.9	-72.2	-63.9	-75	0	0	111.2	V270	V270-M272 HydrophobicContact CG1-CG 4.05Å; V270-M272 HydrophobicContact CG1-SD 4.15Å
273	P	28.3	Very low	29.8	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	80%	0.798	S	S	*	*			trans	-82.9	145.9	-172.3	3.6	16.2	0	0	0	111.4
274	F	31.1	Very low	30.3	Very low	200 Å²	200	140.3 Å²	140.3	88%	0.877	76%	0.763	S	S	*	*			trans	-72.6	120.2	165.5	-168.2	-93.2	0	0	0	109.2
275	T	29.2	Very low	30.9	Very low	130 Å²	130	136 Å²	136	80%	0.798	73%	0.733	S	S	*	*			trans	168.5	130.7	141.3	46.3	0	0	0	0	110.1
276	G	27.1	Very low	31.6	Very low	75 Å²	75	130 Å²	130	77%	0.773	72%	0.72	S	S	*	*			trans	125.3	101.7	151.5	0	0	0	0	0	116.9
277	N	29.6	Very low	32.3	Very low	169 Å²	169	129.8 Å²	129.8	90%	0.904	72%	0.718	S	S	*	*			trans	48.4	101.4	156	-77	-2.3	0	0	0	119.3
278	L	32.3	Very low	32.8	Very low	172 Å²	172	124 Å²	124	90%	0.901	69%	0.69	S	S	*	*			trans	-74	125.2	159.4	-90.6	142.8	0	0	0	110.5	S280	L278-S280 PolarHBondContact O-N 2.81Å
279	D	28.2	Very low	33.4	Very low	139 Å²	139	120.4 Å²	120.4	74%	0.743	68%	0.684	S	S	*	*			trans	-52.7	122.6	177.9	-142.9	-14.9	0	0	0	111.8	S281	D279-S281 PolarHBondContact O-N 2.77Å
280	S	32.1	Very low	33.5	Very low	102 Å²	102	116.7 Å²	116.7	71%	0.713	68%	0.677	S	S	*	*			trans	-84.3	17.7	-175.9	-59.7	0	0	0	0	113.9	L278 S282	L278-S280 PolarHBondContact O-N 2.81Å; S280-S282 PolarHBondContact O-N 3.37Å
281	S	31.5	Very low	33.7	Very low	105 Å²	105	117 Å²	117	73%	0.734	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	6.9	-168.6	101.9	0	0	0	0	115.8	D279	D279-S281 PolarHBondContact O-N 2.77Å
282	S	39.1	Very low	33.9	Very low	108 Å²	108	112.7 Å²	112.7	76%	0.755	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	0.7	-175.7	57.2	0	0	0	0	115.6	S280	S280-S282 PolarHBondContact O-N 3.37Å
283	S	38.1	Very low	34.2	Very low	58 Å²	58	112.7 Å²	112.7	41%	0.406	68%	0.683	S	S	.	*			trans	-88.7	126.6	176.1	-170.4	0	0	0	0	111.1	L285 A286	S283-L285 PolarHBondContact O-N 3.25Å; S283-L285 PolarHBondContact OG-N 3.3Å; S283-A286 PolarHBondContact O-N 3.25Å
284	L	39.9	Very low	34.3	Very low	27 Å²	27	111.7 Å²	111.7	14%	0.141	68%	0.679	C	S	.	*	G	3₁₀ helix	trans	-60.3	-10	172.8	-74	164.1	0	0	0	112.7	L239	L239-L284 HydrophobicContact CD2-CB 4.31Å; L239-L284 HydrophobicContact CD2-CD1 4.45Å; L239-L284 HydrophobicContact CD2-CD2 4.18Å
285	L	41	Very low	34.1	Very low	43 Å²	43	110.4 Å²	110.4	23%	0.225	68%	0.68	C	S	.	*	G	3₁₀ helix	trans	-83.3	-3.7	177.6	-67.5	163.3	0	0	0	114.6	P207 S283 H287 F288	P207-L285 WeakPolarHBondContact O-CD1 3.37Å; S283-L285 PolarHBondContact O-N 3.25Å; S283-L285 PolarHBondContact OG-N 3.3Å; L285-H287 PolarHBondContact O-N 3.24Å; L285-F288 HydrophobicContact CB-CD2 4.2Å; L285-F288 HydrophobicContact CD2-CD2 3.62Å; L285-F288 HydrophobicContact CD2-CE2 3.48Å; L285-F288 VanDerWaalsContact CD2-CE2 3.48Å; L285-F288 HydrophobicContact CD2-CZ 4.31Å; L285-F288 WeakPolarHBondContact O-CD2 3.46Å; L285-F288 PolarHBondContact O-N 3.25Å
286	A	41.4	Very low	34.1	Very low	68 Å²	68	112 Å²	112	56%	0.562	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-61.7	-11.5	179.1	0	0	0	0	0	114.1	S283	S283-A286 PolarHBondContact O-N 3.25Å
287	H	41.6	Very low	34.1	Very low	161 Å²	161	112.6 Å²	112.6	75%	0.745	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-85.6	-4	175.4	-62.1	-63.9	0	0	0	114.3	L285 S289	L285-H287 PolarHBondContact O-N 3.24Å; H287-S289 PolarHBondContact O-N 3.4Å
288	F	41	Very low	33.9	Very low	80 Å²	80	114.1 Å²	114.1	35%	0.351	67%	0.672	S	S	.	*			trans	-88	72.1	173.8	-69.2	-93.3	0	0	0	110.2	L285	L285-F288 HydrophobicContact CB-CD2 4.2Å; L285-F288 HydrophobicContact CD2-CD2 3.62Å; L285-F288 HydrophobicContact CD2-CE2 3.48Å; L285-F288 VanDerWaalsContact CD2-CE2 3.48Å; L285-F288 HydrophobicContact CD2-CZ 4.31Å; L285-F288 WeakPolarHBondContact O-CD2 3.46Å; L285-F288 PolarHBondContact O-N 3.25Å
289	S	37.9	Very low	33.6	Very low	99 Å²	99	111.7 Å²	111.7	69%	0.692	67%	0.665	S	S	*	*			trans	-120.7	123.6	164	-71.4	0	0	0	0	109.1	H287	H287-S289 PolarHBondContact O-N 3.4Å
290	P	33.6	Very low	33.6	Very low	123 Å²	123	114.3 Å²	114.3	80%	0.799	67%	0.673	S	S	*	*			trans	-71.2	136.4	170.6	28.4	-30.4	0	0	0	109.5	S292	P290-S292 PolarHBondContact O-N 3.17Å
291	S	30.1	Very low	33.3	Very low	120 Å²	120	118 Å²	118	84%	0.839	68%	0.679	S	S	*	*			trans	-58.5	110	171.5	-54.2	0	0	0	0	109.7	N293	S291-N293 PolarHBondContact O-N 3.41Å; S291-N293 VanDerWaalsContact O-N 3.07Å
292	S	33.1	Very low	33.1	Very low	116 Å²	116	121.8 Å²	121.8	81%	0.811	69%	0.687	S	S	*	*			trans	-72	96.8	171.7	57	0	0	0	0	109.5	P290 S294	P290-S292 PolarHBondContact O-N 3.17Å; S292-S294 PolarHBondContact O-N 3.42Å
293	N	31.9	Very low	32.5	Very low	156 Å²	156	126 Å²	126	83%	0.834	69%	0.691	S	S	*	*			trans	-88.1	103.2	159.6	-95.7	-4.3	0	0	0	108.9	S291 L295	S291-N293 PolarHBondContact O-N 3.41Å; S291-N293 VanDerWaalsContact O-N 3.07Å; N293-L295 PolarHBondContact O-N 3.24Å
294	S	29.9	Very low	32	Very low	94 Å²	94	127.4 Å²	127.4	66%	0.657	71%	0.707	S	S	*	*			trans	-61.7	121	163.3	165	0	0	0	0	109.8	S292	S292-S294 PolarHBondContact O-N 3.42Å
295	L	28.1	Very low	31.5	Very low	173 Å²	173	132 Å²	132	91%	0.906	74%	0.738	S	S	*	*			trans	-128.2	132.5	148.3	-107.4	108.1	0	0	0	109.4	N293	N293-L295 PolarHBondContact O-N 3.24Å
296	H	29	Very low	30.9	Very low	164 Å²	164	138.6 Å²	138.6	76%	0.759	77%	0.767	S	S	*	*			trans	-66.4	145.6	-170	-82.2	-24.7	0	0	0	114.8
297	S	26.3	Very low	30.3	Very low	87 Å²	87	142.2 Å²	142.2	61%	0.608	78%	0.783	S	S	*	*			trans	-2.5	133.6	151.8	59.8	0	0	0	0	119.5
298	H	25.8	Very low	29.5	Very low	201 Å²	201	141.3 Å²	141.3	93%	0.931	78%	0.783	S	S	*	*				-136.1	124.7	125.8	-89.8	-76.4	0	0	0	109.8
299	T	26.4	Very low	28.9	Very low	121 Å²	121	149 Å²	149	74%	0.742	81%	0.81	S	S	*	*			trans	-84.5	127.3	175.9	-43.3	0	0	0	0	108.8
300	E	27.1	Very low	28.5	Very low	195 Å²	195	150.3 Å²	150.3	91%	0.911	81%	0.814	S	S	*	*			trans	-143	121.9	148.7	-81.3	-158.7	145.2	0	0	109.7
301	E	26.7	Very low	28.8	Very low	180 Å²	180	150 Å²	150	84%	0.841	81%	0.812	S	S	*	*			trans	-71.4	139.8	166	-68.6	178.1	131	0	0	109.8
302	M	26.3	Very low	28.7	Very low	183 Å²	183	153.8 Å²	153.8	90%	0.901	82%	0.816	S	S	*	*			trans	-166.7	112.7	139.6	-112	167.3	158.5	0	0	113.6
303	K	26.4	Very low	28.4	Very low	196 Å²	196	157.5 Å²	157.5	85%	0.852	82%	0.821	S	S	*	*			trans	34.9	120.3	141.4	-77.2	177	173.7	175.6	0	120.7
304	A	28.3	Very low	28.2	Very low	88 Å²	88	159.6 Å²	159.6	73%	0.727	83%	0.826	S	S	*	*			trans	-58.3	160.3	150.5	0	0	0	0	0	112.4
305	P	30.4	Very low	28.1	Very low	124 Å²	124	160.6 Å²	160.6	81%	0.805	83%	0.833	S	S	*	*				-135.1	137.6	121.3	34.2	-21.6	0	0	0	113.6
306	H	26.9	Very low	28.6	Very low	181 Å²	181	157.5 Å²	157.5	84%	0.838	82%	0.823	S	S	*	*			trans	-69.2	139.4	152.3	-79.4	-79.6	0	0	0	109.8
307	T	28.9	Very low	28.5	Very low	145 Å²	145	156.4 Å²	156.4	89%	0.89	83%	0.827	S	S	*	*			trans	-143.8	126	138.4	45.7	0	0	0	0	110.4
308	D	25.4	Very low	28.5	Very low	141 Å²	141	159.1 Å²	159.1	75%	0.754	84%	0.835	S	S	*	*			trans	-78.6	138.4	169.3	-178.5	19.8	0	0	0	110.3
309	R	28.7	Very low	28.6	Very low	243 Å²	243	158.7 Å²	158.7	92%	0.917	83%	0.833	S	S	*	*			trans	176.1	140	137.9	-97.7	174.1	-172.9	-158.1	2.2	113.2
310	T	29.2	Very low	28.7	Very low	126 Å²	126	162.4 Å²	162.4	77%	0.773	84%	0.839	S	S	*	*			trans	-94.3	-171.1	-166.9	-17.8	0	0	0	0	112.5
311	P	39.4	Very low	28.6	Very low	115 Å²	115	161.7 Å²	161.7	75%	0.747	84%	0.835	S	S	*	*				-105.8	164.5	-114.5	40.8	-24.8	0	0	0	115.2
312	E	27.6	Very low	28.5	Very low	200 Å²	200	158 Å²	158	94%	0.935	83%	0.829	S	S	*	*			trans	-131	135.4	160.4	-74.2	-172.4	164	0	0	111.1
313	Q	27.7	Very low	29.1	Very low	194 Å²	194	154.9 Å²	154.9	91%	0.907	82%	0.823	S	S	*	*			trans	-81	141.9	176.6	-65	172.5	-67.8	0	0	110.1
314	E	26.9	Very low	29.1	Very low	200 Å²	200	150.4 Å²	150.4	94%	0.935	82%	0.816	S	S	*	*			trans	-171.7	137.5	131.3	-105	173.5	-168.6	0	0	109.4
315	S	29.6	Very low	29	Very low	115 Å²	115	152.2 Å²	152.2	80%	0.804	82%	0.818	S	S	*	*			trans	-119.3	-171.8	-179	45.6	0	0	0	0	109
316	P	37	Very low	28.9	Very low	109 Å²	109	154.1 Å²	154.1	71%	0.708	82%	0.817	S	S	*	*				-114.4	162.3	-67.5	35.3	-22.5	0	0	0	111.1
317	V	27.7	Very low	28.9	Very low	140 Å²	140	151.6 Å²	151.6	85%	0.848	81%	0.814	S	S	*	*			trans	-114.1	113.2	167	-177.5	0	0	0	0	110.2
318	L	26.6	Very low	28.8	Very low	145 Å²	145	149.4 Å²	149.4	76%	0.759	81%	0.811	S	S	*	*			trans	-74.8	137.7	161.3	-83.3	136.3	0	0	0	109.5
319	E	28	Very low	29	Very low	191 Å²	191	151.8 Å²	151.8	89%	0.893	82%	0.817	S	S	*	*			trans	-128.8	135.1	148.5	-77.9	-164.9	159	0	0	110.6
320	K	27.1	Very low	28.9	Very low	199 Å²	199	146.8 Å²	146.8	87%	0.865	81%	0.813	S	S	*	*			trans	-93.7	161.7	-170.5	-83.1	178.6	171.1	179.3	0	111.6
321	E	24.8	Very low	28.8	Very low	181 Å²	181	145.8 Å²	145.8	85%	0.846	81%	0.811	S	S	*	*			trans	-60.5	167.4	173.7	-59.4	177.2	133.6	0	0	117.4
322	S	25.5	Very low	28.2	Very low	102 Å²	102	147.8 Å²	147.8	71%	0.713	82%	0.816	S	S	*	*			trans	91.1	161.4	140.6	-66.4	0	0	0	0	119.3
323	P	39.3	Very low	28.2	Very low	117 Å²	117	143.3 Å²	143.3	76%	0.76	81%	0.806	S	S	*	*			cis	-144.6	174	-39.1	39.5	-22.2	0	0	0	113.9
324	S	26.3	Very low	29.2	Very low	102 Å²	102	140.3 Å²	140.3	71%	0.713	80%	0.804	S	S	*	*			trans	170.2	116.9	144.7	50.1	0	0	0	0	111
325	T	26	Very low	29.2	Very low	126 Å²	126	134.6 Å²	134.6	77%	0.773	80%	0.799	S	S	*	*				43.8	132	89.7	53.2	0	0	0	0	113.4
326	E	28.5	Very low	29.2	Very low	165 Å²	165	134.5 Å²	134.5	77%	0.771	81%	0.805	S	S	*	*			cis	-173.8	152.3	29.6	-125.1	176	171.9	0	0	109.1
327	T	27	Very low	28.7	Very low	128 Å²	128	133.2 Å²	133.2	79%	0.785	81%	0.811	S	S	*	*			trans	38.7	130.3	146.3	58.8	0	0	0	0	123
328	A	27.3	Very low	28.8	Very low	99 Å²	99	131.1 Å²	131.1	82%	0.818	81%	0.809	S	S	*	*				-171.3	118.3	121.4	0	0	0	0	0	111.5
329	E	28.7	Very low	29.1	Very low	190 Å²	190	133.9 Å²	133.9	89%	0.888	82%	0.818	S	S	*	*			trans	-67.3	138.3	158.2	-58.6	174.8	133.6	0	0	109.4
330	V	27.7	Very low	29.1	Very low	138 Å²	138	128.4 Å²	128.4	84%	0.836	81%	0.813	S	S	*	*			trans	-151.7	118.5	143.3	-178.3	0	0	0	0	109.7
331	S	26.8	Very low	29.6	Very low	105 Å²	105	125.6 Å²	125.6	73%	0.734	81%	0.812	S	S	*	*			trans	-53.3	146.3	160.4	46.7	0	0	0	0	114.5
332	D	26.5	Very low	29.9	Very low	158 Å²	158	126.2 Å²	126.2	85%	0.845	82%	0.815	S	S	*	*			trans	-149.9	137.3	148.9	-145.2	-1.3	0	0	0	115.1
333	S	26.9	Very low	30.7	Very low	105 Å²	105	129 Å²	129	73%	0.734	82%	0.823	S	S	*	*			trans	-168.9	156.1	164.3	-75.5	0	0	0	0	105.6
334	P	49.3	Very low	30.6	Very low	131 Å²	131	135 Å²	135	85%	0.851	83%	0.83	S	S	*	*			cis	-128.7	164.2	-40	33.7	-17.1	0	0	0	111.3
335	G	26.3	Very low	31.5	Very low	81 Å²	81	140.7 Å²	140.7	84%	0.835	84%	0.842	S	S	*	*			trans	-146.4	122.1	179.8	0	0	0	0	0	114.1
336	A	29.6	Very low	32.1	Very low	113 Å²	113	138.2 Å²	138.2	93%	0.934	84%	0.841	S	S	*	*			trans	-68.1	155.3	-168.4	0	0	0	0	0	117.5
337	G	26.2	Very low	33	Very low	81 Å²	81	134 Å²	134	84%	0.835	83%	0.83	S	S	*	*			trans	-155.3	128.3	157.5	0	0	0	0	0	109.6
338	A	30.5	Very low	34.2	Very low	96 Å²	96	132.2 Å²	132.2	79%	0.793	83%	0.828	S	S	*	*			trans	-96	159.3	-157	0	0	0	0	0	115.9
339	E	32.2	Very low	35.3	Very low	203 Å²	203	133 Å²	133	95%	0.949	82%	0.818	S	S	*	*			trans	65.3	121.7	153	-70.4	-175	168.1	0	0	121.1
340	G	28.6	Very low	36.4	Very low	77 Å²	77	125.6 Å²	125.6	79%	0.794	79%	0.793	S	S	*	*			trans	163.7	82	168.4	0	0	0	0	0	111.8	E342	G340-E342 PolarHBondContact O-N 3.42Å
341	T	36.8	Very low	37.9	Very low	139 Å²	139	124.9 Å²	124.9	85%	0.853	78%	0.784	S	S	*	*			trans	-49.9	124.8	177.7	-31.7	0	0	0	0	112.9
342	E	32.5	Very low	39.7	Very low	194 Å²	194	122.7 Å²	122.7	91%	0.907	77%	0.773	S	S	*	*			trans	-158.6	121.8	147.4	-111	175.1	-153.3	0	0	110.5	G340 R344	G340-E342 PolarHBondContact O-N 3.42Å; E342-R344 PolarHBondContact O-N 3.14Å
343	D	40.9	Very low	41.5	Very low	162 Å²	162	121 Å²	121	87%	0.866	76%	0.76	S	S	*	*			trans	-56.9	122.1	178.3	-79.3	-56.7	0	0	0	112.4
344	R	38.3	Very low	43.6	Very low	243 Å²	243	119.9 Å²	119.9	92%	0.917	75%	0.745	S	S	*	*			trans	-146.2	98.2	149.9	-106.2	178.4	-172.1	-173.4	2.2	111	E342 G346	E342-R344 PolarHBondContact O-N 3.14Å; R344-G346 VanDerWaalsContact C-N 3.28Å; R344-G346 PolarHBondContact O-N 3.22Å
345	K	44.7	Very low	44.7	Very low	221 Å²	221	115.5 Å²	115.5	96%	0.961	72%	0.72	S	S	*	*			trans	-58.3	91.6	155.6	-117.2	174.1	176.4	178.4	0	108
346	G	39.6	Very low	47.2	Very low	73 Å²	73	118.3 Å²	118.3	75%	0.753	71%	0.711	S	S	*	*			trans	-92.1	115.2	169.5	0	0	0	0	0	109.3	R344	R344-G346 VanDerWaalsContact C-N 3.28Å; R344-G346 PolarHBondContact O-N 3.22Å
347	S	46.5	Very low	49.6	Very low	78 Å²	78	118.6 Å²	118.6	55%	0.545	69%	0.693	S	S	.	*			trans	-64.2	136.7	-174.3	-168.9	0	0	0	0	112.1	D349 G350	S347-D349 PolarHBondContact O-N 3.48Å; S347-D349 WeakPolarHBondContact OG-CB 3.31Å; S347-D349 PolarHBondContact OG-N 3.36Å; S347-G350 PolarHBondContact O-N 3.37Å
348	A	51.6	Low	52.2	Low	90 Å²	90	121.5 Å²	121.5	74%	0.744	68%	0.679	S	S	*	*	H	α-helix	trans	-56.7	-15.7	167.8	0	0	0	0	0	113	G350	A348-G350 VanDerWaalsContact C-N 3.33Å
349	D	51.7	Low	54.8	Low	115 Å²	115	122 Å²	122	62%	0.615	67%	0.665	S	S	*	*	H	α-helix	trans	-64.5	-32.4	170.7	-85.4	-32.7	0	0	0	113.5	S347 D351 A352 Q353	S347-D349 PolarHBondContact O-N 3.48Å; S347-D349 WeakPolarHBondContact OG-CB 3.31Å; S347-D349 PolarHBondContact OG-N 3.36Å; D349-D351 PolarHBondContact O-N 2.97Å; D349-A352 PolarHBondContact O-N 2.86Å; D349-Q353 WeakPolarHBondContact O-CB 3.36Å; D349-Q353 PolarHBondContact O-N 2.95Å; D349-Q353 VanDerWaalsContact O-N 3.09Å
350	G	52.4	Low	57.2	Low	34 Å²	34	114.3 Å²	114.3	35%	0.351	64%	0.636	S	S	.	*	H	α-helix	trans	-67.1	-39.6	-173.1	0	0	0	0	0	113	S347 A348 L354	S347-G350 PolarHBondContact O-N 3.37Å; A348-G350 VanDerWaalsContact C-N 3.33Å; G350-L354 WeakPolarHBondContact O-CD1 3.27Å; G350-L354 VanDerWaalsContact O-CG 3.3Å; G350-L354 WeakPolarHBondContact O-CG 3.4Å; G350-L354 PolarHBondContact O-N 3.06Å; G350-L354 VanDerWaalsContact O-N 3.17Å
351	D	59.2	Low	59.9	Low	123 Å²	123	115.9 Å²	115.9	66%	0.658	62%	0.623	S	S	*	*	H	α-helix	trans	-74.8	-32.9	-179.9	-78.9	-23.4	0	0	0	112.6	D349 A355	D349-D351 PolarHBondContact O-N 2.97Å; D351-A355 PolarHBondContact O-N 3.27Å; D351-A355 VanDerWaalsContact O-N 3.13Å
352	A	63.8	Low	62.3	Low	59 Å²	59	111.2 Å²	111.2	49%	0.488	59%	0.591	S	S	.	*	H	α-helix	trans	-66.6	-42.5	174.4	0	0	0	0	0	111.2	D349 A355 E356	D349-A352 PolarHBondContact O-N 2.86Å; A352-A355 PolarHBondContact O-N 3.36Å; A352-E356 PolarHBondContact O-N 3Å; A352-E356 VanDerWaalsContact O-N 3.07Å
353	Q	64.7	Low	64.9	Low	124 Å²	124	109.5 Å²	109.5	58%	0.579	58%	0.577	S	S	*	*	H	α-helix	trans	-67.6	-38.3	-179.7	-159	146.8	22.5	0	0	112.1	D349 A355 E356 E357	D349-Q353 WeakPolarHBondContact O-CB 3.36Å; D349-Q353 PolarHBondContact O-N 2.95Å; D349-Q353 VanDerWaalsContact O-N 3.09Å; Q353-A355 VanDerWaalsContact C-N 3.33Å; Q353-A355 PolarHBondContact O-N 3.49Å; Q353-E356 PolarHBondContact O-N 3.04Å; Q353-E357 WeakPolarHBondContact O-CG 3.47Å; Q353-E357 PolarHBondContact O-N 3.16Å; Q353-E357 VanDerWaalsContact O-N 3.08Å
354	L	70.8	Confident	67.2	Low	81 Å²	81	110.5 Å²	110.5	42%	0.424	57%	0.568	S	S	.	*	H	α-helix	trans	-67.7	-29.5	173.6	-72.8	167.7	0	0	0	113.3	G350 R358	G350-L354 WeakPolarHBondContact O-CD1 3.27Å; G350-L354 VanDerWaalsContact O-CG 3.3Å; G350-L354 WeakPolarHBondContact O-CG 3.4Å; G350-L354 PolarHBondContact O-N 3.06Å; G350-L354 VanDerWaalsContact O-N 3.17Å; L354-R358 WeakPolarHBondContact O-CG 3.37Å; L354-R358 VanDerWaalsContact O-CZ 3.29Å; L354-R358 PolarHBondContact O-N 3.13Å; L354-R358 PolarHBondContact O-NE 3.27Å
355	A	72.8	Confident	69.4	Low	39 Å²	39	102.6 Å²	102.6	32%	0.322	54%	0.543	S	S	.	.	H	α-helix	trans	-72.5	-42	175.2	0	0	0	0	0	111.6	D351 A352 Q353 R358 E359	D351-A355 PolarHBondContact O-N 3.27Å; D351-A355 VanDerWaalsContact O-N 3.13Å; A352-A355 PolarHBondContact O-N 3.36Å; Q353-A355 VanDerWaalsContact C-N 3.33Å; Q353-A355 PolarHBondContact O-N 3.49Å; A355-R358 PolarHBondContact O-N 3.13Å; A355-E359 PolarHBondContact O-N 3.5Å
356	E	78.4	Confident	71.4	Confident	139 Å²	139	97.8 Å²	97.8	65%	0.65	52%	0.518	S	S	*	.	H	α-helix	trans	-65.9	-38.5	178.7	-163	170.9	-164.6	0	0	111.8	A352 Q353 E359 A360	A352-E356 PolarHBondContact O-N 3Å; A352-E356 VanDerWaalsContact O-N 3.07Å; Q353-E356 PolarHBondContact O-N 3.04Å; E356-E359 PolarHBondContact O-N 3.01Å; E356-A360 WeakPolarHBondContact O-CB 3.47Å; E356-A360 PolarHBondContact O-N 2.81Å
357	E	79.6	Confident	73.6	Confident	120 Å²	120	101.6 Å²	101.6	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-62.3	-42.4	173.1	-77	-179.4	172.4	0	0	112.5	Q353 E359 A360 E361	Q353-E357 WeakPolarHBondContact O-CG 3.47Å; Q353-E357 PolarHBondContact O-N 3.16Å; Q353-E357 VanDerWaalsContact O-N 3.08Å; E357-E359 VanDerWaalsContact C-N 3.35Å; E357-E359 PolarHBondContact O-N 3.09Å; E357-A360 PolarHBondContact O-N 3.14Å; E357-E361 WeakPolarHBondContact O-CB 3.28Å; E357-E361 PolarHBondContact O-N 3.23Å
358	R	81.3	Confident	75.4	Confident	141 Å²	141	101.3 Å²	101.3	53%	0.532	52%	0.519	S	S	.	.	H	α-helix	trans	-66.6	-34.6	176.7	-74.8	-174.7	-68	-104.6	0.5	112.7	L354 A355 H362	L354-R358 WeakPolarHBondContact O-CG 3.37Å; L354-R358 VanDerWaalsContact O-CZ 3.29Å; L354-R358 PolarHBondContact O-N 3.13Å; L354-R358 PolarHBondContact O-NE 3.27Å; A355-R358 PolarHBondContact O-N 3.13Å; R358-H362 VanDerWaalsContact O-CB 3.3Å; R358-H362 WeakPolarHBondContact O-CB 3.35Å; R358-H362 PolarHBondContact O-N 2.88Å
359	E	84.1	Confident	76.9	Confident	106 Å²	106	99.7 Å²	99.7	50%	0.495	51%	0.511	S	S	.	.	H	α-helix	trans	-72.4	-37.6	173.8	-73.5	-171.3	169	0	0	112.3	A355 E356 E357 H362 R363	A355-E359 PolarHBondContact O-N 3.5Å; E356-E359 PolarHBondContact O-N 3.01Å; E357-E359 VanDerWaalsContact C-N 3.35Å; E357-E359 PolarHBondContact O-N 3.09Å; E359-H362 PolarHBondContact O-N 2.87Å; E359-R363 WeakPolarHBondContact O-CB 3.33Å; E359-R363 PolarHBondContact O-N 2.94Å
360	A	83.8	Confident	78.6	Confident	42 Å²	42	100.9 Å²	100.9	35%	0.347	51%	0.513	S	S	.	.	H	α-helix	trans	-65.5	-40.5	175	0	0	0	0	0	111.6	E356 E357 R363 R364	E356-A360 WeakPolarHBondContact O-CB 3.47Å; E356-A360 PolarHBondContact O-N 2.81Å; E357-A360 PolarHBondContact O-N 3.14Å; A360-R363 PolarHBondContact O-N 3.47Å; A360-R364 WeakPolarHBondContact O-CG 3.3Å; A360-R364 PolarHBondContact O-N 3.02Å
361	E	84.9	Confident	80.4	Confident	111 Å²	111	100.2 Å²	100.2	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-65.6	-45.5	174.7	-176.4	171.8	-153.8	0	0	111.7	E357 R363 R364 M365	E357-E361 WeakPolarHBondContact O-CB 3.28Å; E357-E361 PolarHBondContact O-N 3.23Å; E361-R363 VanDerWaalsContact C-N 3.31Å; E361-R363 PolarHBondContact O-N 3.38Å; E361-R364 WeakPolarHBondContact O-CB 3.35Å; E361-R364 PolarHBondContact O-N 2.89Å; E361-R364 VanDerWaalsContact O-N 3.16Å; E361-M365 HydrophobicContact CG-CE 3.83Å; E361-M365 WeakPolarHBondContact O-CG 3.39Å; E361-M365 PolarHBondContact O-N 2.85Å
362	H	87.3	Confident	81.8	Confident	40 Å²	40	98.1 Å²	98.1	19%	0.185	49%	0.491	C	S	.	.	H	α-helix	trans	-59.2	-41.2	175.4	-178.9	-132.3	0	0	0	112.2	R358 E359 M365 W366 D377	R358-H362 VanDerWaalsContact O-CB 3.3Å; R358-H362 WeakPolarHBondContact O-CB 3.35Å; R358-H362 PolarHBondContact O-N 2.88Å; E359-H362 PolarHBondContact O-N 2.87Å; H362-M365 PolarHBondContact O-N 3.32Å; H362-W366 AromaticContact CE1-NE1 3.95Å; H362-W366 AromaticContact NE2-CD1 3.63Å; H362-W366 AromaticContact NE2-NE1 3.64Å; H362-W366 PolarHBondContact O-N 2.84Å; H362-D377 IonicContact CD2-OD2 3.77Å; H362-D377 IonicContact CE1-OD1 3.09Å; H362-D377 PolarHBondContact CE1-OD1 3.03Å; H362-D377 IonicContact CE1-OD2 3.9Å; H362-D377 VanDerWaalsContact NE2-CG 3.26Å; H362-D377 IonicContact NE2-OD1 2.87Å; H362-D377 PolarHBondContact NE2-OD1 3.28Å; H362-D377 IonicContact NE2-OD2 2.88Å; H362-D377 PolarHBondContact NE2-OD2 3.08Å
363	R	86.9	Confident	82.8	Confident	159 Å²	159	103 Å²	103	60%	0.6	50%	0.498	S	S	*	.	H	α-helix	trans	-63.5	-41.3	174.9	-167.7	-178.7	-54.8	176.3	5.8	112.5	E359 A360 E361 M365 W366 E367	E359-R363 WeakPolarHBondContact O-CB 3.33Å; E359-R363 PolarHBondContact O-N 2.94Å; A360-R363 PolarHBondContact O-N 3.47Å; E361-R363 VanDerWaalsContact C-N 3.31Å; E361-R363 PolarHBondContact O-N 3.38Å; R363-M365 VanDerWaalsContact C-N 3.34Å; R363-M365 PolarHBondContact O-N 3.45Å; R363-W366 WeakPolarHBondContact O-CB 3.39Å; R363-W366 PolarHBondContact O-N 3.2Å; R363-E367 WeakPolarHBondContact O-CG 3.35Å; R363-E367 PolarHBondContact O-N 2.84Å
364	R	88.8	Confident	83.7	Confident	183 Å²	183	105.2 Å²	105.2	69%	0.691	51%	0.513	S	S	*	.	H	α-helix	trans	-62.9	-40.1	175.6	-75.6	175.4	179.8	172.4	2.8	112.1	A360 E361 W366 E367 A368	A360-R364 WeakPolarHBondContact O-CG 3.3Å; A360-R364 PolarHBondContact O-N 3.02Å; E361-R364 WeakPolarHBondContact O-CB 3.35Å; E361-R364 PolarHBondContact O-N 2.89Å; E361-R364 VanDerWaalsContact O-N 3.16Å; R364-W366 VanDerWaalsContact C-N 3.33Å; R364-E367 PolarHBondContact O-N 3.27Å; R364-A368 VanDerWaalsContact O-CB 3.31Å; R364-A368 WeakPolarHBondContact O-CB 3.29Å; R364-A368 PolarHBondContact O-N 3.03Å
365	M	85	Confident	84.6	Confident	77 Å²	77	102.8 Å²	102.8	38%	0.379	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-39.7	176	-68.8	-179.4	-177.6	0	0	111.4	E361 H362 R363 A368 G369 Q370	E361-M365 HydrophobicContact CG-CE 3.83Å; E361-M365 WeakPolarHBondContact O-CG 3.39Å; E361-M365 PolarHBondContact O-N 2.85Å; H362-M365 PolarHBondContact O-N 3.32Å; R363-M365 VanDerWaalsContact C-N 3.34Å; R363-M365 PolarHBondContact O-N 3.45Å; M365-A368 PolarHBondContact O-N 3.37Å; M365-G369 PolarHBondContact O-N 3.17Å; M365-Q370 HydrophobicContact CB-CB 4.41Å; M365-Q370 CarbonylContact O-C 3.39Å; M365-Q370 PolarHBondContact O-N 2.87Å
366	W	85.8	Confident	85.1	Confident	119 Å²	119	107.2 Å²	107.2	45%	0.451	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-48.7	171.6	-104	71.2	0	0	0	112.9	H362 R363 R364 A368 G369 V371 D377 I382	H362-W366 AromaticContact CE1-NE1 3.95Å; H362-W366 AromaticContact NE2-CD1 3.63Å; H362-W366 AromaticContact NE2-NE1 3.64Å; H362-W366 PolarHBondContact O-N 2.84Å; R363-W366 WeakPolarHBondContact O-CB 3.39Å; R363-W366 PolarHBondContact O-N 3.2Å; R364-W366 VanDerWaalsContact C-N 3.33Å; W366-A368 VanDerWaalsContact C-N 3.26Å; W366-A368 PolarHBondContact O-N 3.07Å; W366-G369 PolarHBondContact O-N 3.07Å; W366-G369 VanDerWaalsContact O-N 3.14Å; W366-V371 HydrophobicContact CD2-CG2 4.15Å; W366-V371 HydrophobicContact CG-CG2 4.08Å; W366-V371 HydrophobicContact CZ2-CG1 4.27Å; W366-D377 HydrophobicContact CZ2-CB 4.28Å; W366-D377 PolarHBondContact NE1-OD1 3.35Å; W366-D377 PolarHBondContact NE1-OD2 2.98Å; W366-D377 VanDerWaalsContact NE1-OD2 3.14Å; W366-I382 HydrophobicContact CH2-CD1 4.29Å; W366-I382 HydrophobicContact CZ2-CD1 4.07Å
367	E	86.3	Confident	85.7	Confident	153 Å²	153	101.1 Å²	101.1	72%	0.715	49%	0.488	S	S	*	.	H	α-helix	trans	-65.9	-28.3	179.5	-71.3	173.2	-178.4	0	0	112.8	R363 R364 G369	R363-E367 WeakPolarHBondContact O-CG 3.35Å; R363-E367 PolarHBondContact O-N 2.84Å; R364-E367 PolarHBondContact O-N 3.27Å; E367-G369 VanDerWaalsContact C-N 3.34Å
368	A	85.1	Confident	86.2	Confident	72 Å²	72	96.3 Å²	96.3	60%	0.595	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-0.5	175.9	0	0	0	0	0	114.1	R364 M365 W366 Q370	R364-A368 VanDerWaalsContact O-CB 3.31Å; R364-A368 WeakPolarHBondContact O-CB 3.29Å; R364-A368 PolarHBondContact O-N 3.03Å; M365-A368 PolarHBondContact O-N 3.37Å; W366-A368 VanDerWaalsContact C-N 3.26Å; W366-A368 PolarHBondContact O-N 3.07Å; A368-Q370 VanDerWaalsContact C-N 3.31Å; A368-Q370 PolarHBondContact O-N 3.3Å
369	G	83.3	Confident	86.5	Confident	56 Å²	56	96.7 Å²	96.7	58%	0.577	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	14.9	-178.9	0	0	0	0	0	114.9	M365 W366 E367 V371	M365-G369 PolarHBondContact O-N 3.17Å; W366-G369 PolarHBondContact O-N 3.07Å; W366-G369 VanDerWaalsContact O-N 3.14Å; E367-G369 VanDerWaalsContact C-N 3.34Å; G369-V371 PolarHBondContact O-N 3.34Å
370	Q	86.1	Confident	86.7	Confident	140 Å²	140	99.2 Å²	99.2	65%	0.654	49%	0.486	S	S	*	.			trans	-97.1	58.1	176	-66.2	-175.5	-18.9	0	0	110.6	M365 A368	M365-Q370 HydrophobicContact CB-CB 4.41Å; M365-Q370 CarbonylContact O-C 3.39Å; M365-Q370 PolarHBondContact O-N 2.87Å; A368-Q370 VanDerWaalsContact C-N 3.31Å; A368-Q370 PolarHBondContact O-N 3.3Å
371	V	90	Very high	86.9	Confident	21 Å²	21	101 Å²	101	13%	0.127	49%	0.49	C	S	.	.			trans	-81.5	137.7	-175.2	179.2	0	0	0	0	110.9	W366 G369 Y373 D377	W366-V371 HydrophobicContact CD2-CG2 4.15Å; W366-V371 HydrophobicContact CG-CG2 4.08Å; W366-V371 HydrophobicContact CZ2-CG1 4.27Å; G369-V371 PolarHBondContact O-N 3.34Å; V371-Y373 HydrophobicContact CB-CD1 4.45Å; V371-Y373 HydrophobicContact CB-CD2 4.21Å; V371-Y373 HydrophobicContact CB-CE1 3.93Å; V371-Y373 HydrophobicContact CB-CE2 3.67Å; V371-Y373 HydrophobicContact CG1-CD1 3.85Å; V371-Y373 HydrophobicContact CG1-CD2 4.38Å; V371-Y373 HydrophobicContact CG1-CE1 3.56Å; V371-Y373 HydrophobicContact CG1-CE2 4.14Å; V371-Y373 HydrophobicContact CG1-CG 4.26Å; V371-Y373 VanDerWaalsContact O-CD2 3.27Å; V371-Y373 WeakPolarHBondContact O-CD2 3.45Å; V371-Y373 PolarHBondContact O-N 3.5Å; V371-Y373 VanDerWaalsContact O-N 3.13Å; V371-D377 HydrophobicContact CG1-CB 3.43Å; V371-D377 VanDerWaalsContact CG1-CB 3.43Å
372	D	89.1	Confident	87	Confident	79 Å²	79	98.6 Å²	98.6	42%	0.422	48%	0.48	S	S	.	.			trans	-86.8	76.2	179.5	177.7	21.8	0	0	0	111.8	L374 G375 R376 D377 A378	D372-L374 PolarHBondContact O-N 3.06Å; D372-L374 VanDerWaalsContact O-N 3.13Å; D372-G375 PolarHBondContact O-N 3.15Å; D372-G375 PolarHBondContact OD1-N 2.95Å; D372-G375 WeakPolarHBondContact OD2-CA 3.43Å; D372-G375 PolarHBondContact OD2-N 3.32Å; D372-R376 PolarHBondContact OD2-N 3.23Å; D372-D377 PolarHBondContact N-OD2 3.37Å; D372-D377 CarbonylContact O-C 3.56Å; D372-D377 WeakPolarHBondContact O-CA 3.34Å; D372-D377 WeakPolarHBondContact O-CB 3.28Å; D372-D377 PolarHBondContact O-N 3.06Å; D372-A378 PolarHBondContact O-N 3.2Å
373	Y	84.4	Confident	87	Confident	160 Å²	160	100.1 Å²	100.1	63%	0.627	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.5	-176	-62.5	-71.4	0	0	0	115.2	V371 A378	V371-Y373 HydrophobicContact CB-CD1 4.45Å; V371-Y373 HydrophobicContact CB-CD2 4.21Å; V371-Y373 HydrophobicContact CB-CE1 3.93Å; V371-Y373 HydrophobicContact CB-CE2 3.67Å; V371-Y373 HydrophobicContact CG1-CD1 3.85Å; V371-Y373 HydrophobicContact CG1-CD2 4.38Å; V371-Y373 HydrophobicContact CG1-CE1 3.56Å; V371-Y373 HydrophobicContact CG1-CE2 4.14Å; V371-Y373 HydrophobicContact CG1-CG 4.26Å; V371-Y373 VanDerWaalsContact O-CD2 3.27Å; V371-Y373 WeakPolarHBondContact O-CD2 3.45Å; V371-Y373 PolarHBondContact O-N 3.5Å; V371-Y373 VanDerWaalsContact O-N 3.13Å; Y373-A378 WeakPolarHBondContact O-CA 3.44Å
374	L	83.8	Confident	86.9	Confident	172 Å²	172	99.9 Å²	99.9	90%	0.901	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-9.3	179.7	-65.1	177.6	0	0	0	113.1	D372	D372-L374 PolarHBondContact O-N 3.06Å; D372-L374 VanDerWaalsContact O-N 3.13Å
375	G	89.4	Confident	86.7	Confident	30 Å²	30	97.2 Å²	97.2	31%	0.309	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-109.8	178.9	0	0	0	0	0	112.3	D372 D377 A378 N381	D372-G375 PolarHBondContact O-N 3.15Å; D372-G375 PolarHBondContact OD1-N 2.95Å; D372-G375 WeakPolarHBondContact OD2-CA 3.43Å; D372-G375 PolarHBondContact OD2-N 3.32Å; G375-D377 PolarHBondContact O-N 2.88Å; G375-A378 WeakPolarHBondContact O-CB 3.24Å; G375-A378 PolarHBondContact O-N 3.49Å; G375-N381 PolarHBondContact O-ND2 3.34Å
376	R	84.4	Confident	86.6	Confident	132 Å²	132	97.5 Å²	97.5	50%	0.498	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-33.2	-169.5	-170.6	175.7	-177	-176.8	-0.2	112.6	D372	D372-R376 PolarHBondContact OD2-N 3.23Å
377	D	89.8	Confident	86.5	Confident	11 Å²	11	95.8 Å²	95.8	6%	0.059	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	19.9	-176.2	-51.4	-58.1	0	0	0	112.8	H362 W366 V371 D372 G375 I382	H362-D377 IonicContact CD2-OD2 3.77Å; H362-D377 IonicContact CE1-OD1 3.09Å; H362-D377 PolarHBondContact CE1-OD1 3.03Å; H362-D377 IonicContact CE1-OD2 3.9Å; H362-D377 VanDerWaalsContact NE2-CG 3.26Å; H362-D377 IonicContact NE2-OD1 2.87Å; H362-D377 PolarHBondContact NE2-OD1 3.28Å; H362-D377 IonicContact NE2-OD2 2.88Å; H362-D377 PolarHBondContact NE2-OD2 3.08Å; W366-D377 HydrophobicContact CZ2-CB 4.28Å; W366-D377 PolarHBondContact NE1-OD1 3.35Å; W366-D377 PolarHBondContact NE1-OD2 2.98Å; W366-D377 VanDerWaalsContact NE1-OD2 3.14Å; V371-D377 HydrophobicContact CG1-CB 3.43Å; V371-D377 VanDerWaalsContact CG1-CB 3.43Å; D372-D377 PolarHBondContact N-OD2 3.37Å; D372-D377 CarbonylContact O-C 3.56Å; D372-D377 WeakPolarHBondContact O-CA 3.34Å; D372-D377 WeakPolarHBondContact O-CB 3.28Å; D372-D377 PolarHBondContact O-N 3.06Å; G375-D377 PolarHBondContact O-N 2.88Å; D377-I382 VanDerWaalsContact O-CD1 3.28Å; D377-I382 WeakPolarHBondContact O-CD1 3.37Å
378	A	91.7	Very high	86.3	Confident	18 Å²	18	98.2 Å²	98.2	15%	0.149	49%	0.492	C	S	.	.			trans	-58.1	143.9	173.8	0	0	0	0	0	111.2	D372 Y373 G375 Q380 N381 I382	D372-A378 PolarHBondContact O-N 3.2Å; Y373-A378 WeakPolarHBondContact O-CA 3.44Å; G375-A378 WeakPolarHBondContact O-CB 3.24Å; G375-A378 PolarHBondContact O-N 3.49Å; A378-Q380 PolarHBondContact O-N 3.15Å; A378-Q380 VanDerWaalsContact O-N 3.07Å; A378-N381 WeakPolarHBondContact O-CB 3.19Å; A378-N381 PolarHBondContact O-N 3.46Å; A378-I382 PolarHBondContact O-N 3.05Å
379	F	87.3	Confident	86.1	Confident	150 Å²	150	103 Å²	103	66%	0.658	50%	0.5	S	S	*	.	H	α-helix	trans	-49.1	-41.6	-178.4	175.6	-98.9	0	0	0	112.9	N381 I382 Q383	F379-N381 VanDerWaalsContact C-N 3.29Å; F379-N381 PolarHBondContact O-N 2.9Å; F379-I382 PolarHBondContact O-N 3.45Å; F379-Q383 HydrophobicContact CE1-CB 4.39Å; F379-Q383 HydrophobicContact CZ-CB 4.48Å; F379-Q383 VanDerWaalsContact O-CB 3.28Å; F379-Q383 WeakPolarHBondContact O-CB 3.47Å; F379-Q383 PolarHBondContact O-N 3.17Å
380	Q	88.3	Confident	85.9	Confident	158 Å²	158	106.4 Å²	106.4	74%	0.738	50%	0.504	S	S	*	.	H	α-helix	trans	-61.5	-35.4	179.4	-64.9	175.9	2.3	0	0	112.8	A378 K384	A378-Q380 PolarHBondContact O-N 3.15Å; A378-Q380 VanDerWaalsContact O-N 3.07Å; Q380-K384 VanDerWaalsContact O-CB 3.24Å; Q380-K384 WeakPolarHBondContact O-CB 3.34Å; Q380-K384 PolarHBondContact O-N 3.07Å
381	N	87.4	Confident	85.4	Confident	81 Å²	81	104.3 Å²	104.3	43%	0.433	50%	0.497	S	S	.	.	H	α-helix	trans	-75.4	-40.4	178.8	-66.4	-27.1	0	0	0	111.3	G375 A378 F379 K384 M385	G375-N381 PolarHBondContact O-ND2 3.34Å; A378-N381 WeakPolarHBondContact O-CB 3.19Å; A378-N381 PolarHBondContact O-N 3.46Å; F379-N381 VanDerWaalsContact C-N 3.29Å; F379-N381 PolarHBondContact O-N 2.9Å; N381-K384 PolarHBondContact O-N 3.21Å; N381-M385 PolarHBondContact O-N 3.48Å
382	I	87.6	Confident	83.8	Confident	59 Å²	59	109 Å²	109	30%	0.303	53%	0.529	S	S	.	.	H	α-helix	trans	-64.9	-47.4	176.1	-62	174.6	0	0	0	110	W366 D377 A378 F379 K384 M385 L386	W366-I382 HydrophobicContact CH2-CD1 4.29Å; W366-I382 HydrophobicContact CZ2-CD1 4.07Å; D377-I382 VanDerWaalsContact O-CD1 3.28Å; D377-I382 WeakPolarHBondContact O-CD1 3.37Å; A378-I382 PolarHBondContact O-N 3.05Å; F379-I382 PolarHBondContact O-N 3.45Å; I382-K384 PolarHBondContact O-N 3.46Å; I382-M385 PolarHBondContact O-N 3.41Å; I382-M385 VanDerWaalsContact O-N 3.15Å; I382-L386 HydrophobicContact CG2-CD1 4.07Å; I382-L386 WeakPolarHBondContact O-CG 3.36Å; I382-L386 PolarHBondContact O-N 3.17Å
383	Q	85.6	Confident	82.4	Confident	72 Å²	72	113.1 Å²	113.1	34%	0.336	55%	0.545	S	S	.	.	H	α-helix	trans	-58.1	-47.6	176.7	-172.7	65.4	45.2	0	0	111	F379 M385 L386 D387	F379-Q383 HydrophobicContact CE1-CB 4.39Å; F379-Q383 HydrophobicContact CZ-CB 4.48Å; F379-Q383 VanDerWaalsContact O-CB 3.28Å; F379-Q383 WeakPolarHBondContact O-CB 3.47Å; F379-Q383 PolarHBondContact O-N 3.17Å; Q383-M385 VanDerWaalsContact C-N 3.26Å; Q383-M385 PolarHBondContact O-N 3.13Å; Q383-L386 PolarHBondContact O-N 3.09Å; Q383-D387 PolarHBondContact NE2-OD1 3.42Å; Q383-D387 WeakPolarHBondContact O-CB 3.32Å; Q383-D387 PolarHBondContact O-N 3.33Å
384	K	86.6	Confident	80.8	Confident	155 Å²	155	112.8 Å²	112.8	67%	0.674	55%	0.549	S	S	*	.	H	α-helix	trans	-60.3	-34.4	177.7	-172.9	176.5	-177.5	178.2	0	113	Q380 N381 I382 R388	Q380-K384 VanDerWaalsContact O-CB 3.24Å; Q380-K384 WeakPolarHBondContact O-CB 3.34Å; Q380-K384 PolarHBondContact O-N 3.07Å; N381-K384 PolarHBondContact O-N 3.21Å; I382-K384 PolarHBondContact O-N 3.46Å; K384-R388 WeakPolarHBondContact O-CB 3.3Å; K384-R388 PolarHBondContact O-N 2.98Å
385	M	83.8	Confident	79	Confident	126 Å²	126	113.9 Å²	113.9	62%	0.621	55%	0.549	S	S	*	.	H	α-helix	trans	-74.2	-40.2	178.3	-150.8	-110.1	-81.7	0	0	111.6	N381 I382 Q383 R388 F389	N381-M385 PolarHBondContact O-N 3.48Å; I382-M385 PolarHBondContact O-N 3.41Å; I382-M385 VanDerWaalsContact O-N 3.15Å; Q383-M385 VanDerWaalsContact C-N 3.26Å; Q383-M385 PolarHBondContact O-N 3.13Å; M385-R388 PolarHBondContact O-N 2.93Å; M385-F389 PolarHBondContact O-N 3.13Å; M385-F389 VanDerWaalsContact O-N 3.13Å
386	L	82.3	Confident	77	Confident	83 Å²	83	118.3 Å²	118.3	44%	0.435	57%	0.571	S	S	.	*	H	α-helix	trans	-64.1	-45.1	173.8	-70.9	170.3	0	0	0	111.7	I382 Q383 R388 F389 L390	I382-L386 HydrophobicContact CG2-CD1 4.07Å; I382-L386 WeakPolarHBondContact O-CG 3.36Å; I382-L386 PolarHBondContact O-N 3.17Å; Q383-L386 PolarHBondContact O-N 3.09Å; L386-R388 VanDerWaalsContact C-N 3.29Å; L386-R388 PolarHBondContact O-N 3.13Å; L386-F389 PolarHBondContact O-N 3.48Å; L386-L390 HydrophobicContact CB-CD1 4.42Å; L386-L390 WeakPolarHBondContact O-CB 3.42Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.48Å; L386-L390 PolarHBondContact O-N 3.41Å
387	D	84.9	Confident	75.1	Confident	84 Å²	84	116.6 Å²	116.6	45%	0.449	58%	0.579	S	S	.	*	H	α-helix	trans	-59.9	-41.5	177.5	-65.1	-19.1	0	0	0	110.6	Q383 F389 L390 D391	Q383-D387 PolarHBondContact NE2-OD1 3.42Å; Q383-D387 WeakPolarHBondContact O-CB 3.32Å; Q383-D387 PolarHBondContact O-N 3.33Å; D387-F389 VanDerWaalsContact C-N 3.28Å; D387-F389 PolarHBondContact O-N 3.46Å; D387-L390 PolarHBondContact O-N 3.05Å; D387-D391 WeakPolarHBondContact O-CB 3.5Å; D387-D391 PolarHBondContact O-N 3.32Å; D387-D391 VanDerWaalsContact O-N 3.15Å
388	R	81.9	Confident	72.6	Confident	204 Å²	204	124.2 Å²	124.2	77%	0.77	62%	0.619	S	S	*	*	H	α-helix	trans	-64.1	-32	175	-162.6	-176.2	91.3	174	5.6	113	K384 M385 L386	K384-R388 WeakPolarHBondContact O-CB 3.3Å; K384-R388 PolarHBondContact O-N 2.98Å; M385-R388 PolarHBondContact O-N 2.93Å; L386-R388 VanDerWaalsContact C-N 3.29Å; L386-R388 PolarHBondContact O-N 3.13Å
389	F	80.4	Confident	70.2	Confident	171 Å²	171	132.9 Å²	132.9	75%	0.75	67%	0.673	S	S	*	*	H	α-helix	trans	-85.7	-25.7	-176.6	-145.8	-86.9	0	0	0	112.6	M385 L386 D387	M385-F389 PolarHBondContact O-N 3.13Å; M385-F389 VanDerWaalsContact O-N 3.13Å; L386-F389 PolarHBondContact O-N 3.48Å; D387-F389 VanDerWaalsContact C-N 3.28Å; D387-F389 PolarHBondContact O-N 3.46Å
390	L	79.3	Confident	69.4	Low	128 Å²	128	132 Å²	132	67%	0.67	67%	0.674	S	S	*	*	H	α-helix	trans	-99.9	-12.4	-174.2	-66.7	171.4	0	0	0	113.8	L386 D387 P392	L386-L390 HydrophobicContact CB-CD1 4.42Å; L386-L390 WeakPolarHBondContact O-CB 3.42Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.48Å; L386-L390 PolarHBondContact O-N 3.41Å; D387-L390 PolarHBondContact O-N 3.05Å; L390-P392 WeakPolarHBondContact O-CD 3.47Å
391	D	74.6	Confident	68.4	Low	96 Å²	96	130.6 Å²	130.6	51%	0.513	67%	0.671	S	S	.	*			trans	-86	112.2	178.7	-158.1	-6.8	0	0	0	111.9	D387 Q393	D387-D391 WeakPolarHBondContact O-CB 3.5Å; D387-D391 PolarHBondContact O-N 3.32Å; D387-D391 VanDerWaalsContact O-N 3.15Å; D391-Q393 PolarHBondContact O-N 3.49Å; D391-Q393 VanDerWaalsContact O-N 3.13Å
392	P	58.2	Low	67.3	Low	121 Å²	121	133.4 Å²	133.4	79%	0.786	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	2	-174	-12.8	29.2	0	0	0	114.8	L390	L390-P392 WeakPolarHBondContact O-CD 3.47Å
393	Q	58.5	Low	66.1	Low	164 Å²	164	137.8 Å²	137.8	77%	0.766	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	5.4	-169.4	-64.3	-155.2	-8.6	0	0	116	D391	D391-Q393 PolarHBondContact O-N 3.49Å; D391-Q393 VanDerWaalsContact O-N 3.13Å
394	H	50.5	Low	64.9	Low	154 Å²	154	141.9 Å²	141.9	71%	0.713	73%	0.73	S	S	*	*			trans	-103	11.7	-175	-123.4	-46.6	0	0	0	116.8
395	E	47.3	Very low	63.5	Low	194 Å²	194	141 Å²	141	91%	0.907	73%	0.733	S	S	*	*	S	Bend	trans	-91.1	-1.9	174.4	-103.5	-173.4	179.1	0	0	115.2
396	T	47.4	Very low	62	Low	123 Å²	123	142.1 Å²	142.1	76%	0.755	74%	0.741	S	S	*	*	S	Bend	trans	-116	69.5	175.4	54	0	0	0	0	112.1
397	S	43.3	Very low	60.5	Low	97 Å²	97	146.6 Å²	146.6	68%	0.678	77%	0.765	S	S	*	*			trans	179.7	95.2	145	23.5	0	0	0	0	111.7
398	L	36.8	Very low	58.4	Low	171 Å²	171	151.8 Å²	151.8	90%	0.895	79%	0.791	S	S	*	*			trans	-136.5	137.7	143	-85.8	169.5	0	0	0	107.8
399	P	42.9	Very low	56.3	Low	199 Å²	199	147.1 Å²	147.1	100%	1.292	79%	0.793	S	S	*	*			trans	-69.9	0	-178.5	29.6	-34.5	0	0	0	114

Retrieved 399 of 399 residues in 872 ms (Link to these results)

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