A0A087XQY8_POEFO Loading...

Small ribosomal subunit protein RACK1

Involved in the recruitment, assembly and/or regulation of a variety of signaling molecules. Interacts with a wide variety of proteins and plays a role in many cellular processes. Required for VANGL2 membrane localization, inhibits Wnt signaling and regulates cellular polarization and oriented cell division during gastrulation.

AlphaFold DB , UniProt , Accession A0A087XQY8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 323 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	P	37.8	Very low	58.1	Low	181 Å²	181	106.7 Å²	106.7	100%	1.175	59%	0.59	S	S	*	*				0	105.8	0	9	14.9	0	0	0	109.4
2	S	43.9	Very low	60.5	Low	99 Å²	99	102.5 Å²	102.5	69%	0.692	57%	0.57	S	S	*	*			trans	-36.9	124.5	-172.9	45.5	0	0	0	0	115.9	L4	S2-L4 VanDerWaalsContact C-N 3.27Å; S2-L4 PolarHBondContact O-N 3.31Å
3	N	40	Very low	62.7	Low	170 Å²	170	99.9 Å²	99.9	91%	0.909	56%	0.558	S	S	*	*			trans	-57.7	94	150.5	-89	-19.4	0	0	0	107.5	A5	N3-A5 PolarHBondContact O-N 2.75Å; N3-A5 VanDerWaalsContact O-N 3.1Å
4	L	47.1	Very low	64.6	Low	150 Å²	150	101.1 Å²	101.1	79%	0.785	55%	0.55	S	S	*	.			trans	-67.3	104.2	157.4	-91.1	96.6	0	0	0	105.7	S2 K6	S2-L4 VanDerWaalsContact C-N 3.27Å; S2-L4 PolarHBondContact O-N 3.31Å; L4-K6 PolarHBondContact O-N 3.06Å; L4-K6 VanDerWaalsContact O-N 3.09Å
5	A	44.7	Very low	66.2	Low	57 Å²	57	95.1 Å²	95.1	47%	0.471	52%	0.521	S	S	.	.			trans	-49.1	119.7	159.8	0	0	0	0	0	106.8	N3 M7	N3-A5 PolarHBondContact O-N 2.75Å; N3-A5 VanDerWaalsContact O-N 3.1Å; A5-M7 VanDerWaalsContact C-N 3.32Å; A5-M7 PolarHBondContact O-N 3.46Å
6	K	50.2	Low	67.8	Low	183 Å²	183	90.9 Å²	90.9	80%	0.796	50%	0.499	S	S	*	.			trans	-62.7	101.4	172.4	-88.1	-176.4	174	-176.6	0	106.2	L4 T8	L4-K6 PolarHBondContact O-N 3.06Å; L4-K6 VanDerWaalsContact O-N 3.09Å; K6-T8 PolarHBondContact O-N 2.76Å; K6-T8 VanDerWaalsContact O-N 3.07Å
7	M	55.8	Low	69.3	Low	140 Å²	140	85.7 Å²	85.7	69%	0.69	47%	0.47	S	S	*	.			trans	-60.9	111.6	170.4	-68.8	-177.8	-169.7	0	0	107	A5 I320	A5-M7 VanDerWaalsContact C-N 3.32Å; A5-M7 PolarHBondContact O-N 3.46Å; M7-I320 HydrophobicContact CB-CG2 3.98Å; M7-I320 HydrophobicContact CG-CG2 4.14Å; M7-I320 HydrophobicContact SD-CG2 4.16Å
8	T	68.5	Low	70.6	Confident	45 Å²	45	88.4 Å²	88.4	28%	0.276	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.4	175.1	48.2	0	0	0	0	107.6	K6 G321	K6-T8 PolarHBondContact O-N 2.76Å; K6-T8 VanDerWaalsContact O-N 3.07Å; T8-G321 PolarHBondContact N-O 2.81Å; T8-G321 PolarHBondContact O-N 3.32Å; T8-G321 VanDerWaalsContact O-N 3.08Å
9	E	79.3	Confident	71.7	Confident	55 Å²	55	86.4 Å²	86.4	26%	0.257	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	130.5	170.9	-63.6	-173.9	134.1	0	0	108.9	R251 W253 V318 I320	E9-R251 VanDerWaalsContact CD-NE 3.34Å; E9-R251 IonicContact OE1-CZ 3.16Å; E9-R251 IonicContact OE1-NE 3.2Å; E9-R251 PolarHBondContact OE1-NE 2.67Å; E9-R251 VanDerWaalsContact OE1-NE 3.17Å; E9-R251 IonicContact OE1-NH2 3.62Å; E9-R251 PolarHBondContact OE1-NH2 2.95Å; E9-R251 WeakPolarHBondContact OE2-CD 3.43Å; E9-R251 IonicContact OE2-CZ 2.76Å; E9-R251 IonicContact OE2-NE 3.39Å; E9-R251 PolarHBondContact OE2-NE 3.44Å; E9-R251 IonicContact OE2-NH2 2.67Å; E9-W253 HydrophobicContact CB-CH2 3.73Å; E9-W253 HydrophobicContact CB-CZ2 4.08Å; E9-W253 VanDerWaalsContact OE2-CH2 3.25Å; E9-W253 WeakPolarHBondContact OE2-CH2 3.26Å; E9-W253 WeakPolarHBondContact OE2-CZ2 3.34Å; E9-V318 HydrophobicContact CB-CG1 3.95Å; E9-V318 HydrophobicContact CG-CG1 4.26Å; E9-I320 HydrophobicContact CG-CG1 4.49Å
10	Q	84.5	Confident	72.9	Confident	80 Å²	80	82.8 Å²	82.8	37%	0.374	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	156.5	178.4	-69.2	-174	-25.5	0	0	109.5	T319	Q10-T319 PolarHBondContact N-O 3.27Å; Q10-T319 PolarHBondContact O-N 2.95Å; Q10-T319 VanDerWaalsContact O-O 3.08Å; Q10-T319 PolarHBondContact O-OG1 3.21Å
11	M	87.3	Confident	73.9	Confident	14 Å²	14	83.4 Å²	83.4	7%	0.069	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130.2	178.3	-69.6	-67.5	-118.9	0	0	110.8	I264 D274 L276 W297 L304 W316 V318	M11-I264 HydrophobicContact CE-CD1 3.82Å; M11-I264 HydrophobicContact CG-CD1 3.55Å; M11-I264 HydrophobicContact SD-CD1 4.48Å; M11-D274 PolarHBondContact N-OD2 3.24Å; M11-D274 VanDerWaalsContact N-OD2 3.08Å; M11-L276 HydrophobicContact CB-CD1 4.12Å; M11-L276 HydrophobicContact CB-CD2 3.44Å; M11-L276 VanDerWaalsContact CB-CD2 3.44Å; M11-L276 HydrophobicContact CB-CG 4.44Å; M11-L276 HydrophobicContact CG-CD1 4.31Å; M11-L276 HydrophobicContact CG-CD2 4.06Å; M11-W297 HydrophobicContact CE-CH2 3.24Å; M11-W297 HydrophobicContact CE-CZ2 3.96Å; M11-W297 HydrophobicContact CE-CZ3 3.8Å; M11-W297 HydrophobicContact SD-CH2 4.36Å; M11-L304 HydrophobicContact CE-CB 3.42Å; M11-L304 VanDerWaalsContact CE-CB 3.42Å; M11-L304 HydrophobicContact CE-CD2 3.78Å; M11-L304 HydrophobicContact CE-CG 4.26Å; M11-W316 HydrophobicContact CB-CE3 4.38Å; M11-W316 HydrophobicContact CE-CB 4.27Å; M11-V318 HydrophobicContact CE-CG2 4.18Å; M11-V318 HydrophobicContact SD-CB 4.15Å; M11-V318 HydrophobicContact SD-CG2 3.47Å; M11-V318 WeakPolarHBondContact SD-CG2 3.29Å
12	T	87.8	Confident	76.7	Confident	56 Å²	56	75.3 Å²	75.3	34%	0.344	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.2	175.1	51.6	0	0	0	0	110.8	R14 W316 Q317 T319	T12-R14 PolarHBondContact O-N 2.77Å; T12-W316 CarbonylContact O-C 3.59Å; T12-W316 WeakPolarHBondContact O-CA 3.47Å; T12-Q317 PolarHBondContact N-O 3.4Å; T12-Q317 PolarHBondContact O-N 3.1Å; T12-Q317 PolarHBondContact OG1-O 2.78Å; T12-T319 HydrophobicContact CG2-CG2 4.37Å; T12-T319 WeakPolarHBondContact CG2-OG1 3.37Å; T12-T319 WeakPolarHBondContact OG1-CG2 3.23Å; T12-T319 PolarHBondContact OG1-OG1 3.47Å
13	V	88.4	Confident	79.2	Confident	69 Å²	69	75.4 Å²	75.4	42%	0.418	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	123	172.9	-176.3	0	0	0	0	108.2	W316	V13-W316 HydrophobicContact CB-CE3 4.37Å; V13-W316 HydrophobicContact CB-CZ3 4.33Å; V13-W316 HydrophobicContact CG2-CD2 4.05Å; V13-W316 HydrophobicContact CG2-CE3 3.54Å; V13-W316 HydrophobicContact CG2-CH2 3.25Å; V13-W316 HydrophobicContact CG2-CZ2 3.77Å; V13-W316 HydrophobicContact CG2-CZ3 3.14Å
14	R	88.8	Confident	81.9	Confident	117 Å²	117	67.3 Å²	67.3	44%	0.442	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-31.3	173.8	-77.2	-59.7	-166.8	176.1	0.9	113.7	T12 Y58 V315 Q317	T12-R14 PolarHBondContact O-N 2.77Å; R14-Y58 HydrophobicContact CB-CD2 4.11Å; R14-Y58 HydrophobicContact CB-CE2 4.14Å; R14-V315 PolarHBondContact N-O 3.35Å; R14-Q317 HydrophobicContact CG-CB 3.43Å; R14-Q317 VanDerWaalsContact CG-CB 3.43Å; R14-Q317 HydrophobicContact CG-CG 4.44Å
15	G	89.3	Confident	84.3	Confident	11 Å²	11	61.4 Å²	61.4	11%	0.113	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.4	-172.4	-178.8	0	0	0	0	0	113.2	V315	G15-V315 PolarHBondContact O-N 3.08Å
16	T	91.8	Very high	86.8	Confident	28 Å²	28	60.5 Å²	60.5	17%	0.172	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149.5	178.1	63.2	0	0	0	0	110.5	K18 I313 R314	T16-K18 WeakPolarHBondContact OG1-CE 3.25Å; T16-I313 CarbonylContact C-O 3.6Å; T16-I313 VanDerWaalsContact CA-O 3.26Å; T16-I313 WeakPolarHBondContact CA-O 3.4Å; T16-R314 HydrophobicContact CG2-CG 4.22Å
17	L	92.9	Very high	89.1	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	123.9	169.1	-49.2	169.9	0	0	0	108	I37 W49 L51 Y58 G59 I313 V315	L17-I37 HydrophobicContact CD1-CD1 3.42Å; L17-I37 VanDerWaalsContact CD1-CD1 3.42Å; L17-I37 HydrophobicContact CD1-CG1 4.42Å; L17-W49 HydrophobicContact CB-CD2 4.27Å; L17-W49 HydrophobicContact CB-CE3 3.84Å; L17-W49 HydrophobicContact CB-CH2 3.97Å; L17-W49 HydrophobicContact CB-CZ2 4.38Å; L17-W49 HydrophobicContact CB-CZ3 3.68Å; L17-W49 HydrophobicContact CD1-CD2 4.16Å; L17-W49 HydrophobicContact CD1-CE3 4.33Å; L17-W49 HydrophobicContact CD1-CG 4.3Å; L17-W49 HydrophobicContact CD2-CE3 4.32Å; L17-W49 HydrophobicContact CG-CE3 4.41Å; L17-L51 HydrophobicContact CD1-CD2 4.33Å; L17-Y58 HydrophobicContact CD2-CD1 4.45Å; L17-G59 VanDerWaalsContact CD2-CA 3.44Å; L17-G59 WeakPolarHBondContact CD2-O 3.33Å; L17-I313 HydrophobicContact CB-CB 4.06Å; L17-I313 HydrophobicContact CD1-CB 4.19Å; L17-I313 HydrophobicContact CD1-CD1 4.25Å; L17-I313 HydrophobicContact CD1-CG2 4.08Å; L17-I313 HydrophobicContact CG-CB 4.4Å; L17-I313 PolarHBondContact N-O 2.73Å; L17-I313 PolarHBondContact O-N 3.33Å; L17-V315 HydrophobicContact CD1-CG2 4.48Å; L17-V315 HydrophobicContact CG-CG2 4.28Å
18	K	92.9	Very high	91	Very high	135 Å²	135	45.7 Å²	45.7	59%	0.587	25%	0.249	S	C	*	.			trans	-116.6	133.2	-177.3	-49.1	-163.7	173.9	170.9	0	109.4	T16 W49 L312	T16-K18 WeakPolarHBondContact OG1-CE 3.25Å; K18-W49 WeakPolarHBondContact O-CH2 3.49Å; K18-W49 WeakPolarHBondContact O-CZ3 3.27Å; K18-L312 HydrophobicContact CB-CD2 4.14Å; K18-L312 HydrophobicContact CD-CD2 4.11Å; K18-L312 HydrophobicContact CG-CD2 3.68Å
19	G	91.8	Very high	92.3	Very high	49 Å²	49	45.5 Å²	45.5	51%	0.505	25%	0.248	S	C	.	.			trans	166.1	-26.8	179.7	0	0	0	0	0	114.6
20	H	95.6	Very high	93	Very high	14 Å²	14	43 Å²	43	7%	0.065	24%	0.236	C	C	.	.			trans	-71.4	147.5	172.3	-80.3	-61.6	0	0	0	111.9	V24 S39 S41 D43 I47 W49 N311	H20-V24 HydrophobicContact CB-CG2 4.38Å; H20-S39 PolarHBondContact NE2-OG 2.98Å; H20-S41 WeakPolarHBondContact CE1-CB 3.32Å; H20-S41 WeakPolarHBondContact ND1-CB 3.43Å; H20-D43 WeakPolarHBondContact CA-OD2 3.47Å; H20-D43 IonicContact CE1-OD2 2.65Å; H20-D43 IonicContact CG-OD2 3.95Å; H20-D43 IonicContact ND1-OD1 2.83Å; H20-D43 IonicContact ND1-OD2 3.96Å; H20-D43 PolarHBondContact ND1-OD2 3.09Å; H20-I47 VanDerWaalsContact CE1-CD1 3.47Å; H20-I47 WeakPolarHBondContact CE1-CD1 3.42Å; H20-I47 VanDerWaalsContact CE1-CG1 3.42Å; H20-I47 WeakPolarHBondContact CE1-CG1 3.32Å; H20-I47 WeakPolarHBondContact ND1-CD1 3.48Å; H20-W49 AromaticContact CD2-CZ2 3.93Å; H20-N311 HydrophobicContact CB-CB 4.42Å; H20-N311 WeakPolarHBondContact O-CB 3.16Å
21	S	94.4	Very high	93.3	Very high	97 Å²	97	44 Å²	44	68%	0.678	25%	0.249	S	C	*	.	S	Bend	trans	-107.6	12.6	174.4	71.9	0	0	0	0	113	D43	S21-D43 PolarHBondContact N-OD2 2.9Å; S21-D43 VanDerWaalsContact N-OD2 3.13Å; S21-D43 WeakPolarHBondContact OG-CB 3.48Å
22	G	95	Very high	93.5	Very high	10 Å²	10	49 Å²	49	10%	0.103	27%	0.273	C	S	.	.	S	Bend	trans	-155.9	173.3	179.6	0	0	0	0	0	111.1	V24 S41 N311	G22-V24 PolarHBondContact O-N 3.18Å; G22-S41 PolarHBondContact O-OG 3.31Å; G22-N311 WeakPolarHBondContact CA-OD1 3.49Å; G22-N311 PolarHBondContact N-OD1 3.09Å; G22-N311 WeakPolarHBondContact O-CA 3.38Å; G22-N311 WeakPolarHBondContact O-CB 3.49Å; G22-N311 PolarHBondContact O-OD1 3.25Å
23	W	96.5	Very high	93.7	Very high	102 Å²	102	50.8 Å²	50.8	39%	0.386	27%	0.274	S	S	.	.			trans	-56.6	136.3	-175.4	-58.5	1.7	0	0	0	111.4	T25 S41 R42 T309 N311	W23-T25 PolarHBondContact O-N 3.16Å; W23-S41 WeakPolarHBondContact O-CA 3.42Å; W23-S41 WeakPolarHBondContact O-CB 3.48Å; W23-S41 PolarHBondContact O-OG 3.31Å; W23-S41 VanDerWaalsContact O-OG 3.05Å; W23-R42 HydrophobicContact CB-CG 4.14Å; W23-R42 VanDerWaalsContact CE3-NH1 3.33Å; W23-R42 PolarHBondContact O-N 2.82Å; W23-T309 HydrophobicContact CD2-CG2 3.67Å; W23-T309 HydrophobicContact CE3-CG2 3.64Å; W23-T309 HydrophobicContact CG-CG2 4.19Å; W23-T309 HydrophobicContact CH2-CG2 4.15Å; W23-T309 HydrophobicContact CZ2-CG2 4.17Å; W23-T309 HydrophobicContact CZ3-CG2 3.89Å; W23-T309 PolarHBondContact NE1-O 2.9Å; W23-T309 VanDerWaalsContact NE1-O 3.07Å; W23-N311 PolarHBondContact N-OD1 2.65Å
24	V	97.6	Very high	93.8	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	105.7	177.6	-176.4	0	0	0	0	109.3	H20 G22 I27 A40 T293 S294 Y308 I313	H20-V24 HydrophobicContact CB-CG2 4.38Å; G22-V24 PolarHBondContact O-N 3.18Å; V24-I27 HydrophobicContact CG1-CD1 4.33Å; V24-I27 HydrophobicContact CG1-CG1 3.95Å; V24-A40 CarbonylContact C-O 3.58Å; V24-A40 WeakPolarHBondContact CA-O 3.4Å; V24-T293 WeakPolarHBondContact O-CB 3.48Å; V24-T293 PolarHBondContact O-OG1 2.77Å; V24-S294 PolarHBondContact O-OG 3.27Å; V24-Y308 PolarHBondContact N-O 3.48Å; V24-I313 HydrophobicContact CB-CG1 4.49Å; V24-I313 HydrophobicContact CG1-CD1 4.4Å; V24-I313 HydrophobicContact CG1-CG1 4.03Å; V24-I313 HydrophobicContact CG2-CG1 3.95Å
25	T	97	Very high	94	Very high	26 Å²	26	49 Å²	49	16%	0.16	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-32.1	-169.3	46.7	0	0	0	0	113.3	W23 A40 R42 V72 S73 S294	W23-T25 PolarHBondContact O-N 3.16Å; T25-A40 PolarHBondContact N-O 3.35Å; T25-A40 VanDerWaalsContact OG1-C 3.25Å; T25-A40 WeakPolarHBondContact OG1-CB 3.47Å; T25-A40 PolarHBondContact OG1-O 3.44Å; T25-R42 HydrophobicContact CG2-CG 3.86Å; T25-V72 WeakPolarHBondContact CB-O 3.36Å; T25-V72 WeakPolarHBondContact CG2-O 3.33Å; T25-V72 PolarHBondContact OG1-O 2.93Å; T25-S73 WeakPolarHBondContact CB-O 3.45Å; T25-S294 WeakPolarHBondContact O-CB 3.46Å
26	Q	97.8	Very high	94.3	Very high	37 Å²	37	49.5 Å²	49.5	17%	0.173	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	149	177	-174.9	68.7	18.6	0	0	110.7	S39 A40 D74 V75	Q26-S39 CarbonylContact O-C 3.58Å; Q26-S39 VanDerWaalsContact O-CA 3.28Å; Q26-S39 WeakPolarHBondContact O-CA 3.46Å; Q26-A40 HydrophobicContact CB-CB 4.27Å; Q26-A40 PolarHBondContact O-N 3.11Å; Q26-D74 WeakPolarHBondContact CG-OD1 3.11Å; Q26-V75 HydrophobicContact CB-CG1 4.07Å; Q26-V75 HydrophobicContact CG-CG1 4.03Å
27	I	97.7	Very high	94.5	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.1	169.4	-57.6	166.3	0	0	0	108.5	V24 I37 L38 A296 F305 I313	V24-I27 HydrophobicContact CG1-CD1 4.33Å; V24-I27 HydrophobicContact CG1-CG1 3.95Å; I27-I37 HydrophobicContact CG2-CD1 4.48Å; I27-L38 CarbonylContact C-O 3.52Å; I27-L38 WeakPolarHBondContact CA-O 3.44Å; I27-A296 HydrophobicContact CB-CB 3.91Å; I27-A296 HydrophobicContact CG2-CB 3.84Å; I27-F305 HydrophobicContact CD1-CB 3.99Å; I27-F305 HydrophobicContact CG2-CB 4.03Å; I27-I313 HydrophobicContact CD1-CD1 4.47Å; I27-I313 HydrophobicContact CD1-CG1 4.24Å; I27-I313 HydrophobicContact CD1-CG2 3.68Å
28	A	96.7	Very high	94.7	Very high	11 Å²	11	48.1 Å²	48.1	9%	0.091	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143	174.6	0	0	0	0	0	110.8	L38 V75 I77	A28-L38 PolarHBondContact N-O 3.29Å; A28-L38 PolarHBondContact O-N 2.87Å; A28-V75 HydrophobicContact CB-CG1 4.28Å; A28-I77 HydrophobicContact CB-CD1 4.17Å; A28-I77 HydrophobicContact CB-CG1 3.82Å
29	T	95.6	Very high	94.9	Very high	40 Å²	40	41.7 Å²	41.7	25%	0.245	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	161.3	-179.9	62.1	0	0	0	0	109.1	I37 A296 W297 F305	T29-I37 HydrophobicContact CG2-CG2 4.02Å; T29-A296 HydrophobicContact CG2-CB 4.14Å; T29-W297 WeakPolarHBondContact CB-O 3.4Å; T29-W297 VanDerWaalsContact CG2-O 3.32Å; T29-W297 WeakPolarHBondContact CG2-O 3.5Å; T29-W297 PolarHBondContact OG1-O 2.9Å; T29-F305 HydrophobicContact CG2-CD2 3.85Å; T29-F305 HydrophobicContact CG2-CE2 3.98Å
30	T	93.6	Very high	95.2	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.018	21%	0.214	C	C	.	.			trans	-134	139	176	174.3	0	0	0	0	110.7	Q32 Y33 M36 I77	T30-Q32 VanDerWaalsContact C-N 3.27Å; T30-Q32 PolarHBondContact O-N 2.83Å; T30-Q32 PolarHBondContact OG1-N 2.9Å; T30-Y33 HydrophobicContact CG2-CD2 4.34Å; T30-Y33 CarbonylContact O-C 3.6Å; T30-M36 HydrophobicContact CG2-CE 3.75Å; T30-I77 HydrophobicContact CG2-CD1 4.1Å; T30-I77 HydrophobicContact CG2-CG2 4.35Å
31	P	90.3	Very high	95.3	Very high	100 Å²	100	38.7 Å²	38.7	65%	0.649	21%	0.211	S	C	*	.	S	Bend	trans	-64.9	-28.4	173.3	-21.2	33.3	0	0	0	114	A299	P31-A299 VanDerWaalsContact CA-CB 3.47Å; P31-A299 HydrophobicContact CB-CB 3.84Å; P31-A299 HydrophobicContact CG-CB 3.98Å
32	Q	91.4	Very high	95.4	Very high	120 Å²	120	37.9 Å²	37.9	56%	0.561	19%	0.193	S	C	*	.	S	Bend	trans	-74.1	-31.9	-175	-170.2	59.9	28.6	0	0	112.6	T30	T30-Q32 VanDerWaalsContact C-N 3.27Å; T30-Q32 PolarHBondContact O-N 2.83Å; T30-Q32 PolarHBondContact OG1-N 2.9Å
33	Y	92.8	Very high	95.5	Very high	94 Å²	94	38.7 Å²	38.7	37%	0.369	20%	0.195	S	C	.	.			trans	-129.2	79.7	-179.9	-60.1	-69.3	0	0	0	109.7	T30 D35 M36 Q82	T30-Y33 HydrophobicContact CG2-CD2 4.34Å; T30-Y33 CarbonylContact O-C 3.6Å; Y33-D35 PolarHBondContact O-N 2.95Å; Y33-D35 VanDerWaalsContact O-N 3.11Å; Y33-M36 HydrophobicContact CD2-CE 4.08Å; Y33-M36 HydrophobicContact CG-CE 4.45Å; Y33-M36 PolarHBondContact O-N 3.25Å; Y33-Q82 PolarHBondContact OH-NE2 3.39Å
34	P	91.1	Very high	95.5	Very high	73 Å²	73	38.8 Å²	38.8	47%	0.474	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.9	-175.7	27.1	-36	0	0	0	113.5	M36 R53	P34-M36 VanDerWaalsContact C-N 3.33Å; P34-R53 PolarHBondContact O-NH2 2.79Å
35	D	92.8	Very high	95.4	Very high	74 Å²	74	39 Å²	39	40%	0.396	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	3.9	176.6	-59	-23.5	0	0	0	112.8	Y33 K50 L51 R53	Y33-D35 PolarHBondContact O-N 2.95Å; Y33-D35 VanDerWaalsContact O-N 3.11Å; D35-K50 CarbonylContact O-C 3.6Å; D35-K50 WeakPolarHBondContact O-CA 3.37Å; D35-L51 WeakPolarHBondContact O-CG 3.15Å; D35-L51 PolarHBondContact O-N 3.38Å; D35-R53 IonicContact OD1-CZ 2.86Å; D35-R53 IonicContact OD1-NH1 2.74Å; D35-R53 PolarHBondContact OD1-NH1 3.27Å; D35-R53 IonicContact OD1-NH2 3.24Å; D35-R53 PolarHBondContact OD1-NH2 3.04Å
36	M	94.6	Very high	95.4	Very high	22 Å²	22	37.9 Å²	37.9	11%	0.108	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	130.9	179.5	-174.7	-179.6	70.6	0	0	110.5	T30 Y33 P34 M48 W49 L98	T30-M36 HydrophobicContact CG2-CE 3.75Å; Y33-M36 HydrophobicContact CD2-CE 4.08Å; Y33-M36 HydrophobicContact CG-CE 4.45Å; Y33-M36 PolarHBondContact O-N 3.25Å; P34-M36 VanDerWaalsContact C-N 3.33Å; M36-M48 HydrophobicContact CG-CG 3.91Å; M36-M48 HydrophobicContact CG-SD 4.42Å; M36-M48 HydrophobicContact SD-CG 3.92Å; M36-M48 HydrophobicContact SD-SD 3.66Å; M36-M48 VanDerWaalsContact SD-SD 3.66Å; M36-W49 WeakPolarHBondContact CA-O 3.48Å; M36-L98 HydrophobicContact CE-CD1 3.66Å; M36-L98 HydrophobicContact SD-CD1 4.23Å
37	I	96.3	Very high	95.4	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151	168.3	68.2	164.3	0	0	0	109.9	L17 I27 T29 W49 L51 F305	L17-I37 HydrophobicContact CD1-CD1 3.42Å; L17-I37 VanDerWaalsContact CD1-CD1 3.42Å; L17-I37 HydrophobicContact CD1-CG1 4.42Å; I27-I37 HydrophobicContact CG2-CD1 4.48Å; T29-I37 HydrophobicContact CG2-CG2 4.02Å; I37-W49 HydrophobicContact CD1-CB 4.37Å; I37-W49 HydrophobicContact CD1-CG 4.29Å; I37-W49 HydrophobicContact CG1-CB 3.64Å; I37-W49 HydrophobicContact CG1-CG 3.9Å; I37-W49 PolarHBondContact N-O 2.96Å; I37-W49 PolarHBondContact O-N 3.07Å; I37-L51 HydrophobicContact CD1-CD2 4.18Å; I37-L51 HydrophobicContact CG1-CD2 4.08Å; I37-L51 HydrophobicContact CG2-CD1 3.92Å; I37-L51 HydrophobicContact CG2-CD2 4.38Å; I37-L51 HydrophobicContact CG2-CG 4.36Å; I37-F305 HydrophobicContact CD1-CD1 3.95Å; I37-F305 HydrophobicContact CD1-CE1 4.14Å; I37-F305 HydrophobicContact CD1-CG 4.41Å; I37-F305 HydrophobicContact CG2-CD2 4.42Å; I37-F305 HydrophobicContact CG2-CE1 4.37Å; I37-F305 HydrophobicContact CG2-CE2 3.96Å; I37-F305 HydrophobicContact CG2-CZ 3.95Å
38	L	97.4	Very high	95.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.9	171.1	-59.9	-173.1	0	0	0	109.9	I27 A28 I46 I47 M48 V75 I77 A84 L98	I27-L38 CarbonylContact C-O 3.52Å; I27-L38 WeakPolarHBondContact CA-O 3.44Å; A28-L38 PolarHBondContact N-O 3.29Å; A28-L38 PolarHBondContact O-N 2.87Å; L38-I46 HydrophobicContact CB-CG2 4.27Å; L38-I47 WeakPolarHBondContact CA-O 3.47Å; L38-M48 HydrophobicContact CD2-CB 3.56Å; L38-M48 HydrophobicContact CD2-CG 3.62Å; L38-M48 HydrophobicContact CD2-SD 4.47Å; L38-V75 HydrophobicContact CB-CG2 4.37Å; L38-V75 HydrophobicContact CD1-CG2 4.29Å; L38-I77 HydrophobicContact CB-CD1 4.28Å; L38-I77 HydrophobicContact CB-CG1 4.47Å; L38-I77 HydrophobicContact CD1-CD1 3.91Å; L38-I77 HydrophobicContact CD1-CG1 3.59Å; L38-I77 HydrophobicContact CG-CD1 3.73Å; L38-I77 HydrophobicContact CG-CG1 3.98Å; L38-A84 HydrophobicContact CD1-CB 3.3Å; L38-L98 HydrophobicContact CD1-CD1 4.09Å; L38-L98 HydrophobicContact CD1-CD2 3.83Å; L38-L98 HydrophobicContact CD2-CD2 3.9Å; L38-L98 HydrophobicContact CG-CD2 4.5Å
39	S	97.6	Very high	95.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	133.2	172.4	57.8	0	0	0	0	111.4	H20 Q26 I46 I47 W49 I313	H20-S39 PolarHBondContact NE2-OG 2.98Å; Q26-S39 CarbonylContact O-C 3.58Å; Q26-S39 VanDerWaalsContact O-CA 3.28Å; Q26-S39 WeakPolarHBondContact O-CA 3.46Å; S39-I46 CarbonylContact O-C 3.59Å; S39-I46 WeakPolarHBondContact O-CA 3.49Å; S39-I46 WeakPolarHBondContact O-CG2 3.26Å; S39-I47 PolarHBondContact N-O 2.51Å; S39-I47 PolarHBondContact O-N 3.03Å; S39-W49 PolarHBondContact OG-NE1 2.96Å; S39-I313 WeakPolarHBondContact OG-CD1 3.44Å
40	A	97.8	Very high	95.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	149.4	171.6	0	0	0	0	0	110.3	V24 T25 Q26 I46 V72 V75	V24-A40 CarbonylContact C-O 3.58Å; V24-A40 WeakPolarHBondContact CA-O 3.4Å; T25-A40 PolarHBondContact N-O 3.35Å; T25-A40 VanDerWaalsContact OG1-C 3.25Å; T25-A40 WeakPolarHBondContact OG1-CB 3.47Å; T25-A40 PolarHBondContact OG1-O 3.44Å; Q26-A40 HydrophobicContact CB-CB 4.27Å; Q26-A40 PolarHBondContact O-N 3.11Å; A40-I46 HydrophobicContact CB-CG1 4.46Å; A40-V72 HydrophobicContact CB-CB 3.99Å; A40-V72 HydrophobicContact CB-CG1 3.6Å; A40-V75 HydrophobicContact CB-CB 4Å; A40-V75 HydrophobicContact CB-CG1 3.78Å
41	S	97.9	Very high	95.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	161.3	178.1	175.6	0	0	0	0	113.6	H20 G22 W23 D43 K44 S45 V72	H20-S41 WeakPolarHBondContact CE1-CB 3.32Å; H20-S41 WeakPolarHBondContact ND1-CB 3.43Å; G22-S41 PolarHBondContact O-OG 3.31Å; W23-S41 WeakPolarHBondContact O-CA 3.42Å; W23-S41 WeakPolarHBondContact O-CB 3.48Å; W23-S41 PolarHBondContact O-OG 3.31Å; W23-S41 VanDerWaalsContact O-OG 3.05Å; S41-D43 WeakPolarHBondContact CB-OD1 3.4Å; S41-D43 PolarHBondContact O-N 3.06Å; S41-D43 PolarHBondContact OG-N 2.77Å; S41-D43 VanDerWaalsContact OG-N 3.13Å; S41-D43 PolarHBondContact OG-OD2 2.88Å; S41-K44 PolarHBondContact O-N 3.49Å; S41-S45 PolarHBondContact N-O 2.99Å; S41-V72 PolarHBondContact O-N 2.99Å
42	R	96.6	Very high	95.3	Very high	80 Å²	80	37.6 Å²	37.6	30%	0.302	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-10.4	166.7	-67.6	-167.5	177.4	-179.1	1.1	113.7	W23 T25 K44 F71	W23-R42 HydrophobicContact CB-CG 4.14Å; W23-R42 VanDerWaalsContact CE3-NH1 3.33Å; W23-R42 PolarHBondContact O-N 2.82Å; T25-R42 HydrophobicContact CG2-CG 3.86Å; R42-K44 PolarHBondContact O-N 2.75Å; R42-K44 VanDerWaalsContact O-N 3.13Å; R42-F71 HydrophobicContact CB-CB 4.45Å; R42-F71 HydrophobicContact CB-CD1 3.81Å; R42-F71 HydrophobicContact CB-CE1 4.17Å; R42-F71 HydrophobicContact CB-CG 4.02Å; R42-F71 HydrophobicContact CG-CB 4.17Å; R42-F71 HydrophobicContact CG-CD1 4.23Å; R42-F71 HydrophobicContact CG-CD2 4.14Å; R42-F71 HydrophobicContact CG-CG 3.92Å; R42-F71 WeakPolarHBondContact O-CD1 3.2Å; R42-F71 WeakPolarHBondContact O-CE1 3.21Å
43	D	95.6	Very high	95.2	Very high	28 Å²	28	37.2 Å²	37.2	15%	0.15	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	1.8	169.7	67.2	23.4	0	0	0	114.2	H20 S21 S41 S45	H20-D43 WeakPolarHBondContact CA-OD2 3.47Å; H20-D43 IonicContact CE1-OD2 2.65Å; H20-D43 IonicContact CG-OD2 3.95Å; H20-D43 IonicContact ND1-OD1 2.83Å; H20-D43 IonicContact ND1-OD2 3.96Å; H20-D43 PolarHBondContact ND1-OD2 3.09Å; S21-D43 PolarHBondContact N-OD2 2.9Å; S21-D43 VanDerWaalsContact N-OD2 3.13Å; S21-D43 WeakPolarHBondContact OG-CB 3.48Å; S41-D43 WeakPolarHBondContact CB-OD1 3.4Å; S41-D43 PolarHBondContact O-N 3.06Å; S41-D43 PolarHBondContact OG-N 2.77Å; S41-D43 VanDerWaalsContact OG-N 3.13Å; S41-D43 PolarHBondContact OG-OD2 2.88Å; D43-S45 VanDerWaalsContact CG-OG 3.31Å; D43-S45 PolarHBondContact O-N 2.84Å; D43-S45 WeakPolarHBondContact OD1-CA 3.38Å; D43-S45 WeakPolarHBondContact OD1-CB 3.47Å; D43-S45 PolarHBondContact OD1-N 2.89Å; D43-S45 PolarHBondContact OD1-OG 3.2Å
44	K	96.4	Very high	94.7	Very high	103 Å²	103	36.9 Å²	36.9	45%	0.448	18%	0.178	S	C	.	.	S	Bend	trans	72.9	11.7	178.9	-44.8	171.5	-77.4	-174.7	0	113.2	S41 R42 S69	S41-K44 PolarHBondContact O-N 3.49Å; R42-K44 PolarHBondContact O-N 2.75Å; R42-K44 VanDerWaalsContact O-N 3.13Å; K44-S69 WeakPolarHBondContact CD-O 3.48Å
45	S	96	Very high	93.7	Very high	6 Å²	6	42 Å²	42	4%	0.042	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	158.8	176.8	78.9	0	0	0	0	111.7	S41 D43 L65	S41-S45 PolarHBondContact N-O 2.99Å; D43-S45 VanDerWaalsContact CG-OG 3.31Å; D43-S45 PolarHBondContact O-N 2.84Å; D43-S45 WeakPolarHBondContact OD1-CA 3.38Å; D43-S45 WeakPolarHBondContact OD1-CB 3.47Å; D43-S45 PolarHBondContact OD1-N 2.89Å; D43-S45 PolarHBondContact OD1-OG 3.2Å; S45-L65 WeakPolarHBondContact CA-O 3.38Å
46	I	97.5	Very high	92.8	Very high	1 Å²	1	44 Å²	44	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.2	164.6	-58.8	135.8	0	0	0	106.4	L38 S39 A40 L65 V72 V75 S86 W96	L38-I46 HydrophobicContact CB-CG2 4.27Å; S39-I46 CarbonylContact O-C 3.59Å; S39-I46 WeakPolarHBondContact O-CA 3.49Å; S39-I46 WeakPolarHBondContact O-CG2 3.26Å; A40-I46 HydrophobicContact CB-CG1 4.46Å; I46-L65 HydrophobicContact CB-CB 4.14Å; I46-L65 HydrophobicContact CB-CD1 4.18Å; I46-L65 HydrophobicContact CG2-CD1 4.12Å; I46-L65 PolarHBondContact N-O 2.8Å; I46-L65 PolarHBondContact O-N 2.89Å; I46-V72 HydrophobicContact CD1-CG1 4.24Å; I46-V72 HydrophobicContact CG1-CG1 4.01Å; I46-V72 HydrophobicContact CG1-CG2 4.39Å; I46-V75 HydrophobicContact CG2-CG2 4.11Å; I46-S86 WeakPolarHBondContact CD1-OG 3.29Å; I46-W96 HydrophobicContact CD1-CZ2 4.28Å
47	I	97.4	Very high	92.2	Very high	8 Å²	8	47 Å²	47	4%	0.041	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129.3	176.9	-62.6	178.6	0	0	0	108.6	H20 L38 S39 W49 P61 R63	H20-I47 VanDerWaalsContact CE1-CD1 3.47Å; H20-I47 WeakPolarHBondContact CE1-CD1 3.42Å; H20-I47 VanDerWaalsContact CE1-CG1 3.42Å; H20-I47 WeakPolarHBondContact CE1-CG1 3.32Å; H20-I47 WeakPolarHBondContact ND1-CD1 3.48Å; L38-I47 WeakPolarHBondContact CA-O 3.47Å; S39-I47 PolarHBondContact N-O 2.51Å; S39-I47 PolarHBondContact O-N 3.03Å; I47-W49 HydrophobicContact CB-CZ2 4.01Å; I47-W49 HydrophobicContact CD1-CH2 4.44Å; I47-W49 HydrophobicContact CD1-CZ2 3.98Å; I47-W49 HydrophobicContact CG2-CD2 3.78Å; I47-W49 HydrophobicContact CG2-CE3 4.39Å; I47-W49 HydrophobicContact CG2-CG 4.13Å; I47-W49 HydrophobicContact CG2-CH2 4.29Å; I47-W49 HydrophobicContact CG2-CZ2 3.66Å; I47-W49 PolarHBondContact O-NE1 2.81Å; I47-P61 HydrophobicContact CG2-CB 3.65Å; I47-R63 WeakPolarHBondContact CA-O 3.38Å
48	M	96.9	Very high	91.8	Very high	7 Å²	7	47.3 Å²	47.3	3%	0.034	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.4	166.7	-175.8	175.3	80.3	0	0	108.4	M36 L38 Q62 R63 L98	M36-M48 HydrophobicContact CG-CG 3.91Å; M36-M48 HydrophobicContact CG-SD 4.42Å; M36-M48 HydrophobicContact SD-CG 3.92Å; M36-M48 HydrophobicContact SD-SD 3.66Å; M36-M48 VanDerWaalsContact SD-SD 3.66Å; L38-M48 HydrophobicContact CD2-CB 3.56Å; L38-M48 HydrophobicContact CD2-CG 3.62Å; L38-M48 HydrophobicContact CD2-SD 4.47Å; M48-Q62 HydrophobicContact CE-CB 4.14Å; M48-Q62 HydrophobicContact CE-CG 3.88Å; M48-Q62 WeakPolarHBondContact O-CA 3.21Å; M48-Q62 WeakPolarHBondContact O-CB 3.47Å; M48-Q62 PolarHBondContact O-N 3.05Å; M48-R63 HydrophobicContact CB-CB 4.27Å; M48-R63 HydrophobicContact CE-CB 3.93Å; M48-R63 PolarHBondContact N-O 3.22Å; M48-R63 PolarHBondContact O-N 2.91Å; M48-L98 HydrophobicContact SD-CB 4.23Å; M48-L98 HydrophobicContact SD-CD2 4.18Å
49	W	96.2	Very high	91.5	Very high	1 Å²	1	47.6 Å²	47.6	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	143	-178.7	-53.1	80.2	0	0	0	110.2	L17 K18 H20 M36 I37 S39 I47 I60 P61 I313	L17-W49 HydrophobicContact CB-CD2 4.27Å; L17-W49 HydrophobicContact CB-CE3 3.84Å; L17-W49 HydrophobicContact CB-CH2 3.97Å; L17-W49 HydrophobicContact CB-CZ2 4.38Å; L17-W49 HydrophobicContact CB-CZ3 3.68Å; L17-W49 HydrophobicContact CD1-CD2 4.16Å; L17-W49 HydrophobicContact CD1-CE3 4.33Å; L17-W49 HydrophobicContact CD1-CG 4.3Å; L17-W49 HydrophobicContact CD2-CE3 4.32Å; L17-W49 HydrophobicContact CG-CE3 4.41Å; K18-W49 WeakPolarHBondContact O-CH2 3.49Å; K18-W49 WeakPolarHBondContact O-CZ3 3.27Å; H20-W49 AromaticContact CD2-CZ2 3.93Å; M36-W49 WeakPolarHBondContact CA-O 3.48Å; I37-W49 HydrophobicContact CD1-CB 4.37Å; I37-W49 HydrophobicContact CD1-CG 4.29Å; I37-W49 HydrophobicContact CG1-CB 3.64Å; I37-W49 HydrophobicContact CG1-CG 3.9Å; I37-W49 PolarHBondContact N-O 2.96Å; I37-W49 PolarHBondContact O-N 3.07Å; S39-W49 PolarHBondContact OG-NE1 2.96Å; I47-W49 HydrophobicContact CB-CZ2 4.01Å; I47-W49 HydrophobicContact CD1-CH2 4.44Å; I47-W49 HydrophobicContact CD1-CZ2 3.98Å; I47-W49 HydrophobicContact CG2-CD2 3.78Å; I47-W49 HydrophobicContact CG2-CE3 4.39Å; I47-W49 HydrophobicContact CG2-CG 4.13Å; I47-W49 HydrophobicContact CG2-CH2 4.29Å; I47-W49 HydrophobicContact CG2-CZ2 3.66Å; I47-W49 PolarHBondContact O-NE1 2.81Å; W49-I60 WeakPolarHBondContact CA-O 3.21Å; W49-P61 HydrophobicContact CE3-CB 4Å; W49-P61 HydrophobicContact CH2-CB 4.33Å; W49-P61 HydrophobicContact CZ3-CB 3.86Å; W49-P61 HydrophobicContact CZ3-CG 4.13Å; W49-I313 HydrophobicContact CZ2-CD1 4.01Å
50	K	94.8	Very high	91.2	Very high	109 Å²	109	51.7 Å²	51.7	47%	0.474	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	118.2	165	-176.9	175	178.2	179.8	0	108.5	D35 T52 G59 I60 Q62	D35-K50 CarbonylContact O-C 3.6Å; D35-K50 WeakPolarHBondContact O-CA 3.37Å; K50-T52 PolarHBondContact O-N 2.76Å; K50-G59 CarbonylContact O-C 3.54Å; K50-G59 WeakPolarHBondContact O-CA 3.43Å; K50-I60 HydrophobicContact CB-CG1 4.22Å; K50-I60 PolarHBondContact N-O 3.45Å; K50-I60 PolarHBondContact O-N 2.5Å; K50-Q62 HydrophobicContact CB-CB 4.36Å
51	L	93.9	Very high	91.1	Very high	8 Å²	8	55 Å²	55	4%	0.042	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	116.8	178.1	-53.9	-178.7	0	0	0	109	L17 D35 I37 Y58 F305	L17-L51 HydrophobicContact CD1-CD2 4.33Å; D35-L51 WeakPolarHBondContact O-CG 3.15Å; D35-L51 PolarHBondContact O-N 3.38Å; I37-L51 HydrophobicContact CD1-CD2 4.18Å; I37-L51 HydrophobicContact CG1-CD2 4.08Å; I37-L51 HydrophobicContact CG2-CD1 3.92Å; I37-L51 HydrophobicContact CG2-CD2 4.38Å; I37-L51 HydrophobicContact CG2-CG 4.36Å; L51-Y58 HydrophobicContact CB-CE1 4.36Å; L51-Y58 HydrophobicContact CD1-CE1 4.11Å; L51-Y58 HydrophobicContact CD2-CD1 3.89Å; L51-Y58 HydrophobicContact CD2-CE1 3.93Å; L51-Y58 HydrophobicContact CG-CE1 4.36Å; L51-F305 HydrophobicContact CD1-CE1 4.2Å; L51-F305 HydrophobicContact CD1-CZ 3.72Å; L51-F305 HydrophobicContact CD2-CE1 4.25Å
52	T	90.3	Very high	90.8	Very high	54 Å²	54	60.3 Å²	60.3	33%	0.331	30%	0.299	S	S	.	.			trans	-94.7	-19.7	171.3	56.7	0	0	0	0	111.4	K50 D54 N57 Y58	K50-T52 PolarHBondContact O-N 2.76Å; T52-D54 VanDerWaalsContact CB-OD2 3.23Å; T52-D54 WeakPolarHBondContact CB-OD2 3.39Å; T52-D54 PolarHBondContact O-N 3.13Å; T52-D54 PolarHBondContact OG1-OD2 2.94Å; T52-N57 PolarHBondContact OG1-O 3.31Å; T52-Y58 PolarHBondContact N-O 3.17Å
53	R	88.3	Confident	90.7	Very high	112 Å²	112	61 Å²	61	42%	0.423	30%	0.302	S	S	.	.			trans	59.7	28.4	-177	-51.6	-171.4	179.2	82	4	113.5	P34 D35 Y58	P34-R53 PolarHBondContact O-NH2 2.79Å; D35-R53 IonicContact OD1-CZ 2.86Å; D35-R53 IonicContact OD1-NH1 2.74Å; D35-R53 PolarHBondContact OD1-NH1 3.27Å; D35-R53 IonicContact OD1-NH2 3.24Å; D35-R53 PolarHBondContact OD1-NH2 3.04Å; R53-Y58 HydrophobicContact CB-CE2 4.15Å; R53-Y58 HydrophobicContact CG-CE1 4.19Å; R53-Y58 HydrophobicContact CG-CE2 4.12Å; R53-Y58 PolarHBondContact N-O 2.97Å
54	D	82.3	Confident	90.6	Very high	87 Å²	87	62 Å²	62	47%	0.465	31%	0.311	S	S	.	.			trans	-72.8	152.7	173.6	-55.5	-46.2	0	0	0	110.8	T52 T56 N57	T52-D54 VanDerWaalsContact CB-OD2 3.23Å; T52-D54 WeakPolarHBondContact CB-OD2 3.39Å; T52-D54 PolarHBondContact O-N 3.13Å; T52-D54 PolarHBondContact OG1-OD2 2.94Å; D54-T56 VanDerWaalsContact C-N 3.27Å; D54-T56 PolarHBondContact O-N 2.86Å; D54-N57 CarbonylContact O-C 3.53Å
55	E	71.9	Confident	90.5	Very high	182 Å²	182	57.2 Å²	57.2	85%	0.85	29%	0.29	S	S	*	.	S	Bend	trans	-66	-26.3	-175.5	-63.8	-174.9	163.4	0	0	113.8
56	T	73	Confident	90.5	Very high	114 Å²	114	66.2 Å²	66.2	70%	0.699	32%	0.323	S	S	*	.	S	Bend	trans	-97.1	-42.9	-177.1	52.5	0	0	0	0	112.6	D54	D54-T56 VanDerWaalsContact C-N 3.27Å; D54-T56 PolarHBondContact O-N 2.86Å
57	N	81.2	Confident	90.2	Very high	87 Å²	87	67.8 Å²	67.8	47%	0.465	34%	0.339	S	S	.	.			trans	-129.5	103.2	176.7	-70.5	-33.1	0	0	0	108.3	T52 D54 G59	T52-N57 PolarHBondContact OG1-O 3.31Å; D54-N57 CarbonylContact O-C 3.53Å; N57-G59 PolarHBondContact O-N 3.32Å
58	Y	88.4	Confident	90.2	Very high	6 Å²	6	67.9 Å²	67.9	2%	0.024	34%	0.34	C	S	.	.	S	Bend	trans	-62.1	-21	-176.1	-167.5	-89.9	0	0	0	112.8	R14 L17 L51 T52 R53 F305 V315	R14-Y58 HydrophobicContact CB-CD2 4.11Å; R14-Y58 HydrophobicContact CB-CE2 4.14Å; L17-Y58 HydrophobicContact CD2-CD1 4.45Å; L51-Y58 HydrophobicContact CB-CE1 4.36Å; L51-Y58 HydrophobicContact CD1-CE1 4.11Å; L51-Y58 HydrophobicContact CD2-CD1 3.89Å; L51-Y58 HydrophobicContact CD2-CE1 3.93Å; L51-Y58 HydrophobicContact CG-CE1 4.36Å; T52-Y58 PolarHBondContact N-O 3.17Å; R53-Y58 HydrophobicContact CB-CE2 4.15Å; R53-Y58 HydrophobicContact CG-CE1 4.19Å; R53-Y58 HydrophobicContact CG-CE2 4.12Å; R53-Y58 PolarHBondContact N-O 2.97Å; Y58-F305 HydrophobicContact CD1-CE1 4.44Å; Y58-F305 AromaticContact CE1-CE1 3.94Å; Y58-F305 HydrophobicContact CE1-CE1 3.94Å; Y58-F305 HydrophobicContact CE1-CZ 4.36Å; Y58-V315 HydrophobicContact CD1-CB 4.23Å; Y58-V315 HydrophobicContact CD1-CG1 3.9Å; Y58-V315 HydrophobicContact CD1-CG2 3.76Å; Y58-V315 HydrophobicContact CD2-CB 4.36Å; Y58-V315 HydrophobicContact CD2-CG1 4.06Å; Y58-V315 HydrophobicContact CE1-CG1 3.7Å; Y58-V315 HydrophobicContact CE1-CG2 4.33Å; Y58-V315 HydrophobicContact CE2-CG1 3.84Å; Y58-V315 HydrophobicContact CG-CB 4.16Å; Y58-V315 HydrophobicContact CG-CG1 4.08Å; Y58-V315 HydrophobicContact CG-CG2 3.93Å
59	G	90.8	Very high	90.1	Very high	6 Å²	6	71.9 Å²	71.9	6%	0.062	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	166.8	177	0	0	0	0	0	112.4	L17 K50 N57	L17-G59 VanDerWaalsContact CD2-CA 3.44Å; L17-G59 WeakPolarHBondContact CD2-O 3.33Å; K50-G59 CarbonylContact O-C 3.54Å; K50-G59 WeakPolarHBondContact O-CA 3.43Å; N57-G59 PolarHBondContact O-N 3.32Å
60	I	93	Very high	90.1	Very high	86 Å²	86	75.4 Å²	75.4	44%	0.441	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.4	-177.3	55	171.9	0	0	0	110.7	W49 K50 Q62	W49-I60 WeakPolarHBondContact CA-O 3.21Å; K50-I60 HydrophobicContact CB-CG1 4.22Å; K50-I60 PolarHBondContact N-O 3.45Å; K50-I60 PolarHBondContact O-N 2.5Å; I60-Q62 PolarHBondContact O-N 2.93Å; I60-Q62 VanDerWaalsContact O-N 3.16Å
61	P	94.4	Very high	90.2	Very high	69 Å²	69	73.1 Å²	73.1	45%	0.448	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	111.7	173.5	29.3	-32.2	0	0	0	108.7	I47 W49	I47-P61 HydrophobicContact CG2-CB 3.65Å; W49-P61 HydrophobicContact CE3-CB 4Å; W49-P61 HydrophobicContact CH2-CB 4.33Å; W49-P61 HydrophobicContact CZ3-CB 3.86Å; W49-P61 HydrophobicContact CZ3-CG 4.13Å
62	Q	92.7	Very high	90.4	Very high	112 Å²	112	72.8 Å²	72.8	52%	0.523	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-39	-179.6	-174.7	177.7	-11.3	0	0	111.4	M48 K50 I60	M48-Q62 HydrophobicContact CE-CB 4.14Å; M48-Q62 HydrophobicContact CE-CG 3.88Å; M48-Q62 WeakPolarHBondContact O-CA 3.21Å; M48-Q62 WeakPolarHBondContact O-CB 3.47Å; M48-Q62 PolarHBondContact O-N 3.05Å; K50-Q62 HydrophobicContact CB-CB 4.36Å; I60-Q62 PolarHBondContact O-N 2.93Å; I60-Q62 VanDerWaalsContact O-N 3.16Å
63	R	93.1	Very high	90.7	Very high	96 Å²	96	71 Å²	71	36%	0.362	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	144.6	-178.5	-163.7	176.3	-64.1	-129.3	9.4	111.9	I47 M48 L65 T99 T100	I47-R63 WeakPolarHBondContact CA-O 3.38Å; M48-R63 HydrophobicContact CB-CB 4.27Å; M48-R63 HydrophobicContact CE-CB 3.93Å; M48-R63 PolarHBondContact N-O 3.22Å; M48-R63 PolarHBondContact O-N 2.91Å; R63-L65 HydrophobicContact CG-CD2 4.4Å; R63-T99 PolarHBondContact NH2-O 2.83Å; R63-T99 VanDerWaalsContact NH2-O 3.09Å; R63-T100 PolarHBondContact NH1-O 3.05Å
64	S	94.4	Very high	91.2	Very high	49 Å²	49	65.9 Å²	65.9	34%	0.343	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	114.4	169.5	-178.5	0	0	0	0	108.9	R66	S64-R66 PolarHBondContact OG-NE 2.89Å
65	L	95	Very high	91.9	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	113.1	173.7	-52	176.2	0	0	0	107.8	S45 I46 R63 W96 L98 G101	S45-L65 WeakPolarHBondContact CA-O 3.38Å; I46-L65 HydrophobicContact CB-CB 4.14Å; I46-L65 HydrophobicContact CB-CD1 4.18Å; I46-L65 HydrophobicContact CG2-CD1 4.12Å; I46-L65 PolarHBondContact N-O 2.8Å; I46-L65 PolarHBondContact O-N 2.89Å; R63-L65 HydrophobicContact CG-CD2 4.4Å; L65-W96 HydrophobicContact CB-CD2 4.09Å; L65-W96 HydrophobicContact CB-CE3 3.83Å; L65-W96 HydrophobicContact CB-CH2 4.39Å; L65-W96 HydrophobicContact CB-CZ3 3.98Å; L65-W96 HydrophobicContact CD1-CB 3.97Å; L65-W96 HydrophobicContact CD1-CD2 4.19Å; L65-W96 HydrophobicContact CD1-CE3 4.46Å; L65-W96 HydrophobicContact CD1-CG 3.97Å; L65-W96 HydrophobicContact CD2-CE3 4.31Å; L65-W96 HydrophobicContact CG-CE3 4.43Å; L65-L98 HydrophobicContact CD1-CD2 4.06Å; L65-G101 VanDerWaalsContact CD2-CA 3.49Å; L65-G101 WeakPolarHBondContact CD2-O 3.44Å
66	R	94.4	Very high	93.1	Very high	196 Å²	196	54.8 Å²	54.8	74%	0.74	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	141.7	-176.2	-64.3	-174	176.9	-157.1	-2.1	110.4	S64 W96	S64-R66 PolarHBondContact OG-NE 2.89Å; R66-W96 WeakPolarHBondContact O-CH2 3.18Å
67	G	92.7	Very high	94.1	Very high	34 Å²	34	50.1 Å²	50.1	35%	0.351	26%	0.262	S	S	.	.			trans	160.3	-24.2	175.4	0	0	0	0	0	114.3	R94	G67-R94 PolarHBondContact O-NH2 2.84Å
68	H	95.7	Very high	94.7	Very high	10 Å²	10	46.2 Å²	46.2	5%	0.046	24%	0.241	C	C	.	.			trans	-63.5	139.3	169.8	-79.1	-63.3	0	0	0	111.1	V72 S86 A88 D90 W96	H68-V72 HydrophobicContact CB-CG2 4.06Å; H68-S86 PolarHBondContact NE2-OG 3.45Å; H68-A88 HydrophobicContact CB-CB 4.13Å; H68-A88 VanDerWaalsContact CE1-CB 3.45Å; H68-A88 WeakPolarHBondContact CE1-CB 3.46Å; H68-A88 WeakPolarHBondContact ND1-CB 3.46Å; H68-D90 WeakPolarHBondContact CA-OD2 3.3Å; H68-D90 IonicContact CE1-OD2 3.54Å; H68-D90 IonicContact CG-OD2 3.73Å; H68-D90 IonicContact ND1-OD1 3.75Å; H68-D90 IonicContact ND1-OD2 3.33Å; H68-D90 PolarHBondContact ND1-OD2 2.78Å; H68-W96 AromaticContact CD2-CZ2 3.97Å
69	S	95.4	Very high	94.6	Very high	90 Å²	90	49.4 Å²	49.4	63%	0.629	27%	0.265	S	S	*	.	S	Bend	trans	-88.4	-14.4	-179.9	61.6	0	0	0	0	112.7	K44 D90	K44-S69 WeakPolarHBondContact CD-O 3.48Å; S69-D90 PolarHBondContact N-OD2 3.49Å; S69-D90 VanDerWaalsContact N-OD2 3.11Å; S69-D90 WeakPolarHBondContact OG-CB 3.33Å
70	H	96.6	Very high	94.5	Very high	75 Å²	75	52.3 Å²	52.3	35%	0.347	28%	0.279	S	S	.	.	S	Bend	trans	-135.2	-179.1	177.4	-148.1	-80.9	0	0	0	111.6	V72 W89 D90	H70-V72 PolarHBondContact O-N 3.49Å; H70-W89 HydrophobicContact CB-CB 3.98Å; H70-W89 AromaticContact CE1-CE3 3.69Å; H70-W89 WeakPolarHBondContact ND1-CB 2.95Å; H70-W89 AromaticContact ND1-CE3 3.8Å; H70-D90 HydrophobicContact CB-CB 4.14Å
71	F	97.1	Very high	94.3	Very high	62 Å²	62	48.3 Å²	48.3	27%	0.272	26%	0.259	S	S	.	.			trans	-50.1	130.5	179.7	-54.5	-22.5	0	0	0	112.1	R42 A88 W89	R42-F71 HydrophobicContact CB-CB 4.45Å; R42-F71 HydrophobicContact CB-CD1 3.81Å; R42-F71 HydrophobicContact CB-CE1 4.17Å; R42-F71 HydrophobicContact CB-CG 4.02Å; R42-F71 HydrophobicContact CG-CB 4.17Å; R42-F71 HydrophobicContact CG-CD1 4.23Å; R42-F71 HydrophobicContact CG-CD2 4.14Å; R42-F71 HydrophobicContact CG-CG 3.92Å; R42-F71 WeakPolarHBondContact O-CD1 3.2Å; R42-F71 WeakPolarHBondContact O-CE1 3.21Å; F71-A88 CarbonylContact O-C 3.59Å; F71-A88 VanDerWaalsContact O-CA 3.3Å; F71-A88 WeakPolarHBondContact O-CA 3.43Å; F71-A88 WeakPolarHBondContact O-CB 3.2Å; F71-W89 HydrophobicContact CB-CD2 4.24Å; F71-W89 HydrophobicContact CB-CG 4.23Å; F71-W89 HydrophobicContact CD2-CD2 4.06Å; F71-W89 AromaticContact CD2-CE3 3.62Å; F71-W89 HydrophobicContact CD2-CE3 3.62Å; F71-W89 HydrophobicContact CD2-CH2 4.12Å; F71-W89 AromaticContact CD2-CZ3 3.66Å; F71-W89 HydrophobicContact CD2-CZ3 3.66Å; F71-W89 HydrophobicContact CE2-CE3 4.26Å; F71-W89 HydrophobicContact CE2-CZ3 4.01Å; F71-W89 HydrophobicContact CG-CE3 4.49Å; F71-W89 PolarHBondContact O-N 3.25Å
72	V	97.9	Very high	94.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	125.3	170.5	-170.2	0	0	0	0	107.1	T25 A40 S41 I46 H68 H70 G87	T25-V72 WeakPolarHBondContact CB-O 3.36Å; T25-V72 WeakPolarHBondContact CG2-O 3.33Å; T25-V72 PolarHBondContact OG1-O 2.93Å; A40-V72 HydrophobicContact CB-CB 3.99Å; A40-V72 HydrophobicContact CB-CG1 3.6Å; S41-V72 PolarHBondContact O-N 2.99Å; I46-V72 HydrophobicContact CD1-CG1 4.24Å; I46-V72 HydrophobicContact CG1-CG1 4.01Å; I46-V72 HydrophobicContact CG1-CG2 4.39Å; H68-V72 HydrophobicContact CB-CG2 4.06Å; H70-V72 PolarHBondContact O-N 3.49Å; V72-G87 WeakPolarHBondContact CG1-O 3.42Å
73	S	96.9	Very high	94.3	Very high	18 Å²	18	45.5 Å²	45.5	13%	0.126	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-36.9	-174.5	62.7	0	0	0	0	112.9	T25 G87 V114 L115	T25-S73 WeakPolarHBondContact CB-O 3.45Å; S73-G87 PolarHBondContact N-O 3.42Å; S73-G87 PolarHBondContact OG-O 2.9Å; S73-V114 PolarHBondContact OG-O 3.41Å; S73-L115 WeakPolarHBondContact CB-O 3.43Å; S73-L115 WeakPolarHBondContact OG-CA 3.41Å; S73-L115 PolarHBondContact OG-O 2.78Å
74	D	97.4	Very high	94.4	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.5	-173	-162.1	6.1	0	0	0	109.2	Q26 S86 G87 L115 S116 V117 R161	Q26-D74 WeakPolarHBondContact CG-OD1 3.11Å; D74-S86 WeakPolarHBondContact O-CA 3.43Å; D74-G87 PolarHBondContact N-O 3.06Å; D74-G87 PolarHBondContact O-N 3.18Å; D74-L115 WeakPolarHBondContact CB-O 3.14Å; D74-S116 WeakPolarHBondContact OD2-CA 3.43Å; D74-S116 WeakPolarHBondContact OD2-CB 3.45Å; D74-S116 PolarHBondContact OD2-OG 3.28Å; D74-V117 HydrophobicContact CB-CG2 4.05Å; D74-V117 PolarHBondContact OD2-N 3.05Å; D74-R161 IonicContact OD1-NH2 3.39Å; D74-R161 PolarHBondContact OD1-NH2 3.3Å; D74-R161 IonicContact OD2-CZ 2.93Å; D74-R161 IonicContact OD2-NH1 3.51Å; D74-R161 PolarHBondContact OD2-NH1 2.9Å; D74-R161 IonicContact OD2-NH2 2.91Å; D74-R161 PolarHBondContact OD2-NH2 2.78Å
75	V	97.6	Very high	94.6	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.012	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	139.3	177.3	65.2	0	0	0	0	109.4	Q26 A28 L38 A40 I46 L85	Q26-V75 HydrophobicContact CB-CG1 4.07Å; Q26-V75 HydrophobicContact CG-CG1 4.03Å; A28-V75 HydrophobicContact CB-CG1 4.28Å; L38-V75 HydrophobicContact CB-CG2 4.37Å; L38-V75 HydrophobicContact CD1-CG2 4.29Å; A40-V75 HydrophobicContact CB-CB 4Å; A40-V75 HydrophobicContact CB-CG1 3.78Å; I46-V75 HydrophobicContact CG2-CG2 4.11Å; V75-L85 CarbonylContact C-O 3.56Å; V75-L85 VanDerWaalsContact CA-O 3.32Å; V75-L85 WeakPolarHBondContact CA-O 3.4Å
76	V	96.6	Very high	94.7	Very high	34 Å²	34	38.5 Å²	38.5	21%	0.206	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.4	177	62	0	0	0	0	109.6	A84 L85 V117 F119	V76-A84 WeakPolarHBondContact O-CA 3.41Å; V76-L85 HydrophobicContact CG1-CB 3.85Å; V76-L85 HydrophobicContact CG1-CD2 4.09Å; V76-L85 HydrophobicContact CG1-CG 4.4Å; V76-L85 PolarHBondContact N-O 3.39Å; V76-L85 PolarHBondContact O-N 2.92Å; V76-V117 HydrophobicContact CG1-CG2 4.15Å; V76-F119 HydrophobicContact CB-CD2 4.45Å; V76-F119 HydrophobicContact CG1-CD2 3.57Å; V76-F119 HydrophobicContact CG1-CE2 4.06Å; V76-F119 HydrophobicContact CG1-CG 4.41Å; V76-F119 HydrophobicContact CG2-CD2 4.2Å
77	I	95.4	Very high	94.8	Very high	16 Å²	16	29.2 Å²	29.2	8%	0.082	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	142.2	177.2	-51.1	177.9	0	0	0	108.4	A28 T30 L38 F83 L98	A28-I77 HydrophobicContact CB-CD1 4.17Å; A28-I77 HydrophobicContact CB-CG1 3.82Å; T30-I77 HydrophobicContact CG2-CD1 4.1Å; T30-I77 HydrophobicContact CG2-CG2 4.35Å; L38-I77 HydrophobicContact CB-CD1 4.28Å; L38-I77 HydrophobicContact CB-CG1 4.47Å; L38-I77 HydrophobicContact CD1-CD1 3.91Å; L38-I77 HydrophobicContact CD1-CG1 3.59Å; L38-I77 HydrophobicContact CG-CD1 3.73Å; L38-I77 HydrophobicContact CG-CG1 3.98Å; I77-F83 WeakPolarHBondContact CG2-O 3.06Å; I77-L98 HydrophobicContact CG2-CD1 4.24Å
78	S	92.9	Very high	95	Very high	4 Å²	4	27.6 Å²	27.6	3%	0.028	15%	0.153	C	C	.	.			trans	-64	155.2	169.2	52	0	0	0	0	111.3	D80 G81 F83	S78-D80 VanDerWaalsContact CB-OD1 3.29Å; S78-D80 WeakPolarHBondContact CB-OD1 3.45Å; S78-D80 PolarHBondContact O-N 3.17Å; S78-D80 VanDerWaalsContact O-N 3.17Å; S78-D80 PolarHBondContact OG-OD1 2.79Å; S78-G81 PolarHBondContact O-N 3.42Å; S78-F83 PolarHBondContact N-O 3.1Å; S78-F83 PolarHBondContact OG-N 2.87Å; S78-F83 PolarHBondContact OG-O 2.98Å; S78-F83 VanDerWaalsContact OG-O 3.07Å
79	S	87.4	Confident	95.1	Very high	74 Å²	74	29.8 Å²	29.8	52%	0.517	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.4	-178.8	59.7	0	0	0	0	114	G81 N123	S79-G81 VanDerWaalsContact C-N 3.3Å; S79-N123 PolarHBondContact N-ND2 3.35Å; S79-N123 PolarHBondContact N-OD1 2.77Å; S79-N123 VanDerWaalsContact N-OD1 3.13Å; S79-N123 PolarHBondContact OG-ND2 3.1Å; S79-N123 PolarHBondContact OG-OD1 3.25Å
80	D	87.5	Confident	95	Very high	66 Å²	66	27.2 Å²	27.2	35%	0.353	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-8	173.3	64.8	9.2	0	0	0	114	S78 Q82	S78-D80 VanDerWaalsContact CB-OD1 3.29Å; S78-D80 WeakPolarHBondContact CB-OD1 3.45Å; S78-D80 PolarHBondContact O-N 3.17Å; S78-D80 VanDerWaalsContact O-N 3.17Å; S78-D80 PolarHBondContact OG-OD1 2.79Å; D80-Q82 HydrophobicContact CB-CG 4.36Å; D80-Q82 PolarHBondContact O-N 3.08Å; D80-Q82 PolarHBondContact OD1-N 2.88Å
81	G	89.7	Confident	94.9	Very high	2 Å²	2	24 Å²	24	2%	0.021	13%	0.127	C	C	.	.	S	Bend	trans	69.2	8.8	-179	0	0	0	0	0	115.2	S78 S79 L98	S78-G81 PolarHBondContact O-N 3.42Å; S79-G81 VanDerWaalsContact C-N 3.3Å; G81-L98 WeakPolarHBondContact O-CD1 3.42Å
82	Q	91.9	Very high	94.9	Very high	54 Å²	54	21.7 Å²	21.7	25%	0.252	12%	0.118	S	C	.	.	S	Bend	trans	-92.2	-29.2	-177	-60.5	-55.4	-39.9	0	0	113.2	Y33 D80 L98	Y33-Q82 PolarHBondContact OH-NE2 3.39Å; D80-Q82 HydrophobicContact CB-CG 4.36Å; D80-Q82 PolarHBondContact O-N 3.08Å; D80-Q82 PolarHBondContact OD1-N 2.88Å; Q82-L98 VanDerWaalsContact O-CB 3.32Å; Q82-L98 WeakPolarHBondContact O-CB 3.37Å; Q82-L98 WeakPolarHBondContact O-CG 3.39Å; Q82-L98 PolarHBondContact O-N 2.92Å
83	F	94.8	Very high	94.9	Very high	68 Å²	68	21.7 Å²	21.7	30%	0.298	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	147.4	-175.5	-61.6	-82.6	0	0	0	111.9	I77 S78 L95 W96 D97 T104	I77-F83 WeakPolarHBondContact CG2-O 3.06Å; S78-F83 PolarHBondContact N-O 3.1Å; S78-F83 PolarHBondContact OG-N 2.87Å; S78-F83 PolarHBondContact OG-O 2.98Å; S78-F83 VanDerWaalsContact OG-O 3.07Å; F83-L95 HydrophobicContact CB-CD1 3.9Å; F83-L95 HydrophobicContact CB-CG 4.47Å; F83-L95 HydrophobicContact CD1-CD2 4.36Å; F83-L95 HydrophobicContact CD1-CG 4.19Å; F83-L95 HydrophobicContact CG-CD1 4.45Å; F83-W96 CarbonylContact C-O 3.59Å; F83-W96 WeakPolarHBondContact CA-O 3.47Å; F83-W96 WeakPolarHBondContact CD1-O 3.49Å; F83-D97 HydrophobicContact CD1-CB 4.21Å; F83-D97 HydrophobicContact CE1-CB 4.01Å; F83-T104 HydrophobicContact CE1-CG2 4.28Å
84	A	96.1	Very high	94.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	141.4	167	0	0	0	0	0	110	L38 V76 L95 W96 L98	L38-A84 HydrophobicContact CD1-CB 3.3Å; V76-A84 WeakPolarHBondContact O-CA 3.41Å; A84-L95 CarbonylContact O-C 3.52Å; A84-L95 WeakPolarHBondContact O-CA 3.31Å; A84-W96 HydrophobicContact CB-CB 4.24Å; A84-W96 PolarHBondContact N-O 3.49Å; A84-W96 PolarHBondContact O-N 2.65Å; A84-L98 HydrophobicContact CB-CD1 4.45Å; A84-L98 HydrophobicContact CB-CD2 3.83Å; A84-L98 HydrophobicContact CB-CG 4.27Å
85	L	97.1	Very high	94.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131.2	170.4	177.4	73.9	0	0	0	108.5	V75 V76 L93 R94 L95 F107 V117 F119 I126	V75-L85 CarbonylContact C-O 3.56Å; V75-L85 VanDerWaalsContact CA-O 3.32Å; V75-L85 WeakPolarHBondContact CA-O 3.4Å; V76-L85 HydrophobicContact CG1-CB 3.85Å; V76-L85 HydrophobicContact CG1-CD2 4.09Å; V76-L85 HydrophobicContact CG1-CG 4.4Å; V76-L85 PolarHBondContact N-O 3.39Å; V76-L85 PolarHBondContact O-N 2.92Å; L85-L93 HydrophobicContact CD1-CB 4.14Å; L85-L93 HydrophobicContact CD1-CD2 4.19Å; L85-R94 WeakPolarHBondContact CA-O 3.37Å; L85-L95 HydrophobicContact CB-CD1 4.48Å; L85-F107 HydrophobicContact CD1-CE2 4.23Å; L85-V117 HydrophobicContact CD2-CB 3.88Å; L85-V117 HydrophobicContact CD2-CG2 4.31Å; L85-V117 HydrophobicContact CG-CB 4.21Å; L85-V117 HydrophobicContact CG-CG2 4.25Å; L85-F119 HydrophobicContact CB-CD2 4.08Å; L85-F119 HydrophobicContact CB-CE2 3.26Å; L85-F119 HydrophobicContact CB-CZ 3.54Å; L85-F119 HydrophobicContact CD2-CD2 4.43Å; L85-F119 HydrophobicContact CD2-CE1 4.44Å; L85-F119 HydrophobicContact CD2-CE2 4.19Å; L85-F119 HydrophobicContact CD2-CZ 4.19Å; L85-F119 HydrophobicContact CG-CE2 4.34Å; L85-F119 HydrophobicContact CG-CZ 4.37Å; L85-I126 HydrophobicContact CD1-CD1 4.13Å; L85-I126 HydrophobicContact CD1-CG2 4.41Å; L85-I126 HydrophobicContact CD2-CB 4.28Å; L85-I126 HydrophobicContact CD2-CD1 4.14Å; L85-I126 HydrophobicContact CD2-CG1 4.05Å; L85-I126 HydrophobicContact CD2-CG2 3.34Å; L85-I126 HydrophobicContact CG-CG2 4.49Å
86	S	97.3	Very high	94.8	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.1	176	58.2	0	0	0	0	111.6	I46 H68 D74 L93 R94 W96	I46-S86 WeakPolarHBondContact CD1-OG 3.29Å; H68-S86 PolarHBondContact NE2-OG 3.45Å; D74-S86 WeakPolarHBondContact O-CA 3.43Å; S86-L93 CarbonylContact O-C 3.53Å; S86-L93 WeakPolarHBondContact O-CA 3.28Å; S86-L93 WeakPolarHBondContact O-CB 3.35Å; S86-R94 PolarHBondContact N-O 3.5Å; S86-R94 PolarHBondContact O-N 2.82Å; S86-R94 PolarHBondContact OG-O 2.98Å; S86-W96 PolarHBondContact OG-NE1 3.29Å
87	G	97	Very high	94.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139	167.7	0	0	0	0	0	110.1	V72 S73 D74	V72-G87 WeakPolarHBondContact CG1-O 3.42Å; S73-G87 PolarHBondContact N-O 3.42Å; S73-G87 PolarHBondContact OG-O 2.9Å; D74-G87 PolarHBondContact N-O 3.06Å; D74-G87 PolarHBondContact O-N 3.18Å
88	A	97.3	Very high	94.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	164.7	-179.2	0	0	0	0	0	113	H68 F71 D90 G91 T92 V114	H68-A88 HydrophobicContact CB-CB 4.13Å; H68-A88 VanDerWaalsContact CE1-CB 3.45Å; H68-A88 WeakPolarHBondContact CE1-CB 3.46Å; H68-A88 WeakPolarHBondContact ND1-CB 3.46Å; F71-A88 CarbonylContact O-C 3.59Å; F71-A88 VanDerWaalsContact O-CA 3.3Å; F71-A88 WeakPolarHBondContact O-CA 3.43Å; F71-A88 WeakPolarHBondContact O-CB 3.2Å; A88-D90 PolarHBondContact O-N 2.86Å; A88-D90 VanDerWaalsContact O-N 3.17Å; A88-G91 PolarHBondContact O-N 3.07Å; A88-T92 PolarHBondContact N-O 3.45Å; A88-V114 CarbonylContact C-O 3.6Å; A88-V114 WeakPolarHBondContact O-CB 3.49Å; A88-V114 PolarHBondContact O-N 2.63Å
89	W	97.1	Very high	94.6	Very high	57 Å²	57	26.2 Å²	26.2	22%	0.216	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-1.7	176.5	-69	19.2	0	0	0	113.2	H70 F71 G91 D113	H70-W89 HydrophobicContact CB-CB 3.98Å; H70-W89 AromaticContact CE1-CE3 3.69Å; H70-W89 WeakPolarHBondContact ND1-CB 2.95Å; H70-W89 AromaticContact ND1-CE3 3.8Å; F71-W89 HydrophobicContact CB-CD2 4.24Å; F71-W89 HydrophobicContact CB-CG 4.23Å; F71-W89 HydrophobicContact CD2-CD2 4.06Å; F71-W89 AromaticContact CD2-CE3 3.62Å; F71-W89 HydrophobicContact CD2-CE3 3.62Å; F71-W89 HydrophobicContact CD2-CH2 4.12Å; F71-W89 AromaticContact CD2-CZ3 3.66Å; F71-W89 HydrophobicContact CD2-CZ3 3.66Å; F71-W89 HydrophobicContact CE2-CE3 4.26Å; F71-W89 HydrophobicContact CE2-CZ3 4.01Å; F71-W89 HydrophobicContact CG-CE3 4.49Å; F71-W89 PolarHBondContact O-N 3.25Å; W89-G91 PolarHBondContact O-N 3.08Å; W89-D113 HydrophobicContact CB-CB 4Å; W89-D113 HydrophobicContact CD2-CB 4.49Å; W89-D113 HydrophobicContact CG-CB 3.91Å
90	D	94.5	Very high	94.8	Very high	36 Å²	36	26.3 Å²	26.3	19%	0.193	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	1.5	168.7	64.9	19.3	0	0	0	113.2	H68 S69 H70 A88 T92	H68-D90 WeakPolarHBondContact CA-OD2 3.3Å; H68-D90 IonicContact CE1-OD2 3.54Å; H68-D90 IonicContact CG-OD2 3.73Å; H68-D90 IonicContact ND1-OD1 3.75Å; H68-D90 IonicContact ND1-OD2 3.33Å; H68-D90 PolarHBondContact ND1-OD2 2.78Å; S69-D90 PolarHBondContact N-OD2 3.49Å; S69-D90 VanDerWaalsContact N-OD2 3.11Å; S69-D90 WeakPolarHBondContact OG-CB 3.33Å; H70-D90 HydrophobicContact CB-CB 4.14Å; A88-D90 PolarHBondContact O-N 2.86Å; A88-D90 VanDerWaalsContact O-N 3.17Å; D90-T92 VanDerWaalsContact CG-OG1 3.29Å; D90-T92 PolarHBondContact O-N 3.13Å; D90-T92 WeakPolarHBondContact OD1-CA 2.96Å; D90-T92 WeakPolarHBondContact OD1-CB 3.44Å; D90-T92 PolarHBondContact OD1-N 2.7Å; D90-T92 PolarHBondContact OD1-OG1 2.77Å; D90-T92 PolarHBondContact OD2-OG1 3.45Å
91	G	94.4	Very high	94.9	Very high	7 Å²	7	23.9 Å²	23.9	7%	0.072	13%	0.128	C	C	.	.	S	Bend	trans	78.9	5.9	-179.6	0	0	0	0	0	113.6	A88 W89 K112	A88-G91 PolarHBondContact O-N 3.07Å; W89-G91 PolarHBondContact O-N 3.08Å; G91-K112 WeakPolarHBondContact CA-O 3.35Å
92	T	96.4	Very high	95	Very high	13 Å²	13	26.1 Å²	26.1	8%	0.08	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	152.3	-178	75.8	0	0	0	0	111.7	A88 D90 Q106 F107 V108	A88-T92 PolarHBondContact N-O 3.45Å; D90-T92 VanDerWaalsContact CG-OG1 3.29Å; D90-T92 PolarHBondContact O-N 3.13Å; D90-T92 WeakPolarHBondContact OD1-CA 2.96Å; D90-T92 WeakPolarHBondContact OD1-CB 3.44Å; D90-T92 PolarHBondContact OD1-N 2.7Å; D90-T92 PolarHBondContact OD1-OG1 2.77Å; D90-T92 PolarHBondContact OD2-OG1 3.45Å; T92-Q106 PolarHBondContact OG1-NE2 3.49Å; T92-F107 WeakPolarHBondContact CA-O 3.21Å; T92-V108 HydrophobicContact CG2-CG2 4.18Å
93	L	97.4	Very high	95.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	153.2	162.7	-50.6	65.2	0	0	0	108.7	L85 S86 Q106 F107 V114 V117 I126 W138	L85-L93 HydrophobicContact CD1-CB 4.14Å; L85-L93 HydrophobicContact CD1-CD2 4.19Å; S86-L93 CarbonylContact O-C 3.53Å; S86-L93 WeakPolarHBondContact O-CA 3.28Å; S86-L93 WeakPolarHBondContact O-CB 3.35Å; L93-Q106 WeakPolarHBondContact O-CA 3.45Å; L93-F107 HydrophobicContact CB-CB 3.84Å; L93-F107 HydrophobicContact CB-CD2 3.97Å; L93-F107 HydrophobicContact CB-CG 4.06Å; L93-F107 HydrophobicContact CD1-CB 4.09Å; L93-F107 HydrophobicContact CG-CB 4.39Å; L93-F107 PolarHBondContact N-O 3.08Å; L93-F107 VanDerWaalsContact N-O 3.09Å; L93-F107 PolarHBondContact O-N 3.31Å; L93-V114 HydrophobicContact CD1-CG1 4.31Å; L93-V114 HydrophobicContact CD1-CG2 3.99Å; L93-V114 HydrophobicContact CG-CG1 4.37Å; L93-V117 HydrophobicContact CD2-CB 4.5Å; L93-V117 HydrophobicContact CD2-CG1 3.57Å; L93-V117 HydrophobicContact CG-CG1 3.76Å; L93-I126 HydrophobicContact CD2-CG2 3.97Å; L93-W138 HydrophobicContact CD1-CZ2 4.15Å
94	R	96.9	Very high	95.1	Very high	39 Å²	39	25.7 Å²	25.7	15%	0.147	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.4	174.6	-72.4	-179.3	176.7	-128.8	-0.2	110.5	G67 L85 S86 W96 T103 R105 Q106	G67-R94 PolarHBondContact O-NH2 2.84Å; L85-R94 WeakPolarHBondContact CA-O 3.37Å; S86-R94 PolarHBondContact N-O 3.5Å; S86-R94 PolarHBondContact O-N 2.82Å; S86-R94 PolarHBondContact OG-O 2.98Å; R94-W96 HydrophobicContact CB-CZ2 3.84Å; R94-W96 HydrophobicContact CG-CZ2 4.27Å; R94-T103 HydrophobicContact CB-CG2 4Å; R94-T103 HydrophobicContact CG-CG2 3.96Å; R94-T103 PolarHBondContact NH1-OG1 2.9Å; R94-R105 WeakPolarHBondContact CA-O 3.46Å; R94-Q106 HydrophobicContact CG-CG 4.3Å
95	L	96.6	Very high	95.1	Very high	12 Å²	12	30.1 Å²	30.1	6%	0.063	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	124.3	167	-171.8	70.5	0	0	0	107.9	F83 A84 L85 T103 T104 R105 F107 F119	F83-L95 HydrophobicContact CB-CD1 3.9Å; F83-L95 HydrophobicContact CB-CG 4.47Å; F83-L95 HydrophobicContact CD1-CD2 4.36Å; F83-L95 HydrophobicContact CD1-CG 4.19Å; F83-L95 HydrophobicContact CG-CD1 4.45Å; A84-L95 CarbonylContact O-C 3.52Å; A84-L95 WeakPolarHBondContact O-CA 3.31Å; L85-L95 HydrophobicContact CB-CD1 4.48Å; L95-T103 CarbonylContact O-C 3.59Å; L95-T103 WeakPolarHBondContact O-CA 3.18Å; L95-T104 PolarHBondContact O-N 2.91Å; L95-T104 PolarHBondContact O-OG1 2.83Å; L95-T104 VanDerWaalsContact O-OG1 3.09Å; L95-R105 HydrophobicContact CB-CB 4.21Å; L95-R105 PolarHBondContact N-O 3.32Å; L95-R105 PolarHBondContact O-N 2.7Å; L95-F107 HydrophobicContact CB-CE2 3.82Å; L95-F107 HydrophobicContact CB-CZ 4.38Å; L95-F119 HydrophobicContact CD1-CE1 4.46Å; L95-F119 HydrophobicContact CD1-CZ 3.65Å
96	W	96.4	Very high	95	Very high	3 Å²	3	34.7 Å²	34.7	1%	0.011	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	136.1	-179.1	-52.6	86.1	0	0	0	108.8	I46 L65 R66 H68 F83 A84 S86 R94 A102 T103	I46-W96 HydrophobicContact CD1-CZ2 4.28Å; L65-W96 HydrophobicContact CB-CD2 4.09Å; L65-W96 HydrophobicContact CB-CE3 3.83Å; L65-W96 HydrophobicContact CB-CH2 4.39Å; L65-W96 HydrophobicContact CB-CZ3 3.98Å; L65-W96 HydrophobicContact CD1-CB 3.97Å; L65-W96 HydrophobicContact CD1-CD2 4.19Å; L65-W96 HydrophobicContact CD1-CE3 4.46Å; L65-W96 HydrophobicContact CD1-CG 3.97Å; L65-W96 HydrophobicContact CD2-CE3 4.31Å; L65-W96 HydrophobicContact CG-CE3 4.43Å; R66-W96 WeakPolarHBondContact O-CH2 3.18Å; H68-W96 AromaticContact CD2-CZ2 3.97Å; F83-W96 CarbonylContact C-O 3.59Å; F83-W96 WeakPolarHBondContact CA-O 3.47Å; F83-W96 WeakPolarHBondContact CD1-O 3.49Å; A84-W96 HydrophobicContact CB-CB 4.24Å; A84-W96 PolarHBondContact N-O 3.49Å; A84-W96 PolarHBondContact O-N 2.65Å; S86-W96 PolarHBondContact OG-NE1 3.29Å; R94-W96 HydrophobicContact CB-CZ2 3.84Å; R94-W96 HydrophobicContact CG-CZ2 4.27Å; W96-A102 WeakPolarHBondContact CA-O 3.32Å; W96-T103 WeakPolarHBondContact CH2-OG1 3.25Å; W96-T103 WeakPolarHBondContact CZ3-OG1 3.35Å
97	D	95.4	Very high	94.9	Very high	27 Å²	27	34.7 Å²	34.7	14%	0.144	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	121.8	164.6	168.6	5.7	0	0	0	108.2	F83 T99 T100 G101 A102 T104	F83-D97 HydrophobicContact CD1-CB 4.21Å; F83-D97 HydrophobicContact CE1-CB 4.01Å; D97-T99 VanDerWaalsContact C-N 3.3Å; D97-T99 VanDerWaalsContact CG-OG1 3.31Å; D97-T99 PolarHBondContact O-N 2.86Å; D97-T99 WeakPolarHBondContact OD1-CB 3.46Å; D97-T99 PolarHBondContact OD1-N 2.85Å; D97-T99 PolarHBondContact OD1-OG1 2.81Å; D97-T99 PolarHBondContact OD2-OG1 3.02Å; D97-T100 WeakPolarHBondContact CB-OG1 3.29Å; D97-T100 VanDerWaalsContact OD2-CG2 3.25Å; D97-T100 WeakPolarHBondContact OD2-CG2 3.38Å; D97-T100 PolarHBondContact OD2-OG1 3Å; D97-G101 WeakPolarHBondContact O-CA 3.41Å; D97-G101 PolarHBondContact O-N 3.4Å; D97-A102 PolarHBondContact N-O 3.15Å; D97-T104 HydrophobicContact CB-CG2 3.59Å
98	L	93.4	Very high	94.8	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.047	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-22	-175.6	-66.1	177.4	0	0	0	112.8	M36 L38 M48 L65 I77 G81 Q82 A84	M36-L98 HydrophobicContact CE-CD1 3.66Å; M36-L98 HydrophobicContact SD-CD1 4.23Å; L38-L98 HydrophobicContact CD1-CD1 4.09Å; L38-L98 HydrophobicContact CD1-CD2 3.83Å; L38-L98 HydrophobicContact CD2-CD2 3.9Å; L38-L98 HydrophobicContact CG-CD2 4.5Å; M48-L98 HydrophobicContact SD-CB 4.23Å; M48-L98 HydrophobicContact SD-CD2 4.18Å; L65-L98 HydrophobicContact CD1-CD2 4.06Å; I77-L98 HydrophobicContact CG2-CD1 4.24Å; G81-L98 WeakPolarHBondContact O-CD1 3.42Å; Q82-L98 VanDerWaalsContact O-CB 3.32Å; Q82-L98 WeakPolarHBondContact O-CB 3.37Å; Q82-L98 WeakPolarHBondContact O-CG 3.39Å; Q82-L98 PolarHBondContact O-N 2.92Å; A84-L98 HydrophobicContact CB-CD1 4.45Å; A84-L98 HydrophobicContact CB-CD2 3.83Å; A84-L98 HydrophobicContact CB-CG 4.27Å
99	T	91.4	Very high	94.5	Very high	83 Å²	83	41.4 Å²	41.4	51%	0.509	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-48.7	177.3	68.1	0	0	0	0	111	R63 D97	R63-T99 PolarHBondContact NH2-O 2.83Å; R63-T99 VanDerWaalsContact NH2-O 3.09Å; D97-T99 VanDerWaalsContact C-N 3.3Å; D97-T99 VanDerWaalsContact CG-OG1 3.31Å; D97-T99 PolarHBondContact O-N 2.86Å; D97-T99 WeakPolarHBondContact OD1-CB 3.46Å; D97-T99 PolarHBondContact OD1-N 2.85Å; D97-T99 PolarHBondContact OD1-OG1 2.81Å; D97-T99 PolarHBondContact OD2-OG1 3.02Å
100	T	91.9	Very high	94.4	Very high	76 Å²	76	39.4 Å²	39.4	47%	0.466	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-21.7	-179	60.4	0	0	0	0	113	R63 D97 A102	R63-T100 PolarHBondContact NH1-O 3.05Å; D97-T100 WeakPolarHBondContact CB-OG1 3.29Å; D97-T100 VanDerWaalsContact OD2-CG2 3.25Å; D97-T100 WeakPolarHBondContact OD2-CG2 3.38Å; D97-T100 PolarHBondContact OD2-OG1 3Å; T100-A102 PolarHBondContact O-N 3.34Å; T100-A102 PolarHBondContact OG1-N 2.89Å
101	G	89.9	Confident	94.4	Very high	16 Å²	16	42.4 Å²	42.4	17%	0.165	26%	0.256	C	S	.	.			trans	67.6	12.6	-174.2	0	0	0	0	0	114.5	L65 D97	L65-G101 VanDerWaalsContact CD2-CA 3.49Å; L65-G101 WeakPolarHBondContact CD2-O 3.44Å; D97-G101 WeakPolarHBondContact O-CA 3.41Å; D97-G101 PolarHBondContact O-N 3.4Å
102	A	92.6	Very high	94.5	Very high	49 Å²	49	47.3 Å²	47.3	41%	0.405	28%	0.275	S	S	.	.			trans	-94	150.9	-179.1	0	0	0	0	0	110.9	W96 D97 T100 T104	W96-A102 WeakPolarHBondContact CA-O 3.32Å; D97-A102 PolarHBondContact N-O 3.15Å; T100-A102 PolarHBondContact O-N 3.34Å; T100-A102 PolarHBondContact OG1-N 2.89Å; A102-T104 PolarHBondContact O-N 2.93Å
103	T	94.8	Very high	94.5	Very high	47 Å²	47	48.3 Å²	48.3	29%	0.288	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	117	166.3	-53.1	0	0	0	0	108.2	R94 L95 W96 R105	R94-T103 HydrophobicContact CB-CG2 4Å; R94-T103 HydrophobicContact CG-CG2 3.96Å; R94-T103 PolarHBondContact NH1-OG1 2.9Å; L95-T103 CarbonylContact O-C 3.59Å; L95-T103 WeakPolarHBondContact O-CA 3.18Å; W96-T103 WeakPolarHBondContact CH2-OG1 3.25Å; W96-T103 WeakPolarHBondContact CZ3-OG1 3.35Å; T103-R105 VanDerWaalsContact CG2-O 3.3Å; T103-R105 WeakPolarHBondContact CG2-O 3.47Å
104	T	93.9	Very high	94.5	Very high	65 Å²	65	48.3 Å²	48.3	40%	0.399	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-38.6	175	56	0	0	0	0	111.1	F83 L95 D97 A102	F83-T104 HydrophobicContact CE1-CG2 4.28Å; L95-T104 PolarHBondContact O-N 2.91Å; L95-T104 PolarHBondContact O-OG1 2.83Å; L95-T104 VanDerWaalsContact O-OG1 3.09Å; D97-T104 HydrophobicContact CB-CG2 3.59Å; A102-T104 PolarHBondContact O-N 2.93Å
105	R	94.7	Very high	94.5	Very high	94 Å²	94	47.7 Å²	47.7	36%	0.355	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	147.4	-177.5	-66.1	-178.4	171.8	147.2	2.8	111.9	R94 L95 T103 F107 T140 L141	R94-R105 WeakPolarHBondContact CA-O 3.46Å; L95-R105 HydrophobicContact CB-CB 4.21Å; L95-R105 PolarHBondContact N-O 3.32Å; L95-R105 PolarHBondContact O-N 2.7Å; T103-R105 VanDerWaalsContact CG2-O 3.3Å; T103-R105 WeakPolarHBondContact CG2-O 3.47Å; R105-F107 HydrophobicContact CB-CE2 4.07Å; R105-T140 WeakPolarHBondContact CD-O 3.44Å; R105-T140 PolarHBondContact NH1-O 2.93Å; R105-L141 VanDerWaalsContact NH1-CD2 3.34Å
106	Q	95.1	Very high	94.5	Very high	95 Å²	95	47.2 Å²	47.2	44%	0.444	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.9	171.4	-168.3	175.6	13.8	0	0	109.1	T92 L93 R94 V108	T92-Q106 PolarHBondContact OG1-NE2 3.49Å; L93-Q106 WeakPolarHBondContact O-CA 3.45Å; R94-Q106 HydrophobicContact CG-CG 4.3Å; Q106-V108 HydrophobicContact CG-CG2 4.03Å
107	F	95.6	Very high	94.6	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	112.6	-179.4	-56.6	-114.2	0	0	0	106.8	L85 T92 L93 L95 R105 I126 W138 N139 G142	L85-F107 HydrophobicContact CD1-CE2 4.23Å; T92-F107 WeakPolarHBondContact CA-O 3.21Å; L93-F107 HydrophobicContact CB-CB 3.84Å; L93-F107 HydrophobicContact CB-CD2 3.97Å; L93-F107 HydrophobicContact CB-CG 4.06Å; L93-F107 HydrophobicContact CD1-CB 4.09Å; L93-F107 HydrophobicContact CG-CB 4.39Å; L93-F107 PolarHBondContact N-O 3.08Å; L93-F107 VanDerWaalsContact N-O 3.09Å; L93-F107 PolarHBondContact O-N 3.31Å; L95-F107 HydrophobicContact CB-CE2 3.82Å; L95-F107 HydrophobicContact CB-CZ 4.38Å; R105-F107 HydrophobicContact CB-CE2 4.07Å; F107-I126 HydrophobicContact CE1-CD1 3.7Å; F107-I126 HydrophobicContact CZ-CD1 3.61Å; F107-W138 HydrophobicContact CB-CD2 4.31Å; F107-W138 HydrophobicContact CB-CE3 3.97Å; F107-W138 HydrophobicContact CB-CH2 4.3Å; F107-W138 HydrophobicContact CB-CZ3 3.96Å; F107-W138 HydrophobicContact CD1-CB 3.84Å; F107-W138 AromaticContact CD1-CD2 3.87Å; F107-W138 HydrophobicContact CD1-CD2 3.87Å; F107-W138 AromaticContact CD1-CE3 3.75Å; F107-W138 HydrophobicContact CD1-CE3 3.75Å; F107-W138 AromaticContact CD1-CG 3.93Å; F107-W138 HydrophobicContact CD1-CG 3.93Å; F107-W138 HydrophobicContact CE1-CB 3.97Å; F107-W138 HydrophobicContact CG-CE3 4.37Å; F107-N139 VanDerWaalsContact CE1-O 3.3Å; F107-N139 WeakPolarHBondContact CE1-O 3.04Å; F107-G142 VanDerWaalsContact CE1-CA 3.47Å
108	V	94.8	Very high	94.6	Very high	102 Å²	102	46 Å²	46	62%	0.618	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.1	-178.4	-176	0	0	0	0	107.9	T92 Q106	T92-V108 HydrophobicContact CG2-CG2 4.18Å; Q106-V108 HydrophobicContact CG-CG2 4.03Å
109	G	91.8	Very high	94.5	Very high	39 Å²	39	46.7 Å²	46.7	40%	0.402	28%	0.275	S	S	.	.			trans	160.5	-15.3	177.3	0	0	0	0	0	115.4	K136	G109-K136 WeakPolarHBondContact O-CE 3.43Å
110	H	94.8	Very high	94.5	Very high	15 Å²	15	43.2 Å²	43.2	7%	0.069	25%	0.253	C	S	.	.			trans	-74.3	141.6	163.4	-80.2	-65.5	0	0	0	110	V114 S128 S130 D132 K136 W138	H110-V114 HydrophobicContact CB-CG2 4.02Å; H110-S128 PolarHBondContact CD2-OG 2.76Å; H110-S128 PolarHBondContact NE2-OG 3.4Å; H110-S130 VanDerWaalsContact CE1-CB 3.47Å; H110-S130 WeakPolarHBondContact CE1-CB 3.49Å; H110-S130 WeakPolarHBondContact ND1-CB 3.09Å; H110-D132 WeakPolarHBondContact CA-OD2 3.43Å; H110-D132 IonicContact CE1-OD1 2.78Å; H110-D132 IonicContact CE1-OD2 3.74Å; H110-D132 IonicContact CG-OD2 2.76Å; H110-D132 IonicContact ND1-OD1 3.88Å; H110-D132 PolarHBondContact ND1-OD1 3.07Å; H110-D132 IonicContact ND1-OD2 3.57Å; H110-D132 PolarHBondContact ND1-OD2 3.09Å; H110-K136 VanDerWaalsContact CE1-CD 3.5Å; H110-K136 WeakPolarHBondContact CE1-CD 3.5Å; H110-W138 AromaticContact CD2-CZ2 3.89Å
111	S	94.8	Very high	94.1	Very high	99 Å²	99	43.3 Å²	43.3	69%	0.692	26%	0.262	S	S	*	.	S	Bend	trans	-91.2	-11.6	-178.7	63.5	0	0	0	0	113.5	D132	S111-D132 PolarHBondContact N-OD2 2.84Å; S111-D132 VanDerWaalsContact OG-CB 3.26Å; S111-D132 WeakPolarHBondContact OG-CB 3.3Å
112	K	96.1	Very high	93.9	Very high	110 Å²	110	46.7 Å²	46.7	48%	0.478	28%	0.276	S	S	.	.	S	Bend	trans	-140.8	178.9	179.6	-64.2	-172.4	177.5	179.3	0	110.4	G91 V114 S130 R131 D132	G91-K112 WeakPolarHBondContact CA-O 3.35Å; K112-V114 PolarHBondContact O-N 3.11Å; K112-S130 PolarHBondContact O-OG 3.42Å; K112-S130 VanDerWaalsContact O-OG 3.08Å; K112-R131 HydrophobicContact CB-CB 4.02Å; K112-R131 HydrophobicContact CD-CB 4.37Å; K112-D132 HydrophobicContact CB-CB 4.17Å; K112-D132 HydrophobicContact CG-CB 4.35Å
113	D	96.3	Very high	93.5	Very high	35 Å²	35	46 Å²	46	19%	0.187	27%	0.266	C	S	.	.			trans	-43.6	125	179.8	-50.3	11.4	0	0	0	112.4	W89 L115 S130 R131	W89-D113 HydrophobicContact CB-CB 4Å; W89-D113 HydrophobicContact CD2-CB 4.49Å; W89-D113 HydrophobicContact CG-CB 3.91Å; D113-L115 HydrophobicContact CB-CD2 4.46Å; D113-S130 VanDerWaalsContact O-CA 3.31Å; D113-S130 WeakPolarHBondContact O-CA 3.18Å; D113-S130 WeakPolarHBondContact O-CB 3.41Å; D113-S130 PolarHBondContact O-OG 2.82Å; D113-R131 HydrophobicContact CB-CB 4.39Å; D113-R131 HydrophobicContact CB-CG 4.08Å; D113-R131 PolarHBondContact O-N 2.85Å; D113-R131 IonicContact OD2-CZ 3.52Å; D113-R131 IonicContact OD2-NE 2.74Å; D113-R131 IonicContact OD2-NH1 3.64Å; D113-R131 PolarHBondContact OD2-NH1 2.74Å; D113-R131 IonicContact OD2-NH2 3.12Å
114	V	97.6	Very high	93.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	127.5	167.9	-177.8	0	0	0	0	106.8	S73 A88 L93 H110 K112 V117	S73-V114 PolarHBondContact OG-O 3.41Å; A88-V114 CarbonylContact C-O 3.6Å; A88-V114 WeakPolarHBondContact O-CB 3.49Å; A88-V114 PolarHBondContact O-N 2.63Å; L93-V114 HydrophobicContact CD1-CG1 4.31Å; L93-V114 HydrophobicContact CD1-CG2 3.99Å; L93-V114 HydrophobicContact CG-CG1 4.37Å; H110-V114 HydrophobicContact CB-CG2 4.02Å; K112-V114 PolarHBondContact O-N 3.11Å; V114-V117 HydrophobicContact CG1-CG1 3.98Å
115	L	97.2	Very high	93	Very high	26 Å²	26	52 Å²	52	14%	0.136	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-34	-178.5	-64.8	-175.3	0	0	0	111.8	S73 D74 D113 G129 R131 W156 V157	S73-L115 WeakPolarHBondContact CB-O 3.43Å; S73-L115 WeakPolarHBondContact OG-CA 3.41Å; S73-L115 PolarHBondContact OG-O 2.78Å; D74-L115 WeakPolarHBondContact CB-O 3.14Å; D113-L115 HydrophobicContact CB-CD2 4.46Å; L115-G129 PolarHBondContact N-O 3.27Å; L115-R131 HydrophobicContact CD1-CG 3.68Å; L115-R131 HydrophobicContact CD2-CG 4.15Å; L115-R131 HydrophobicContact CG-CG 3.91Å; L115-W156 HydrophobicContact CD1-CB 4.33Å; L115-V157 WeakPolarHBondContact CD1-O 3.36Å
116	S	96.8	Very high	93	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	147.3	-176.3	-178.8	0	0	0	0	112.9	D74 S128 G129 S158 V160 R161	D74-S116 WeakPolarHBondContact OD2-CA 3.43Å; D74-S116 WeakPolarHBondContact OD2-CB 3.45Å; D74-S116 PolarHBondContact OD2-OG 3.28Å; S116-S128 VanDerWaalsContact O-CA 3.22Å; S116-S128 WeakPolarHBondContact O-CA 3.08Å; S116-S128 WeakPolarHBondContact O-CB 3.32Å; S116-G129 PolarHBondContact N-O 3.13Å; S116-G129 PolarHBondContact O-N 3.25Å; S116-S158 WeakPolarHBondContact CB-O 3.37Å; S116-V160 PolarHBondContact OG-N 3.13Å; S116-V160 VanDerWaalsContact OG-N 3.09Å; S116-V160 PolarHBondContact OG-O 3.01Å; S116-R161 PolarHBondContact OG-NH1 2.88Å
117	V	97	Very high	93.1	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	144.5	176.9	-65.4	0	0	0	0	109.9	D74 V76 L85 L93 V114 V127 R161	D74-V117 HydrophobicContact CB-CG2 4.05Å; D74-V117 PolarHBondContact OD2-N 3.05Å; V76-V117 HydrophobicContact CG1-CG2 4.15Å; L85-V117 HydrophobicContact CD2-CB 3.88Å; L85-V117 HydrophobicContact CD2-CG2 4.31Å; L85-V117 HydrophobicContact CG-CB 4.21Å; L85-V117 HydrophobicContact CG-CG2 4.25Å; L93-V117 HydrophobicContact CD2-CB 4.5Å; L93-V117 HydrophobicContact CD2-CG1 3.57Å; L93-V117 HydrophobicContact CG-CG1 3.76Å; V114-V117 HydrophobicContact CG1-CG1 3.98Å; V117-V127 WeakPolarHBondContact CA-O 3.41Å; V117-R161 PolarHBondContact O-NH1 3.24Å; V117-R161 VanDerWaalsContact O-NH1 3.08Å
118	A	95.4	Very high	93.1	Very high	5 Å²	5	43 Å²	43	4%	0.041	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.4	172.1	0	0	0	0	0	111.7	V127 F162	A118-V127 HydrophobicContact CB-CG1 3.81Å; A118-V127 PolarHBondContact N-O 3.44Å; A118-V127 PolarHBondContact O-N 3.19Å; A118-F162 HydrophobicContact CB-CD2 3.96Å; A118-F162 HydrophobicContact CB-CE2 4.47Å
119	F	92.7	Very high	93.2	Very high	24 Å²	24	38.2 Å²	38.2	11%	0.105	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	144.4	170.1	-86.3	-65.7	0	0	0	110.9	V76 L85 L95 I126 F162	V76-F119 HydrophobicContact CB-CD2 4.45Å; V76-F119 HydrophobicContact CG1-CD2 3.57Å; V76-F119 HydrophobicContact CG1-CE2 4.06Å; V76-F119 HydrophobicContact CG1-CG 4.41Å; V76-F119 HydrophobicContact CG2-CD2 4.2Å; L85-F119 HydrophobicContact CB-CD2 4.08Å; L85-F119 HydrophobicContact CB-CE2 3.26Å; L85-F119 HydrophobicContact CB-CZ 3.54Å; L85-F119 HydrophobicContact CD2-CD2 4.43Å; L85-F119 HydrophobicContact CD2-CE1 4.44Å; L85-F119 HydrophobicContact CD2-CE2 4.19Å; L85-F119 HydrophobicContact CD2-CZ 4.19Å; L85-F119 HydrophobicContact CG-CE2 4.34Å; L85-F119 HydrophobicContact CG-CZ 4.37Å; L95-F119 HydrophobicContact CD1-CE1 4.46Å; L95-F119 HydrophobicContact CD1-CZ 3.65Å; F119-I126 HydrophobicContact CD1-CD1 4.37Å; F119-I126 HydrophobicContact CD1-CG1 3.7Å; F119-I126 HydrophobicContact CE1-CD1 3.69Å; F119-I126 HydrophobicContact CE1-CG1 3.54Å; F119-I126 HydrophobicContact CZ-CD1 4.34Å; F119-I126 HydrophobicContact CZ-CG1 4.48Å; F119-F162 WeakPolarHBondContact O-CD2 3.36Å
120	S	90.4	Very high	93.5	Very high	9 Å²	9	36.3 Å²	36.3	6%	0.063	19%	0.192	C	C	.	.			trans	-69.4	153.6	162.1	58.6	0	0	0	0	110.4	D122 N123 R124 Q125	S120-D122 VanDerWaalsContact CB-OD1 3.29Å; S120-D122 WeakPolarHBondContact CB-OD1 3.46Å; S120-D122 PolarHBondContact O-N 3.23Å; S120-D122 VanDerWaalsContact O-N 3.15Å; S120-D122 PolarHBondContact OG-OD1 3.47Å; S120-N123 WeakPolarHBondContact O-CA 3.2Å; S120-N123 PolarHBondContact O-N 2.83Å; S120-R124 PolarHBondContact OG-N 2.98Å; S120-Q125 PolarHBondContact N-O 2.89Å; S120-Q125 PolarHBondContact OG-N 3.15Å; S120-Q125 PolarHBondContact OG-O 3.3Å; S120-Q125 VanDerWaalsContact OG-O 3.05Å
121	A	84.5	Confident	93.5	Very high	78 Å²	78	37.9 Å²	37.9	65%	0.645	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.7	179.8	0	0	0	0	0	113.5	N123	A121-N123 VanDerWaalsContact C-N 3.31Å
122	D	84.1	Confident	93.5	Very high	88 Å²	88	34.3 Å²	34.3	47%	0.471	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	0.4	175.4	73.2	-10.5	0	0	0	113.9	S120 R124	S120-D122 VanDerWaalsContact CB-OD1 3.29Å; S120-D122 WeakPolarHBondContact CB-OD1 3.46Å; S120-D122 PolarHBondContact O-N 3.23Å; S120-D122 VanDerWaalsContact O-N 3.15Å; S120-D122 PolarHBondContact OG-OD1 3.47Å; D122-R124 HydrophobicContact CB-CG 4.47Å; D122-R124 PolarHBondContact O-N 3.02Å; D122-R124 PolarHBondContact OD1-N 2.62Å; D122-R124 WeakPolarHBondContact OD2-CD 3.44Å
123	N	85.4	Confident	93.4	Very high	33 Å²	33	32.7 Å²	32.7	18%	0.176	16%	0.163	C	C	.	.	S	Bend	trans	54.4	14.4	-173.8	-57.6	-38	0	0	0	115.3	S79 S120 A121 T140	S79-N123 PolarHBondContact N-ND2 3.35Å; S79-N123 PolarHBondContact N-OD1 2.77Å; S79-N123 VanDerWaalsContact N-OD1 3.13Å; S79-N123 PolarHBondContact OG-ND2 3.1Å; S79-N123 PolarHBondContact OG-OD1 3.25Å; S120-N123 WeakPolarHBondContact O-CA 3.2Å; S120-N123 PolarHBondContact O-N 2.83Å; A121-N123 VanDerWaalsContact C-N 3.31Å; N123-T140 WeakPolarHBondContact O-CG2 3.42Å
124	R	87.1	Confident	93.4	Very high	181 Å²	181	31.4 Å²	31.4	68%	0.683	16%	0.157	S	C	*	.	S	Bend	trans	-90.7	-21.8	-177.4	-67.3	-177.4	174.3	-170.4	-1.8	113.3	S120 D122	S120-R124 PolarHBondContact OG-N 2.98Å; D122-R124 HydrophobicContact CB-CG 4.47Å; D122-R124 PolarHBondContact O-N 3.02Å; D122-R124 PolarHBondContact OD1-N 2.62Å; D122-R124 WeakPolarHBondContact OD2-CD 3.44Å
125	Q	91.3	Very high	93.3	Very high	59 Å²	59	31.6 Å²	31.6	28%	0.276	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.9	-175.9	-53.8	-169.5	24	0	0	110.2	S120 F162	S120-Q125 PolarHBondContact N-O 2.89Å; S120-Q125 PolarHBondContact OG-N 3.15Å; S120-Q125 PolarHBondContact OG-O 3.3Å; S120-Q125 VanDerWaalsContact OG-O 3.05Å; Q125-F162 HydrophobicContact CB-CZ 4.34Å
126	I	95.3	Very high	93.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.7	177.7	-66.7	169.1	0	0	0	106.8	L85 L93 F107 F119 L137 W138	L85-I126 HydrophobicContact CD1-CD1 4.13Å; L85-I126 HydrophobicContact CD1-CG2 4.41Å; L85-I126 HydrophobicContact CD2-CB 4.28Å; L85-I126 HydrophobicContact CD2-CD1 4.14Å; L85-I126 HydrophobicContact CD2-CG1 4.05Å; L85-I126 HydrophobicContact CD2-CG2 3.34Å; L85-I126 HydrophobicContact CG-CG2 4.49Å; L93-I126 HydrophobicContact CD2-CG2 3.97Å; F107-I126 HydrophobicContact CE1-CD1 3.7Å; F107-I126 HydrophobicContact CZ-CD1 3.61Å; F119-I126 HydrophobicContact CD1-CD1 4.37Å; F119-I126 HydrophobicContact CD1-CG1 3.7Å; F119-I126 HydrophobicContact CE1-CD1 3.69Å; F119-I126 HydrophobicContact CE1-CG1 3.54Å; F119-I126 HydrophobicContact CZ-CD1 4.34Å; F119-I126 HydrophobicContact CZ-CG1 4.48Å; I126-L137 CarbonylContact O-C 3.59Å; I126-L137 WeakPolarHBondContact O-CA 3.49Å; I126-W138 HydrophobicContact CB-CB 4.12Å; I126-W138 HydrophobicContact CG2-CB 4.46Å; I126-W138 PolarHBondContact N-O 3.05Å; I126-W138 PolarHBondContact O-N 3.24Å
127	V	95.8	Very high	93.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	143.8	172.4	70.9	0	0	0	0	109.6	V117 A118 I135 K136 L137 V160 F162 I171	V117-V127 WeakPolarHBondContact CA-O 3.41Å; A118-V127 HydrophobicContact CB-CG1 3.81Å; A118-V127 PolarHBondContact N-O 3.44Å; A118-V127 PolarHBondContact O-N 3.19Å; V127-I135 HydrophobicContact CG2-CG2 3.35Å; V127-K136 WeakPolarHBondContact CA-O 3.39Å; V127-L137 HydrophobicContact CB-CD2 3.83Å; V127-L137 HydrophobicContact CG2-CD2 3.8Å; V127-V160 HydrophobicContact CG1-CB 4.22Å; V127-V160 HydrophobicContact CG1-CG2 3.9Å; V127-V160 HydrophobicContact CG2-CB 4.46Å; V127-V160 HydrophobicContact CG2-CG2 4.39Å; V127-F162 HydrophobicContact CB-CE2 3.69Å; V127-F162 HydrophobicContact CB-CZ 3.8Å; V127-F162 HydrophobicContact CG1-CD2 3.74Å; V127-F162 HydrophobicContact CG1-CE2 3.28Å; V127-F162 HydrophobicContact CG1-CZ 3.86Å; V127-I171 HydrophobicContact CG2-CD1 4.23Å
128	S	96.6	Very high	93.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.6	172.1	53.8	0	0	0	0	112.9	H110 S116 I135 K136 W138	H110-S128 PolarHBondContact CD2-OG 2.76Å; H110-S128 PolarHBondContact NE2-OG 3.4Å; S116-S128 VanDerWaalsContact O-CA 3.22Å; S116-S128 WeakPolarHBondContact O-CA 3.08Å; S116-S128 WeakPolarHBondContact O-CB 3.32Å; S128-I135 VanDerWaalsContact O-CA 3.32Å; S128-I135 WeakPolarHBondContact O-CA 3.49Å; S128-K136 PolarHBondContact N-O 2.59Å; S128-K136 PolarHBondContact O-N 3.25Å; S128-W138 PolarHBondContact OG-NE1 3.01Å
129	G	96.5	Very high	92.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.8	172.2	0	0	0	0	0	110.6	L115 S116	L115-G129 PolarHBondContact N-O 3.27Å; S116-G129 PolarHBondContact N-O 3.13Å; S116-G129 PolarHBondContact O-N 3.25Å
130	S	96.9	Very high	92.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	162.5	-174.8	172.2	0	0	0	0	112.7	H110 K112 D113 D132 K133 T134 V157	H110-S130 VanDerWaalsContact CE1-CB 3.47Å; H110-S130 WeakPolarHBondContact CE1-CB 3.49Å; H110-S130 WeakPolarHBondContact ND1-CB 3.09Å; K112-S130 PolarHBondContact O-OG 3.42Å; K112-S130 VanDerWaalsContact O-OG 3.08Å; D113-S130 VanDerWaalsContact O-CA 3.31Å; D113-S130 WeakPolarHBondContact O-CA 3.18Å; D113-S130 WeakPolarHBondContact O-CB 3.41Å; D113-S130 PolarHBondContact O-OG 2.82Å; S130-D132 VanDerWaalsContact CB-OD1 3.31Å; S130-D132 WeakPolarHBondContact CB-OD1 3.5Å; S130-D132 PolarHBondContact O-N 2.65Å; S130-D132 PolarHBondContact OG-N 3.41Å; S130-D132 VanDerWaalsContact OG-N 3.09Å; S130-D132 PolarHBondContact OG-OD1 2.99Å; S130-K133 PolarHBondContact O-N 2.99Å; S130-T134 PolarHBondContact N-O 3.48Å; S130-V157 PolarHBondContact O-N 3.37Å; S130-V157 VanDerWaalsContact O-N 3.16Å
131	R	96.1	Very high	92.6	Very high	48 Å²	48	38.4 Å²	38.4	18%	0.181	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.4	166.5	-68.8	-164.9	-178.3	151.9	13.5	113.8	K112 D113 L115 K133 W156	K112-R131 HydrophobicContact CB-CB 4.02Å; K112-R131 HydrophobicContact CD-CB 4.37Å; D113-R131 HydrophobicContact CB-CB 4.39Å; D113-R131 HydrophobicContact CB-CG 4.08Å; D113-R131 PolarHBondContact O-N 2.85Å; D113-R131 IonicContact OD2-CZ 3.52Å; D113-R131 IonicContact OD2-NE 2.74Å; D113-R131 IonicContact OD2-NH1 3.64Å; D113-R131 PolarHBondContact OD2-NH1 2.74Å; D113-R131 IonicContact OD2-NH2 3.12Å; L115-R131 HydrophobicContact CD1-CG 3.68Å; L115-R131 HydrophobicContact CD2-CG 4.15Å; L115-R131 HydrophobicContact CG-CG 3.91Å; R131-K133 PolarHBondContact O-N 2.96Å; R131-W156 HydrophobicContact CB-CD2 4.41Å; R131-W156 HydrophobicContact CB-CG 4.04Å; R131-W156 HydrophobicContact CG-CB 4.22Å; R131-W156 HydrophobicContact CG-CD2 3.81Å; R131-W156 HydrophobicContact CG-CE3 4.28Å; R131-W156 HydrophobicContact CG-CG 3.76Å
132	D	94.4	Very high	92.8	Very high	24 Å²	24	35.5 Å²	35.5	13%	0.128	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	1.9	168.8	73.3	11.4	0	0	0	113.4	H110 S111 K112 S130 T134	H110-D132 WeakPolarHBondContact CA-OD2 3.43Å; H110-D132 IonicContact CE1-OD1 2.78Å; H110-D132 IonicContact CE1-OD2 3.74Å; H110-D132 IonicContact CG-OD2 2.76Å; H110-D132 IonicContact ND1-OD1 3.88Å; H110-D132 PolarHBondContact ND1-OD1 3.07Å; H110-D132 IonicContact ND1-OD2 3.57Å; H110-D132 PolarHBondContact ND1-OD2 3.09Å; S111-D132 PolarHBondContact N-OD2 2.84Å; S111-D132 VanDerWaalsContact OG-CB 3.26Å; S111-D132 WeakPolarHBondContact OG-CB 3.3Å; K112-D132 HydrophobicContact CB-CB 4.17Å; K112-D132 HydrophobicContact CG-CB 4.35Å; S130-D132 VanDerWaalsContact CB-OD1 3.31Å; S130-D132 WeakPolarHBondContact CB-OD1 3.5Å; S130-D132 PolarHBondContact O-N 2.65Å; S130-D132 PolarHBondContact OG-N 3.41Å; S130-D132 VanDerWaalsContact OG-N 3.09Å; S130-D132 PolarHBondContact OG-OD1 2.99Å; D132-T134 VanDerWaalsContact CG-OG1 3.29Å; D132-T134 PolarHBondContact O-N 3.26Å; D132-T134 WeakPolarHBondContact OD1-CB 3.46Å; D132-T134 PolarHBondContact OD1-N 2.82Å; D132-T134 PolarHBondContact OD1-OG1 3.09Å; D132-T134 PolarHBondContact OD2-OG1 2.81Å
133	K	95.1	Very high	93.2	Very high	75 Å²	75	35.3 Å²	35.3	33%	0.326	17%	0.173	S	C	.	.	S	Bend	trans	72.6	10.9	176.1	-44.8	178.8	169.1	-154.1	0	113.3	S130 R131 T154 E155	S130-K133 PolarHBondContact O-N 2.99Å; R131-K133 PolarHBondContact O-N 2.96Å; K133-T154 VanDerWaalsContact CD-O 3.28Å; K133-T154 WeakPolarHBondContact CD-O 3.34Å; K133-T154 WeakPolarHBondContact CE-O 3.16Å; K133-T154 PolarHBondContact NZ-O 3.08Å; K133-E155 WeakPolarHBondContact CE-OE2 3.39Å; K133-E155 VanDerWaalsContact NZ-CD 3.33Å; K133-E155 IonicContact NZ-OE1 3.55Å; K133-E155 PolarHBondContact NZ-OE1 3.25Å; K133-E155 VanDerWaalsContact NZ-OE1 3.12Å; K133-E155 IonicContact NZ-OE2 3.54Å; K133-E155 PolarHBondContact NZ-OE2 3.36Å; K133-E155 VanDerWaalsContact NZ-OE2 3.08Å
134	T	95.1	Very high	93.6	Very high	9 Å²	9	35.9 Å²	35.9	6%	0.055	18%	0.179	C	C	.	.			trans	-111.7	155.3	-178.6	76.3	0	0	0	0	111.9	S130 D132 T147 Q149	S130-T134 PolarHBondContact N-O 3.48Å; D132-T134 VanDerWaalsContact CG-OG1 3.29Å; D132-T134 PolarHBondContact O-N 3.26Å; D132-T134 WeakPolarHBondContact OD1-CB 3.46Å; D132-T134 PolarHBondContact OD1-N 2.82Å; D132-T134 PolarHBondContact OD1-OG1 3.09Å; D132-T134 PolarHBondContact OD2-OG1 2.81Å; T134-T147 HydrophobicContact CG2-CG2 4.28Å; T134-Q149 HydrophobicContact CG2-CG 3.49Å; T134-Q149 VanDerWaalsContact CG2-CG 3.49Å
135	I	96.1	Very high	93.8	Very high	3 Å²	3	34 Å²	34	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.1	166.7	-58.6	168	0	0	0	107.2	V127 S128 I148 V157 V160 I171 S173 W183	V127-I135 HydrophobicContact CG2-CG2 3.35Å; S128-I135 VanDerWaalsContact O-CA 3.32Å; S128-I135 WeakPolarHBondContact O-CA 3.49Å; I135-I148 HydrophobicContact CB-CB 4.2Å; I135-I148 HydrophobicContact CB-CD1 4.38Å; I135-I148 HydrophobicContact CG2-CD1 4.29Å; I135-I148 PolarHBondContact N-O 2.96Å; I135-I148 PolarHBondContact O-N 2.91Å; I135-V157 HydrophobicContact CD1-CG1 4.38Å; I135-V157 HydrophobicContact CG1-CG1 4.01Å; I135-V157 HydrophobicContact CG1-CG2 4.11Å; I135-V160 HydrophobicContact CD1-CG1 4.31Å; I135-V160 HydrophobicContact CG1-CG1 4.19Å; I135-V160 HydrophobicContact CG2-CG1 4.35Å; I135-I171 HydrophobicContact CG2-CD1 4.2Å; I135-S173 VanDerWaalsContact CD1-CB 3.49Å; I135-S173 WeakPolarHBondContact CD1-OG 3.19Å; I135-W183 HydrophobicContact CD1-CZ2 4.09Å
136	K	95.6	Very high	93.9	Very high	22 Å²	22	36 Å²	36	10%	0.096	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137.6	178.2	-71.7	-178.9	-175.6	-81.3	0	110.8	G109 H110 V127 S128 W138 T147	G109-K136 WeakPolarHBondContact O-CE 3.43Å; H110-K136 VanDerWaalsContact CE1-CD 3.5Å; H110-K136 WeakPolarHBondContact CE1-CD 3.5Å; V127-K136 WeakPolarHBondContact CA-O 3.39Å; S128-K136 PolarHBondContact N-O 2.59Å; S128-K136 PolarHBondContact O-N 3.25Å; K136-W138 HydrophobicContact CB-CZ2 3.84Å; K136-W138 HydrophobicContact CD-CH2 4.17Å; K136-W138 HydrophobicContact CD-CZ2 3.63Å; K136-W138 HydrophobicContact CG-CZ2 4.37Å; K136-W138 PolarHBondContact O-NE1 2.99Å; K136-T147 HydrophobicContact CG-CG2 4.01Å; K136-T147 PolarHBondContact NZ-OG1 2.89Å
137	L	94.8	Very high	93.8	Very high	8 Å²	8	38 Å²	38	4%	0.042	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132	171.1	-70	171.6	0	0	0	109.4	I126 V127 C144 K145 Y146 F162 L185 C188	I126-L137 CarbonylContact O-C 3.59Å; I126-L137 WeakPolarHBondContact O-CA 3.49Å; V127-L137 HydrophobicContact CB-CD2 3.83Å; V127-L137 HydrophobicContact CG2-CD2 3.8Å; L137-C144 CarbonylContact O-C 3.55Å; L137-K145 PolarHBondContact O-N 2.94Å; L137-Y146 PolarHBondContact N-O 2.93Å; L137-Y146 PolarHBondContact O-N 3.01Å; L137-F162 HydrophobicContact CD2-CZ 4.41Å; L137-L185 HydrophobicContact CD1-CD1 3.8Å; L137-L185 HydrophobicContact CD2-CD1 3.78Å; L137-L185 HydrophobicContact CG-CD1 4.48Å; L137-C188 WeakPolarHBondContact CD1-SG 3.37Å
138	W	95.2	Very high	93.6	Very high	3 Å²	3	38.2 Å²	38.2	1%	0.011	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	151	-177.1	-44.2	78.4	0	0	0	110.1	L93 F107 H110 I126 S128 K136 V143 C144	L93-W138 HydrophobicContact CD1-CZ2 4.15Å; F107-W138 HydrophobicContact CB-CD2 4.31Å; F107-W138 HydrophobicContact CB-CE3 3.97Å; F107-W138 HydrophobicContact CB-CH2 4.3Å; F107-W138 HydrophobicContact CB-CZ3 3.96Å; F107-W138 HydrophobicContact CD1-CB 3.84Å; F107-W138 AromaticContact CD1-CD2 3.87Å; F107-W138 HydrophobicContact CD1-CD2 3.87Å; F107-W138 AromaticContact CD1-CE3 3.75Å; F107-W138 HydrophobicContact CD1-CE3 3.75Å; F107-W138 AromaticContact CD1-CG 3.93Å; F107-W138 HydrophobicContact CD1-CG 3.93Å; F107-W138 HydrophobicContact CE1-CB 3.97Å; F107-W138 HydrophobicContact CG-CE3 4.37Å; H110-W138 AromaticContact CD2-CZ2 3.89Å; I126-W138 HydrophobicContact CB-CB 4.12Å; I126-W138 HydrophobicContact CG2-CB 4.46Å; I126-W138 PolarHBondContact N-O 3.05Å; I126-W138 PolarHBondContact O-N 3.24Å; S128-W138 PolarHBondContact OG-NE1 3.01Å; K136-W138 HydrophobicContact CB-CZ2 3.84Å; K136-W138 HydrophobicContact CD-CH2 4.17Å; K136-W138 HydrophobicContact CD-CZ2 3.63Å; K136-W138 HydrophobicContact CG-CZ2 4.37Å; K136-W138 PolarHBondContact O-NE1 2.99Å; W138-V143 WeakPolarHBondContact CA-O 3.21Å; W138-C144 HydrophobicContact CD2-CB 4.3Å; W138-C144 HydrophobicContact CE3-CB 3.73Å; W138-C144 HydrophobicContact CH2-CB 4.18Å; W138-C144 HydrophobicContact CZ3-CB 3.67Å
139	N	91.9	Very high	93	Very high	24 Å²	24	44 Å²	44	13%	0.128	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	166.6	160.9	67.2	11.3	0	0	0	110.1	F107 L141 G142 V143 K145	F107-N139 VanDerWaalsContact CE1-O 3.3Å; F107-N139 WeakPolarHBondContact CE1-O 3.04Å; N139-L141 PolarHBondContact O-N 2.96Å; N139-L141 VanDerWaalsContact O-N 3.08Å; N139-L141 WeakPolarHBondContact OD1-CA 3.44Å; N139-L141 WeakPolarHBondContact OD1-CB 3.48Å; N139-L141 PolarHBondContact OD1-N 3.32Å; N139-G142 PolarHBondContact O-N 3.43Å; N139-G142 PolarHBondContact OD1-N 2.51Å; N139-G142 VanDerWaalsContact OD1-N 3.1Å; N139-V143 PolarHBondContact N-O 2.91Å; N139-V143 WeakPolarHBondContact OD1-CB 3.35Å; N139-V143 PolarHBondContact OD1-N 3.24Å; N139-V143 PolarHBondContact OD1-O 2.79Å; N139-K145 HydrophobicContact CB-CD 4.23Å; N139-K145 HydrophobicContact CB-CG 4.47Å
140	T	87.8	Confident	92.2	Very high	46 Å²	46	50.2 Å²	50.2	28%	0.282	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.5	174.8	55.4	0	0	0	0	113.5	R105 N123 G142	R105-T140 WeakPolarHBondContact CD-O 3.44Å; R105-T140 PolarHBondContact NH1-O 2.93Å; N123-T140 WeakPolarHBondContact O-CG2 3.42Å; T140-G142 VanDerWaalsContact C-N 3.29Å; T140-G142 PolarHBondContact O-N 3.15Å
141	L	89.6	Confident	91.5	Very high	105 Å²	105	56.7 Å²	56.7	55%	0.55	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-6.1	179.9	-52.1	179.8	0	0	0	114.3	R105 N139	R105-L141 VanDerWaalsContact NH1-CD2 3.34Å; N139-L141 PolarHBondContact O-N 2.96Å; N139-L141 VanDerWaalsContact O-N 3.08Å; N139-L141 WeakPolarHBondContact OD1-CA 3.44Å; N139-L141 WeakPolarHBondContact OD1-CB 3.48Å; N139-L141 PolarHBondContact OD1-N 3.32Å
142	G	88.4	Confident	91	Very high	18 Å²	18	55 Å²	55	19%	0.186	28%	0.284	C	S	.	.	S	Bend	trans	96.6	2.1	-179	0	0	0	0	0	114.8	F107 N139 T140	F107-G142 VanDerWaalsContact CE1-CA 3.47Å; N139-G142 PolarHBondContact O-N 3.43Å; N139-G142 PolarHBondContact OD1-N 2.51Å; N139-G142 VanDerWaalsContact OD1-N 3.1Å; T140-G142 VanDerWaalsContact C-N 3.29Å; T140-G142 PolarHBondContact O-N 3.15Å
143	V	92.3	Very high	91	Very high	83 Å²	83	54.4 Å²	54.4	50%	0.503	28%	0.28	S	S	.	.			trans	-94.2	127.6	-176.3	-174.4	0	0	0	0	110	W138 N139 K145	W138-V143 WeakPolarHBondContact CA-O 3.21Å; N139-V143 PolarHBondContact N-O 2.91Å; N139-V143 WeakPolarHBondContact OD1-CB 3.35Å; N139-V143 PolarHBondContact OD1-N 3.24Å; N139-V143 PolarHBondContact OD1-O 2.79Å; V143-K145 PolarHBondContact O-N 3.19Å
144	C	93.6	Very high	90.9	Very high	45 Å²	45	55.3 Å²	55.3	30%	0.304	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	112.5	170.4	-174.3	0	0	0	0	109	L137 W138	L137-C144 CarbonylContact O-C 3.55Å; W138-C144 HydrophobicContact CD2-CB 4.3Å; W138-C144 HydrophobicContact CE3-CB 3.73Å; W138-C144 HydrophobicContact CH2-CB 4.18Å; W138-C144 HydrophobicContact CZ3-CB 3.67Å
145	K	92.3	Very high	90.9	Very high	141 Å²	141	58.7 Å²	58.7	61%	0.613	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	-38.9	178.3	-80.1	-174.4	160.9	179.9	0	112.1	L137 N139 V143	L137-K145 PolarHBondContact O-N 2.94Å; N139-K145 HydrophobicContact CB-CD 4.23Å; N139-K145 HydrophobicContact CB-CG 4.47Å; V143-K145 PolarHBondContact O-N 3.19Å
146	Y	92.4	Very high	90.9	Very high	101 Å²	101	62 Å²	62	40%	0.396	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	144.9	-175.7	-156.2	-98.8	0	0	0	110.4	L137 I148 C188	L137-Y146 PolarHBondContact N-O 2.93Å; L137-Y146 PolarHBondContact O-N 3.01Å; Y146-I148 HydrophobicContact CD1-CG1 3.74Å; Y146-I148 HydrophobicContact CE1-CG1 4Å; Y146-C188 HydrophobicContact CD1-CB 3.48Å; Y146-C188 VanDerWaalsContact CD1-CB 3.48Å; Y146-C188 HydrophobicContact CE1-CB 3.29Å; Y146-C188 HydrophobicContact CG-CB 4.19Å
147	T	93.8	Very high	91	Very high	43 Å²	43	60.9 Å²	60.9	26%	0.264	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.2	171.6	-60	0	0	0	0	107.5	T134 K136 Q149	T134-T147 HydrophobicContact CG2-CG2 4.28Å; K136-T147 HydrophobicContact CG-CG2 4.01Å; K136-T147 PolarHBondContact NZ-OG1 2.89Å; T147-Q149 HydrophobicContact CG2-CG 3.93Å; T147-Q149 PolarHBondContact O-N 3.01Å
148	I	90.6	Very high	91	Very high	5 Å²	5	61.1 Å²	61.1	3%	0.026	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	104	175.8	-53.5	175.6	0	0	0	107	I135 Y146 I171 W183 C188	I135-I148 HydrophobicContact CB-CB 4.2Å; I135-I148 HydrophobicContact CB-CD1 4.38Å; I135-I148 HydrophobicContact CG2-CD1 4.29Å; I135-I148 PolarHBondContact N-O 2.96Å; I135-I148 PolarHBondContact O-N 2.91Å; Y146-I148 HydrophobicContact CD1-CG1 3.74Å; Y146-I148 HydrophobicContact CE1-CG1 4Å; I148-I171 HydrophobicContact CD1-CD1 3.76Å; I148-W183 HydrophobicContact CG2-CD2 4.23Å; I148-W183 HydrophobicContact CG2-CE3 3.62Å; I148-W183 HydrophobicContact CG2-CH2 3.73Å; I148-W183 HydrophobicContact CG2-CZ2 4.31Å; I148-W183 HydrophobicContact CG2-CZ3 3.35Å; I148-C188 HydrophobicContact CD1-CB 4.47Å; I148-C188 HydrophobicContact CG1-CB 4.33Å
149	Q	84.3	Confident	91.1	Very high	121 Å²	121	61.2 Å²	61.2	57%	0.565	32%	0.318	S	S	*	.			trans	-118.1	-38.8	173.7	-86.3	170.7	9.6	0	0	110.8	T134 T147 E151 G152	T134-Q149 HydrophobicContact CG2-CG 3.49Å; T134-Q149 VanDerWaalsContact CG2-CG 3.49Å; T147-Q149 HydrophobicContact CG2-CG 3.93Å; T147-Q149 PolarHBondContact O-N 3.01Å; Q149-E151 PolarHBondContact O-N 2.65Å; Q149-G152 WeakPolarHBondContact O-CA 3.17Å; Q149-G152 PolarHBondContact O-N 2.63Å
150	D	79.3	Confident	91.3	Very high	131 Å²	131	60.1 Å²	60.1	70%	0.701	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	125.8	178.6	-60.2	-29.7	0	0	0	110.4	G152	D150-G152 PolarHBondContact O-N 3.07Å; D150-G152 VanDerWaalsContact O-N 3.1Å
151	E	83.8	Confident	91.7	Very high	135 Å²	135	60.1 Å²	60.1	63%	0.631	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	20.8	-172.4	-53.4	-175.7	161.8	0	0	114.4	Q149 K181 W183 L190	Q149-E151 PolarHBondContact O-N 2.65Å; E151-K181 PolarHBondContact O-NZ 3.36Å; E151-W183 VanDerWaalsContact O-CH2 3.27Å; E151-W183 WeakPolarHBondContact O-CH2 3.27Å; E151-L190 HydrophobicContact CB-CB 4.5Å; E151-L190 HydrophobicContact CB-CD2 3.95Å; E151-L190 WeakPolarHBondContact OE2-CB 3.49Å; E151-L190 WeakPolarHBondContact OE2-CD2 3.44Å
152	G	85.4	Confident	92	Very high	14 Å²	14	56.4 Å²	56.4	14%	0.144	29%	0.287	C	S	.	.			trans	-55.9	-175.4	177.6	0	0	0	0	0	115.5	Q149 D150 K181	Q149-G152 WeakPolarHBondContact O-CA 3.17Å; Q149-G152 PolarHBondContact O-N 2.63Å; D150-G152 PolarHBondContact O-N 3.07Å; D150-G152 VanDerWaalsContact O-N 3.1Å; G152-K181 WeakPolarHBondContact O-CE 3.38Å; G152-K181 PolarHBondContact O-NZ 2.97Å
153	H	93.1	Very high	92.1	Very high	10 Å²	10	56.2 Å²	56.2	5%	0.046	28%	0.282	C	S	.	.			trans	-73.5	142.1	168.1	-73.6	-82.4	0	0	0	110	E155 V157 S173 G175 D177 M179	H153-E155 VanDerWaalsContact C-N 3.29Å; H153-E155 WeakPolarHBondContact CB-O 3.09Å; H153-V157 HydrophobicContact CB-CG2 4.03Å; H153-S173 PolarHBondContact NE2-OG 3.47Å; H153-G175 PolarHBondContact CE1-N 3.43Å; H153-D177 VanDerWaalsContact CA-OD2 3.24Å; H153-D177 WeakPolarHBondContact CA-OD2 3.48Å; H153-D177 WeakPolarHBondContact CB-OD2 3.22Å; H153-D177 IonicContact CE1-OD1 2.82Å; H153-D177 IonicContact CG-OD1 3.38Å; H153-D177 IonicContact CG-OD2 2.65Å; H153-D177 VanDerWaalsContact ND1-CG 3.28Å; H153-D177 IonicContact ND1-OD1 3.72Å; H153-D177 PolarHBondContact ND1-OD1 3.15Å; H153-D177 IonicContact ND1-OD2 3.73Å; H153-D177 PolarHBondContact ND1-OD2 2.51Å; H153-M179 PolarHBondContact CE1-O 2.83Å
154	T	93.9	Very high	91.9	Very high	94 Å²	94	55 Å²	55	58%	0.577	28%	0.276	S	S	*	.	S	Bend	trans	-80	-17.2	176.5	59.1	0	0	0	0	112.2	K133 D177	K133-T154 VanDerWaalsContact CD-O 3.28Å; K133-T154 WeakPolarHBondContact CD-O 3.34Å; K133-T154 WeakPolarHBondContact CE-O 3.16Å; K133-T154 PolarHBondContact NZ-O 3.08Å; T154-D177 PolarHBondContact N-OD2 2.97Å; T154-D177 VanDerWaalsContact N-OD2 3.16Å; T154-D177 WeakPolarHBondContact OG1-CB 3.37Å
155	E	95.8	Very high	91.5	Very high	80 Å²	80	54.6 Å²	54.6	37%	0.374	27%	0.271	S	S	.	.	S	Bend	trans	-129.3	-168.7	177.3	-69.7	-55	147.6	0	0	111.8	K133 H153 V157 W176 D177	K133-E155 WeakPolarHBondContact CE-OE2 3.39Å; K133-E155 VanDerWaalsContact NZ-CD 3.33Å; K133-E155 IonicContact NZ-OE1 3.55Å; K133-E155 PolarHBondContact NZ-OE1 3.25Å; K133-E155 VanDerWaalsContact NZ-OE1 3.12Å; K133-E155 IonicContact NZ-OE2 3.54Å; K133-E155 PolarHBondContact NZ-OE2 3.36Å; K133-E155 VanDerWaalsContact NZ-OE2 3.08Å; H153-E155 VanDerWaalsContact C-N 3.29Å; H153-E155 WeakPolarHBondContact CB-O 3.09Å; E155-V157 PolarHBondContact O-N 3.28Å; E155-W176 HydrophobicContact CB-CB 3.94Å; E155-D177 HydrophobicContact CB-CB 4.19Å
156	W	95.8	Very high	90.7	Very high	72 Å²	72	53.5 Å²	53.5	27%	0.273	28%	0.281	S	S	.	.			trans	-56.4	136.9	-176.8	-55.7	-16.4	0	0	0	112	L115 R131 S158 G175 W176	L115-W156 HydrophobicContact CD1-CB 4.33Å; R131-W156 HydrophobicContact CB-CD2 4.41Å; R131-W156 HydrophobicContact CB-CG 4.04Å; R131-W156 HydrophobicContact CG-CB 4.22Å; R131-W156 HydrophobicContact CG-CD2 3.81Å; R131-W156 HydrophobicContact CG-CE3 4.28Å; R131-W156 HydrophobicContact CG-CG 3.76Å; W156-S158 PolarHBondContact O-N 3.17Å; W156-G175 CarbonylContact O-C 3.56Å; W156-G175 WeakPolarHBondContact O-CA 3.41Å; W156-W176 HydrophobicContact CB-CB 4.31Å; W156-W176 HydrophobicContact CB-CG 4.14Å; W156-W176 HydrophobicContact CD2-CD2 4.42Å; W156-W176 AromaticContact CE3-CD2 3.64Å; W156-W176 HydrophobicContact CE3-CD2 3.64Å; W156-W176 AromaticContact CE3-CE2 3.73Å; W156-W176 AromaticContact CE3-CE3 3.74Å; W156-W176 HydrophobicContact CE3-CE3 3.74Å; W156-W176 HydrophobicContact CE3-CG 4.24Å; W156-W176 HydrophobicContact CE3-CH2 4.05Å; W156-W176 AromaticContact CE3-CZ2 3.95Å; W156-W176 HydrophobicContact CE3-CZ2 3.95Å; W156-W176 AromaticContact CE3-CZ3 3.94Å; W156-W176 HydrophobicContact CE3-CZ3 3.94Å; W156-W176 HydrophobicContact CH2-CZ3 4.38Å; W156-W176 HydrophobicContact CZ3-CD2 4.17Å; W156-W176 AromaticContact CZ3-CE3 3.88Å; W156-W176 HydrophobicContact CZ3-CE3 3.88Å; W156-W176 AromaticContact CZ3-CH2 3.61Å; W156-W176 HydrophobicContact CZ3-CH2 3.61Å; W156-W176 AromaticContact CZ3-CZ2 3.91Å; W156-W176 HydrophobicContact CZ3-CZ2 3.91Å; W156-W176 AromaticContact CZ3-CZ3 3.59Å; W156-W176 HydrophobicContact CZ3-CZ3 3.59Å; W156-W176 PolarHBondContact O-N 3.37Å
157	V	96.9	Very high	90.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	109.6	170.4	-172	0	0	0	0	107.7	L115 S130 I135 H153 E155 V160	L115-V157 WeakPolarHBondContact CD1-O 3.36Å; S130-V157 PolarHBondContact O-N 3.37Å; S130-V157 VanDerWaalsContact O-N 3.16Å; I135-V157 HydrophobicContact CD1-CG1 4.38Å; I135-V157 HydrophobicContact CG1-CG1 4.01Å; I135-V157 HydrophobicContact CG1-CG2 4.11Å; H153-V157 HydrophobicContact CB-CG2 4.03Å; E155-V157 PolarHBondContact O-N 3.28Å; V157-V160 HydrophobicContact CG1-CG1 3.66Å
158	S	95.9	Very high	89.3	Confident	12 Å²	12	53.5 Å²	53.5	8%	0.084	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-44	-173.6	45.5	0	0	0	0	112.8	S116 W156 C174 L201	S116-S158 WeakPolarHBondContact CB-O 3.37Å; W156-S158 PolarHBondContact O-N 3.17Å; S158-C174 PolarHBondContact N-O 3.44Å; S158-C174 PolarHBondContact OG-O 3.2Å; S158-C174 VanDerWaalsContact OG-O 3.1Å; S158-C174 PolarHBondContact OG-SG 2.89Å; S158-L201 WeakPolarHBondContact CB-O 3.37Å; S158-L201 PolarHBondContact OG-O 2.81Å
159	C	96.8	Very high	89.1	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.034	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	142.7	-179.9	-170.1	0	0	0	0	111.6	S173 C174 V204	C159-S173 VanDerWaalsContact O-CA 3.31Å; C159-S173 WeakPolarHBondContact O-CA 3.46Å; C159-C174 VanDerWaalsContact CB-SG 3.56Å; C159-C174 PolarHBondContact N-O 3.43Å; C159-C174 PolarHBondContact O-N 3.46Å; C159-V204 HydrophobicContact CB-CG1 3.98Å
160	V	96.6	Very high	89.5	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.2	173.9	-65.6	0	0	0	0	109.5	S116 V127 I135 V157 V172	S116-V160 PolarHBondContact OG-N 3.13Å; S116-V160 VanDerWaalsContact OG-N 3.09Å; S116-V160 PolarHBondContact OG-O 3.01Å; V127-V160 HydrophobicContact CG1-CB 4.22Å; V127-V160 HydrophobicContact CG1-CG2 3.9Å; V127-V160 HydrophobicContact CG2-CB 4.46Å; V127-V160 HydrophobicContact CG2-CG2 4.39Å; I135-V160 HydrophobicContact CD1-CG1 4.31Å; I135-V160 HydrophobicContact CG1-CG1 4.19Å; I135-V160 HydrophobicContact CG2-CG1 4.35Å; V157-V160 HydrophobicContact CG1-CG1 3.66Å; V160-V172 WeakPolarHBondContact CA-O 3.37Å
161	R	96.1	Very high	90.2	Very high	47 Å²	47	44.2 Å²	44.2	18%	0.177	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.4	178.5	-64.2	-65	176.9	-117.5	13.3	110.6	D74 S116 V117 I171 V172 V204 V206	D74-R161 IonicContact OD1-NH2 3.39Å; D74-R161 PolarHBondContact OD1-NH2 3.3Å; D74-R161 IonicContact OD2-CZ 2.93Å; D74-R161 IonicContact OD2-NH1 3.51Å; D74-R161 PolarHBondContact OD2-NH1 2.9Å; D74-R161 IonicContact OD2-NH2 2.91Å; D74-R161 PolarHBondContact OD2-NH2 2.78Å; S116-R161 PolarHBondContact OG-NH1 2.88Å; V117-R161 PolarHBondContact O-NH1 3.24Å; V117-R161 VanDerWaalsContact O-NH1 3.08Å; R161-I171 WeakPolarHBondContact O-CA 3.43Å; R161-V172 PolarHBondContact N-O 3.09Å; R161-V172 PolarHBondContact O-N 2.65Å; R161-V204 HydrophobicContact CG-CG1 4.26Å; R161-V204 WeakPolarHBondContact CG-O 3.41Å; R161-V206 HydrophobicContact CB-CG2 4.29Å
162	F	94.1	Very high	90.7	Very high	26 Å²	26	37.8 Å²	37.8	11%	0.114	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	143	169.1	-79	-83.2	0	0	0	109.9	A118 F119 Q125 V127 L137 I171 L185	A118-F162 HydrophobicContact CB-CD2 3.96Å; A118-F162 HydrophobicContact CB-CE2 4.47Å; F119-F162 WeakPolarHBondContact O-CD2 3.36Å; Q125-F162 HydrophobicContact CB-CZ 4.34Å; V127-F162 HydrophobicContact CB-CE2 3.69Å; V127-F162 HydrophobicContact CB-CZ 3.8Å; V127-F162 HydrophobicContact CG1-CD2 3.74Å; V127-F162 HydrophobicContact CG1-CE2 3.28Å; V127-F162 HydrophobicContact CG1-CZ 3.86Å; L137-F162 HydrophobicContact CD2-CZ 4.41Å; F162-I171 HydrophobicContact CD1-CG2 3.4Å; F162-I171 HydrophobicContact CE1-CG2 3.34Å; F162-I171 HydrophobicContact CG-CG2 4.08Å; F162-I171 HydrophobicContact CZ-CG2 4.01Å; F162-L185 HydrophobicContact CD1-CD2 4.43Å; F162-L185 HydrophobicContact CE1-CD1 3.89Å; F162-L185 HydrophobicContact CE1-CD2 3.8Å; F162-L185 HydrophobicContact CE1-CG 4.48Å
163	S	91.9	Very high	91.3	Very high	14 Å²	14	37.1 Å²	37.1	10%	0.098	22%	0.215	C	C	.	.			trans	-75.2	134.1	161.8	-179.6	0	0	0	0	109.2	N165 I170	S163-N165 PolarHBondContact O-N 2.87Å; S163-N165 PolarHBondContact OG-N 3.21Å; S163-I170 PolarHBondContact N-O 3.26Å
164	P	88.1	Confident	91.4	Very high	58 Å²	58	36.7 Å²	36.7	38%	0.377	21%	0.212	S	C	.	.			trans	-73	-9.1	177.1	30.6	-35	0	0	0	112.9	S166 S207 P208	P164-S166 PolarHBondContact O-N 3.27Å; P164-S207 WeakPolarHBondContact CG-O 3.22Å; P164-P208 WeakPolarHBondContact CG-O 3.31Å
165	N	84.2	Confident	91.5	Very high	36 Å²	36	32.2 Å²	32.2	19%	0.193	19%	0.185	C	C	.	.			trans	-68	117.3	-178	-171.6	-10.2	0	0	0	111.5	S163 S167 N168	S163-N165 PolarHBondContact O-N 2.87Å; S163-N165 PolarHBondContact OG-N 3.21Å; N165-S167 VanDerWaalsContact CG-OG 3.32Å; N165-S167 PolarHBondContact ND2-OG 3.01Å; N165-S167 WeakPolarHBondContact OD1-CB 3.3Å; N165-S167 PolarHBondContact OD1-N 3.17Å; N165-S167 PolarHBondContact OD1-OG 3.33Å; N165-N168 CarbonylContact O-C 3.5Å
166	S	76.6	Confident	91.5	Very high	119 Å²	119	32.5 Å²	32.5	83%	0.832	18%	0.183	S	C	*	.	S	Bend	trans	-73.2	-25.3	-179.5	58.9	0	0	0	0	113.7	P164	P164-S166 PolarHBondContact O-N 3.27Å
167	S	79.1	Confident	91.4	Very high	98 Å²	98	30.2 Å²	30.2	69%	0.685	18%	0.176	S	C	*	.	S	Bend	trans	-73.3	-29.5	-178.8	67	0	0	0	0	112.8	N165	N165-S167 VanDerWaalsContact CG-OG 3.32Å; N165-S167 PolarHBondContact ND2-OG 3.01Å; N165-S167 WeakPolarHBondContact OD1-CB 3.3Å; N165-S167 PolarHBondContact OD1-N 3.17Å; N165-S167 PolarHBondContact OD1-OG 3.33Å
168	N	78	Confident	91.3	Very high	45 Å²	45	34.9 Å²	34.9	24%	0.241	20%	0.196	C	C	.	.	S	Bend	trans	-136.4	87.1	-178.8	-159.1	-11	0	0	0	110	N165 I170 K191	N165-N168 CarbonylContact O-C 3.5Å; N168-I170 HydrophobicContact CB-CD1 4.13Å; N168-I170 VanDerWaalsContact CG-CD1 3.41Å; N168-I170 WeakPolarHBondContact O-CG1 3.35Å; N168-I170 PolarHBondContact O-N 3.07Å; N168-I170 WeakPolarHBondContact OD1-CD1 3.38Å; N168-I170 WeakPolarHBondContact OD1-CG1 3.34Å; N168-K191 PolarHBondContact ND2-NZ 2.87Å
169	P	85.9	Confident	91.2	Very high	53 Å²	53	36.2 Å²	36.2	34%	0.344	20%	0.201	S	C	.	.			trans	-68.9	104	-176.4	29.1	-34.7	0	0	0	109.5	L185	P169-L185 HydrophobicContact CB-CB 4.1Å; P169-L185 HydrophobicContact CB-CD2 4.11Å; P169-L185 WeakPolarHBondContact O-CB 3.2Å; P169-L185 PolarHBondContact O-N 3.23Å
170	I	92.1	Very high	91.2	Very high	6 Å²	6	36 Å²	36	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.7	-173.3	-74.4	171	0	0	0	109.4	S163 N168 V172 V182 W183 K191	S163-I170 PolarHBondContact N-O 3.26Å; N168-I170 HydrophobicContact CB-CD1 4.13Å; N168-I170 VanDerWaalsContact CG-CD1 3.41Å; N168-I170 WeakPolarHBondContact O-CG1 3.35Å; N168-I170 PolarHBondContact O-N 3.07Å; N168-I170 WeakPolarHBondContact OD1-CD1 3.38Å; N168-I170 WeakPolarHBondContact OD1-CG1 3.34Å; I170-V172 HydrophobicContact CG2-CG2 4.22Å; I170-V182 HydrophobicContact CD1-CG1 4.31Å; I170-V182 HydrophobicContact CG2-CG1 3.25Å; I170-W183 VanDerWaalsContact CA-O 3.3Å; I170-W183 WeakPolarHBondContact CA-O 3.39Å; I170-K191 HydrophobicContact CD1-CD 3.84Å
171	I	93.6	Very high	91.1	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141	163.3	57.3	170.3	0	0	0	109.2	V127 I135 I148 R161 F162 W183 L185	V127-I171 HydrophobicContact CG2-CD1 4.23Å; I135-I171 HydrophobicContact CG2-CD1 4.2Å; I148-I171 HydrophobicContact CD1-CD1 3.76Å; R161-I171 WeakPolarHBondContact O-CA 3.43Å; F162-I171 HydrophobicContact CD1-CG2 3.4Å; F162-I171 HydrophobicContact CE1-CG2 3.34Å; F162-I171 HydrophobicContact CG-CG2 4.08Å; F162-I171 HydrophobicContact CZ-CG2 4.01Å; I171-W183 HydrophobicContact CD1-CB 3.91Å; I171-W183 HydrophobicContact CD1-CG 4.01Å; I171-W183 HydrophobicContact CG1-CB 3.51Å; I171-W183 HydrophobicContact CG1-CG 3.88Å; I171-W183 PolarHBondContact N-O 3.41Å; I171-W183 PolarHBondContact O-N 2.99Å; I171-L185 HydrophobicContact CG2-CD1 4.18Å
172	V	95.6	Very high	91	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.1	172.8	-171.7	0	0	0	0	107.8	V160 R161 I170 V180 K181 V182 V204 V206 L227	V160-V172 WeakPolarHBondContact CA-O 3.37Å; R161-V172 PolarHBondContact N-O 3.09Å; R161-V172 PolarHBondContact O-N 2.65Å; I170-V172 HydrophobicContact CG2-CG2 4.22Å; V172-V180 HydrophobicContact CG1-CG1 3.64Å; V172-K181 WeakPolarHBondContact CA-O 3.35Å; V172-V182 HydrophobicContact CG1-CG2 4.43Å; V172-V182 HydrophobicContact CG2-CG2 4.44Å; V172-V204 HydrophobicContact CG1-CG2 3.82Å; V172-V206 HydrophobicContact CB-CG2 4.35Å; V172-V206 HydrophobicContact CG2-CG2 4.02Å; V172-L227 HydrophobicContact CG2-CD1 4.13Å; V172-L227 HydrophobicContact CG2-CD2 3.8Å
173	S	96.3	Very high	91	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.1	175.5	64.5	0	0	0	0	110.9	I135 H153 C159 V180 K181 W183	I135-S173 VanDerWaalsContact CD1-CB 3.49Å; I135-S173 WeakPolarHBondContact CD1-OG 3.19Å; H153-S173 PolarHBondContact NE2-OG 3.47Å; C159-S173 VanDerWaalsContact O-CA 3.31Å; C159-S173 WeakPolarHBondContact O-CA 3.46Å; S173-V180 CarbonylContact O-C 3.55Å; S173-V180 WeakPolarHBondContact O-CA 3.49Å; S173-K181 PolarHBondContact N-O 3.06Å; S173-K181 PolarHBondContact O-N 2.81Å; S173-K181 PolarHBondContact OG-O 2.83Å; S173-W183 PolarHBondContact OG-NE1 2.88Å
174	C	96.3	Very high	91	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	150	166.7	66.9	0	0	0	0	110.4	S158 C159 V180 L201 T203 V204	S158-C174 PolarHBondContact N-O 3.44Å; S158-C174 PolarHBondContact OG-O 3.2Å; S158-C174 VanDerWaalsContact OG-O 3.1Å; S158-C174 PolarHBondContact OG-SG 2.89Å; C159-C174 VanDerWaalsContact CB-SG 3.56Å; C159-C174 PolarHBondContact N-O 3.43Å; C159-C174 PolarHBondContact O-N 3.46Å; C174-V180 HydrophobicContact CB-CG2 4.16Å; C174-L201 HydrophobicContact CB-CB 3.87Å; C174-L201 HydrophobicContact CB-CD1 3.8Å; C174-L201 HydrophobicContact CB-CG 4.48Å; C174-T203 VanDerWaalsContact SG-C 3.55Å; C174-V204 HydrophobicContact CB-CB 4.08Å; C174-V204 HydrophobicContact CB-CG1 4.37Å
175	G	95.3	Very high	90.9	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	166.3	-177.4	0	0	0	0	0	113.9	H153 W156 D177 K178 M179 L201	H153-G175 PolarHBondContact CE1-N 3.43Å; W156-G175 CarbonylContact O-C 3.56Å; W156-G175 WeakPolarHBondContact O-CA 3.41Å; G175-D177 WeakPolarHBondContact CA-OD1 3.41Å; G175-D177 PolarHBondContact O-N 3.29Å; G175-K178 PolarHBondContact O-N 2.86Å; G175-M179 PolarHBondContact N-O 2.8Å; G175-M179 VanDerWaalsContact N-O 3.13Å; G175-L201 WeakPolarHBondContact O-CB 3.4Å; G175-L201 PolarHBondContact O-N 2.71Å
176	W	95.7	Very high	91	Very high	86 Å²	86	35.4 Å²	35.4	33%	0.326	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-8.2	173.6	-79.8	42.9	0	0	0	112.8	E155 W156 K178 Y200	E155-W176 HydrophobicContact CB-CB 3.94Å; W156-W176 HydrophobicContact CB-CB 4.31Å; W156-W176 HydrophobicContact CB-CG 4.14Å; W156-W176 HydrophobicContact CD2-CD2 4.42Å; W156-W176 AromaticContact CE3-CD2 3.64Å; W156-W176 HydrophobicContact CE3-CD2 3.64Å; W156-W176 AromaticContact CE3-CE2 3.73Å; W156-W176 AromaticContact CE3-CE3 3.74Å; W156-W176 HydrophobicContact CE3-CE3 3.74Å; W156-W176 HydrophobicContact CE3-CG 4.24Å; W156-W176 HydrophobicContact CE3-CH2 4.05Å; W156-W176 AromaticContact CE3-CZ2 3.95Å; W156-W176 HydrophobicContact CE3-CZ2 3.95Å; W156-W176 AromaticContact CE3-CZ3 3.94Å; W156-W176 HydrophobicContact CE3-CZ3 3.94Å; W156-W176 HydrophobicContact CH2-CZ3 4.38Å; W156-W176 HydrophobicContact CZ3-CD2 4.17Å; W156-W176 AromaticContact CZ3-CE3 3.88Å; W156-W176 HydrophobicContact CZ3-CE3 3.88Å; W156-W176 AromaticContact CZ3-CH2 3.61Å; W156-W176 HydrophobicContact CZ3-CH2 3.61Å; W156-W176 AromaticContact CZ3-CZ2 3.91Å; W156-W176 HydrophobicContact CZ3-CZ2 3.91Å; W156-W176 AromaticContact CZ3-CZ3 3.59Å; W156-W176 HydrophobicContact CZ3-CZ3 3.59Å; W156-W176 PolarHBondContact O-N 3.37Å; W176-K178 PolarHBondContact O-N 3.08Å; W176-Y200 HydrophobicContact CD2-CD2 4.25Å; W176-Y200 HydrophobicContact CD2-CG 4.21Å; W176-Y200 HydrophobicContact CE3-CG 4.27Å; W176-Y200 HydrophobicContact CH2-CD2 4.46Å; W176-Y200 HydrophobicContact CH2-CE2 4.35Å; W176-Y200 HydrophobicContact CZ2-CD2 4.12Å; W176-Y200 HydrophobicContact CZ2-CE2 4.17Å
177	D	93.9	Very high	91.4	Very high	25 Å²	25	33.5 Å²	33.5	13%	0.134	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	6.1	169	63.8	-7.8	0	0	0	113.2	H153 T154 E155 G175 M179	H153-D177 VanDerWaalsContact CA-OD2 3.24Å; H153-D177 WeakPolarHBondContact CA-OD2 3.48Å; H153-D177 WeakPolarHBondContact CB-OD2 3.22Å; H153-D177 IonicContact CE1-OD1 2.82Å; H153-D177 IonicContact CG-OD1 3.38Å; H153-D177 IonicContact CG-OD2 2.65Å; H153-D177 VanDerWaalsContact ND1-CG 3.28Å; H153-D177 IonicContact ND1-OD1 3.72Å; H153-D177 PolarHBondContact ND1-OD1 3.15Å; H153-D177 IonicContact ND1-OD2 3.73Å; H153-D177 PolarHBondContact ND1-OD2 2.51Å; T154-D177 PolarHBondContact N-OD2 2.97Å; T154-D177 VanDerWaalsContact N-OD2 3.16Å; T154-D177 WeakPolarHBondContact OG1-CB 3.37Å; E155-D177 HydrophobicContact CB-CB 4.19Å; G175-D177 WeakPolarHBondContact CA-OD1 3.41Å; G175-D177 PolarHBondContact O-N 3.29Å; D177-M179 PolarHBondContact O-N 3Å; D177-M179 PolarHBondContact OD1-N 3.37Å
178	K	94.9	Very high	91.7	Very high	98 Å²	98	29.9 Å²	29.9	43%	0.426	16%	0.163	S	C	.	.	S	Bend	trans	69.6	12.6	178.5	-37.3	179.6	-179.2	-173.9	0	113.5	G175 W176 H197 T198 G199	G175-K178 PolarHBondContact O-N 2.86Å; W176-K178 PolarHBondContact O-N 3.08Å; K178-H197 HydrophobicContact CB-CB 4.4Å; K178-T198 WeakPolarHBondContact CD-O 3.49Å; K178-T198 VanDerWaalsContact CE-O 3.29Å; K178-T198 WeakPolarHBondContact CE-O 3.26Å; K178-T198 PolarHBondContact NZ-O 3.1Å; K178-G199 WeakPolarHBondContact CB-O 3.39Å; K178-G199 VanDerWaalsContact CG-O 3.3Å; K178-G199 WeakPolarHBondContact CG-O 3.4Å
179	M	94.1	Very high	92.2	Very high	39 Å²	39	34.5 Å²	34.5	19%	0.192	18%	0.181	C	C	.	.			trans	-103.9	139.9	-176.9	-61.3	-67.9	-83.5	0	0	110.2	H153 G175 D177 K181 N193 I195	H153-M179 PolarHBondContact CE1-O 2.83Å; G175-M179 PolarHBondContact N-O 2.8Å; G175-M179 VanDerWaalsContact N-O 3.13Å; D177-M179 PolarHBondContact O-N 3Å; D177-M179 PolarHBondContact OD1-N 3.37Å; M179-K181 HydrophobicContact CB-CG 4.31Å; M179-N193 HydrophobicContact CE-CB 3.9Å; M179-I195 HydrophobicContact CE-CD1 4.36Å; M179-I195 HydrophobicContact CE-CG1 3.61Å; M179-I195 HydrophobicContact SD-CG1 3.85Å
180	V	96.3	Very high	92.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.9	160.2	179.8	0	0	0	0	107.2	V172 S173 C174 H194 L201	V172-V180 HydrophobicContact CG1-CG1 3.64Å; S173-V180 CarbonylContact O-C 3.55Å; S173-V180 WeakPolarHBondContact O-CA 3.49Å; C174-V180 HydrophobicContact CB-CG2 4.16Å; V180-H194 HydrophobicContact CB-CB 4.02Å; V180-H194 PolarHBondContact N-O 3.29Å; V180-H194 WeakPolarHBondContact O-CB 3.4Å; V180-H194 PolarHBondContact O-N 2.81Å; V180-L201 HydrophobicContact CG2-CD1 3.44Å; V180-L201 VanDerWaalsContact CG2-CD1 3.44Å
181	K	95.3	Very high	92.4	Very high	17 Å²	17	37.2 Å²	37.2	7%	0.074	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.8	-177	-63.9	-169.8	175.4	-134.3	0	109.9	E151 G152 V172 S173 M179 W183 L190 N193	E151-K181 PolarHBondContact O-NZ 3.36Å; G152-K181 WeakPolarHBondContact O-CE 3.38Å; G152-K181 PolarHBondContact O-NZ 2.97Å; V172-K181 WeakPolarHBondContact CA-O 3.35Å; S173-K181 PolarHBondContact N-O 3.06Å; S173-K181 PolarHBondContact O-N 2.81Å; S173-K181 PolarHBondContact OG-O 2.83Å; M179-K181 HydrophobicContact CB-CG 4.31Å; K181-W183 HydrophobicContact CB-CZ2 3.73Å; K181-W183 HydrophobicContact CD-CH2 3.98Å; K181-W183 HydrophobicContact CD-CZ2 3.52Å; K181-W183 HydrophobicContact CG-CZ2 4.27Å; K181-L190 HydrophobicContact CB-CD1 3.85Å; K181-L190 HydrophobicContact CD-CD1 4.14Å; K181-L190 HydrophobicContact CG-CD1 4.21Å; K181-N193 WeakPolarHBondContact CG-OD1 3.2Å
182	V	94.8	Very high	92.3	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.012	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.8	179	-176.7	0	0	0	0	107.7	I170 V172 K191 T192 H194 L227	I170-V182 HydrophobicContact CD1-CG1 4.31Å; I170-V182 HydrophobicContact CG2-CG1 3.25Å; V172-V182 HydrophobicContact CG1-CG2 4.43Å; V172-V182 HydrophobicContact CG2-CG2 4.44Å; V182-K191 HydrophobicContact CG1-CB 4.37Å; V182-K191 HydrophobicContact CG1-CD 4.33Å; V182-K191 WeakPolarHBondContact O-CA 3.5Å; V182-K191 WeakPolarHBondContact O-CB 3.35Å; V182-K191 PolarHBondContact O-N 2.91Å; V182-T192 PolarHBondContact N-O 3.03Å; V182-T192 PolarHBondContact O-N 3.09Å; V182-H194 WeakPolarHBondContact CG2-NE2 3.41Å; V182-L227 HydrophobicContact CG1-CD2 4.49Å; V182-L227 HydrophobicContact CG2-CD2 3.93Å
183	W	93.2	Very high	92.1	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.3	-176	-38.4	73.9	0	0	0	110.6	I135 I148 E151 I170 I171 S173 K181 K189 L190	I135-W183 HydrophobicContact CD1-CZ2 4.09Å; I148-W183 HydrophobicContact CG2-CD2 4.23Å; I148-W183 HydrophobicContact CG2-CE3 3.62Å; I148-W183 HydrophobicContact CG2-CH2 3.73Å; I148-W183 HydrophobicContact CG2-CZ2 4.31Å; I148-W183 HydrophobicContact CG2-CZ3 3.35Å; E151-W183 VanDerWaalsContact O-CH2 3.27Å; E151-W183 WeakPolarHBondContact O-CH2 3.27Å; I170-W183 VanDerWaalsContact CA-O 3.3Å; I170-W183 WeakPolarHBondContact CA-O 3.39Å; I171-W183 HydrophobicContact CD1-CB 3.91Å; I171-W183 HydrophobicContact CD1-CG 4.01Å; I171-W183 HydrophobicContact CG1-CB 3.51Å; I171-W183 HydrophobicContact CG1-CG 3.88Å; I171-W183 PolarHBondContact N-O 3.41Å; I171-W183 PolarHBondContact O-N 2.99Å; S173-W183 PolarHBondContact OG-NE1 2.88Å; K181-W183 HydrophobicContact CB-CZ2 3.73Å; K181-W183 HydrophobicContact CD-CH2 3.98Å; K181-W183 HydrophobicContact CD-CZ2 3.52Å; K181-W183 HydrophobicContact CG-CZ2 4.27Å; W183-K189 WeakPolarHBondContact CA-O 3.35Å; W183-L190 HydrophobicContact CD2-CD1 4.11Å; W183-L190 HydrophobicContact CE3-CB 3.99Å; W183-L190 HydrophobicContact CE3-CD1 3.99Å; W183-L190 HydrophobicContact CH2-CD1 4.07Å; W183-L190 HydrophobicContact CZ2-CD1 4.21Å; W183-L190 HydrophobicContact CZ3-CB 3.88Å; W183-L190 HydrophobicContact CZ3-CD1 3.96Å; W183-L190 HydrophobicContact CZ3-CG 4.44Å
184	N	91.2	Very high	91.9	Very high	40 Å²	40	42.3 Å²	42.3	21%	0.214	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.6	171.5	-177.4	-19.6	0	0	0	109.3	A186 N187 C188 K189	N184-A186 VanDerWaalsContact C-N 3.32Å; N184-A186 PolarHBondContact O-N 3.24Å; N184-A186 WeakPolarHBondContact OD1-CB 3.44Å; N184-A186 PolarHBondContact OD1-N 2.86Å; N184-N187 WeakPolarHBondContact CB-OD1 3.47Å; N184-N187 PolarHBondContact O-OD1 2.96Å; N184-C188 WeakPolarHBondContact O-CA 3.47Å; N184-C188 PolarHBondContact O-N 2.8Å; N184-K189 PolarHBondContact N-O 2.77Å
185	L	85.9	Confident	91.7	Very high	23 Å²	23	48.6 Å²	48.6	12%	0.12	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-29.8	-177	-170.3	65.2	0	0	0	112.7	L137 F162 P169 I171	L137-L185 HydrophobicContact CD1-CD1 3.8Å; L137-L185 HydrophobicContact CD2-CD1 3.78Å; L137-L185 HydrophobicContact CG-CD1 4.48Å; F162-L185 HydrophobicContact CD1-CD2 4.43Å; F162-L185 HydrophobicContact CE1-CD1 3.89Å; F162-L185 HydrophobicContact CE1-CD2 3.8Å; F162-L185 HydrophobicContact CE1-CG 4.48Å; P169-L185 HydrophobicContact CB-CB 4.1Å; P169-L185 HydrophobicContact CB-CD2 4.11Å; P169-L185 WeakPolarHBondContact O-CB 3.2Å; P169-L185 PolarHBondContact O-N 3.23Å; I171-L185 HydrophobicContact CG2-CD1 4.18Å
186	A	86.1	Confident	91.4	Very high	87 Å²	87	50.4 Å²	50.4	72%	0.719	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-37.8	-173.4	0	0	0	0	0	112.8	N184	N184-A186 VanDerWaalsContact C-N 3.32Å; N184-A186 PolarHBondContact O-N 3.24Å; N184-A186 WeakPolarHBondContact OD1-CB 3.44Å; N184-A186 PolarHBondContact OD1-N 2.86Å
187	N	86.2	Confident	91.4	Very high	80 Å²	80	47 Å²	47	43%	0.428	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-1	-179.2	64.7	10	0	0	0	113.3	N184 K189	N184-N187 WeakPolarHBondContact CB-OD1 3.47Å; N184-N187 PolarHBondContact O-OD1 2.96Å; N187-K189 HydrophobicContact CB-CG 4.37Å; N187-K189 PolarHBondContact O-N 2.84Å; N187-K189 VanDerWaalsContact O-N 3.16Å; N187-K189 WeakPolarHBondContact OD1-CB 3.35Å; N187-K189 PolarHBondContact OD1-N 3.21Å
188	C	85	Confident	91.3	Very high	21 Å²	21	50.3 Å²	50.3	14%	0.142	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	29.5	-177	-60.7	0	0	0	0	113.8	L137 Y146 I148 N184	L137-C188 WeakPolarHBondContact CD1-SG 3.37Å; Y146-C188 HydrophobicContact CD1-CB 3.48Å; Y146-C188 VanDerWaalsContact CD1-CB 3.48Å; Y146-C188 HydrophobicContact CE1-CB 3.29Å; Y146-C188 HydrophobicContact CG-CB 4.19Å; I148-C188 HydrophobicContact CD1-CB 4.47Å; I148-C188 HydrophobicContact CG1-CB 4.33Å; N184-C188 WeakPolarHBondContact O-CA 3.47Å; N184-C188 PolarHBondContact O-N 2.8Å
189	K	89.1	Confident	91.3	Very high	143 Å²	143	46.2 Å²	46.2	62%	0.622	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	151.1	176.7	-66.3	-169.7	174.1	-172.5	0	111.4	W183 N184 N187 K191	W183-K189 WeakPolarHBondContact CA-O 3.35Å; N184-K189 PolarHBondContact N-O 2.77Å; N187-K189 HydrophobicContact CB-CG 4.37Å; N187-K189 PolarHBondContact O-N 2.84Å; N187-K189 VanDerWaalsContact O-N 3.16Å; N187-K189 WeakPolarHBondContact OD1-CB 3.35Å; N187-K189 PolarHBondContact OD1-N 3.21Å; K189-K191 PolarHBondContact O-N 2.9Å
190	L	91.3	Very high	91.3	Very high	31 Å²	31	47.9 Å²	47.9	16%	0.162	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	127.3	171.6	-173.1	62.9	0	0	0	109.7	E151 K181 W183 N193	E151-L190 HydrophobicContact CB-CB 4.5Å; E151-L190 HydrophobicContact CB-CD2 3.95Å; E151-L190 WeakPolarHBondContact OE2-CB 3.49Å; E151-L190 WeakPolarHBondContact OE2-CD2 3.44Å; K181-L190 HydrophobicContact CB-CD1 3.85Å; K181-L190 HydrophobicContact CD-CD1 4.14Å; K181-L190 HydrophobicContact CG-CD1 4.21Å; W183-L190 HydrophobicContact CD2-CD1 4.11Å; W183-L190 HydrophobicContact CE3-CB 3.99Å; W183-L190 HydrophobicContact CE3-CD1 3.99Å; W183-L190 HydrophobicContact CH2-CD1 4.07Å; W183-L190 HydrophobicContact CZ2-CD1 4.21Å; W183-L190 HydrophobicContact CZ3-CB 3.88Å; W183-L190 HydrophobicContact CZ3-CD1 3.96Å; W183-L190 HydrophobicContact CZ3-CG 4.44Å; L190-N193 WeakPolarHBondContact CD2-ND2 3.47Å; L190-N193 WeakPolarHBondContact CD2-OD1 3.48Å
191	K	90.4	Very high	91.3	Very high	84 Å²	84	47.9 Å²	47.9	37%	0.365	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-52.1	177	-172.4	-174.2	176.9	-164.5	0	110.3	N168 I170 V182 K189	N168-K191 PolarHBondContact ND2-NZ 2.87Å; I170-K191 HydrophobicContact CD1-CD 3.84Å; V182-K191 HydrophobicContact CG1-CB 4.37Å; V182-K191 HydrophobicContact CG1-CD 4.33Å; V182-K191 WeakPolarHBondContact O-CA 3.5Å; V182-K191 WeakPolarHBondContact O-CB 3.35Å; V182-K191 PolarHBondContact O-N 2.91Å; K189-K191 PolarHBondContact O-N 2.9Å
192	T	90.6	Very high	91.4	Very high	37 Å²	37	48.8 Å²	48.8	23%	0.227	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	139.5	-175	-47.4	0	0	0	0	110.6	V182	V182-T192 PolarHBondContact N-O 3.03Å; V182-T192 PolarHBondContact O-N 3.09Å
193	N	92.4	Very high	91.5	Very high	69 Å²	69	49.4 Å²	49.4	37%	0.369	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.9	165	-75	-48.2	0	0	0	108.8	M179 K181 L190	M179-N193 HydrophobicContact CE-CB 3.9Å; K181-N193 WeakPolarHBondContact CG-OD1 3.2Å; L190-N193 WeakPolarHBondContact CD2-ND2 3.47Å; L190-N193 WeakPolarHBondContact CD2-OD1 3.48Å
194	H	92.2	Very high	91.6	Very high	6 Å²	6	49.4 Å²	49.4	3%	0.028	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.3	172.1	-65.1	-60.6	0	0	0	109.2	V180 V182 W225 G230	V180-H194 HydrophobicContact CB-CB 4.02Å; V180-H194 PolarHBondContact N-O 3.29Å; V180-H194 WeakPolarHBondContact O-CB 3.4Å; V180-H194 PolarHBondContact O-N 2.81Å; V182-H194 WeakPolarHBondContact CG2-NE2 3.41Å; H194-W225 HydrophobicContact CB-CD2 3.91Å; H194-W225 HydrophobicContact CB-CE3 3.66Å; H194-W225 HydrophobicContact CB-CH2 3.97Å; H194-W225 HydrophobicContact CB-CZ2 4.2Å; H194-W225 HydrophobicContact CB-CZ3 3.68Å; H194-W225 AromaticContact CG-CD2 3.91Å; H194-W225 AromaticContact CG-CE3 3.67Å; H194-W225 AromaticContact ND1-CE3 3.51Å; H194-G230 PolarHBondContact CE1-O 2.87Å
195	I	92	Very high	91.9	Very high	131 Å²	131	48.4 Å²	48.4	67%	0.672	27%	0.273	S	S	*	.			trans	-110	135.3	-179	-56.1	157.7	0	0	0	107.3	M179	M179-I195 HydrophobicContact CE-CD1 4.36Å; M179-I195 HydrophobicContact CE-CG1 3.61Å; M179-I195 HydrophobicContact SD-CG1 3.85Å
196	G	89.9	Confident	92.3	Very high	39 Å²	39	48.2 Å²	48.2	40%	0.402	27%	0.272	S	S	.	.			trans	169.1	-34.3	175.3	0	0	0	0	0	113.5	M223	G196-M223 WeakPolarHBondContact O-CE 3.37Å
197	H	94.1	Very high	92.7	Very high	13 Å²	13	44.3 Å²	44.3	6%	0.06	24%	0.24	C	C	.	.			trans	-66.2	139.1	-179.4	-75.6	-80	0	0	0	112.7	K178 L201 S215 D219 Q221 M223 W225	K178-H197 HydrophobicContact CB-CB 4.4Å; H197-L201 HydrophobicContact CB-CD2 4.11Å; H197-L201 HydrophobicContact CB-CG 4.44Å; H197-S215 PolarHBondContact NE2-OG 3.39Å; H197-D219 WeakPolarHBondContact CB-OD2 3.45Å; H197-D219 IonicContact CE1-OD2 3.26Å; H197-D219 IonicContact CG-OD2 2.81Å; H197-D219 IonicContact ND1-OD1 3.93Å; H197-D219 IonicContact ND1-OD2 3.25Å; H197-D219 PolarHBondContact ND1-OD2 2.85Å; H197-Q221 PolarHBondContact CE1-O 3.25Å; H197-M223 VanDerWaalsContact CE1-CG 3.49Å; H197-M223 WeakPolarHBondContact CE1-CG 3.47Å; H197-W225 AromaticContact CD2-CZ2 3.92Å; H197-W225 AromaticContact NE2-CZ2 3.95Å
198	T	93.4	Very high	92.9	Very high	95 Å²	95	44.3 Å²	44.3	58%	0.583	24%	0.244	S	C	*	.	S	Bend	trans	-99	-20.5	-179.4	60.2	0	0	0	0	112.2	K178 D219	K178-T198 WeakPolarHBondContact CD-O 3.49Å; K178-T198 VanDerWaalsContact CE-O 3.29Å; K178-T198 WeakPolarHBondContact CE-O 3.26Å; K178-T198 PolarHBondContact NZ-O 3.1Å; T198-D219 PolarHBondContact N-OD2 3.28Å; T198-D219 WeakPolarHBondContact OG1-CB 3.3Å
199	G	93.8	Very high	93.1	Very high	12 Å²	12	48 Å²	48	12%	0.124	26%	0.262	C	S	.	.	S	Bend	trans	-111.9	172	176.5	0	0	0	0	0	113.2	K178	K178-G199 WeakPolarHBondContact CB-O 3.39Å; K178-G199 VanDerWaalsContact CG-O 3.3Å; K178-G199 WeakPolarHBondContact CG-O 3.4Å
200	Y	94.8	Very high	93.2	Very high	75 Å²	75	41.2 Å²	41.2	29%	0.294	23%	0.233	S	C	.	.			trans	-66.3	148.9	172.5	60	-101.6	0	0	0	110.6	W176 N202 G217 K218	W176-Y200 HydrophobicContact CD2-CD2 4.25Å; W176-Y200 HydrophobicContact CD2-CG 4.21Å; W176-Y200 HydrophobicContact CE3-CG 4.27Å; W176-Y200 HydrophobicContact CH2-CD2 4.46Å; W176-Y200 HydrophobicContact CH2-CE2 4.35Å; W176-Y200 HydrophobicContact CZ2-CD2 4.12Å; W176-Y200 HydrophobicContact CZ2-CE2 4.17Å; Y200-N202 WeakPolarHBondContact CE2-OD1 3.11Å; Y200-G217 WeakPolarHBondContact O-CA 3.49Å; Y200-K218 HydrophobicContact CD1-CB 3.86Å; Y200-K218 HydrophobicContact CD1-CG 4.21Å; Y200-K218 HydrophobicContact CD2-CB 4Å; Y200-K218 HydrophobicContact CE1-CB 3.61Å; Y200-K218 HydrophobicContact CE1-CD 4.22Å; Y200-K218 HydrophobicContact CE1-CG 3.59Å; Y200-K218 HydrophobicContact CE2-CB 3.75Å; Y200-K218 HydrophobicContact CE2-CG 4.41Å; Y200-K218 HydrophobicContact CG-CB 4.04Å; Y200-K218 PolarHBondContact O-N 2.88Å
201	L	96.8	Very high	93.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136.2	-179.2	-65.7	174.2	0	0	0	111.4	S158 C174 G175 V180 H197	S158-L201 WeakPolarHBondContact CB-O 3.37Å; S158-L201 PolarHBondContact OG-O 2.81Å; C174-L201 HydrophobicContact CB-CB 3.87Å; C174-L201 HydrophobicContact CB-CD1 3.8Å; C174-L201 HydrophobicContact CB-CG 4.48Å; G175-L201 WeakPolarHBondContact O-CB 3.4Å; G175-L201 PolarHBondContact O-N 2.71Å; V180-L201 HydrophobicContact CG2-CD1 3.44Å; V180-L201 VanDerWaalsContact CG2-CD1 3.44Å; H197-L201 HydrophobicContact CB-CD2 4.11Å; H197-L201 HydrophobicContact CB-CG 4.44Å
202	N	95.9	Very high	93.3	Very high	36 Å²	36	37.2 Å²	37.2	19%	0.193	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-38.6	176.5	-72.9	-29.6	0	0	0	111.8	Y200 G216 I242	Y200-N202 WeakPolarHBondContact CE2-OD1 3.11Å; N202-G216 PolarHBondContact N-O 2.85Å; N202-I242 WeakPolarHBondContact CB-O 3.46Å; N202-I242 PolarHBondContact ND2-O 2.94Å
203	T	96.6	Very high	93.5	Very high	14 Å²	14	35.4 Å²	35.4	9%	0.086	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	148.9	-167.3	-173.5	0	0	0	0	111.8	C174 G216 I242 L245	C174-T203 VanDerWaalsContact SG-C 3.55Å; T203-G216 PolarHBondContact N-O 3.37Å; T203-G216 PolarHBondContact O-N 2.92Å; T203-G216 VanDerWaalsContact O-N 3.09Å; T203-I242 HydrophobicContact CG2-CG2 4.01Å; T203-L245 HydrophobicContact CG2-CB 4.01Å; T203-L245 HydrophobicContact CG2-CD1 3.93Å; T203-L245 HydrophobicContact CG2-CG 3.75Å
204	V	96.8	Very high	93.7	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144	167.4	70.1	0	0	0	0	108.6	C159 R161 V172 C174 C213 A214	C159-V204 HydrophobicContact CB-CG1 3.98Å; R161-V204 HydrophobicContact CG-CG1 4.26Å; R161-V204 WeakPolarHBondContact CG-O 3.41Å; V172-V204 HydrophobicContact CG1-CG2 3.82Å; C174-V204 HydrophobicContact CB-CB 4.08Å; C174-V204 HydrophobicContact CB-CG1 4.37Å; V204-C213 WeakPolarHBondContact CG2-SG 3.21Å; V204-A214 CarbonylContact C-O 3.6Å; V204-A214 WeakPolarHBondContact CA-O 3.4Å
205	T	96.3	Very high	94	Very high	20 Å²	20	31.9 Å²	31.9	12%	0.123	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	148.8	172.9	-172.8	0	0	0	0	109.4	C213 A214 L245 F247 L254	T205-C213 WeakPolarHBondContact O-CA 3.43Å; T205-A214 HydrophobicContact CG2-CB 3.98Å; T205-A214 PolarHBondContact N-O 2.85Å; T205-A214 PolarHBondContact O-N 2.9Å; T205-L245 WeakPolarHBondContact CB-O 3.43Å; T205-L245 HydrophobicContact CG2-CB 3.63Å; T205-F247 HydrophobicContact CG2-CD2 3.68Å; T205-F247 HydrophobicContact CG2-CE2 3.7Å; T205-L254 HydrophobicContact CG2-CD1 4.35Å
206	V	95.6	Very high	94.2	Very high	19 Å²	19	25.6 Å²	25.6	12%	0.115	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.1	176.6	-176.2	0	0	0	0	108.3	R161 V172 L212 L227 F247	R161-V206 HydrophobicContact CB-CG2 4.29Å; V172-V206 HydrophobicContact CB-CG2 4.35Å; V172-V206 HydrophobicContact CG2-CG2 4.02Å; V206-L212 WeakPolarHBondContact CA-O 3.18Å; V206-L212 WeakPolarHBondContact CG1-O 3.47Å; V206-L227 HydrophobicContact CG1-CD1 3.75Å; V206-L227 HydrophobicContact CG2-CD1 4.36Å; V206-F247 WeakPolarHBondContact O-CD2 3.5Å
207	S	94.2	Very high	94.4	Very high	5 Å²	5	23.8 Å²	23.8	4%	0.035	14%	0.137	C	C	.	.			trans	-68.2	156.4	175.5	55.9	0	0	0	0	111.6	P164 D209 G210 S211 L212	P164-S207 WeakPolarHBondContact CG-O 3.22Å; S207-D209 WeakPolarHBondContact CB-OD1 3.31Å; S207-D209 PolarHBondContact O-N 3.06Å; S207-D209 PolarHBondContact OG-OD1 2.86Å; S207-G210 WeakPolarHBondContact O-CA 3.41Å; S207-G210 PolarHBondContact O-N 2.9Å; S207-S211 PolarHBondContact OG-N 2.83Å; S207-L212 PolarHBondContact N-O 3.24Å; S207-L212 PolarHBondContact OG-N 2.9Å; S207-L212 PolarHBondContact OG-O 2.88Å
208	P	90.8	Very high	94.4	Very high	79 Å²	79	28 Å²	28	51%	0.513	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-28.8	-179.2	-25.2	34	0	0	0	114.8	P164	P164-P208 WeakPolarHBondContact CG-O 3.31Å
209	D	89	Confident	94.4	Very high	98 Å²	98	25.1 Å²	25.1	52%	0.524	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-11.3	175.3	68.9	-18.3	0	0	0	113.2	S207 S211	S207-D209 WeakPolarHBondContact CB-OD1 3.31Å; S207-D209 PolarHBondContact O-N 3.06Å; S207-D209 PolarHBondContact OG-OD1 2.86Å; D209-S211 VanDerWaalsContact C-N 3.28Å; D209-S211 PolarHBondContact O-N 2.83Å; D209-S211 PolarHBondContact OD1-N 3.13Å; D209-S211 VanDerWaalsContact OD1-N 3.15Å; D209-S211 PolarHBondContact OD1-OG 3.06Å; D209-S211 VanDerWaalsContact OD1-OG 3.07Å; D209-S211 WeakPolarHBondContact OD2-CB 3.48Å; D209-S211 PolarHBondContact OD2-OG 2.74Å
210	G	90.1	Very high	94.3	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.01	13%	0.131	C	C	.	.	S	Bend	trans	74.4	11.2	-179.3	0	0	0	0	0	115.3	S207	S207-G210 WeakPolarHBondContact O-CA 3.41Å; S207-G210 PolarHBondContact O-N 2.9Å
211	S	90.9	Very high	94.2	Very high	23 Å²	23	24.2 Å²	24.2	16%	0.161	13%	0.131	C	C	.	.	S	Bend	trans	-84.3	-34.6	179.3	69.2	0	0	0	0	112.7	S207 D209 L227	S207-S211 PolarHBondContact OG-N 2.83Å; D209-S211 VanDerWaalsContact C-N 3.28Å; D209-S211 PolarHBondContact O-N 2.83Å; D209-S211 PolarHBondContact OD1-N 3.13Å; D209-S211 VanDerWaalsContact OD1-N 3.15Å; D209-S211 PolarHBondContact OD1-OG 3.06Å; D209-S211 VanDerWaalsContact OD1-OG 3.07Å; D209-S211 WeakPolarHBondContact OD2-CB 3.48Å; D209-S211 PolarHBondContact OD2-OG 2.74Å; S211-L227 PolarHBondContact O-N 2.95Å
212	L	93.6	Very high	94.2	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.042	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	144.9	-175.6	-59	172.1	0	0	0	111.9	V206 S207 W225 L233 F247 Y252	V206-L212 WeakPolarHBondContact CA-O 3.18Å; V206-L212 WeakPolarHBondContact CG1-O 3.47Å; S207-L212 PolarHBondContact N-O 3.24Å; S207-L212 PolarHBondContact OG-N 2.9Å; S207-L212 PolarHBondContact OG-O 2.88Å; L212-W225 CarbonylContact C-O 3.59Å; L212-W225 WeakPolarHBondContact CA-O 3.32Å; L212-L233 HydrophobicContact CD2-CD1 3.33Å; L212-F247 HydrophobicContact CB-CZ 4.12Å; L212-Y252 HydrophobicContact CD1-CE2 3.74Å; L212-Y252 VanDerWaalsContact CD1-OH 3.26Å; L212-Y252 WeakPolarHBondContact CD1-OH 3.5Å
213	C	95.3	Very high	94.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	132	166.1	171.1	0	0	0	0	108.8	V204 T205 L224 W225 L227	V204-C213 WeakPolarHBondContact CG2-SG 3.21Å; T205-C213 WeakPolarHBondContact O-CA 3.43Å; C213-L224 CarbonylContact O-C 3.55Å; C213-L224 WeakPolarHBondContact O-CA 3.31Å; C213-W225 HydrophobicContact CB-CB 4.27Å; C213-W225 PolarHBondContact N-O 2.86Å; C213-W225 PolarHBondContact O-N 2.8Å; C213-L227 HydrophobicContact CB-CD1 4Å; C213-L227 HydrophobicContact CB-CD2 3.69Å; C213-L227 HydrophobicContact CB-CG 3.78Å
214	A	96.6	Very high	94.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.5	169.5	0	0	0	0	0	109.6	V204 T205 M223 L224 L245 F247 L254	V204-A214 CarbonylContact C-O 3.6Å; V204-A214 WeakPolarHBondContact CA-O 3.4Å; T205-A214 HydrophobicContact CG2-CB 3.98Å; T205-A214 PolarHBondContact N-O 2.85Å; T205-A214 PolarHBondContact O-N 2.9Å; A214-M223 WeakPolarHBondContact CA-O 3.45Å; A214-L224 HydrophobicContact CB-CG 4.45Å; A214-L245 HydrophobicContact CB-CD1 4.19Å; A214-F247 HydrophobicContact CB-CE2 3.82Å; A214-F247 HydrophobicContact CB-CZ 3.61Å; A214-L254 HydrophobicContact CB-CD1 3.92Å; A214-L254 HydrophobicContact CB-CD2 3.94Å
215	S	96.9	Very high	94	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	148	175.8	55.2	0	0	0	0	111.2	H197 A222 M223 W225 L245	H197-S215 PolarHBondContact NE2-OG 3.39Å; S215-A222 CarbonylContact O-C 3.51Å; S215-A222 WeakPolarHBondContact O-CA 3.42Å; S215-M223 PolarHBondContact N-O 2.88Å; S215-M223 PolarHBondContact O-N 3.31Å; S215-W225 PolarHBondContact OG-NE1 3.39Å; S215-L245 VanDerWaalsContact C-CD1 3.41Å
216	G	96.1	Very high	93.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	155.3	-179.2	0	0	0	0	0	112.7	N202 T203	N202-G216 PolarHBondContact N-O 2.85Å; T203-G216 PolarHBondContact N-O 3.37Å; T203-G216 PolarHBondContact O-N 2.92Å; T203-G216 VanDerWaalsContact O-N 3.09Å
217	G	95	Very high	93.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169	-140	-179.2	0	0	0	0	0	113.5	Y200 D219 G220 I242	Y200-G217 WeakPolarHBondContact O-CA 3.49Å; G217-D219 VanDerWaalsContact C-N 3.33Å; G217-D219 PolarHBondContact O-N 2.89Å; G217-G220 PolarHBondContact O-N 2.81Å; G217-I242 PolarHBondContact O-N 3.18Å
218	K	94.4	Very high	93.3	Very high	103 Å²	103	26.4 Å²	26.4	45%	0.448	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-24.7	-170.4	-173	53.8	-178.8	174.5	0	114.9	Y200 G220 T241	Y200-K218 HydrophobicContact CD1-CB 3.86Å; Y200-K218 HydrophobicContact CD1-CG 4.21Å; Y200-K218 HydrophobicContact CD2-CB 4Å; Y200-K218 HydrophobicContact CE1-CB 3.61Å; Y200-K218 HydrophobicContact CE1-CD 4.22Å; Y200-K218 HydrophobicContact CE1-CG 3.59Å; Y200-K218 HydrophobicContact CE2-CB 3.75Å; Y200-K218 HydrophobicContact CE2-CG 4.41Å; Y200-K218 HydrophobicContact CG-CB 4.04Å; Y200-K218 PolarHBondContact O-N 2.88Å; K218-G220 PolarHBondContact O-N 3.23Å; K218-T241 HydrophobicContact CD-CG2 3.97Å; K218-T241 WeakPolarHBondContact CD-OG1 3.15Å; K218-T241 PolarHBondContact NZ-OG1 3.3Å
219	D	92.3	Very high	93.1	Very high	34 Å²	34	28.4 Å²	28.4	18%	0.182	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.4	177.3	54.5	15	0	0	0	113.4	H197 T198 G217 Q221	H197-D219 WeakPolarHBondContact CB-OD2 3.45Å; H197-D219 IonicContact CE1-OD2 3.26Å; H197-D219 IonicContact CG-OD2 2.81Å; H197-D219 IonicContact ND1-OD1 3.93Å; H197-D219 IonicContact ND1-OD2 3.25Å; H197-D219 PolarHBondContact ND1-OD2 2.85Å; T198-D219 PolarHBondContact N-OD2 3.28Å; T198-D219 WeakPolarHBondContact OG1-CB 3.3Å; G217-D219 VanDerWaalsContact C-N 3.33Å; G217-D219 PolarHBondContact O-N 2.89Å; D219-Q221 PolarHBondContact O-N 3.08Å; D219-Q221 PolarHBondContact OD1-N 3.32Å; D219-Q221 VanDerWaalsContact OD1-N 3.08Å
220	G	91.9	Very high	92.9	Very high	2 Å²	2	24.8 Å²	24.8	2%	0.021	13%	0.129	C	C	.	.			trans	68	16.1	-177.8	0	0	0	0	0	113.6	G217 K218 S238 D240	G217-G220 PolarHBondContact O-N 2.81Å; K218-G220 PolarHBondContact O-N 3.23Å; G220-S238 WeakPolarHBondContact O-CA 3.49Å; G220-S238 VanDerWaalsContact O-CB 3.24Å; G220-S238 WeakPolarHBondContact O-CB 3.44Å; G220-S238 PolarHBondContact O-N 3.26Å; G220-D240 WeakPolarHBondContact CA-O 3.38Å
221	Q	94	Very high	92.9	Very high	65 Å²	65	30.4 Å²	30.4	30%	0.304	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.4	179.4	-68.7	-170	-4.8	0	0	109.9	H197 D219 M223 T235	H197-Q221 PolarHBondContact CE1-O 3.25Å; D219-Q221 PolarHBondContact O-N 3.08Å; D219-Q221 PolarHBondContact OD1-N 3.32Å; D219-Q221 VanDerWaalsContact OD1-N 3.08Å; Q221-M223 HydrophobicContact CB-CE 4.34Å; Q221-T235 HydrophobicContact CB-CG2 3.65Å; Q221-T235 HydrophobicContact CG-CG2 3.97Å
222	A	95.5	Very high	93	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	105.6	167.7	0	0	0	0	0	108.2	S215 L236 I242 L245 L254	S215-A222 CarbonylContact O-C 3.51Å; S215-A222 WeakPolarHBondContact O-CA 3.42Å; A222-L236 HydrophobicContact CB-CB 4.25Å; A222-L236 PolarHBondContact N-O 2.9Å; A222-L236 PolarHBondContact O-N 2.65Å; A222-I242 HydrophobicContact CB-CD1 3.86Å; A222-L245 HydrophobicContact CB-CD2 4.38Å; A222-L254 HydrophobicContact CB-CD2 4.46Å
223	M	95.4	Very high	92.9	Very high	8 Å²	8	36.7 Å²	36.7	4%	0.039	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.5	178.2	-64	-170.8	-179.4	0	0	110	G196 H197 A214 S215 Q221 W225 T235	G196-M223 WeakPolarHBondContact O-CE 3.37Å; H197-M223 VanDerWaalsContact CE1-CG 3.49Å; H197-M223 WeakPolarHBondContact CE1-CG 3.47Å; A214-M223 WeakPolarHBondContact CA-O 3.45Å; S215-M223 PolarHBondContact N-O 2.88Å; S215-M223 PolarHBondContact O-N 3.31Å; Q221-M223 HydrophobicContact CB-CE 4.34Å; M223-W225 HydrophobicContact CB-CH2 4.42Å; M223-W225 HydrophobicContact CB-CZ2 3.53Å; M223-W225 HydrophobicContact CG-CZ2 4.14Å; M223-W225 PolarHBondContact O-NE1 2.74Å; M223-W225 HydrophobicContact SD-CH2 3.79Å; M223-W225 HydrophobicContact SD-CZ2 3.55Å; M223-W225 VanDerWaalsContact SD-CZ2 3.55Å; M223-T235 HydrophobicContact CE-CG2 4.48Å; M223-T235 HydrophobicContact CG-CG2 4.01Å
224	L	95.9	Very high	92.8	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.6	173.2	-83.2	79.4	0	0	0	110.7	C213 A214 L233 Y234 L236 L254 L267	C213-L224 CarbonylContact O-C 3.55Å; C213-L224 WeakPolarHBondContact O-CA 3.31Å; A214-L224 HydrophobicContact CB-CG 4.45Å; L224-L233 HydrophobicContact CB-CB 4.48Å; L224-L233 PolarHBondContact O-N 2.88Å; L224-Y234 HydrophobicContact CD1-CE2 4.24Å; L224-Y234 HydrophobicContact CD2-CE2 4.18Å; L224-Y234 PolarHBondContact N-O 2.76Å; L224-L236 HydrophobicContact CD1-CD1 3.95Å; L224-L236 HydrophobicContact CD1-CG 4.38Å; L224-L254 HydrophobicContact CD1-CD2 3.91Å; L224-L267 HydrophobicContact CD1-CD2 4.49Å; L224-L267 HydrophobicContact CD2-CD1 4.24Å; L224-L267 HydrophobicContact CD2-CD2 3.77Å
225	W	95	Very high	92.7	Very high	4 Å²	4	41 Å²	41	2%	0.015	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139.3	-178.7	-40.7	86.7	0	0	0	109.5	H194 H197 L212 C213 S215 M223 K231 H232	H194-W225 HydrophobicContact CB-CD2 3.91Å; H194-W225 HydrophobicContact CB-CE3 3.66Å; H194-W225 HydrophobicContact CB-CH2 3.97Å; H194-W225 HydrophobicContact CB-CZ2 4.2Å; H194-W225 HydrophobicContact CB-CZ3 3.68Å; H194-W225 AromaticContact CG-CD2 3.91Å; H194-W225 AromaticContact CG-CE3 3.67Å; H194-W225 AromaticContact ND1-CE3 3.51Å; H197-W225 AromaticContact CD2-CZ2 3.92Å; H197-W225 AromaticContact NE2-CZ2 3.95Å; L212-W225 CarbonylContact C-O 3.59Å; L212-W225 WeakPolarHBondContact CA-O 3.32Å; C213-W225 HydrophobicContact CB-CB 4.27Å; C213-W225 PolarHBondContact N-O 2.86Å; C213-W225 PolarHBondContact O-N 2.8Å; S215-W225 PolarHBondContact OG-NE1 3.39Å; M223-W225 HydrophobicContact CB-CH2 4.42Å; M223-W225 HydrophobicContact CB-CZ2 3.53Å; M223-W225 HydrophobicContact CG-CZ2 4.14Å; M223-W225 PolarHBondContact O-NE1 2.74Å; M223-W225 HydrophobicContact SD-CH2 3.79Å; M223-W225 HydrophobicContact SD-CZ2 3.55Å; M223-W225 VanDerWaalsContact SD-CZ2 3.55Å; W225-K231 CarbonylContact C-O 3.52Å; W225-K231 WeakPolarHBondContact CA-O 3.31Å; W225-H232 HydrophobicContact CE3-CB 3.73Å; W225-H232 AromaticContact CE3-CD2 3.9Å; W225-H232 AromaticContact CH2-CD2 3.91Å; W225-H232 HydrophobicContact CZ3-CB 3.65Å; W225-H232 AromaticContact CZ3-CD2 3.69Å
226	D	93.3	Very high	92.5	Very high	29 Å²	29	41.4 Å²	41.4	16%	0.155	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.7	168	-171.8	-31.6	0	0	0	109	N228 E229 G230 K231 L233	D226-N228 WeakPolarHBondContact OD1-CA 3.14Å; D226-N228 WeakPolarHBondContact OD1-CB 3.46Å; D226-N228 PolarHBondContact OD1-N 3.44Å; D226-E229 HydrophobicContact CB-CB 4.37Å; D226-E229 PolarHBondContact OD1-N 2.9Å; D226-E229 VanDerWaalsContact OD1-N 3.1Å; D226-G230 CarbonylContact O-C 3.57Å; D226-G230 WeakPolarHBondContact O-CA 3.35Å; D226-G230 PolarHBondContact O-N 2.84Å; D226-K231 PolarHBondContact N-O 3.45Å; D226-K231 PolarHBondContact O-N 3.09Å; D226-L233 HydrophobicContact CB-CD1 4.18Å; D226-L233 HydrophobicContact CB-CD2 4.16Å; D226-L233 HydrophobicContact CB-CG 4.14Å
227	L	89.1	Confident	92.3	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-20.9	-179.7	-68.7	176.4	0	0	0	113.4	V172 V182 V206 S211 C213	V172-L227 HydrophobicContact CG2-CD1 4.13Å; V172-L227 HydrophobicContact CG2-CD2 3.8Å; V182-L227 HydrophobicContact CG1-CD2 4.49Å; V182-L227 HydrophobicContact CG2-CD2 3.93Å; V206-L227 HydrophobicContact CG1-CD1 3.75Å; V206-L227 HydrophobicContact CG2-CD1 4.36Å; S211-L227 PolarHBondContact O-N 2.95Å; C213-L227 HydrophobicContact CB-CD1 4Å; C213-L227 HydrophobicContact CB-CD2 3.69Å; C213-L227 HydrophobicContact CB-CG 3.78Å
228	N	87.4	Confident	91.9	Very high	93 Å²	93	46.5 Å²	46.5	50%	0.497	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-50.2	177.7	-63.7	-39.5	0	0	0	110.1	D226	D226-N228 WeakPolarHBondContact OD1-CA 3.14Å; D226-N228 WeakPolarHBondContact OD1-CB 3.46Å; D226-N228 PolarHBondContact OD1-N 3.44Å
229	E	86.3	Confident	91.5	Very high	121 Å²	121	44.6 Å²	44.6	57%	0.565	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-20.3	178.9	-63.8	-161	178.2	0	0	113.5	D226 K231	D226-E229 HydrophobicContact CB-CB 4.37Å; D226-E229 PolarHBondContact OD1-N 2.9Å; D226-E229 VanDerWaalsContact OD1-N 3.1Å; E229-K231 VanDerWaalsContact C-N 3.33Å; E229-K231 HydrophobicContact CB-CB 4.5Å; E229-K231 HydrophobicContact CB-CD 4.29Å; E229-K231 HydrophobicContact CB-CG 4.18Å; E229-K231 WeakPolarHBondContact OE2-CD 3.24Å; E229-K231 WeakPolarHBondContact OE2-CE 3.42Å; E229-K231 IonicContact OE2-NZ 3.08Å; E229-K231 PolarHBondContact OE2-NZ 2.92Å
230	G	85.4	Confident	91.5	Very high	22 Å²	22	46.4 Å²	46.4	23%	0.227	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	72	24.5	-176.1	0	0	0	0	0	113.6	H194 D226	H194-G230 PolarHBondContact CE1-O 2.87Å; D226-G230 CarbonylContact O-C 3.57Å; D226-G230 WeakPolarHBondContact O-CA 3.35Å; D226-G230 PolarHBondContact O-N 2.84Å
231	K	89.8	Confident	91.5	Very high	120 Å²	120	47.1 Å²	47.1	52%	0.522	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	151.8	-175.4	-65.6	180	-167.1	153.4	0	112.4	W225 D226 E229	W225-K231 CarbonylContact C-O 3.52Å; W225-K231 WeakPolarHBondContact CA-O 3.31Å; D226-K231 PolarHBondContact N-O 3.45Å; D226-K231 PolarHBondContact O-N 3.09Å; E229-K231 VanDerWaalsContact C-N 3.33Å; E229-K231 HydrophobicContact CB-CB 4.5Å; E229-K231 HydrophobicContact CB-CD 4.29Å; E229-K231 HydrophobicContact CB-CG 4.18Å; E229-K231 WeakPolarHBondContact OE2-CD 3.24Å; E229-K231 WeakPolarHBondContact OE2-CE 3.42Å; E229-K231 IonicContact OE2-NZ 3.08Å; E229-K231 PolarHBondContact OE2-NZ 2.92Å
232	H	93.9	Very high	91.6	Very high	86 Å²	86	44 Å²	44	40%	0.398	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	133.6	165.3	178.4	-102.1	0	0	0	109.5	W225 Y234 T235	W225-H232 HydrophobicContact CE3-CB 3.73Å; W225-H232 AromaticContact CE3-CD2 3.9Å; W225-H232 AromaticContact CH2-CD2 3.91Å; W225-H232 HydrophobicContact CZ3-CB 3.65Å; W225-H232 AromaticContact CZ3-CD2 3.69Å; H232-Y234 PolarHBondContact NE2-O 2.8Å; H232-T235 PolarHBondContact CE1-OG1 2.97Å; H232-T235 PolarHBondContact NE2-OG1 3.42Å
233	L	92.2	Very high	91.6	Very high	77 Å²	77	46.2 Å²	46.2	40%	0.403	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-62	179.4	-67.6	174.9	0	0	0	111	L212 L224 D226	L212-L233 HydrophobicContact CD2-CD1 3.33Å; L224-L233 HydrophobicContact CB-CB 4.48Å; L224-L233 PolarHBondContact O-N 2.88Å; D226-L233 HydrophobicContact CB-CD1 4.18Å; D226-L233 HydrophobicContact CB-CD2 4.16Å; D226-L233 HydrophobicContact CB-CG 4.14Å
234	Y	92.6	Very high	91.7	Very high	37 Å²	37	46.1 Å²	46.1	15%	0.145	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	169.7	177.4	55.7	-91.9	0	0	0	110.5	L224 H232 L236 L267 K270	L224-Y234 HydrophobicContact CD1-CE2 4.24Å; L224-Y234 HydrophobicContact CD2-CE2 4.18Å; L224-Y234 PolarHBondContact N-O 2.76Å; H232-Y234 PolarHBondContact NE2-O 2.8Å; Y234-L236 HydrophobicContact CD2-CD2 4.03Å; Y234-L236 HydrophobicContact CD2-CG 4.13Å; Y234-L236 HydrophobicContact CE2-CD1 4.2Å; Y234-L236 HydrophobicContact CE2-CD2 3.85Å; Y234-L236 HydrophobicContact CE2-CG 3.93Å; Y234-L267 PolarHBondContact OH-O 3.1Å; Y234-K270 HydrophobicContact CD2-CD 4.32Å; Y234-K270 HydrophobicContact CE2-CD 4.26Å; Y234-K270 HydrophobicContact CE2-CG 4.16Å; Y234-K270 HydrophobicContact CG-CD 4.46Å
235	T	94.2	Very high	91.7	Very high	53 Å²	53	46.6 Å²	46.6	33%	0.325	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.6	-179.5	-57.2	0	0	0	0	109.6	Q221 M223 H232	Q221-T235 HydrophobicContact CB-CG2 3.65Å; Q221-T235 HydrophobicContact CG-CG2 3.97Å; M223-T235 HydrophobicContact CE-CG2 4.48Å; M223-T235 HydrophobicContact CG-CG2 4.01Å; H232-T235 PolarHBondContact CE1-OG1 2.97Å; H232-T235 PolarHBondContact NE2-OG1 3.42Å
236	L	93.3	Very high	91.7	Very high	8 Å²	8	47 Å²	47	4%	0.042	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.5	174	-61.1	171.6	0	0	0	108.9	A222 L224 Y234 S238 L254 W265 L267	A222-L236 HydrophobicContact CB-CB 4.25Å; A222-L236 PolarHBondContact N-O 2.9Å; A222-L236 PolarHBondContact O-N 2.65Å; L224-L236 HydrophobicContact CD1-CD1 3.95Å; L224-L236 HydrophobicContact CD1-CG 4.38Å; Y234-L236 HydrophobicContact CD2-CD2 4.03Å; Y234-L236 HydrophobicContact CD2-CG 4.13Å; Y234-L236 HydrophobicContact CE2-CD1 4.2Å; Y234-L236 HydrophobicContact CE2-CD2 3.85Å; Y234-L236 HydrophobicContact CE2-CG 3.93Å; L236-S238 PolarHBondContact O-N 3.47Å; L236-L254 HydrophobicContact CD1-CD2 4.22Å; L236-W265 HydrophobicContact CB-CD2 4.4Å; L236-W265 HydrophobicContact CB-CZ2 4.45Å; L236-W265 HydrophobicContact CD1-CB 4.01Å; L236-W265 HydrophobicContact CD1-CD2 4.09Å; L236-W265 HydrophobicContact CD1-CE3 4.44Å; L236-W265 HydrophobicContact CD1-CG 3.89Å; L236-W265 HydrophobicContact CD2-CD2 4.27Å; L236-W265 HydrophobicContact CD2-CE3 3.87Å; L236-W265 HydrophobicContact CD2-CZ3 4.07Å; L236-W265 HydrophobicContact CG-CD2 4.49Å; L236-L267 HydrophobicContact CD1-CD2 3.92Å
237	D	92.5	Very high	91.9	Very high	106 Å²	106	46.6 Å²	46.6	57%	0.567	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	114.3	179.6	-173.7	5.9	0	0	0	110.8	G239 W265	D237-G239 PolarHBondContact OD1-N 3.46Å; D237-W265 WeakPolarHBondContact O-CZ2 3.4Å
238	S	85.6	Confident	92.2	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.014	26%	0.257	C	S	.	.			trans	-93.5	-13.5	-179.9	-68.3	0	0	0	0	113.4	G220 L236 D240 T258 K263	G220-S238 WeakPolarHBondContact O-CA 3.49Å; G220-S238 VanDerWaalsContact O-CB 3.24Å; G220-S238 WeakPolarHBondContact O-CB 3.44Å; G220-S238 PolarHBondContact O-N 3.26Å; L236-S238 PolarHBondContact O-N 3.47Å; S238-D240 PolarHBondContact O-N 2.95Å; S238-D240 VanDerWaalsContact O-N 3.16Å; S238-T258 VanDerWaalsContact CB-CG2 3.41Å; S238-K263 WeakPolarHBondContact O-CE 3.48Å; S238-K263 PolarHBondContact O-NZ 3.2Å
239	G	86.2	Confident	92.4	Very high	63 Å²	63	44.8 Å²	44.8	65%	0.649	25%	0.251	S	S	*	.	S	Bend	trans	74.1	-10.9	174.7	0	0	0	0	0	116.8	D237	D237-G239 PolarHBondContact OD1-N 3.46Å
240	D	91.1	Very high	92.7	Very high	72 Å²	72	42.6 Å²	42.6	39%	0.385	24%	0.243	S	C	.	.	S	Bend	trans	-149	169.6	172.2	-159.3	-4.9	0	0	0	110.3	G220 S238 I242	G220-D240 WeakPolarHBondContact CA-O 3.38Å; S238-D240 PolarHBondContact O-N 2.95Å; S238-D240 VanDerWaalsContact O-N 3.16Å; D240-I242 PolarHBondContact O-N 3.03Å
241	T	93.3	Very high	92.9	Very high	17 Å²	17	43.6 Å²	43.6	10%	0.104	24%	0.24	C	C	.	.			trans	-51.4	123	179.8	-49.8	0	0	0	0	111.1	K218 T258 G259	K218-T241 HydrophobicContact CD-CG2 3.97Å; K218-T241 WeakPolarHBondContact CD-OG1 3.15Å; K218-T241 PolarHBondContact NZ-OG1 3.3Å; T241-T258 WeakPolarHBondContact O-CA 3.27Å; T241-G259 PolarHBondContact O-N 2.85Å
242	I	96.1	Very high	93.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.5	177.4	-59.7	165	0	0	0	108.5	N202 T203 G217 A222 D240 L245 A257 T258	N202-I242 WeakPolarHBondContact CB-O 3.46Å; N202-I242 PolarHBondContact ND2-O 2.94Å; T203-I242 HydrophobicContact CG2-CG2 4.01Å; G217-I242 PolarHBondContact O-N 3.18Å; A222-I242 HydrophobicContact CB-CD1 3.86Å; D240-I242 PolarHBondContact O-N 3.03Å; I242-L245 HydrophobicContact CG2-CD1 4.3Å; I242-L245 HydrophobicContact CG2-CD2 3.93Å; I242-L245 HydrophobicContact CG2-CG 3.74Å; I242-A257 WeakPolarHBondContact CA-O 3.39Å; I242-T258 HydrophobicContact CG1-CG2 4.12Å
243	N	95.3	Very high	93.1	Very high	46 Å²	46	40.1 Å²	40.1	25%	0.246	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-40.2	178	-65.8	-37.1	0	0	0	112.1	A257 C292	N243-A257 PolarHBondContact N-O 3.16Å; N243-C292 WeakPolarHBondContact CB-O 3.49Å; N243-C292 PolarHBondContact ND2-O 2.92Å
244	A	96.5	Very high	93.3	Very high	6 Å²	6	36.5 Å²	36.5	5%	0.05	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	146.8	-178.4	0	0	0	0	0	111.1	A257 L295	A244-A257 HydrophobicContact CB-CB 4.06Å; A244-A257 PolarHBondContact O-N 2.96Å; A244-L295 HydrophobicContact CB-CB 4.39Å; A244-L295 HydrophobicContact CB-CD1 4.49Å; A244-L295 HydrophobicContact CB-CG 4.22Å
245	L	96.8	Very high	93.4	Very high	11 Å²	11	34.7 Å²	34.7	6%	0.058	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139	173.3	-72.4	169.9	0	0	0	108.7	T203 T205 A214 S215 A222 I242 L254 C255 A256	T203-L245 HydrophobicContact CG2-CB 4.01Å; T203-L245 HydrophobicContact CG2-CD1 3.93Å; T203-L245 HydrophobicContact CG2-CG 3.75Å; T205-L245 WeakPolarHBondContact CB-O 3.43Å; T205-L245 HydrophobicContact CG2-CB 3.63Å; A214-L245 HydrophobicContact CB-CD1 4.19Å; S215-L245 VanDerWaalsContact C-CD1 3.41Å; A222-L245 HydrophobicContact CB-CD2 4.38Å; I242-L245 HydrophobicContact CG2-CD1 4.3Å; I242-L245 HydrophobicContact CG2-CD2 3.93Å; I242-L245 HydrophobicContact CG2-CG 3.74Å; L245-L254 HydrophobicContact CB-CD1 4.46Å; L245-L254 HydrophobicContact CD2-CD1 4.16Å; L245-L254 HydrophobicContact CD2-CD2 4.35Å; L245-L254 HydrophobicContact CD2-CG 4.29Å; L245-C255 WeakPolarHBondContact CA-O 3.37Å; L245-A256 HydrophobicContact CD2-CB 3.53Å
246	C	95.9	Very high	93.5	Very high	13 Å²	13	32.2 Å²	32.2	9%	0.088	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	137.2	168.7	63.8	0	0	0	0	110.8	C255 L295 W297	C246-C255 PolarHBondContact N-O 3.3Å; C246-C255 PolarHBondContact O-N 3.05Å; C246-L295 HydrophobicContact CB-CB 4.43Å; C246-L295 VanDerWaalsContact SG-CB 3.53Å; C246-W297 VanDerWaalsContact SG-CD1 3.52Å
247	F	96.4	Very high	93.6	Very high	19 Å²	19	31.8 Å²	31.8	8%	0.083	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	145.7	168.1	-70.4	-80.3	0	0	0	110.1	T205 V206 L212 A214 W253 L254 L267 W297	T205-F247 HydrophobicContact CG2-CD2 3.68Å; T205-F247 HydrophobicContact CG2-CE2 3.7Å; V206-F247 WeakPolarHBondContact O-CD2 3.5Å; L212-F247 HydrophobicContact CB-CZ 4.12Å; A214-F247 HydrophobicContact CB-CE2 3.82Å; A214-F247 HydrophobicContact CB-CZ 3.61Å; F247-W253 WeakPolarHBondContact CA-O 3.33Å; F247-L254 HydrophobicContact CD1-CB 4.36Å; F247-L254 HydrophobicContact CD1-CD1 4.01Å; F247-L254 HydrophobicContact CD2-CD1 4.47Å; F247-L254 HydrophobicContact CE1-CB 4.36Å; F247-L254 HydrophobicContact CE1-CD1 3.97Å; F247-L254 HydrophobicContact CE2-CD1 4.44Å; F247-L254 HydrophobicContact CG-CD1 4.28Å; F247-L254 HydrophobicContact CZ-CD1 4.19Å; F247-L267 HydrophobicContact CD1-CD1 3.92Å; F247-L267 HydrophobicContact CE1-CD1 3.56Å; F247-W297 VanDerWaalsContact O-CD1 3.26Å
248	S	94.9	Very high	93.6	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.021	15%	0.151	C	C	.	.			trans	-68	140.1	165.5	174.8	0	0	0	0	109.9	N250 R251 W253	S248-N250 VanDerWaalsContact C-N 3.34Å; S248-N250 PolarHBondContact OG-N 3.41Å; S248-N250 PolarHBondContact OG-OD1 2.89Å; S248-R251 WeakPolarHBondContact CB-O 3.32Å; S248-R251 PolarHBondContact OG-N 2.95Å; S248-W253 PolarHBondContact N-O 2.96Å
249	P	92.4	Very high	93.7	Very high	58 Å²	58	26.8 Å²	26.8	38%	0.377	15%	0.151	S	C	.	.	S	Bend	trans	-75.2	-22.7	179.4	29.4	-34.9	0	0	0	113.4	W297	P249-W297 HydrophobicContact CG-CB 4.28Å
250	N	91.7	Very high	93.8	Very high	76 Å²	76	25.8 Å²	25.8	41%	0.406	13%	0.133	S	C	.	.	S	Bend	trans	-118.3	-16.9	-172.2	70.5	-6	0	0	0	114.2	S248 D300	S248-N250 VanDerWaalsContact C-N 3.34Å; S248-N250 PolarHBondContact OG-N 3.41Å; S248-N250 PolarHBondContact OG-OD1 2.89Å; N250-D300 PolarHBondContact ND2-O 3.16Å
251	R	91.3	Very high	93.8	Very high	42 Å²	42	22.8 Å²	22.8	16%	0.158	12%	0.118	C	C	.	.	S	Bend	trans	-122.4	153.9	-178.9	-70.6	171.9	-172.6	96.3	-10.5	108.9	E9 S248 W253 G301	E9-R251 VanDerWaalsContact CD-NE 3.34Å; E9-R251 IonicContact OE1-CZ 3.16Å; E9-R251 IonicContact OE1-NE 3.2Å; E9-R251 PolarHBondContact OE1-NE 2.67Å; E9-R251 VanDerWaalsContact OE1-NE 3.17Å; E9-R251 IonicContact OE1-NH2 3.62Å; E9-R251 PolarHBondContact OE1-NH2 2.95Å; E9-R251 WeakPolarHBondContact OE2-CD 3.43Å; E9-R251 IonicContact OE2-CZ 2.76Å; E9-R251 IonicContact OE2-NE 3.39Å; E9-R251 PolarHBondContact OE2-NE 3.44Å; E9-R251 IonicContact OE2-NH2 2.67Å; S248-R251 WeakPolarHBondContact CB-O 3.32Å; S248-R251 PolarHBondContact OG-N 2.95Å; R251-W253 HydrophobicContact CB-CB 4.41Å; R251-W253 HydrophobicContact CB-CD2 4.03Å; R251-W253 HydrophobicContact CB-CG 3.95Å; R251-W253 PolarHBondContact O-N 2.94Å; R251-G301 PolarHBondContact NH1-O 2.77Å
252	Y	92.7	Very high	93.9	Very high	116 Å²	116	22 Å²	22	46%	0.455	11%	0.113	S	C	.	.	S	Bend	trans	-80.5	51.3	176.6	-158.6	-132	0	0	0	111.6	L212 L267 E268	L212-Y252 HydrophobicContact CD1-CE2 3.74Å; L212-Y252 VanDerWaalsContact CD1-OH 3.26Å; L212-Y252 WeakPolarHBondContact CD1-OH 3.5Å; Y252-L267 HydrophobicContact CD1-CB 3.45Å; Y252-L267 VanDerWaalsContact CD1-CB 3.45Å; Y252-L267 HydrophobicContact CD2-CB 4.48Å; Y252-L267 HydrophobicContact CD2-CD1 4.19Å; Y252-L267 HydrophobicContact CE1-CB 3.35Å; Y252-L267 HydrophobicContact CE1-CD1 4.46Å; Y252-L267 HydrophobicContact CE2-CB 4.41Å; Y252-L267 HydrophobicContact CE2-CD1 4.06Å; Y252-L267 HydrophobicContact CG-CB 4.02Å; Y252-L267 HydrophobicContact CG-CD1 4.42Å; Y252-L267 WeakPolarHBondContact O-CB 3.11Å; Y252-L267 WeakPolarHBondContact O-CG 3.39Å; Y252-L267 PolarHBondContact O-N 3.46Å; Y252-E268 HydrophobicContact CD1-CB 4.18Å
253	W	94.6	Very high	93.8	Very high	18 Å²	18	23.4 Å²	23.4	7%	0.068	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	143.5	-177.2	-68.3	-3.9	0	0	0	111.8	E9 F247 S248 R251 I264 W265 V273 W297 V318	E9-W253 HydrophobicContact CB-CH2 3.73Å; E9-W253 HydrophobicContact CB-CZ2 4.08Å; E9-W253 VanDerWaalsContact OE2-CH2 3.25Å; E9-W253 WeakPolarHBondContact OE2-CH2 3.26Å; E9-W253 WeakPolarHBondContact OE2-CZ2 3.34Å; F247-W253 WeakPolarHBondContact CA-O 3.33Å; S248-W253 PolarHBondContact N-O 2.96Å; R251-W253 HydrophobicContact CB-CB 4.41Å; R251-W253 HydrophobicContact CB-CD2 4.03Å; R251-W253 HydrophobicContact CB-CG 3.95Å; R251-W253 PolarHBondContact O-N 2.94Å; W253-I264 HydrophobicContact CB-CG2 4.17Å; W253-I264 HydrophobicContact CD2-CG2 3.94Å; W253-I264 HydrophobicContact CE3-CG2 3.74Å; W253-I264 HydrophobicContact CG-CG2 4.16Å; W253-I264 HydrophobicContact CZ3-CG2 4.42Å; W253-W265 CarbonylContact C-O 3.54Å; W253-W265 WeakPolarHBondContact CA-O 3.41Å; W253-V273 HydrophobicContact CH2-CG1 4.17Å; W253-V273 HydrophobicContact CZ2-CG1 3.9Å; W253-V273 HydrophobicContact CZ2-CG2 4.38Å; W253-W297 HydrophobicContact CE3-CH2 4.24Å; W253-W297 HydrophobicContact CE3-CZ2 4.25Å; W253-W297 HydrophobicContact CZ3-CH2 4.33Å; W253-V318 HydrophobicContact CH2-CG1 4.5Å; W253-V318 HydrophobicContact CZ3-CG2 4.26Å
254	L	95.9	Very high	93.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.2	168.4	178.7	65.2	0	0	0	109.6	T205 A214 A222 L224 L236 L245 F247 W265 L267	T205-L254 HydrophobicContact CG2-CD1 4.35Å; A214-L254 HydrophobicContact CB-CD1 3.92Å; A214-L254 HydrophobicContact CB-CD2 3.94Å; A222-L254 HydrophobicContact CB-CD2 4.46Å; L224-L254 HydrophobicContact CD1-CD2 3.91Å; L236-L254 HydrophobicContact CD1-CD2 4.22Å; L245-L254 HydrophobicContact CB-CD1 4.46Å; L245-L254 HydrophobicContact CD2-CD1 4.16Å; L245-L254 HydrophobicContact CD2-CD2 4.35Å; L245-L254 HydrophobicContact CD2-CG 4.29Å; F247-L254 HydrophobicContact CD1-CB 4.36Å; F247-L254 HydrophobicContact CD1-CD1 4.01Å; F247-L254 HydrophobicContact CD2-CD1 4.47Å; F247-L254 HydrophobicContact CE1-CB 4.36Å; F247-L254 HydrophobicContact CE1-CD1 3.97Å; F247-L254 HydrophobicContact CE2-CD1 4.44Å; F247-L254 HydrophobicContact CG-CD1 4.28Å; F247-L254 HydrophobicContact CZ-CD1 4.19Å; L254-W265 PolarHBondContact N-O 2.85Å; L254-W265 PolarHBondContact O-N 2.87Å; L254-L267 HydrophobicContact CB-CD1 4.19Å; L254-L267 HydrophobicContact CB-CD2 3.84Å; L254-L267 HydrophobicContact CB-CG 4.19Å; L254-L267 HydrophobicContact CD2-CD2 4.41Å
255	C	95.8	Very high	93.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130	172.6	-55.6	0	0	0	0	109.7	L245 C246 K263 L295 W297	L245-C255 WeakPolarHBondContact CA-O 3.37Å; C246-C255 PolarHBondContact N-O 3.3Å; C246-C255 PolarHBondContact O-N 3.05Å; C255-K263 CarbonylContact C-O 3.58Å; C255-K263 WeakPolarHBondContact CA-O 3.19Å; C255-L295 HydrophobicContact CB-CD1 3.97Å; C255-W297 WeakPolarHBondContact SG-CZ2 3.38Å; C255-W297 PolarHBondContact SG-NE1 3.39Å
256	A	96.2	Very high	93.4	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.1	175.7	0	0	0	0	0	110	L245 T258 I262 K263	L245-A256 HydrophobicContact CD2-CB 3.53Å; A256-T258 HydrophobicContact CB-CG2 3.83Å; A256-T258 PolarHBondContact O-N 2.75Å; A256-I262 CarbonylContact O-C 3.56Å; A256-I262 WeakPolarHBondContact O-CA 3.4Å; A256-K263 PolarHBondContact N-O 3.09Å; A256-K263 PolarHBondContact O-N 3.08Å
257	A	94.9	Very high	93.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	104.5	170.2	0	0	0	0	0	108.7	I242 N243 A244 C292 L295	I242-A257 WeakPolarHBondContact CA-O 3.39Å; N243-A257 PolarHBondContact N-O 3.16Å; A244-A257 HydrophobicContact CB-CB 4.06Å; A244-A257 PolarHBondContact O-N 2.96Å; A257-C292 HydrophobicContact CB-CB 3.9Å; A257-L295 HydrophobicContact CB-CD1 3.75Å; A257-L295 HydrophobicContact CB-CD2 4.43Å; A257-L295 HydrophobicContact CB-CG 3.92Å
258	T	92.1	Very high	92.8	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.012	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	90.9	-168.5	56	0	0	0	0	108.4	S238 T241 I242 A256 P260 S261	S238-T258 VanDerWaalsContact CB-CG2 3.41Å; T241-T258 WeakPolarHBondContact O-CA 3.27Å; I242-T258 HydrophobicContact CG1-CG2 4.12Å; A256-T258 HydrophobicContact CB-CG2 3.83Å; A256-T258 PolarHBondContact O-N 2.75Å; T258-P260 WeakPolarHBondContact O-CD 3.4Å; T258-P260 VanDerWaalsContact O-N 3.16Å; T258-S261 CarbonylContact C-O 3.57Å; T258-S261 PolarHBondContact N-O 3.34Å; T258-S261 PolarHBondContact O-N 3.02Å; T258-S261 VanDerWaalsContact O-N 3.1Å; T258-S261 PolarHBondContact O-OG 3.33Å; T258-S261 PolarHBondContact OG1-O 2.83Å; T258-S261 PolarHBondContact OG1-OG 2.83Å; T258-S261 VanDerWaalsContact OG1-OG 3.13Å
259	G	87.2	Confident	92.3	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.01	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	-116.6	-171.5	0	0	0	0	0	112.8	T241 Q291 C292	T241-G259 PolarHBondContact O-N 2.85Å; G259-Q291 CarbonylContact O-C 3.59Å; G259-Q291 WeakPolarHBondContact O-CA 3.34Å; G259-Q291 PolarHBondContact O-OE1 2.91Å; G259-C292 PolarHBondContact O-N 3.2Å
260	P	88.5	Confident	92.2	Very high	42 Å²	42	33.9 Å²	33.9	27%	0.273	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-15.2	180	34.2	-34.6	0	0	0	114.5	T258 P289	T258-P260 WeakPolarHBondContact O-CD 3.4Å; T258-P260 VanDerWaalsContact O-N 3.16Å; P260-P289 HydrophobicContact CB-CB 3.85Å; P260-P289 HydrophobicContact CB-CG 3.71Å; P260-P289 HydrophobicContact CG-CG 3.93Å
261	S	91.8	Very high	92.1	Very high	9 Å²	9	35.1 Å²	35.1	6%	0.063	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	161.3	-179.1	67.3	0	0	0	0	112.1	T258 E275 L276	T258-S261 CarbonylContact C-O 3.57Å; T258-S261 PolarHBondContact N-O 3.34Å; T258-S261 PolarHBondContact O-N 3.02Å; T258-S261 VanDerWaalsContact O-N 3.1Å; T258-S261 PolarHBondContact O-OG 3.33Å; T258-S261 PolarHBondContact OG1-O 2.83Å; T258-S261 PolarHBondContact OG1-OG 2.83Å; T258-S261 VanDerWaalsContact OG1-OG 3.13Å; S261-E275 WeakPolarHBondContact CB-OE1 3.45Å; S261-E275 PolarHBondContact OG-OE1 3.17Å; S261-E275 VanDerWaalsContact OG-OE1 3.06Å; S261-L276 CarbonylContact C-O 3.55Å; S261-L276 VanDerWaalsContact CA-O 3.27Å; S261-L276 WeakPolarHBondContact CA-O 3.41Å; S261-L276 WeakPolarHBondContact CB-O 3.5Å
262	I	94.2	Very high	92	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.5	171.1	-55.5	163.3	0	0	0	107.2	A256 L276 C292 L295 L304 A306 Y308	A256-I262 CarbonylContact O-C 3.56Å; A256-I262 WeakPolarHBondContact O-CA 3.4Å; I262-L276 HydrophobicContact CB-CB 4.05Å; I262-L276 HydrophobicContact CB-CD1 4.13Å; I262-L276 HydrophobicContact CB-CG 4.18Å; I262-L276 HydrophobicContact CD1-CD1 4.35Å; I262-L276 HydrophobicContact CG2-CD1 4.29Å; I262-L276 PolarHBondContact N-O 3.3Å; I262-L276 PolarHBondContact O-N 3.43Å; I262-C292 HydrophobicContact CG1-CB 4.18Å; I262-L295 HydrophobicContact CD1-CD2 3.77Å; I262-L295 HydrophobicContact CG1-CD2 4.13Å; I262-L295 HydrophobicContact CG2-CD1 4.18Å; I262-L295 HydrophobicContact CG2-CD2 4.11Å; I262-L304 HydrophobicContact CG2-CD2 4.31Å; I262-A306 HydrophobicContact CD1-CB 3.51Å; I262-Y308 WeakPolarHBondContact CD1-OH 3.4Å
263	K	94.3	Very high	91.7	Very high	29 Å²	29	33.3 Å²	33.3	13%	0.126	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	131.1	175.1	-72.3	-178.5	174.3	-178.5	0	109.9	S238 C255 A256 E275	S238-K263 WeakPolarHBondContact O-CE 3.48Å; S238-K263 PolarHBondContact O-NZ 3.2Å; C255-K263 CarbonylContact C-O 3.58Å; C255-K263 WeakPolarHBondContact CA-O 3.19Å; A256-K263 PolarHBondContact N-O 3.09Å; A256-K263 PolarHBondContact O-N 3.08Å; K263-E275 HydrophobicContact CG-CG 3.98Å
264	I	94.2	Very high	91.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.3	174.3	-54.1	-175.8	0	0	0	108	M11 W253 I272 V273 D274 L276 L304	M11-I264 HydrophobicContact CE-CD1 3.82Å; M11-I264 HydrophobicContact CG-CD1 3.55Å; M11-I264 HydrophobicContact SD-CD1 4.48Å; W253-I264 HydrophobicContact CB-CG2 4.17Å; W253-I264 HydrophobicContact CD2-CG2 3.94Å; W253-I264 HydrophobicContact CE3-CG2 3.74Å; W253-I264 HydrophobicContact CG-CG2 4.16Å; W253-I264 HydrophobicContact CZ3-CG2 4.42Å; I264-I272 CarbonylContact O-C 3.56Å; I264-I272 WeakPolarHBondContact O-CA 3.35Å; I264-V273 HydrophobicContact CB-CB 4.41Å; I264-V273 HydrophobicContact CG2-CB 4.19Å; I264-V273 HydrophobicContact CG2-CG2 4.48Å; I264-V273 PolarHBondContact O-N 2.79Å; I264-D274 PolarHBondContact N-O 3.38Å; I264-L276 HydrophobicContact CD1-CD1 4.11Å; I264-L276 HydrophobicContact CD1-CD2 4.49Å; I264-L276 HydrophobicContact CD1-CG 4.41Å; I264-L304 HydrophobicContact CD1-CD2 4.46Å
265	W	93.6	Very high	91.1	Very high	24 Å²	24	37.2 Å²	37.2	9%	0.091	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	133.5	179	-66.8	89.7	0	0	0	110.1	L236 D237 W253 L254 I271 I272	L236-W265 HydrophobicContact CB-CD2 4.4Å; L236-W265 HydrophobicContact CB-CZ2 4.45Å; L236-W265 HydrophobicContact CD1-CB 4.01Å; L236-W265 HydrophobicContact CD1-CD2 4.09Å; L236-W265 HydrophobicContact CD1-CE3 4.44Å; L236-W265 HydrophobicContact CD1-CG 3.89Å; L236-W265 HydrophobicContact CD2-CD2 4.27Å; L236-W265 HydrophobicContact CD2-CE3 3.87Å; L236-W265 HydrophobicContact CD2-CZ3 4.07Å; L236-W265 HydrophobicContact CG-CD2 4.49Å; D237-W265 WeakPolarHBondContact O-CZ2 3.4Å; W253-W265 CarbonylContact C-O 3.54Å; W253-W265 WeakPolarHBondContact CA-O 3.41Å; L254-W265 PolarHBondContact N-O 2.85Å; L254-W265 PolarHBondContact O-N 2.87Å; W265-I271 WeakPolarHBondContact CA-O 3.38Å; W265-I272 HydrophobicContact CD2-CG1 3.9Å; W265-I272 HydrophobicContact CE3-CG1 3.69Å; W265-I272 HydrophobicContact CH2-CD1 3.64Å; W265-I272 HydrophobicContact CH2-CG1 3.33Å; W265-I272 HydrophobicContact CZ2-CD1 3.71Å; W265-I272 HydrophobicContact CZ2-CG1 3.53Å; W265-I272 HydrophobicContact CZ3-CD1 4.22Å; W265-I272 HydrophobicContact CZ3-CG1 3.41Å; W265-I272 VanDerWaalsContact CZ3-CG1 3.41Å
266	D	92.9	Very high	90.6	Very high	31 Å²	31	37.4 Å²	37.4	17%	0.166	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	120.8	161.6	173.2	27.8	0	0	0	108.6	E268 G269 K270 I271 V273	D266-E268 VanDerWaalsContact C-N 3.34Å; D266-E268 PolarHBondContact OD1-N 2.84Å; D266-G269 PolarHBondContact OD2-N 2.97Å; D266-K270 WeakPolarHBondContact O-CA 3.36Å; D266-K270 PolarHBondContact O-N 3.38Å; D266-I271 HydrophobicContact CB-CG1 4.23Å; D266-I271 PolarHBondContact N-O 3.33Å; D266-I271 PolarHBondContact O-N 2.83Å; D266-V273 HydrophobicContact CB-CG2 3.57Å
267	L	90.8	Very high	90.1	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.026	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-17.4	-174.1	-60.5	174.1	0	0	0	112.6	L224 Y234 L236 F247 Y252 L254	L224-L267 HydrophobicContact CD1-CD2 4.49Å; L224-L267 HydrophobicContact CD2-CD1 4.24Å; L224-L267 HydrophobicContact CD2-CD2 3.77Å; Y234-L267 PolarHBondContact OH-O 3.1Å; L236-L267 HydrophobicContact CD1-CD2 3.92Å; F247-L267 HydrophobicContact CD1-CD1 3.92Å; F247-L267 HydrophobicContact CE1-CD1 3.56Å; Y252-L267 HydrophobicContact CD1-CB 3.45Å; Y252-L267 VanDerWaalsContact CD1-CB 3.45Å; Y252-L267 HydrophobicContact CD2-CB 4.48Å; Y252-L267 HydrophobicContact CD2-CD1 4.19Å; Y252-L267 HydrophobicContact CE1-CB 3.35Å; Y252-L267 HydrophobicContact CE1-CD1 4.46Å; Y252-L267 HydrophobicContact CE2-CB 4.41Å; Y252-L267 HydrophobicContact CE2-CD1 4.06Å; Y252-L267 HydrophobicContact CG-CB 4.02Å; Y252-L267 HydrophobicContact CG-CD1 4.42Å; Y252-L267 WeakPolarHBondContact O-CB 3.11Å; Y252-L267 WeakPolarHBondContact O-CG 3.39Å; Y252-L267 PolarHBondContact O-N 3.46Å; L254-L267 HydrophobicContact CB-CD1 4.19Å; L254-L267 HydrophobicContact CB-CD2 3.84Å; L254-L267 HydrophobicContact CB-CG 4.19Å; L254-L267 HydrophobicContact CD2-CD2 4.41Å
268	E	89.1	Confident	88.9	Confident	165 Å²	165	49.2 Å²	49.2	77%	0.771	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-54	173.8	-173.7	172.3	-170.2	0	0	109.9	Y252 D266	Y252-E268 HydrophobicContact CD1-CB 4.18Å; D266-E268 VanDerWaalsContact C-N 3.34Å; D266-E268 PolarHBondContact OD1-N 2.84Å
269	G	85.2	Confident	87.3	Confident	42 Å²	42	57.4 Å²	57.4	43%	0.433	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-15.3	177.6	0	0	0	0	0	115	D266 I271	D266-G269 PolarHBondContact OD2-N 2.97Å; G269-I271 PolarHBondContact O-N 2.63Å
270	K	89.3	Confident	85.9	Confident	109 Å²	109	60.8 Å²	60.8	47%	0.474	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	32.6	-168.8	-54.2	177.5	-176.2	-178.5	0	112.6	Y234 D266	Y234-K270 HydrophobicContact CD2-CD 4.32Å; Y234-K270 HydrophobicContact CE2-CD 4.26Å; Y234-K270 HydrophobicContact CE2-CG 4.16Å; Y234-K270 HydrophobicContact CG-CD 4.46Å; D266-K270 WeakPolarHBondContact O-CA 3.36Å; D266-K270 PolarHBondContact O-N 3.38Å
271	I	89.6	Confident	84	Confident	103 Å²	103	66.3 Å²	66.3	53%	0.528	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	151.6	-178.2	56.9	171.2	0	0	0	110.5	W265 D266 G269 V273	W265-I271 WeakPolarHBondContact CA-O 3.38Å; D266-I271 HydrophobicContact CB-CG1 4.23Å; D266-I271 PolarHBondContact N-O 3.33Å; D266-I271 PolarHBondContact O-N 2.83Å; G269-I271 PolarHBondContact O-N 2.63Å; I271-V273 PolarHBondContact O-N 2.94Å
272	I	88.8	Confident	81.9	Confident	75 Å²	75	68.4 Å²	68.4	39%	0.385	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	119.5	170	-58.2	176.7	0	0	0	107.3	I264 W265 D274	I264-I272 CarbonylContact O-C 3.56Å; I264-I272 WeakPolarHBondContact O-CA 3.35Å; W265-I272 HydrophobicContact CD2-CG1 3.9Å; W265-I272 HydrophobicContact CE3-CG1 3.69Å; W265-I272 HydrophobicContact CH2-CD1 3.64Å; W265-I272 HydrophobicContact CH2-CG1 3.33Å; W265-I272 HydrophobicContact CZ2-CD1 3.71Å; W265-I272 HydrophobicContact CZ2-CG1 3.53Å; W265-I272 HydrophobicContact CZ3-CD1 4.22Å; W265-I272 HydrophobicContact CZ3-CG1 3.41Å; W265-I272 VanDerWaalsContact CZ3-CG1 3.41Å; I272-D274 WeakPolarHBondContact CG2-O 3.46Å
273	V	87.7	Confident	79.7	Confident	45 Å²	45	75.1 Å²	75.1	27%	0.273	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-48.9	173.2	178.5	0	0	0	0	109.3	W253 I264 D266 I271	W253-V273 HydrophobicContact CH2-CG1 4.17Å; W253-V273 HydrophobicContact CZ2-CG1 3.9Å; W253-V273 HydrophobicContact CZ2-CG2 4.38Å; I264-V273 HydrophobicContact CB-CB 4.41Å; I264-V273 HydrophobicContact CG2-CB 4.19Å; I264-V273 HydrophobicContact CG2-CG2 4.48Å; I264-V273 PolarHBondContact O-N 2.79Å; D266-V273 HydrophobicContact CB-CG2 3.57Å; I271-V273 PolarHBondContact O-N 2.94Å
274	D	86.6	Confident	77.6	Confident	40 Å²	40	79.1 Å²	79.1	21%	0.214	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	152.9	-176.8	-147.7	-17.9	0	0	0	110.9	M11 I264 I272 L276	M11-D274 PolarHBondContact N-OD2 3.24Å; M11-D274 VanDerWaalsContact N-OD2 3.08Å; I264-D274 PolarHBondContact N-O 3.38Å; I272-D274 WeakPolarHBondContact CG2-O 3.46Å; D274-L276 HydrophobicContact CB-CD2 4.03Å
275	E	89.6	Confident	75.7	Confident	60 Å²	60	85.3 Å²	85.3	28%	0.28	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	103.1	170.3	-173.3	178.4	172	0	0	109.1	S261 K263 R277	S261-E275 WeakPolarHBondContact CB-OE1 3.45Å; S261-E275 PolarHBondContact OG-OE1 3.17Å; S261-E275 VanDerWaalsContact OG-OE1 3.06Å; K263-E275 HydrophobicContact CG-CG 3.98Å; E275-R277 VanDerWaalsContact CD-NH2 3.34Å; E275-R277 HydrophobicContact CG-CG 4.32Å; E275-R277 PolarHBondContact O-N 3.31Å; E275-R277 VanDerWaalsContact O-N 3.15Å; E275-R277 IonicContact OE1-CZ 3.97Å; E275-R277 IonicContact OE1-NE 2.82Å; E275-R277 PolarHBondContact OE1-NE 3.29Å; E275-R277 IonicContact OE1-NH2 3.96Å; E275-R277 PolarHBondContact OE1-NH2 3.16Å; E275-R277 IonicContact OE2-CZ 2.77Å; E275-R277 IonicContact OE2-NE 3.17Å; E275-R277 IonicContact OE2-NH2 3.52Å; E275-R277 PolarHBondContact OE2-NH2 3.46Å
276	L	87	Confident	73.8	Confident	4 Å²	4	93.7 Å²	93.7	2%	0.021	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	106.2	-176.6	-39.5	-176.3	0	0	0	108.5	M11 S261 I262 I264 D274 L304 W316	M11-L276 HydrophobicContact CB-CD1 4.12Å; M11-L276 HydrophobicContact CB-CD2 3.44Å; M11-L276 VanDerWaalsContact CB-CD2 3.44Å; M11-L276 HydrophobicContact CB-CG 4.44Å; M11-L276 HydrophobicContact CG-CD1 4.31Å; M11-L276 HydrophobicContact CG-CD2 4.06Å; S261-L276 CarbonylContact C-O 3.55Å; S261-L276 VanDerWaalsContact CA-O 3.27Å; S261-L276 WeakPolarHBondContact CA-O 3.41Å; S261-L276 WeakPolarHBondContact CB-O 3.5Å; I262-L276 HydrophobicContact CB-CB 4.05Å; I262-L276 HydrophobicContact CB-CD1 4.13Å; I262-L276 HydrophobicContact CB-CG 4.18Å; I262-L276 HydrophobicContact CD1-CD1 4.35Å; I262-L276 HydrophobicContact CG2-CD1 4.29Å; I262-L276 PolarHBondContact N-O 3.3Å; I262-L276 PolarHBondContact O-N 3.43Å; I264-L276 HydrophobicContact CD1-CD1 4.11Å; I264-L276 HydrophobicContact CD1-CD2 4.49Å; I264-L276 HydrophobicContact CD1-CG 4.41Å; D274-L276 HydrophobicContact CB-CD2 4.03Å; L276-L304 HydrophobicContact CD1-CD2 4.21Å; L276-W316 HydrophobicContact CB-CD2 4.45Å; L276-W316 HydrophobicContact CB-CE3 4.36Å; L276-W316 HydrophobicContact CB-CH2 3.85Å; L276-W316 HydrophobicContact CB-CZ2 3.95Å; L276-W316 HydrophobicContact CB-CZ3 4.04Å; L276-W316 HydrophobicContact CD1-CB 4.37Å; L276-W316 HydrophobicContact CD1-CD2 3.73Å; L276-W316 HydrophobicContact CD1-CE3 3.98Å; L276-W316 HydrophobicContact CD1-CG 3.89Å; L276-W316 HydrophobicContact CD1-CZ3 4.49Å; L276-W316 HydrophobicContact CD2-CE3 4.29Å; L276-W316 HydrophobicContact CD2-CZ3 4.3Å; L276-W316 HydrophobicContact CG-CE3 4.44Å
277	R	84.1	Confident	72.3	Confident	173 Å²	173	95.3 Å²	95.3	65%	0.653	51%	0.506	S	S	*	.			trans	-113.4	141	168.6	-67.1	-176.6	-177.2	179.8	5.5	108.3	E275	E275-R277 VanDerWaalsContact CD-NH2 3.34Å; E275-R277 HydrophobicContact CG-CG 4.32Å; E275-R277 PolarHBondContact O-N 3.31Å; E275-R277 VanDerWaalsContact O-N 3.15Å; E275-R277 IonicContact OE1-CZ 3.97Å; E275-R277 IonicContact OE1-NE 2.82Å; E275-R277 PolarHBondContact OE1-NE 3.29Å; E275-R277 IonicContact OE1-NH2 3.96Å; E275-R277 PolarHBondContact OE1-NH2 3.16Å; E275-R277 IonicContact OE2-CZ 2.77Å; E275-R277 IonicContact OE2-NE 3.17Å; E275-R277 IonicContact OE2-NH2 3.52Å; E275-R277 PolarHBondContact OE2-NH2 3.46Å
278	Q	70.8	Confident	71.5	Confident	74 Å²	74	103.3 Å²	103.3	35%	0.346	54%	0.543	S	S	.	.			trans	-96.9	136.8	167.1	-159.6	-178.1	22.9	0	0	109.4	V280	Q278-V280 PolarHBondContact O-N 2.94Å
279	E	59.2	Low	71.3	Confident	175 Å²	175	97.9 Å²	97.9	82%	0.818	52%	0.522	S	S	*	.			trans	-66	101.9	166	-67.9	-173.1	171.1	0	0	108.8	I281	E279-I281 PolarHBondContact O-N 3.45Å
280	V	57	Low	71.5	Confident	72 Å²	72	97 Å²	97	44%	0.436	51%	0.509	S	S	.	.			trans	-80	100.4	169.3	-173.6	0	0	0	0	106.4	Q278 S282 P289 P290	Q278-V280 PolarHBondContact O-N 2.94Å; V280-S282 PolarHBondContact O-N 2.86Å; V280-P289 HydrophobicContact CG2-CB 4.07Å; V280-P290 HydrophobicContact CG2-CG 4.33Å
281	I	49.2	Very low	71.7	Confident	158 Å²	158	94.1 Å²	94.1	81%	0.81	50%	0.497	S	S	*	.			trans	-72.7	75	167.4	-52	172.6	0	0	0	107.1	E279	E279-I281 PolarHBondContact O-N 3.45Å
282	S	47	Very low	71.9	Confident	53 Å²	53	89.2 Å²	89.2	37%	0.371	47%	0.472	S	S	.	.			trans	-87.3	122.8	171.2	177.1	0	0	0	0	108.8	V280 N284	V280-S282 PolarHBondContact O-N 2.86Å; S282-N284 PolarHBondContact O-N 2.97Å; S282-N284 PolarHBondContact OG-N 2.76Å; S282-N284 VanDerWaalsContact OG-N 3.08Å; S282-N284 PolarHBondContact OG-O 3.47Å
283	T	47.8	Very low	72.2	Confident	141 Å²	141	87 Å²	87	87%	0.865	46%	0.462	S	S	*	.	S	Bend	trans	-71.4	-4.5	168.6	52.2	0	0	0	0	112.8
284	N	50.8	Low	72.6	Confident	112 Å²	112	84.9 Å²	84.9	60%	0.599	45%	0.449	S	S	*	.			trans	-123.5	116.3	-179.1	-94.5	-33.1	0	0	0	111.2	S282 K286 A287	S282-N284 PolarHBondContact O-N 2.97Å; S282-N284 PolarHBondContact OG-N 2.76Å; S282-N284 VanDerWaalsContact OG-N 3.08Å; S282-N284 PolarHBondContact OG-O 3.47Å; N284-K286 PolarHBondContact O-N 2.83Å; N284-A287 PolarHBondContact O-N 3.39Å
285	S	53.9	Low	73.1	Confident	131 Å²	131	83.3 Å²	83.3	92%	0.916	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-0.8	178.9	57.1	0	0	0	0	115.4
286	K	53.8	Low	73.5	Confident	200 Å²	200	81 Å²	81	87%	0.87	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-4.8	-178.6	-73	-172.7	177.5	-178.6	0	115.1	N284	N284-K286 PolarHBondContact O-N 2.83Å
287	A	61.9	Low	73.9	Confident	64 Å²	64	81.4 Å²	81.4	53%	0.529	43%	0.433	S	S	.	.	S	Bend	trans	-83	120.7	178	0	0	0	0	0	109.7	N284	N284-A287 PolarHBondContact O-N 3.39Å
288	E	73.1	Confident	74.5	Confident	174 Å²	174	73.8 Å²	73.8	81%	0.813	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-60.4	137.8	171.4	-74.2	-177.2	169.1	0	0	109.8
289	P	85.1	Confident	75.4	Confident	51 Å²	51	72.4 Å²	72.4	33%	0.331	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-62	149.8	178.5	26	-33.7	0	0	0	110.7	P260 V280 Q291	P260-P289 HydrophobicContact CB-CB 3.85Å; P260-P289 HydrophobicContact CB-CG 3.71Å; P260-P289 HydrophobicContact CG-CG 3.93Å; V280-P289 HydrophobicContact CG2-CB 4.07Å; P289-Q291 PolarHBondContact O-N 2.93Å; P289-Q291 PolarHBondContact O-NE2 3.45Å
290	P	89.9	Confident	77	Confident	24 Å²	24	68.2 Å²	68.2	16%	0.156	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-63.1	124.6	178.1	27.1	-32.3	0	0	0	109.9	V280 Y308 T309 D310	V280-P290 HydrophobicContact CG2-CG 4.33Å; P290-Y308 HydrophobicContact CB-CD1 4.43Å; P290-T309 WeakPolarHBondContact CA-OG1 3.47Å; P290-D310 HydrophobicContact CB-CB 3.92Å
291	Q	92.3	Very high	78.6	Confident	47 Å²	47	64.8 Å²	64.8	22%	0.22	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-79.6	142.2	179.4	-49.7	-66.2	-57.6	0	0	110.4	G259 P289 Y308 T309	G259-Q291 CarbonylContact O-C 3.59Å; G259-Q291 WeakPolarHBondContact O-CA 3.34Å; G259-Q291 PolarHBondContact O-OE1 2.91Å; P289-Q291 PolarHBondContact O-N 2.93Å; P289-Q291 PolarHBondContact O-NE2 3.45Å; Q291-Y308 WeakPolarHBondContact O-CA 3.3Å; Q291-T309 HydrophobicContact CB-CG2 3.94Å; Q291-T309 PolarHBondContact N-OG1 2.96Å; Q291-T309 PolarHBondContact O-N 3.29Å; Q291-T309 PolarHBondContact O-OG1 2.87Å
292	C	94.5	Very high	80.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.5	170.4	-174.4	0	0	0	0	109	N243 A257 G259 I262 Y308	N243-C292 WeakPolarHBondContact CB-O 3.49Å; N243-C292 PolarHBondContact ND2-O 2.92Å; A257-C292 HydrophobicContact CB-CB 3.9Å; G259-C292 PolarHBondContact O-N 3.2Å; I262-C292 HydrophobicContact CG1-CB 4.18Å; C292-Y308 HydrophobicContact CB-CD1 4.12Å; C292-Y308 HydrophobicContact CB-CE1 3.77Å
293	T	95.3	Very high	82.9	Confident	29 Å²	29	58.1 Å²	58.1	18%	0.178	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-25.4	-173.9	38.2	0	0	0	0	113.2	V24 G307 T309	V24-T293 WeakPolarHBondContact O-CB 3.48Å; V24-T293 PolarHBondContact O-OG1 2.77Å; T293-G307 PolarHBondContact N-O 3.39Å; T293-G307 PolarHBondContact OG1-O 2.82Å; T293-G307 VanDerWaalsContact OG1-O 3.09Å; T293-T309 HydrophobicContact CG2-CG2 3.61Å
294	S	96.4	Very high	85.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	152.2	-179.2	51.9	0	0	0	0	112.6	V24 T25 A306 G307	V24-S294 PolarHBondContact O-OG 3.27Å; T25-S294 WeakPolarHBondContact O-CB 3.46Å; S294-A306 WeakPolarHBondContact O-CA 3.4Å; S294-G307 PolarHBondContact N-O 3.08Å; S294-G307 PolarHBondContact O-N 2.74Å; S294-G307 WeakPolarHBondContact OG-CA 3.18Å
295	L	97.1	Very high	87.4	Confident	8 Å²	8	46.2 Å²	46.2	4%	0.042	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	142.2	177.7	-65.1	174.3	0	0	0	110	A244 C246 C255 A257 I262 L304 F305 A306	A244-L295 HydrophobicContact CB-CB 4.39Å; A244-L295 HydrophobicContact CB-CD1 4.49Å; A244-L295 HydrophobicContact CB-CG 4.22Å; C246-L295 HydrophobicContact CB-CB 4.43Å; C246-L295 VanDerWaalsContact SG-CB 3.53Å; C255-L295 HydrophobicContact CB-CD1 3.97Å; A257-L295 HydrophobicContact CB-CD1 3.75Å; A257-L295 HydrophobicContact CB-CD2 4.43Å; A257-L295 HydrophobicContact CB-CG 3.92Å; I262-L295 HydrophobicContact CD1-CD2 3.77Å; I262-L295 HydrophobicContact CG1-CD2 4.13Å; I262-L295 HydrophobicContact CG2-CD1 4.18Å; I262-L295 HydrophobicContact CG2-CD2 4.11Å; L295-L304 HydrophobicContact CB-CD1 4.47Å; L295-L304 HydrophobicContact CD2-CD1 4.36Å; L295-L304 HydrophobicContact CD2-CD2 4.49Å; L295-F305 CarbonylContact C-O 3.51Å; L295-F305 WeakPolarHBondContact CA-O 3.46Å; L295-A306 HydrophobicContact CD2-CB 3.78Å
296	A	97.1	Very high	89.5	Confident	10 Å²	10	40 Å²	40	8%	0.083	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	134	169.5	0	0	0	0	0	110.9	I27 T29 F305	I27-A296 HydrophobicContact CB-CB 3.91Å; I27-A296 HydrophobicContact CG2-CB 3.84Å; T29-A296 HydrophobicContact CG2-CB 4.14Å; A296-F305 PolarHBondContact N-O 2.83Å; A296-F305 WeakPolarHBondContact O-CD2 3.48Å; A296-F305 PolarHBondContact O-N 2.83Å
297	W	96.8	Very high	91.5	Very high	13 Å²	13	30.4 Å²	30.4	5%	0.049	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	145.2	170.8	-78.8	101.5	0	0	0	111.1	M11 T29 C246 F247 P249 W253 C255 G301 L304 V318	M11-W297 HydrophobicContact CE-CH2 3.24Å; M11-W297 HydrophobicContact CE-CZ2 3.96Å; M11-W297 HydrophobicContact CE-CZ3 3.8Å; M11-W297 HydrophobicContact SD-CH2 4.36Å; T29-W297 WeakPolarHBondContact CB-O 3.4Å; T29-W297 VanDerWaalsContact CG2-O 3.32Å; T29-W297 WeakPolarHBondContact CG2-O 3.5Å; T29-W297 PolarHBondContact OG1-O 2.9Å; C246-W297 VanDerWaalsContact SG-CD1 3.52Å; F247-W297 VanDerWaalsContact O-CD1 3.26Å; P249-W297 HydrophobicContact CG-CB 4.28Å; W253-W297 HydrophobicContact CE3-CH2 4.24Å; W253-W297 HydrophobicContact CE3-CZ2 4.25Å; W253-W297 HydrophobicContact CZ3-CH2 4.33Å; C255-W297 WeakPolarHBondContact SG-CZ2 3.38Å; C255-W297 PolarHBondContact SG-NE1 3.39Å; W297-G301 WeakPolarHBondContact CZ3-O 3.28Å; W297-L304 HydrophobicContact CD2-CB 4.31Å; W297-L304 HydrophobicContact CD2-CD1 3.98Å; W297-L304 HydrophobicContact CE3-CB 4.08Å; W297-L304 HydrophobicContact CG-CD1 4.16Å; W297-L304 HydrophobicContact CH2-CB 4.19Å; W297-L304 HydrophobicContact CZ2-CB 4.38Å; W297-L304 HydrophobicContact CZ2-CD1 4.4Å; W297-L304 HydrophobicContact CZ3-CB 4.02Å; W297-V318 HydrophobicContact CH2-CG2 4.03Å; W297-V318 HydrophobicContact CZ3-CG2 4.01Å
298	S	95.3	Very high	93.1	Very high	13 Å²	13	27.6 Å²	27.6	9%	0.091	15%	0.151	C	C	.	.			trans	-62.4	155.5	160.9	54.1	0	0	0	0	110.2	D300 G301 Q302 T303	S298-D300 VanDerWaalsContact CB-OD1 3.27Å; S298-D300 WeakPolarHBondContact CB-OD1 3.41Å; S298-D300 PolarHBondContact O-N 3.1Å; S298-D300 PolarHBondContact OG-OD1 2.91Å; S298-G301 WeakPolarHBondContact O-CA 3.43Å; S298-G301 PolarHBondContact O-N 2.66Å; S298-Q302 PolarHBondContact OG-N 3.3Å; S298-T303 PolarHBondContact N-O 3.13Å; S298-T303 WeakPolarHBondContact OG-CA 3.37Å; S298-T303 WeakPolarHBondContact OG-CB 3.45Å; S298-T303 PolarHBondContact OG-N 3.3Å; S298-T303 PolarHBondContact OG-O 3.41Å; S298-T303 VanDerWaalsContact OG-O 3.05Å
299	A	91	Very high	94.1	Very high	45 Å²	45	20.5 Å²	20.5	37%	0.372	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.1	-178	0	0	0	0	0	113.5	P31 G301	P31-A299 VanDerWaalsContact CA-CB 3.47Å; P31-A299 HydrophobicContact CB-CB 3.84Å; P31-A299 HydrophobicContact CG-CB 3.98Å; A299-G301 VanDerWaalsContact C-N 3.26Å; A299-G301 PolarHBondContact O-N 3Å
300	D	90.8	Very high	94.5	Very high	88 Å²	88	20.6 Å²	20.6	47%	0.471	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-7.8	174.6	67.1	0.5	0	0	0	113.6	N250 S298 Q302	N250-D300 PolarHBondContact ND2-O 3.16Å; S298-D300 VanDerWaalsContact CB-OD1 3.27Å; S298-D300 WeakPolarHBondContact CB-OD1 3.41Å; S298-D300 PolarHBondContact O-N 3.1Å; S298-D300 PolarHBondContact OG-OD1 2.91Å; D300-Q302 HydrophobicContact CB-CG 4.48Å; D300-Q302 PolarHBondContact O-N 3.4Å; D300-Q302 PolarHBondContact OD1-N 3.24Å
301	G	92.1	Very high	94.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	64.2	18.5	-176.7	0	0	0	0	0	114.8	R251 W297 S298 A299	R251-G301 PolarHBondContact NH1-O 2.77Å; W297-G301 WeakPolarHBondContact CZ3-O 3.28Å; S298-G301 WeakPolarHBondContact O-CA 3.43Å; S298-G301 PolarHBondContact O-N 2.66Å; A299-G301 VanDerWaalsContact C-N 3.26Å; A299-G301 PolarHBondContact O-N 3Å
302	Q	92.6	Very high	94.8	Very high	65 Å²	65	21.3 Å²	21.3	30%	0.304	12%	0.121	S	C	.	.	S	Bend	trans	-97.8	-19.5	178.8	-61.4	-60.1	-9	0	0	113.5	S298 D300 Q317 V318	S298-Q302 PolarHBondContact OG-N 3.3Å; D300-Q302 HydrophobicContact CB-CG 4.48Å; D300-Q302 PolarHBondContact O-N 3.4Å; D300-Q302 PolarHBondContact OD1-N 3.24Å; Q302-Q317 WeakPolarHBondContact O-CA 3.38Å; Q302-Q317 WeakPolarHBondContact O-CG 3.48Å; Q302-V318 PolarHBondContact O-N 2.93Å
303	T	94.4	Very high	94.9	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.031	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.1	-177.1	-51.3	0	0	0	0	110	S298 F305 V315 W316	S298-T303 PolarHBondContact N-O 3.13Å; S298-T303 WeakPolarHBondContact OG-CA 3.37Å; S298-T303 WeakPolarHBondContact OG-CB 3.45Å; S298-T303 PolarHBondContact OG-N 3.3Å; S298-T303 PolarHBondContact OG-O 3.41Å; S298-T303 VanDerWaalsContact OG-O 3.05Å; T303-F305 HydrophobicContact CG2-CD1 4.47Å; T303-F305 HydrophobicContact CG2-CE1 3.88Å; T303-F305 HydrophobicContact CG2-CE2 4.04Å; T303-F305 HydrophobicContact CG2-CZ 3.63Å; T303-V315 HydrophobicContact CG2-CG1 3.27Å; T303-W316 CarbonylContact C-O 3.52Å; T303-W316 WeakPolarHBondContact CA-O 3.47Å
304	L	96.1	Very high	94.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.1	172.9	177.9	67	0	0	0	109.3	M11 I262 I264 L276 L295 W297 W316	M11-L304 HydrophobicContact CE-CB 3.42Å; M11-L304 VanDerWaalsContact CE-CB 3.42Å; M11-L304 HydrophobicContact CE-CD2 3.78Å; M11-L304 HydrophobicContact CE-CG 4.26Å; I262-L304 HydrophobicContact CG2-CD2 4.31Å; I264-L304 HydrophobicContact CD1-CD2 4.46Å; L276-L304 HydrophobicContact CD1-CD2 4.21Å; L295-L304 HydrophobicContact CB-CD1 4.47Å; L295-L304 HydrophobicContact CD2-CD1 4.36Å; L295-L304 HydrophobicContact CD2-CD2 4.49Å; W297-L304 HydrophobicContact CD2-CB 4.31Å; W297-L304 HydrophobicContact CD2-CD1 3.98Å; W297-L304 HydrophobicContact CE3-CB 4.08Å; W297-L304 HydrophobicContact CG-CD1 4.16Å; W297-L304 HydrophobicContact CH2-CB 4.19Å; W297-L304 HydrophobicContact CZ2-CB 4.38Å; W297-L304 HydrophobicContact CZ2-CD1 4.4Å; W297-L304 HydrophobicContact CZ3-CB 4.02Å; L304-W316 HydrophobicContact CB-CB 4.29Å; L304-W316 PolarHBondContact N-O 3.16Å; L304-W316 PolarHBondContact O-N 2.98Å
305	F	96.6	Very high	94.7	Very high	3 Å²	3	20.3 Å²	20.3	1%	0.013	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.5	173	-56.6	-79.2	0	0	0	109.3	I27 T29 I37 L51 Y58 L295 A296 T303 I313 V315	I27-F305 HydrophobicContact CD1-CB 3.99Å; I27-F305 HydrophobicContact CG2-CB 4.03Å; T29-F305 HydrophobicContact CG2-CD2 3.85Å; T29-F305 HydrophobicContact CG2-CE2 3.98Å; I37-F305 HydrophobicContact CD1-CD1 3.95Å; I37-F305 HydrophobicContact CD1-CE1 4.14Å; I37-F305 HydrophobicContact CD1-CG 4.41Å; I37-F305 HydrophobicContact CG2-CD2 4.42Å; I37-F305 HydrophobicContact CG2-CE1 4.37Å; I37-F305 HydrophobicContact CG2-CE2 3.96Å; I37-F305 HydrophobicContact CG2-CZ 3.95Å; L51-F305 HydrophobicContact CD1-CE1 4.2Å; L51-F305 HydrophobicContact CD1-CZ 3.72Å; L51-F305 HydrophobicContact CD2-CE1 4.25Å; Y58-F305 HydrophobicContact CD1-CE1 4.44Å; Y58-F305 AromaticContact CE1-CE1 3.94Å; Y58-F305 HydrophobicContact CE1-CE1 3.94Å; Y58-F305 HydrophobicContact CE1-CZ 4.36Å; L295-F305 CarbonylContact C-O 3.51Å; L295-F305 WeakPolarHBondContact CA-O 3.46Å; A296-F305 PolarHBondContact N-O 2.83Å; A296-F305 WeakPolarHBondContact O-CD2 3.48Å; A296-F305 PolarHBondContact O-N 2.83Å; T303-F305 HydrophobicContact CG2-CD1 4.47Å; T303-F305 HydrophobicContact CG2-CE1 3.88Å; T303-F305 HydrophobicContact CG2-CE2 4.04Å; T303-F305 HydrophobicContact CG2-CZ 3.63Å; F305-I313 HydrophobicContact CB-CG2 4.39Å; F305-V315 HydrophobicContact CD1-CG1 4.11Å; F305-V315 HydrophobicContact CD1-CG2 3.91Å; F305-V315 HydrophobicContact CE1-CG1 3.85Å; F305-V315 HydrophobicContact CE1-CG2 4.05Å
306	A	96.8	Very high	94.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	122.9	-179.8	0	0	0	0	0	110.4	I262 S294 L295 Y308 I313 R314	I262-A306 HydrophobicContact CD1-CB 3.51Å; S294-A306 WeakPolarHBondContact O-CA 3.4Å; L295-A306 HydrophobicContact CD2-CB 3.78Å; A306-Y308 HydrophobicContact CB-CD2 4.36Å; A306-Y308 HydrophobicContact CB-CE2 3.53Å; A306-Y308 VanDerWaalsContact O-CD2 3.31Å; A306-Y308 WeakPolarHBondContact O-CD2 3.24Å; A306-Y308 WeakPolarHBondContact O-CE2 3.41Å; A306-I313 CarbonylContact O-C 3.55Å; A306-I313 WeakPolarHBondContact O-CA 3.44Å; A306-R314 PolarHBondContact N-O 3.32Å; A306-R314 PolarHBondContact O-N 3.12Å
307	G	96.4	Very high	94.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	138.9	177.9	0	0	0	0	0	110.9	T293 S294	T293-G307 PolarHBondContact N-O 3.39Å; T293-G307 PolarHBondContact OG1-O 2.82Å; T293-G307 VanDerWaalsContact OG1-O 3.09Å; S294-G307 PolarHBondContact N-O 3.08Å; S294-G307 PolarHBondContact O-N 2.74Å; S294-G307 WeakPolarHBondContact OG-CA 3.18Å
308	Y	95.8	Very high	94	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.016	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	164.7	-173.7	-72.1	-103.8	0	0	0	113.4	V24 I262 P290 Q291 C292 A306 D310 N311 L312 R314	V24-Y308 PolarHBondContact N-O 3.48Å; I262-Y308 WeakPolarHBondContact CD1-OH 3.4Å; P290-Y308 HydrophobicContact CB-CD1 4.43Å; Q291-Y308 WeakPolarHBondContact O-CA 3.3Å; C292-Y308 HydrophobicContact CB-CD1 4.12Å; C292-Y308 HydrophobicContact CB-CE1 3.77Å; A306-Y308 HydrophobicContact CB-CD2 4.36Å; A306-Y308 HydrophobicContact CB-CE2 3.53Å; A306-Y308 VanDerWaalsContact O-CD2 3.31Å; A306-Y308 WeakPolarHBondContact O-CD2 3.24Å; A306-Y308 WeakPolarHBondContact O-CE2 3.41Å; Y308-D310 VanDerWaalsContact C-N 3.26Å; Y308-D310 WeakPolarHBondContact CB-OD1 3.49Å; Y308-D310 PolarHBondContact O-N 3.36Å; Y308-N311 PolarHBondContact O-N 3.03Å; Y308-L312 PolarHBondContact N-O 2.75Å; Y308-R314 HydrophobicContact CD2-CB 4.32Å; Y308-R314 HydrophobicContact CD2-CG 3.85Å; Y308-R314 HydrophobicContact CE2-CB 3.81Å; Y308-R314 HydrophobicContact CE2-CG 3.69Å
309	T	94.4	Very high	93.5	Very high	25 Å²	25	23.7 Å²	23.7	15%	0.153	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-10.6	175.9	51.6	0	0	0	0	114.8	W23 P290 Q291 T293 N311	W23-T309 HydrophobicContact CD2-CG2 3.67Å; W23-T309 HydrophobicContact CE3-CG2 3.64Å; W23-T309 HydrophobicContact CG-CG2 4.19Å; W23-T309 HydrophobicContact CH2-CG2 4.15Å; W23-T309 HydrophobicContact CZ2-CG2 4.17Å; W23-T309 HydrophobicContact CZ3-CG2 3.89Å; W23-T309 PolarHBondContact NE1-O 2.9Å; W23-T309 VanDerWaalsContact NE1-O 3.07Å; P290-T309 WeakPolarHBondContact CA-OG1 3.47Å; Q291-T309 HydrophobicContact CB-CG2 3.94Å; Q291-T309 PolarHBondContact N-OG1 2.96Å; Q291-T309 PolarHBondContact O-N 3.29Å; Q291-T309 PolarHBondContact O-OG1 2.87Å; T293-T309 HydrophobicContact CG2-CG2 3.61Å; T309-N311 PolarHBondContact O-N 3.38Å
310	D	93.3	Very high	93	Very high	54 Å²	54	26.8 Å²	26.8	29%	0.289	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	18.5	172	67	-17.6	0	0	0	113.2	P290 Y308 L312 R314	P290-D310 HydrophobicContact CB-CB 3.92Å; Y308-D310 VanDerWaalsContact C-N 3.26Å; Y308-D310 WeakPolarHBondContact CB-OD1 3.49Å; Y308-D310 PolarHBondContact O-N 3.36Å; D310-L312 PolarHBondContact O-N 3.42Å; D310-L312 PolarHBondContact OD1-N 2.74Å; D310-R314 IonicContact OD1-CZ 3.83Å; D310-R314 IonicContact OD1-NH1 3.2Å; D310-R314 PolarHBondContact OD1-NH1 2.81Å; D310-R314 IonicContact OD1-NH2 3.73Å; D310-R314 IonicContact OD2-CZ 3.88Å; D310-R314 IonicContact OD2-NH1 2.76Å; D310-R314 PolarHBondContact OD2-NH1 2.89Å; D310-R314 IonicContact OD2-NH2 3.85Å; D310-R314 PolarHBondContact OD2-NH2 2.91Å
311	N	94.2	Very high	91.6	Very high	51 Å²	51	23.6 Å²	23.6	27%	0.273	13%	0.127	S	C	.	.	S	Bend	trans	70.6	10.5	176.5	-37.8	-37.3	0	0	0	114.4	H20 G22 W23 Y308 T309	H20-N311 HydrophobicContact CB-CB 4.42Å; H20-N311 WeakPolarHBondContact O-CB 3.16Å; G22-N311 WeakPolarHBondContact CA-OD1 3.49Å; G22-N311 PolarHBondContact N-OD1 3.09Å; G22-N311 WeakPolarHBondContact O-CA 3.38Å; G22-N311 WeakPolarHBondContact O-CB 3.49Å; G22-N311 PolarHBondContact O-OD1 3.25Å; W23-N311 PolarHBondContact N-OD1 2.65Å; Y308-N311 PolarHBondContact O-N 3.03Å; T309-N311 PolarHBondContact O-N 3.38Å
312	L	94.2	Very high	89.5	Confident	35 Å²	35	29.3 Å²	29.3	18%	0.183	16%	0.162	C	C	.	.			trans	-102.4	147.2	-179.5	-60.9	-175.7	0	0	0	111.8	K18 Y308 D310	K18-L312 HydrophobicContact CB-CD2 4.14Å; K18-L312 HydrophobicContact CD-CD2 4.11Å; K18-L312 HydrophobicContact CG-CD2 3.68Å; Y308-L312 PolarHBondContact N-O 2.75Å; D310-L312 PolarHBondContact O-N 3.42Å; D310-L312 PolarHBondContact OD1-N 2.74Å
313	I	95.4	Very high	87.3	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128.8	161.3	-54.9	169.2	0	0	0	107	T16 L17 V24 I27 S39 W49 F305 A306	T16-I313 CarbonylContact C-O 3.6Å; T16-I313 VanDerWaalsContact CA-O 3.26Å; T16-I313 WeakPolarHBondContact CA-O 3.4Å; L17-I313 HydrophobicContact CB-CB 4.06Å; L17-I313 HydrophobicContact CD1-CB 4.19Å; L17-I313 HydrophobicContact CD1-CD1 4.25Å; L17-I313 HydrophobicContact CD1-CG2 4.08Å; L17-I313 HydrophobicContact CG-CB 4.4Å; L17-I313 PolarHBondContact N-O 2.73Å; L17-I313 PolarHBondContact O-N 3.33Å; V24-I313 HydrophobicContact CB-CG1 4.49Å; V24-I313 HydrophobicContact CG1-CD1 4.4Å; V24-I313 HydrophobicContact CG1-CG1 4.03Å; V24-I313 HydrophobicContact CG2-CG1 3.95Å; I27-I313 HydrophobicContact CD1-CD1 4.47Å; I27-I313 HydrophobicContact CD1-CG1 4.24Å; I27-I313 HydrophobicContact CD1-CG2 3.68Å; S39-I313 WeakPolarHBondContact OG-CD1 3.44Å; W49-I313 HydrophobicContact CZ2-CD1 4.01Å; F305-I313 HydrophobicContact CB-CG2 4.39Å; A306-I313 CarbonylContact O-C 3.55Å; A306-I313 WeakPolarHBondContact O-CA 3.44Å
314	R	93.9	Very high	87	Confident	8 Å²	8	39.6 Å²	39.6	3%	0.03	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.7	175.7	-58	-179.3	172.3	61.1	-2.3	109.2	T16 A306 Y308 D310	T16-R314 HydrophobicContact CG2-CG 4.22Å; A306-R314 PolarHBondContact N-O 3.32Å; A306-R314 PolarHBondContact O-N 3.12Å; Y308-R314 HydrophobicContact CD2-CB 4.32Å; Y308-R314 HydrophobicContact CD2-CG 3.85Å; Y308-R314 HydrophobicContact CE2-CB 3.81Å; Y308-R314 HydrophobicContact CE2-CG 3.69Å; D310-R314 IonicContact OD1-CZ 3.83Å; D310-R314 IonicContact OD1-NH1 3.2Å; D310-R314 PolarHBondContact OD1-NH1 2.81Å; D310-R314 IonicContact OD1-NH2 3.73Å; D310-R314 IonicContact OD2-CZ 3.88Å; D310-R314 IonicContact OD2-NH1 2.76Å; D310-R314 PolarHBondContact OD2-NH1 2.89Å; D310-R314 IonicContact OD2-NH2 3.85Å; D310-R314 PolarHBondContact OD2-NH2 2.91Å
315	V	94.4	Very high	86.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.2	-175.6	-170.2	0	0	0	0	108.5	R14 G15 L17 Y58 T303 F305	R14-V315 PolarHBondContact N-O 3.35Å; G15-V315 PolarHBondContact O-N 3.08Å; L17-V315 HydrophobicContact CD1-CG2 4.48Å; L17-V315 HydrophobicContact CG-CG2 4.28Å; Y58-V315 HydrophobicContact CD1-CB 4.23Å; Y58-V315 HydrophobicContact CD1-CG1 3.9Å; Y58-V315 HydrophobicContact CD1-CG2 3.76Å; Y58-V315 HydrophobicContact CD2-CB 4.36Å; Y58-V315 HydrophobicContact CD2-CG1 4.06Å; Y58-V315 HydrophobicContact CE1-CG1 3.7Å; Y58-V315 HydrophobicContact CE1-CG2 4.33Å; Y58-V315 HydrophobicContact CE2-CG1 3.84Å; Y58-V315 HydrophobicContact CG-CB 4.16Å; Y58-V315 HydrophobicContact CG-CG1 4.08Å; Y58-V315 HydrophobicContact CG-CG2 3.93Å; T303-V315 HydrophobicContact CG2-CG1 3.27Å; F305-V315 HydrophobicContact CD1-CG1 4.11Å; F305-V315 HydrophobicContact CD1-CG2 3.91Å; F305-V315 HydrophobicContact CE1-CG1 3.85Å; F305-V315 HydrophobicContact CE1-CG2 4.05Å
316	W	93.4	Very high	85.9	Confident	12 Å²	12	43.8 Å²	43.8	5%	0.045	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.4	176.1	-58.1	88.7	0	0	0	108.6	M11 T12 V13 L276 T303 L304	M11-W316 HydrophobicContact CB-CE3 4.38Å; M11-W316 HydrophobicContact CE-CB 4.27Å; T12-W316 CarbonylContact O-C 3.59Å; T12-W316 WeakPolarHBondContact O-CA 3.47Å; V13-W316 HydrophobicContact CB-CE3 4.37Å; V13-W316 HydrophobicContact CB-CZ3 4.33Å; V13-W316 HydrophobicContact CG2-CD2 4.05Å; V13-W316 HydrophobicContact CG2-CE3 3.54Å; V13-W316 HydrophobicContact CG2-CH2 3.25Å; V13-W316 HydrophobicContact CG2-CZ2 3.77Å; V13-W316 HydrophobicContact CG2-CZ3 3.14Å; L276-W316 HydrophobicContact CB-CD2 4.45Å; L276-W316 HydrophobicContact CB-CE3 4.36Å; L276-W316 HydrophobicContact CB-CH2 3.85Å; L276-W316 HydrophobicContact CB-CZ2 3.95Å; L276-W316 HydrophobicContact CB-CZ3 4.04Å; L276-W316 HydrophobicContact CD1-CB 4.37Å; L276-W316 HydrophobicContact CD1-CD2 3.73Å; L276-W316 HydrophobicContact CD1-CE3 3.98Å; L276-W316 HydrophobicContact CD1-CG 3.89Å; L276-W316 HydrophobicContact CD1-CZ3 4.49Å; L276-W316 HydrophobicContact CD2-CE3 4.29Å; L276-W316 HydrophobicContact CD2-CZ3 4.3Å; L276-W316 HydrophobicContact CG-CE3 4.44Å; T303-W316 CarbonylContact C-O 3.52Å; T303-W316 WeakPolarHBondContact CA-O 3.47Å; L304-W316 HydrophobicContact CB-CB 4.29Å; L304-W316 PolarHBondContact N-O 3.16Å; L304-W316 PolarHBondContact O-N 2.98Å
317	Q	91.6	Very high	85.3	Confident	52 Å²	52	46.4 Å²	46.4	24%	0.243	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.1	176.5	-164.9	176.4	25.9	0	0	110.3	T12 R14 Q302 T319	T12-Q317 PolarHBondContact N-O 3.4Å; T12-Q317 PolarHBondContact O-N 3.1Å; T12-Q317 PolarHBondContact OG1-O 2.78Å; R14-Q317 HydrophobicContact CG-CB 3.43Å; R14-Q317 VanDerWaalsContact CG-CB 3.43Å; R14-Q317 HydrophobicContact CG-CG 4.44Å; Q302-Q317 WeakPolarHBondContact O-CA 3.38Å; Q302-Q317 WeakPolarHBondContact O-CG 3.48Å; Q317-T319 PolarHBondContact O-N 2.7Å
318	V	90.8	Very high	84.6	Confident	14 Å²	14	49.3 Å²	49.3	9%	0.085	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	127.7	172.9	-174.6	0	0	0	0	108.4	E9 M11 W253 W297 Q302	E9-V318 HydrophobicContact CB-CG1 3.95Å; E9-V318 HydrophobicContact CG-CG1 4.26Å; M11-V318 HydrophobicContact CE-CG2 4.18Å; M11-V318 HydrophobicContact SD-CB 4.15Å; M11-V318 HydrophobicContact SD-CG2 3.47Å; M11-V318 WeakPolarHBondContact SD-CG2 3.29Å; W253-V318 HydrophobicContact CH2-CG1 4.5Å; W253-V318 HydrophobicContact CZ3-CG2 4.26Å; W297-V318 HydrophobicContact CH2-CG2 4.03Å; W297-V318 HydrophobicContact CZ3-CG2 4.01Å; Q302-V318 PolarHBondContact O-N 2.93Å
319	T	85.9	Confident	83.9	Confident	36 Å²	36	52.3 Å²	52.3	22%	0.221	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.6	176.1	45.6	0	0	0	0	108.9	Q10 T12 Q317 G321	Q10-T319 PolarHBondContact N-O 3.27Å; Q10-T319 PolarHBondContact O-N 2.95Å; Q10-T319 VanDerWaalsContact O-O 3.08Å; Q10-T319 PolarHBondContact O-OG1 3.21Å; T12-T319 HydrophobicContact CG2-CG2 4.37Å; T12-T319 WeakPolarHBondContact CG2-OG1 3.37Å; T12-T319 WeakPolarHBondContact OG1-CG2 3.23Å; T12-T319 PolarHBondContact OG1-OG1 3.47Å; Q317-T319 PolarHBondContact O-N 2.7Å; T319-G321 PolarHBondContact O-N 3.24Å
320	I	79.3	Confident	83.1	Confident	111 Å²	111	54.3 Å²	54.3	57%	0.569	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	108.8	176.8	-60.2	169.7	0	0	0	107	M7 E9	M7-I320 HydrophobicContact CB-CG2 3.98Å; M7-I320 HydrophobicContact CG-CG2 4.14Å; M7-I320 HydrophobicContact SD-CG2 4.16Å; E9-I320 HydrophobicContact CG-CG1 4.49Å
321	G	61.3	Low	82.3	Confident	20 Å²	20	54.3 Å²	54.3	21%	0.206	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	127	170.1	0	0	0	0	0	109.9	T8 T319	T8-G321 PolarHBondContact N-O 2.81Å; T8-G321 PolarHBondContact O-N 3.32Å; T8-G321 VanDerWaalsContact O-N 3.08Å; T319-G321 PolarHBondContact O-N 3.24Å
322	T	48.7	Very low	81.4	Confident	121 Å²	121	54.6 Å²	54.6	74%	0.742	27%	0.271	S	S	*	.			trans	-83.2	110.8	160.8	50.8	0	0	0	0	107.8
323	R	47.3	Very low	80.2	Confident	246 Å²	246	56.4 Å²	56.4	93%	0.928	28%	0.279	S	S	*	.			trans	-85.3	0	160.2	-85.9	-174	175.1	-178.1	1.2	109.9

Retrieved 323 of 323 residues in 371.8 ms (Link to these results)

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