A0A077ZG89_TRITR Loading...

Retinoblastoma binding protein 5

AlphaFold DB , UniProt , Accession A0A077ZG89, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 449 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.9	Very low	49.7	Very low	170 Å²	170	103.4 Å²	103.4	84%	0.837	62%	0.617	S	S	*	*				0	140.6	0	-80.6	-157.6	-167.3	0	0	106.7	G3 V296 M374	M1-G3 PolarHBondContact O-N 3.17Å; M1-V296 HydrophobicContact CE-CG2 4.38Å; M1-M374 HydrophobicContact CE-CE 3.88Å; M1-M374 HydrophobicContact CE-SD 4.18Å; M1-M374 HydrophobicContact CG-CE 4.3Å; M1-M374 HydrophobicContact SD-CE 4.1Å
2	G	30.7	Very low	53.1	Low	75 Å²	75	94.8 Å²	94.8	77%	0.773	57%	0.565	S	S	*	*			trans	-52.9	125.9	-175	0	0	0	0	0	112.3	T4	G2-T4 PolarHBondContact O-N 3.46Å; G2-T4 VanDerWaalsContact O-N 3.15Å
3	G	27.3	Very low	56	Low	81 Å²	81	91.2 Å²	91.2	84%	0.835	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	41	-178.9	0	0	0	0	0	114.1	M1	M1-G3 PolarHBondContact O-N 3.17Å
4	T	32.6	Very low	58.5	Low	125 Å²	125	90.7 Å²	90.7	77%	0.767	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.5	3.1	-174.2	51.1	0	0	0	0	117.9	G2	G2-T4 PolarHBondContact O-N 3.46Å; G2-T4 VanDerWaalsContact O-N 3.15Å
5	E	42.4	Very low	60.8	Low	129 Å²	129	89.9 Å²	89.9	60%	0.603	52%	0.521	S	S	*	.			trans	-133.9	80	169.6	-73.6	-172.9	173.5	0	0	112.8	F7	E5-F7 PolarHBondContact O-N 3.15Å; E5-F7 VanDerWaalsContact O-N 3.15Å
6	P	43.3	Very low	62.8	Low	115 Å²	115	88.6 Å²	88.6	75%	0.747	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-2.9	173.1	24.8	-28.7	0	0	0	113.8
7	F	48.4	Very low	64.6	Low	197 Å²	197	84.5 Å²	84.5	86%	0.864	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.3	12	-176.5	-65.9	-76.9	0	0	0	114.4	E5	E5-F7 PolarHBondContact O-N 3.15Å; E5-F7 VanDerWaalsContact O-N 3.15Å
8	G	55.5	Low	66.3	Low	32 Å²	32	84.3 Å²	84.3	33%	0.33	49%	0.488	S	S	.	.			trans	-64.7	140.5	-179.4	0	0	0	0	0	113.1	N10	G8-N10 PolarHBondContact O-OD1 2.86Å
9	Q	64.6	Low	67.9	Low	98 Å²	98	80.8 Å²	80.8	46%	0.458	47%	0.467	S	S	.	.			trans	-62.6	136.1	176.4	-86.5	159.8	-7.8	0	0	112.1	Y11 H313	Q9-Y11 HydrophobicContact CG-CE1 4.46Å; Q9-Y11 PolarHBondContact O-N 3.09Å; Q9-H313 PolarHBondContact OE1-NE2 3.44Å
10	N	78.3	Confident	69.2	Low	82 Å²	82	81.4 Å²	81.4	44%	0.439	47%	0.469	S	S	.	.	S	Bend	trans	-94.7	18.8	-169.7	-71.4	-25.7	0	0	0	114.8	G8 Y255 T298	G8-N10 PolarHBondContact O-OD1 2.86Å; N10-Y255 HydrophobicContact CB-CE2 3.67Å; N10-T298 WeakPolarHBondContact O-CG2 3.4Å
11	Y	86.2	Confident	70.3	Confident	33 Å²	33	78.1 Å²	78.1	13%	0.129	45%	0.451	C	S	.	.	S	Bend	trans	-142	151.7	-179.6	58.6	-96	0	0	0	112.2	Q9 E13 Y255 V277 K278	Q9-Y11 HydrophobicContact CG-CE1 4.46Å; Q9-Y11 PolarHBondContact O-N 3.09Å; Y11-E13 HydrophobicContact CD2-CG 4.31Å; Y11-E13 HydrophobicContact CE2-CG 4.04Å; Y11-E13 VanDerWaalsContact CE2-OE1 3.24Å; Y11-E13 WeakPolarHBondContact CE2-OE1 2.88Å; Y11-Y255 AromaticContact CD1-CE1 3.95Å; Y11-Y255 HydrophobicContact CD1-CE1 3.95Å; Y11-V277 HydrophobicContact CD1-CG1 3.81Å; Y11-V277 HydrophobicContact CD2-CG1 4.39Å; Y11-V277 HydrophobicContact CE1-CG1 3.41Å; Y11-V277 VanDerWaalsContact CE1-CG1 3.41Å; Y11-V277 HydrophobicContact CE2-CG1 4.07Å; Y11-V277 HydrophobicContact CG-CG1 4.29Å; Y11-K278 HydrophobicContact CD2-CB 4.19Å; Y11-K278 HydrophobicContact CD2-CG 4.5Å; Y11-K278 HydrophobicContact CE2-CB 4.22Å; Y11-K278 HydrophobicContact CE2-CD 4.19Å; Y11-K278 HydrophobicContact CE2-CG 4.39Å
12	P	90.6	Very high	73	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	44%	0.444	C	S	.	.			trans	-71	146.9	177.5	29.6	-35.8	0	0	0	111.8	I268 L280 W293 V300 W311	P12-I268 HydrophobicContact CG-CD1 3.63Å; P12-L280 HydrophobicContact CB-CD1 4.48Å; P12-L280 HydrophobicContact CG-CD1 4.23Å; P12-W293 HydrophobicContact CG-CH2 4.19Å; P12-W293 HydrophobicContact CG-CZ3 4.4Å; P12-V300 HydrophobicContact CG-CB 4.47Å; P12-V300 HydrophobicContact CG-CG2 3.93Å; P12-W311 HydrophobicContact CB-CB 4.12Å
13	E	89.9	Confident	76.1	Confident	49 Å²	49	71.8 Å²	71.8	23%	0.229	42%	0.417	C	S	.	.			trans	-121.9	-30.7	-171.7	-63.8	-134	124.6	0	0	114.4	Y11 K278 L280 S312	Y11-E13 HydrophobicContact CD2-CG 4.31Å; Y11-E13 HydrophobicContact CE2-CG 4.04Å; Y11-E13 VanDerWaalsContact CE2-OE1 3.24Å; Y11-E13 WeakPolarHBondContact CE2-OE1 2.88Å; E13-K278 IonicContact OE1-NZ 3.79Å; E13-K278 PolarHBondContact OE1-NZ 3.38Å; E13-K278 IonicContact OE2-NZ 3.93Å; E13-K278 PolarHBondContact OE2-NZ 3.18Å; E13-L280 WeakPolarHBondContact O-CD2 3.27Å; E13-S312 PolarHBondContact N-O 3.36Å
14	E	91.1	Very high	79.5	Confident	84 Å²	84	72.6 Å²	72.6	39%	0.393	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	165.3	-172.7	64.7	177.1	-169	0	0	112.6	E16 W311 S312 C314	E14-E16 PolarHBondContact O-N 3.21Å; E14-W311 CarbonylContact O-C 3.52Å; E14-W311 VanDerWaalsContact O-CA 3.25Å; E14-W311 WeakPolarHBondContact O-CA 3.49Å; E14-S312 PolarHBondContact N-O 3Å; E14-S312 VanDerWaalsContact N-O 3.11Å; E14-S312 PolarHBondContact O-N 3.02Å; E14-C314 VanDerWaalsContact CD-CB 3.4Å; E14-C314 VanDerWaalsContact CD-SG 3.57Å; E14-C314 HydrophobicContact CG-CB 4.09Å; E14-C314 VanDerWaalsContact OE1-CA 3.24Å; E14-C314 WeakPolarHBondContact OE1-CA 3.49Å; E14-C314 WeakPolarHBondContact OE1-CB 3.16Å; E14-C314 PolarHBondContact OE1-SG 3.05Å
15	L	93.6	Very high	82.6	Confident	79 Å²	79	66.6 Å²	66.6	41%	0.414	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	109.3	172.5	179.7	67.6	0	0	0	108.6	A309 W311	L15-A309 HydrophobicContact CD1-CB 3.6Å; L15-W311 HydrophobicContact CB-CE3 3.95Å; L15-W311 HydrophobicContact CB-CH2 4.06Å; L15-W311 HydrophobicContact CB-CZ3 3.65Å; L15-W311 HydrophobicContact CD1-CD2 4.28Å; L15-W311 HydrophobicContact CD1-CE3 4.43Å; L15-W311 HydrophobicContact CD1-CH2 4.28Å; L15-W311 HydrophobicContact CD1-CZ2 4.13Å; L15-W311 HydrophobicContact CD1-CZ3 4.44Å
16	E	93.2	Very high	85.1	Confident	69 Å²	69	62.9 Å²	62.9	32%	0.322	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-41.3	-179.1	-179.7	178.3	-165.7	0	0	111.9	E14 R54 L310 S312	E14-E16 PolarHBondContact O-N 3.21Å; E16-R54 IonicContact OE1-CZ 2.59Å; E16-R54 IonicContact OE1-NH1 3.51Å; E16-R54 IonicContact OE1-NH2 3.87Å; E16-R54 PolarHBondContact OE1-NH2 3.48Å; E16-R54 IonicContact OE2-NH2 3.6Å; E16-L310 HydrophobicContact CB-CG 4.37Å; E16-L310 PolarHBondContact N-O 3.43Å; E16-L310 WeakPolarHBondContact OE2-CD2 3.31Å; E16-S312 WeakPolarHBondContact CB-OG 3.23Å; E16-S312 WeakPolarHBondContact OE2-CB 3.2Å; E16-S312 PolarHBondContact OE2-OG 3.23Å
17	A	93.5	Very high	87.6	Confident	19 Å²	19	57.8 Å²	57.8	16%	0.157	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	158.7	-177	0	0	0	0	0	112.6	L310	A17-L310 HydrophobicContact CB-CB 4.31Å; A17-L310 HydrophobicContact CB-CD2 4.48Å; A17-L310 PolarHBondContact N-O 3.07Å; A17-L310 PolarHBondContact O-N 3.02Å
18	T	95	Very high	89.9	Confident	80 Å²	80	48.4 Å²	48.4	49%	0.491	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126.4	168.2	-59.1	0	0	0	0	108.7	K307 L308	T18-K307 HydrophobicContact CG2-CB 4.08Å; T18-K307 HydrophobicContact CG2-CD 4.18Å; T18-L308 CarbonylContact C-O 3.55Å; T18-L308 VanDerWaalsContact CA-O 3.32Å; T18-L308 WeakPolarHBondContact CA-O 3.48Å
19	L	95.8	Very high	91.8	Very high	18 Å²	18	51.1 Å²	51.1	9%	0.094	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.9	177.3	-46.6	-179.7	0	0	0	109.5	Y49 R54 F301 L308	L19-Y49 HydrophobicContact CB-CE1 4.41Å; L19-Y49 HydrophobicContact CD1-CD1 4.15Å; L19-Y49 HydrophobicContact CD1-CE1 4.25Å; L19-R54 HydrophobicContact CD2-CB 3.94Å; L19-F301 HydrophobicContact CD1-CE1 3.65Å; L19-F301 HydrophobicContact CD1-CZ 3.76Å; L19-F301 HydrophobicContact CG-CE1 4.2Å; L19-L308 HydrophobicContact CB-CB 4.26Å; L19-L308 PolarHBondContact N-O 2.92Å; L19-L308 PolarHBondContact O-N 2.79Å
20	D	94.6	Very high	93.3	Very high	92 Å²	92	47 Å²	47	49%	0.492	25%	0.25	S	C	.	.			trans	-110.8	124.7	171.5	-162.7	-31.1	0	0	0	108.1	G22 Y49 K307	D20-G22 VanDerWaalsContact C-N 3.35Å; D20-G22 PolarHBondContact OD1-N 3.3Å; D20-Y49 PolarHBondContact O-OH 3.35Å; D20-K307 VanDerWaalsContact OD2-CE 3.3Å; D20-K307 WeakPolarHBondContact OD2-CE 3.43Å; D20-K307 IonicContact OD2-NZ 3.88Å
21	C	92.7	Very high	93.9	Very high	14 Å²	14	43.2 Å²	43.2	10%	0.095	23%	0.229	C	C	.	.			trans	-93.2	3.8	-179.5	69.4	0	0	0	0	113.4	H23 C41 V47 Y49	C21-H23 PolarHBondContact O-CD2 3.27Å; C21-H23 VanDerWaalsContact O-CD2 3.23Å; C21-H23 PolarHBondContact O-N 3.02Å; C21-H23 PolarHBondContact SG-O 3.18Å; C21-C41 VanDerWaalsContact SG-SG 3.67Å; C21-V47 HydrophobicContact CB-CB 4.39Å; C21-V47 HydrophobicContact CB-CG1 4.31Å; C21-V47 HydrophobicContact CB-CG2 4.21Å; C21-Y49 WeakPolarHBondContact CA-OH 3.4Å; C21-Y49 HydrophobicContact CB-CE2 3.87Å; C21-Y49 WeakPolarHBondContact CB-OH 3.45Å; C21-Y49 PolarHBondContact N-OH 3.34Å
22	G	94.3	Very high	94	Very high	68 Å²	68	43.1 Å²	43.1	70%	0.701	23%	0.229	S	C	*	.	S	Bend	trans	75.6	-6.9	-174.7	0	0	0	0	0	113.7	D20	D20-G22 VanDerWaalsContact C-N 3.35Å; D20-G22 PolarHBondContact OD1-N 3.3Å
23	H	96.3	Very high	93.7	Very high	43 Å²	43	44.5 Å²	44.5	20%	0.199	23%	0.234	C	C	.	.	S	Bend	trans	-126.1	165.1	178.8	-57.2	-83.8	0	0	0	109.4	C21 A25 C41 D43 H45 N59	C21-H23 PolarHBondContact O-CD2 3.27Å; C21-H23 VanDerWaalsContact O-CD2 3.23Å; C21-H23 PolarHBondContact O-N 3.02Å; C21-H23 PolarHBondContact SG-O 3.18Å; H23-A25 PolarHBondContact O-N 2.96Å; H23-C41 HydrophobicContact CB-CB 3.75Å; H23-D43 IonicContact CE1-OD2 2.7Å; H23-D43 IonicContact CG-OD2 3.15Å; H23-D43 IonicContact ND1-OD1 3.51Å; H23-D43 IonicContact ND1-OD2 3.26Å; H23-D43 PolarHBondContact ND1-OD2 2.67Å; H23-H45 AromaticContact CE1-CD2 3.35Å; H23-H45 PolarHBondContact CE1-CD2 2.73Å; H23-H45 AromaticContact CE1-CE1 3.46Å; H23-H45 PolarHBondContact CE1-CE1 3.34Å; H23-H45 VanDerWaalsContact CE1-CE1 3.46Å; H23-H45 AromaticContact CE1-CG 3.44Å; H23-H45 VanDerWaalsContact CE1-CG 3.44Å; H23-H45 AromaticContact CE1-ND1 3.52Å; H23-H45 AromaticContact CE1-NE2 3.38Å; H23-H45 PolarHBondContact CE1-NE2 3.25Å; H23-H45 AromaticContact ND1-CD2 3.56Å; H23-H45 AromaticContact ND1-CG 3.75Å; H23-H45 AromaticContact ND1-NE2 4Å; H23-H45 AromaticContact NE2-CE1 3.77Å; H23-H45 AromaticContact NE2-CG 3.67Å; H23-H45 AromaticContact NE2-ND1 3.5Å; H23-N59 PolarHBondContact NE2-ND2 3.48Å; H23-N59 VanDerWaalsContact NE2-ND2 3.18Å
24	Y	96.9	Very high	93.8	Very high	98 Å²	98	42.1 Å²	42.1	38%	0.384	22%	0.223	S	C	.	.			trans	-84	101.4	178.2	-165.1	-80.4	0	0	0	110.1	C41 N42 L289	Y24-C41 CarbonylContact O-C 3.58Å; Y24-C41 VanDerWaalsContact O-CA 3.29Å; Y24-C41 WeakPolarHBondContact O-CA 3.27Å; Y24-N42 VanDerWaalsContact CB-CG 3.47Å; Y24-N42 VanDerWaalsContact CB-OD1 3.32Å; Y24-N42 WeakPolarHBondContact CB-OD1 3.17Å; Y24-N42 HydrophobicContact CD1-CB 4.37Å; Y24-N42 PolarHBondContact O-N 3.21Å; Y24-L289 HydrophobicContact CE1-CD1 4.19Å
25	A	97.6	Very high	93.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	138.5	179.3	0	0	0	0	0	112.5	H23 V39 V303 G306 L308	H23-A25 PolarHBondContact O-N 2.96Å; A25-V39 HydrophobicContact CB-CG1 3.55Å; A25-V303 HydrophobicContact CB-CG1 3.95Å; A25-V303 WeakPolarHBondContact O-CG1 3.29Å; A25-G306 VanDerWaalsContact CB-O 3.31Å; A25-G306 WeakPolarHBondContact CB-O 3.5Å; A25-G306 PolarHBondContact N-O 3Å; A25-G306 WeakPolarHBondContact O-CA 3.4Å; A25-L308 HydrophobicContact CB-CD1 4.11Å; A25-L308 HydrophobicContact CB-CG 4.48Å
26	I	95.8	Very high	93.9	Very high	50 Å²	50	35.5 Å²	35.5	26%	0.256	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	-47.6	178.9	-63.9	179.7	0	0	0	111.2	G40 N42 A66 D290	I26-G40 PolarHBondContact N-O 3.41Å; I26-N42 HydrophobicContact CD1-CB 3.63Å; I26-N42 HydrophobicContact CG1-CB 4.16Å; I26-A66 HydrophobicContact CD1-CB 3.7Å; I26-D290 WeakPolarHBondContact O-CB 3.4Å
27	C	95.6	Very high	94.1	Very high	8 Å²	8	32.2 Å²	32.2	5%	0.054	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	155.1	-176.9	63.2	0	0	0	0	111.1	V39 G40 D290	C27-V39 WeakPolarHBondContact O-CA 3.26Å; C27-G40 PolarHBondContact N-O 3.4Å; C27-G40 PolarHBondContact O-N 2.81Å; C27-D290 WeakPolarHBondContact CA-OD2 3.2Å; C27-D290 HydrophobicContact CB-CB 4.49Å; C27-D290 WeakPolarHBondContact CB-OD2 3.31Å
28	C	96.5	Very high	94.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	141.4	179.5	67	0	0	0	0	112.4	L37 A38 V39 D290 V292 V303 L308	C28-L37 HydrophobicContact CB-CD1 4.05Å; C28-L37 HydrophobicContact CB-CG 4.4Å; C28-A38 CarbonylContact C-O 3.19Å; C28-A38 WeakPolarHBondContact CA-O 3.37Å; C28-V39 HydrophobicContact CB-CG2 4.36Å; C28-D290 PolarHBondContact N-OD2 3.39Å; C28-V292 VanDerWaalsContact SG-CG1 3.55Å; C28-V303 HydrophobicContact CB-CG2 4.17Å; C28-L308 HydrophobicContact CB-CD2 3.87Å
29	R	96.4	Very high	94.5	Very high	90 Å²	90	27.5 Å²	27.5	34%	0.34	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	133.2	179.8	-67.5	-65.9	175.8	-101.6	1.3	111.3	A38 I70 W72 D290	R29-A38 PolarHBondContact N-O 2.72Å; R29-A38 PolarHBondContact O-N 2.72Å; R29-I70 HydrophobicContact CB-CB 4.42Å; R29-I70 HydrophobicContact CB-CG2 4.27Å; R29-I70 HydrophobicContact CG-CB 4.14Å; R29-W72 PolarHBondContact O-NE1 3.12Å; R29-D290 IonicContact CZ-OD1 3.55Å; R29-D290 IonicContact CZ-OD2 2.73Å; R29-D290 IonicContact NH1-OD1 2.7Å; R29-D290 PolarHBondContact NH1-OD1 2.9Å; R29-D290 IonicContact NH1-OD2 3.33Å; R29-D290 PolarHBondContact NH1-OD2 2.9Å; R29-D290 IonicContact NH2-OD1 2.75Å; R29-D290 PolarHBondContact NH2-OD1 3.29Å; R29-D290 IonicContact NH2-OD2 3.42Å
30	F	94.5	Very high	94.6	Very high	12 Å²	12	26.7 Å²	26.7	5%	0.053	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	147.9	170.6	-79.6	-68.1	0	0	0	111.7	L36 L37 F51 V292 H294 F301	F30-L36 WeakPolarHBondContact CA-O 3.43Å; F30-L36 WeakPolarHBondContact CD1-O 3.49Å; F30-L37 HydrophobicContact CD1-CB 4.16Å; F30-L37 HydrophobicContact CD1-CD1 3.97Å; F30-L37 HydrophobicContact CD2-CD1 4.17Å; F30-L37 HydrophobicContact CE1-CB 4.08Å; F30-L37 HydrophobicContact CE1-CD1 4.05Å; F30-L37 HydrophobicContact CE2-CD1 4.24Å; F30-L37 HydrophobicContact CG-CD1 4.05Å; F30-L37 HydrophobicContact CZ-CD1 4.19Å; F30-F51 HydrophobicContact CE1-CB 4.5Å; F30-F51 AromaticContact CE1-CD2 3.71Å; F30-F51 HydrophobicContact CE1-CD2 3.71Å; F30-F51 HydrophobicContact CE1-CE2 4.29Å; F30-F51 HydrophobicContact CE1-CG 4.27Å; F30-F51 AromaticContact CZ-CD2 3.91Å; F30-F51 HydrophobicContact CZ-CD2 3.91Å; F30-F51 HydrophobicContact CZ-CE2 4.02Å; F30-V292 HydrophobicContact CD2-CB 4.39Å; F30-V292 HydrophobicContact CD2-CG1 3.75Å; F30-V292 HydrophobicContact CD2-CG2 3.81Å; F30-V292 HydrophobicContact CE2-CG1 3.84Å; F30-H294 HydrophobicContact CD2-CB 4.41Å; F30-H294 AromaticContact CE1-CD2 3.6Å; F30-H294 HydrophobicContact CE2-CB 3.78Å; F30-H294 HydrophobicContact CZ-CB 3.97Å; F30-H294 AromaticContact CZ-CD2 3.55Å; F30-F301 HydrophobicContact CE1-CD2 4.38Å; F30-F301 HydrophobicContact CE1-CE2 4.3Å; F30-F301 AromaticContact CE2-CD2 3.89Å; F30-F301 HydrophobicContact CE2-CD2 3.89Å; F30-F301 AromaticContact CZ-CD2 3.45Å; F30-F301 HydrophobicContact CZ-CD2 3.45Å; F30-F301 VanDerWaalsContact CZ-CD2 3.45Å; F30-F301 AromaticContact CZ-CE2 3.67Å; F30-F301 HydrophobicContact CZ-CE2 3.67Å
31	N	92.9	Very high	94.8	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	12%	0.118	C	C	.	.			trans	-65.8	176.8	160.3	76.2	-11	0	0	0	110.7	W33 G34 S35 L36 W72	N31-W33 VanDerWaalsContact C-N 3.31Å; N31-W33 PolarHBondContact O-N 3.3Å; N31-G34 PolarHBondContact O-N 2.97Å; N31-G34 WeakPolarHBondContact OD1-CA 3.35Å; N31-G34 PolarHBondContact OD1-N 3.25Å; N31-S35 PolarHBondContact ND2-OG 3.05Å; N31-S35 PolarHBondContact OD1-N 2.85Å; N31-L36 HydrophobicContact CB-CB 4.3Å; N31-L36 PolarHBondContact N-O 3.01Å; N31-L36 PolarHBondContact OD1-N 3.23Å; N31-L36 PolarHBondContact OD1-O 3.35Å; N31-W72 HydrophobicContact CB-CD2 3.8Å; N31-W72 HydrophobicContact CB-CE3 3.89Å; N31-W72 HydrophobicContact CB-CG 4.19Å; N31-W72 HydrophobicContact CB-CH2 4.42Å; N31-W72 HydrophobicContact CB-CZ2 4.36Å; N31-W72 HydrophobicContact CB-CZ3 4.19Å
32	R	87.3	Confident	95	Very high	32 Å²	32	25.2 Å²	25.2	12%	0.121	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-37.7	-174.3	168.7	170.7	171	-152.5	10.3	114.2	R74 F377 D383	R32-R74 WeakPolarHBondContact CD-O 3.4Å; R32-F377 PolarHBondContact NH2-O 3.09Å; R32-D383 IonicContact CZ-OD2 3.06Å; R32-D383 IonicContact NH1-OD2 3.6Å; R32-D383 PolarHBondContact NH1-OD2 3.14Å; R32-D383 VanDerWaalsContact NH1-OD2 3.1Å; R32-D383 IonicContact NH2-OD2 3.04Å; R32-D383 PolarHBondContact NH2-OD2 3.09Å
33	W	84.8	Confident	95.1	Very high	28 Å²	28	25 Å²	25	11%	0.106	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-6.4	-178.1	-64.7	-86.7	0	0	0	114.2	N31 S35 R74 P386 R388	N31-W33 VanDerWaalsContact C-N 3.31Å; N31-W33 PolarHBondContact O-N 3.3Å; W33-S35 VanDerWaalsContact C-N 3.26Å; W33-S35 PolarHBondContact O-N 2.83Å; W33-R74 WeakPolarHBondContact CH2-O 3.09Å; W33-R74 WeakPolarHBondContact CZ3-O 3.18Å; W33-P386 HydrophobicContact CD2-CB 4.46Å; W33-P386 HydrophobicContact CD2-CG 4.12Å; W33-P386 HydrophobicContact CE3-CB 3.84Å; W33-P386 HydrophobicContact CE3-CG 3.97Å; W33-P386 HydrophobicContact CH2-CB 2.85Å; W33-P386 HydrophobicContact CH2-CG 3.16Å; W33-P386 HydrophobicContact CZ2-CB 3.55Å; W33-P386 HydrophobicContact CZ2-CG 3.23Å; W33-P386 HydrophobicContact CZ3-CB 3.02Å; W33-P386 HydrophobicContact CZ3-CG 3.55Å; W33-R388 HydrophobicContact CD2-CG 4.37Å; W33-R388 HydrophobicContact CE3-CG 4.37Å
34	G	90.6	Very high	95.2	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	76.6	9.3	-175.9	0	0	0	0	0	114.4	N31 F51 H294 P295	N31-G34 PolarHBondContact O-N 2.97Å; N31-G34 WeakPolarHBondContact OD1-CA 3.35Å; N31-G34 PolarHBondContact OD1-N 3.25Å; G34-F51 VanDerWaalsContact O-CB 3.27Å; G34-F51 WeakPolarHBondContact O-CB 3.46Å; G34-H294 PolarHBondContact O-CD2 3.09Å; G34-H294 PolarHBondContact O-NE2 2.96Å; G34-P295 VanDerWaalsContact N-CG 3.34Å
35	S	92.4	Very high	95.2	Very high	23 Å²	23	20.4 Å²	20.4	16%	0.161	10%	0.098	C	C	.	.	S	Bend	trans	-74.9	-28.3	178.2	59.2	0	0	0	0	112.9	N31 W33 F51 R388	N31-S35 PolarHBondContact ND2-OG 3.05Å; N31-S35 PolarHBondContact OD1-N 2.85Å; W33-S35 VanDerWaalsContact C-N 3.26Å; W33-S35 PolarHBondContact O-N 2.83Å; S35-F51 WeakPolarHBondContact O-CB 3.46Å; S35-F51 PolarHBondContact O-N 3.24Å; S35-R388 WeakPolarHBondContact CB-O 3.27Å; S35-R388 PolarHBondContact OG-O 3.13Å
36	L	95.3	Very high	95.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	140.8	178.4	-58.4	173.4	0	0	0	110.6	F30 N31 I48 Y49 D50 W72 I390	F30-L36 WeakPolarHBondContact CA-O 3.43Å; F30-L36 WeakPolarHBondContact CD1-O 3.49Å; N31-L36 HydrophobicContact CB-CB 4.3Å; N31-L36 PolarHBondContact N-O 3.01Å; N31-L36 PolarHBondContact OD1-N 3.23Å; N31-L36 PolarHBondContact OD1-O 3.35Å; L36-I48 HydrophobicContact CB-CG2 4.26Å; L36-I48 HydrophobicContact CD2-CG2 4.39Å; L36-Y49 CarbonylContact C-O 3.58Å; L36-Y49 VanDerWaalsContact CA-O 3.27Å; L36-Y49 WeakPolarHBondContact CA-O 3.44Å; L36-D50 HydrophobicContact CD2-CB 4.48Å; L36-W72 HydrophobicContact CB-CH2 3.85Å; L36-W72 HydrophobicContact CB-CZ2 4.13Å; L36-W72 HydrophobicContact CD1-CH2 4.03Å; L36-W72 HydrophobicContact CD1-CZ3 4.3Å; L36-I390 HydrophobicContact CD1-CD1 3.92Å; L36-I390 HydrophobicContact CD1-CG1 3.92Å; L36-I390 HydrophobicContact CD2-CD1 4.31Å; L36-I390 HydrophobicContact CD2-CG1 4.33Å
37	L	97.2	Very high	95.3	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	117.8	174	-179	73.7	0	0	0	109.3	C28 F30 V39 I48 Y49 V292 F301 L308	C28-L37 HydrophobicContact CB-CD1 4.05Å; C28-L37 HydrophobicContact CB-CG 4.4Å; F30-L37 HydrophobicContact CD1-CB 4.16Å; F30-L37 HydrophobicContact CD1-CD1 3.97Å; F30-L37 HydrophobicContact CD2-CD1 4.17Å; F30-L37 HydrophobicContact CE1-CB 4.08Å; F30-L37 HydrophobicContact CE1-CD1 4.05Å; F30-L37 HydrophobicContact CE2-CD1 4.24Å; F30-L37 HydrophobicContact CG-CD1 4.05Å; F30-L37 HydrophobicContact CZ-CD1 4.19Å; L37-V39 HydrophobicContact CD2-CG2 4.22Å; L37-V39 HydrophobicContact CG-CG2 4.25Å; L37-I48 WeakPolarHBondContact O-CA 3.49Å; L37-Y49 PolarHBondContact N-O 2.82Å; L37-Y49 PolarHBondContact O-N 3.44Å; L37-V292 HydrophobicContact CD1-CG1 3.98Å; L37-F301 HydrophobicContact CD1-CD2 4.44Å; L37-F301 HydrophobicContact CD2-CD1 4.26Å; L37-F301 HydrophobicContact CD2-CD2 3.76Å; L37-F301 HydrophobicContact CD2-CE1 4.27Å; L37-F301 HydrophobicContact CD2-CE2 3.78Å; L37-F301 HydrophobicContact CD2-CG 4Å; L37-F301 HydrophobicContact CD2-CZ 4.04Å; L37-L308 HydrophobicContact CD2-CD2 3.73Å
38	A	97.9	Very high	95.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	137.5	169.4	0	0	0	0	0	109.5	C28 R29 L46 V47 I70 W72 I79	C28-A38 CarbonylContact C-O 3.19Å; C28-A38 WeakPolarHBondContact CA-O 3.37Å; R29-A38 PolarHBondContact N-O 2.72Å; R29-A38 PolarHBondContact O-N 2.72Å; A38-L46 HydrophobicContact CB-CD1 4.05Å; A38-V47 CarbonylContact C-O 3.52Å; A38-I70 HydrophobicContact CB-CD1 4.34Å; A38-I70 HydrophobicContact CB-CG2 3.93Å; A38-W72 HydrophobicContact CB-CZ2 3.49Å; A38-W72 VanDerWaalsContact CB-CZ2 3.49Å; A38-I79 HydrophobicContact CB-CD1 4.14Å
39	V	98.4	Very high	95.4	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.1	179.2	-175.8	0	0	0	0	108.4	A25 C27 C28 L37 L46 V47 Y49 L308	A25-V39 HydrophobicContact CB-CG1 3.55Å; C27-V39 WeakPolarHBondContact O-CA 3.26Å; C28-V39 HydrophobicContact CB-CG2 4.36Å; L37-V39 HydrophobicContact CD2-CG2 4.22Å; L37-V39 HydrophobicContact CG-CG2 4.25Å; V39-L46 WeakPolarHBondContact O-CA 3.08Å; V39-V47 HydrophobicContact CB-CB 4.42Å; V39-V47 PolarHBondContact N-O 2.75Å; V39-V47 PolarHBondContact O-N 3.29Å; V39-Y49 HydrophobicContact CG2-CD2 3.92Å; V39-Y49 HydrophobicContact CG2-CE2 4.16Å; V39-L308 HydrophobicContact CG1-CD1 4.03Å; V39-L308 HydrophobicContact CG1-CD2 4.24Å; V39-L308 HydrophobicContact CG2-CD1 4.09Å; V39-L308 HydrophobicContact CG2-CD2 3.55Å; V39-L308 HydrophobicContact CG2-CG 4.47Å
40	G	98.2	Very high	95.3	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129.4	176	0	0	0	0	0	110.2	I26 C27 I70	I26-G40 PolarHBondContact N-O 3.41Å; C27-G40 PolarHBondContact N-O 3.4Å; C27-G40 PolarHBondContact O-N 2.81Å; G40-I70 VanDerWaalsContact N-CD1 3.33Å
41	C	98.4	Very high	95.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	165.2	-172.6	-58.3	0	0	0	0	112.3	C21 H23 Y24 D43 G44 H45 A66 I67	C21-C41 VanDerWaalsContact SG-SG 3.67Å; H23-C41 HydrophobicContact CB-CB 3.75Å; Y24-C41 CarbonylContact O-C 3.58Å; Y24-C41 VanDerWaalsContact O-CA 3.29Å; Y24-C41 WeakPolarHBondContact O-CA 3.27Å; C41-D43 VanDerWaalsContact CB-OD1 3.23Å; C41-D43 WeakPolarHBondContact CB-OD1 3.1Å; C41-D43 PolarHBondContact O-N 2.87Å; C41-G44 PolarHBondContact O-N 2.78Å; C41-H45 HydrophobicContact CB-CB 4.11Å; C41-H45 WeakPolarHBondContact CB-O 3.37Å; C41-H45 PolarHBondContact N-O 2.7Å; C41-A66 WeakPolarHBondContact O-CA 3.46Å; C41-I67 PolarHBondContact O-N 2.92Å
42	N	97.5	Very high	95.1	Very high	75 Å²	75	19.2 Å²	19.2	40%	0.401	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-18.8	-177.4	74.2	-35.4	0	0	0	115	Y24 I26 A66	Y24-N42 VanDerWaalsContact CB-CG 3.47Å; Y24-N42 VanDerWaalsContact CB-OD1 3.32Å; Y24-N42 WeakPolarHBondContact CB-OD1 3.17Å; Y24-N42 HydrophobicContact CD1-CB 4.37Å; Y24-N42 PolarHBondContact O-N 3.21Å; I26-N42 HydrophobicContact CD1-CB 3.63Å; I26-N42 HydrophobicContact CG1-CB 4.16Å; N42-A66 VanDerWaalsContact O-CA 3.26Å; N42-A66 WeakPolarHBondContact O-CA 3.45Å; N42-A66 WeakPolarHBondContact O-CB 3.4Å; N42-A66 PolarHBondContact O-N 2.9Å
43	D	97.1	Very high	95.4	Very high	64 Å²	64	21.3 Å²	21.3	34%	0.342	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	7.5	-176.9	55.3	3.2	0	0	0	112.8	H23 C41 H45	H23-D43 IonicContact CE1-OD2 2.7Å; H23-D43 IonicContact CG-OD2 3.15Å; H23-D43 IonicContact ND1-OD1 3.51Å; H23-D43 IonicContact ND1-OD2 3.26Å; H23-D43 PolarHBondContact ND1-OD2 2.67Å; C41-D43 VanDerWaalsContact CB-OD1 3.23Å; C41-D43 WeakPolarHBondContact CB-OD1 3.1Å; C41-D43 PolarHBondContact O-N 2.87Å; D43-H45 VanDerWaalsContact CG-CD2 3.46Å; D43-H45 WeakPolarHBondContact OD1-CB 3.49Å; D43-H45 IonicContact OD1-CD2 3.79Å; D43-H45 PolarHBondContact OD1-CD2 3.46Å; D43-H45 IonicContact OD1-CG 3.56Å; D43-H45 PolarHBondContact OD1-N 2.99Å; D43-H45 IonicContact OD2-CD2 3.67Å
44	G	97.3	Very high	95.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	88.2	3.8	177.8	0	0	0	0	0	114.6	C41 P62 H63 S65	C41-G44 PolarHBondContact O-N 2.78Å; G44-P62 WeakPolarHBondContact O-CD 3.43Å; G44-H63 WeakPolarHBondContact CA-O 3.35Å; G44-S65 WeakPolarHBondContact CA-O 3.22Å; G44-S65 PolarHBondContact N-O 2.84Å
45	H	98.2	Very high	95.9	Very high	44 Å²	44	27.2 Å²	27.2	20%	0.204	15%	0.148	C	C	.	.			trans	-72.8	139.1	171.6	-78.1	-97.4	0	0	0	112.2	H23 C41 D43 N59 Y60 T61 I67	H23-H45 AromaticContact CE1-CD2 3.35Å; H23-H45 PolarHBondContact CE1-CD2 2.73Å; H23-H45 AromaticContact CE1-CE1 3.46Å; H23-H45 PolarHBondContact CE1-CE1 3.34Å; H23-H45 VanDerWaalsContact CE1-CE1 3.46Å; H23-H45 AromaticContact CE1-CG 3.44Å; H23-H45 VanDerWaalsContact CE1-CG 3.44Å; H23-H45 AromaticContact CE1-ND1 3.52Å; H23-H45 AromaticContact CE1-NE2 3.38Å; H23-H45 PolarHBondContact CE1-NE2 3.25Å; H23-H45 AromaticContact ND1-CD2 3.56Å; H23-H45 AromaticContact ND1-CG 3.75Å; H23-H45 AromaticContact ND1-NE2 4Å; H23-H45 AromaticContact NE2-CE1 3.77Å; H23-H45 AromaticContact NE2-CG 3.67Å; H23-H45 AromaticContact NE2-ND1 3.5Å; C41-H45 HydrophobicContact CB-CB 4.11Å; C41-H45 WeakPolarHBondContact CB-O 3.37Å; C41-H45 PolarHBondContact N-O 2.7Å; D43-H45 VanDerWaalsContact CG-CD2 3.46Å; D43-H45 WeakPolarHBondContact OD1-CB 3.49Å; D43-H45 IonicContact OD1-CD2 3.79Å; D43-H45 PolarHBondContact OD1-CD2 3.46Å; D43-H45 IonicContact OD1-CG 3.56Å; D43-H45 PolarHBondContact OD1-N 2.99Å; D43-H45 IonicContact OD2-CD2 3.67Å; H45-N59 PolarHBondContact ND1-OD1 2.85Å; H45-Y60 CarbonylContact C-O 3.59Å; H45-Y60 WeakPolarHBondContact CA-O 3.18Å; H45-T61 WeakPolarHBondContact CE1-CG2 3.4Å; H45-T61 VanDerWaalsContact ND1-CG2 3.33Å; H45-T61 WeakPolarHBondContact ND1-CG2 3.21Å; H45-T61 WeakPolarHBondContact NE2-CG2 3.18Å; H45-I67 VanDerWaalsContact O-CD1 3.29Å; H45-I67 WeakPolarHBondContact O-CD1 3.3Å
46	L	98.2	Very high	95.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	105.4	170.1	176.7	66	0	0	0	108.1	A38 V39 Y60 P62 I67 I70 I79 T81	A38-L46 HydrophobicContact CB-CD1 4.05Å; V39-L46 WeakPolarHBondContact O-CA 3.08Å; L46-Y60 PolarHBondContact N-O 2.85Å; L46-Y60 PolarHBondContact O-N 3.15Å; L46-P62 HydrophobicContact CB-CG 3.93Å; L46-P62 HydrophobicContact CD2-CG 4.43Å; L46-I67 HydrophobicContact CB-CD1 3.88Å; L46-I70 HydrophobicContact CD1-CD1 3.96Å; L46-I79 HydrophobicContact CD2-CD1 4.12Å; L46-I79 HydrophobicContact CD2-CG2 4.15Å; L46-T81 HydrophobicContact CD1-CG2 4.15Å; L46-T81 HydrophobicContact CD2-CG2 3.96Å
47	V	97.7	Very high	95.8	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.3	178.9	-172.7	0	0	0	0	109.3	C21 A38 V39 Y49 P56 K58	C21-V47 HydrophobicContact CB-CB 4.39Å; C21-V47 HydrophobicContact CB-CG1 4.31Å; C21-V47 HydrophobicContact CB-CG2 4.21Å; A38-V47 CarbonylContact C-O 3.52Å; V39-V47 HydrophobicContact CB-CB 4.42Å; V39-V47 PolarHBondContact N-O 2.75Å; V39-V47 PolarHBondContact O-N 3.29Å; V47-Y49 HydrophobicContact CB-CE2 4.32Å; V47-Y49 HydrophobicContact CG1-CD2 3.98Å; V47-Y49 HydrophobicContact CG1-CE2 3.57Å; V47-P56 HydrophobicContact CG1-CB 3.92Å; V47-K58 WeakPolarHBondContact CA-O 3.36Å
48	I	97.2	Very high	95.7	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	118.8	177.9	-53	-178.7	0	0	0	108.4	L36 L37 M57 K58 Y60 W72 I79 V93 I390	L36-I48 HydrophobicContact CB-CG2 4.26Å; L36-I48 HydrophobicContact CD2-CG2 4.39Å; L37-I48 WeakPolarHBondContact O-CA 3.49Å; I48-M57 PolarHBondContact O-N 2.62Å; I48-K58 HydrophobicContact CB-CB 4.19Å; I48-K58 HydrophobicContact CD1-CB 4.29Å; I48-K58 HydrophobicContact CG1-CB 4.38Å; I48-K58 PolarHBondContact N-O 3.45Å; I48-K58 PolarHBondContact O-N 3.25Å; I48-Y60 HydrophobicContact CD1-CD2 4.36Å; I48-Y60 HydrophobicContact CD1-CE2 4.07Å; I48-W72 HydrophobicContact CD1-CH2 4.39Å; I48-W72 HydrophobicContact CG2-CH2 4.01Å; I48-W72 HydrophobicContact CG2-CZ2 4.41Å; I48-I79 HydrophobicContact CD1-CD1 3.75Å; I48-I79 HydrophobicContact CG1-CD1 4.32Å; I48-V93 HydrophobicContact CD1-CG1 3.91Å; I48-I390 HydrophobicContact CG2-CD1 4.16Å
49	Y	95.9	Very high	95.6	Very high	6 Å²	6	38.6 Å²	38.6	2%	0.024	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	145.9	175	-80.1	-95	0	0	0	111.6	L19 D20 C21 L36 L37 V39 V47 R54 C55 P56	L19-Y49 HydrophobicContact CB-CE1 4.41Å; L19-Y49 HydrophobicContact CD1-CD1 4.15Å; L19-Y49 HydrophobicContact CD1-CE1 4.25Å; D20-Y49 PolarHBondContact O-OH 3.35Å; C21-Y49 WeakPolarHBondContact CA-OH 3.4Å; C21-Y49 HydrophobicContact CB-CE2 3.87Å; C21-Y49 WeakPolarHBondContact CB-OH 3.45Å; C21-Y49 PolarHBondContact N-OH 3.34Å; L36-Y49 CarbonylContact C-O 3.58Å; L36-Y49 VanDerWaalsContact CA-O 3.27Å; L36-Y49 WeakPolarHBondContact CA-O 3.44Å; L37-Y49 PolarHBondContact N-O 2.82Å; L37-Y49 PolarHBondContact O-N 3.44Å; V39-Y49 HydrophobicContact CG2-CD2 3.92Å; V39-Y49 HydrophobicContact CG2-CE2 4.16Å; V47-Y49 HydrophobicContact CB-CE2 4.32Å; V47-Y49 HydrophobicContact CG1-CD2 3.98Å; V47-Y49 HydrophobicContact CG1-CE2 3.57Å; Y49-R54 WeakPolarHBondContact CD1-O 3.21Å; Y49-C55 WeakPolarHBondContact CA-O 3.38Å; Y49-C55 VanDerWaalsContact CD1-C 3.43Å; Y49-C55 WeakPolarHBondContact CD1-O 3.33Å; Y49-P56 HydrophobicContact CD1-CB 4.39Å; Y49-P56 HydrophobicContact CE1-CB 4.05Å; Y49-P56 HydrophobicContact CE1-CG 4.35Å
50	D	94.1	Very high	95.5	Very high	9 Å²	9	40.1 Å²	40.1	5%	0.048	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130	158.7	174.4	-93.7	0	0	0	109.9	L36 V52 T53 R54 C55 M57	L36-D50 HydrophobicContact CD2-CB 4.48Å; D50-V52 PolarHBondContact O-N 3.44Å; D50-V52 PolarHBondContact OD1-N 3.06Å; D50-T53 WeakPolarHBondContact CB-OG1 3.47Å; D50-T53 WeakPolarHBondContact OD1-CB 3.3Å; D50-T53 WeakPolarHBondContact OD1-CG2 3.42Å; D50-T53 PolarHBondContact OD1-N 3.02Å; D50-T53 PolarHBondContact OD1-OG1 3.07Å; D50-R54 VanDerWaalsContact O-CA 3.24Å; D50-R54 WeakPolarHBondContact O-CA 3.49Å; D50-R54 PolarHBondContact O-N 2.96Å; D50-C55 PolarHBondContact N-O 2.95Å; D50-M57 HydrophobicContact CB-CE 3.45Å; D50-M57 VanDerWaalsContact CB-CE 3.45Å; D50-M57 HydrophobicContact CB-CG 3.63Å; D50-M57 HydrophobicContact CB-SD 4.31Å
51	F	93.4	Very high	95.4	Very high	20 Å²	20	44.5 Å²	44.5	9%	0.088	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-31.8	-173.9	179.2	-104.4	0	0	0	113	F30 G34 S35 H294 A299 F301 L310	F30-F51 HydrophobicContact CE1-CB 4.5Å; F30-F51 AromaticContact CE1-CD2 3.71Å; F30-F51 HydrophobicContact CE1-CD2 3.71Å; F30-F51 HydrophobicContact CE1-CE2 4.29Å; F30-F51 HydrophobicContact CE1-CG 4.27Å; F30-F51 AromaticContact CZ-CD2 3.91Å; F30-F51 HydrophobicContact CZ-CD2 3.91Å; F30-F51 HydrophobicContact CZ-CE2 4.02Å; G34-F51 VanDerWaalsContact O-CB 3.27Å; G34-F51 WeakPolarHBondContact O-CB 3.46Å; S35-F51 WeakPolarHBondContact O-CB 3.46Å; S35-F51 PolarHBondContact O-N 3.24Å; F51-H294 AromaticContact CD1-CD2 3.93Å; F51-H294 AromaticContact CD1-NE2 3.61Å; F51-H294 AromaticContact CD2-CD2 3.98Å; F51-H294 AromaticContact CE1-CD2 3.75Å; F51-H294 AromaticContact CE1-NE2 3.63Å; F51-H294 AromaticContact CE2-CD2 3.79Å; F51-H294 AromaticContact CZ-CD2 3.67Å; F51-A299 HydrophobicContact CZ-CB 4.12Å; F51-F301 AromaticContact CD2-CE2 3.87Å; F51-F301 HydrophobicContact CD2-CE2 3.87Å; F51-F301 AromaticContact CE2-CE2 3.8Å; F51-F301 HydrophobicContact CE2-CE2 3.8Å; F51-F301 HydrophobicContact CE2-CZ 4.49Å; F51-L310 HydrophobicContact CE2-CD1 4.1Å
52	V	91	Very high	95.4	Very high	99 Å²	99	45.8 Å²	45.8	60%	0.6	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-50.2	-174.6	177.8	0	0	0	0	110.6	D50	D50-V52 PolarHBondContact O-N 3.44Å; D50-V52 PolarHBondContact OD1-N 3.06Å
53	T	92.2	Very high	95.4	Very high	76 Å²	76	42.6 Å²	42.6	47%	0.466	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-20.8	-179.8	59.9	0	0	0	0	112.6	D50 C55 M57	D50-T53 WeakPolarHBondContact CB-OG1 3.47Å; D50-T53 WeakPolarHBondContact OD1-CB 3.3Å; D50-T53 WeakPolarHBondContact OD1-CG2 3.42Å; D50-T53 PolarHBondContact OD1-N 3.02Å; D50-T53 PolarHBondContact OD1-OG1 3.07Å; T53-C55 PolarHBondContact O-N 2.96Å; T53-C55 PolarHBondContact O-SG 3.22Å; T53-C55 PolarHBondContact OG1-N 2.87Å; T53-M57 HydrophobicContact CG2-CE 4.46Å; T53-M57 WeakPolarHBondContact OG1-CE 3.47Å
54	R	92.9	Very high	95.3	Very high	89 Å²	89	47.5 Å²	47.5	34%	0.336	26%	0.257	S	S	.	.			trans	62.1	17.3	-174.2	-51.6	179.1	-175.9	169.2	5	113.7	E16 L19 Y49 D50	E16-R54 IonicContact OE1-CZ 2.59Å; E16-R54 IonicContact OE1-NH1 3.51Å; E16-R54 IonicContact OE1-NH2 3.87Å; E16-R54 PolarHBondContact OE1-NH2 3.48Å; E16-R54 IonicContact OE2-NH2 3.6Å; L19-R54 HydrophobicContact CD2-CB 3.94Å; Y49-R54 WeakPolarHBondContact CD1-O 3.21Å; D50-R54 VanDerWaalsContact O-CA 3.24Å; D50-R54 WeakPolarHBondContact O-CA 3.49Å; D50-R54 PolarHBondContact O-N 2.96Å
55	C	92.5	Very high	95.3	Very high	63 Å²	63	49.6 Å²	49.6	43%	0.426	27%	0.272	S	S	.	.			trans	-96.8	145.4	-179.4	-67	0	0	0	0	111	Y49 D50 T53 M57	Y49-C55 WeakPolarHBondContact CA-O 3.38Å; Y49-C55 VanDerWaalsContact CD1-C 3.43Å; Y49-C55 WeakPolarHBondContact CD1-O 3.33Å; D50-C55 PolarHBondContact N-O 2.95Å; T53-C55 PolarHBondContact O-N 2.96Å; T53-C55 PolarHBondContact O-SG 3.22Å; T53-C55 PolarHBondContact OG1-N 2.87Å; C55-M57 HydrophobicContact CB-CE 3.89Å; C55-M57 PolarHBondContact O-N 3.39Å
56	P	93.4	Very high	95.3	Very high	79 Å²	79	48.7 Å²	48.7	51%	0.513	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	127.6	167.7	29.9	-32.3	0	0	0	108.8	V47 Y49	V47-P56 HydrophobicContact CG1-CB 3.92Å; Y49-P56 HydrophobicContact CD1-CB 4.39Å; Y49-P56 HydrophobicContact CE1-CB 4.05Å; Y49-P56 HydrophobicContact CE1-CG 4.35Å
57	M	93.1	Very high	95.3	Very high	41 Å²	41	48.7 Å²	48.7	20%	0.202	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-34.8	-179.5	-67.3	-60.7	158.7	0	0	112.5	I48 D50 T53 C55	I48-M57 PolarHBondContact O-N 2.62Å; D50-M57 HydrophobicContact CB-CE 3.45Å; D50-M57 VanDerWaalsContact CB-CE 3.45Å; D50-M57 HydrophobicContact CB-CG 3.63Å; D50-M57 HydrophobicContact CB-SD 4.31Å; T53-M57 HydrophobicContact CG2-CE 4.46Å; T53-M57 WeakPolarHBondContact OG1-CE 3.47Å; C55-M57 HydrophobicContact CB-CE 3.89Å; C55-M57 PolarHBondContact O-N 3.39Å
58	K	94.7	Very high	95.1	Very high	68 Å²	68	50.8 Å²	50.8	30%	0.296	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	147.6	178.8	-63.7	-65.9	-172.4	171.7	0	110.3	V47 I48 Y60 L94 I390	V47-K58 WeakPolarHBondContact CA-O 3.36Å; I48-K58 HydrophobicContact CB-CB 4.19Å; I48-K58 HydrophobicContact CD1-CB 4.29Å; I48-K58 HydrophobicContact CG1-CB 4.38Å; I48-K58 PolarHBondContact N-O 3.45Å; I48-K58 PolarHBondContact O-N 3.25Å; K58-Y60 HydrophobicContact CB-CD2 4.28Å; K58-Y60 HydrophobicContact CB-CE2 3.62Å; K58-Y60 HydrophobicContact CD-CE1 4.48Å; K58-Y60 VanDerWaalsContact CD-OH 3.27Å; K58-Y60 WeakPolarHBondContact CD-OH 3.19Å; K58-Y60 HydrophobicContact CG-CE2 4.05Å; K58-Y60 WeakPolarHBondContact CG-OH 3.3Å; K58-L94 PolarHBondContact NZ-O 2.97Å; K58-I390 HydrophobicContact CG-CD1 4.25Å
59	N	95.7	Very high	95.1	Very high	75 Å²	75	51.2 Å²	51.2	40%	0.401	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	117	171.7	-173.4	-7.6	0	0	0	108.4	H23 H45	H23-N59 PolarHBondContact NE2-ND2 3.48Å; H23-N59 VanDerWaalsContact NE2-ND2 3.18Å; H45-N59 PolarHBondContact ND1-OD1 2.85Å
60	Y	96.7	Very high	95.2	Very high	31 Å²	31	51.5 Å²	51.5	12%	0.122	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	157.5	-179.1	-58	-56.4	0	0	0	110.5	H45 L46 I48 K58 P62 V93 L94 G96	H45-Y60 CarbonylContact C-O 3.59Å; H45-Y60 WeakPolarHBondContact CA-O 3.18Å; L46-Y60 PolarHBondContact N-O 2.85Å; L46-Y60 PolarHBondContact O-N 3.15Å; I48-Y60 HydrophobicContact CD1-CD2 4.36Å; I48-Y60 HydrophobicContact CD1-CE2 4.07Å; K58-Y60 HydrophobicContact CB-CD2 4.28Å; K58-Y60 HydrophobicContact CB-CE2 3.62Å; K58-Y60 HydrophobicContact CD-CE1 4.48Å; K58-Y60 VanDerWaalsContact CD-OH 3.27Å; K58-Y60 WeakPolarHBondContact CD-OH 3.19Å; K58-Y60 HydrophobicContact CG-CE2 4.05Å; K58-Y60 WeakPolarHBondContact CG-OH 3.3Å; Y60-P62 VanDerWaalsContact O-CD 3.28Å; Y60-P62 WeakPolarHBondContact O-CD 3.38Å; Y60-V93 PolarHBondContact OH-O 3.37Å; Y60-V93 VanDerWaalsContact OH-O 3.07Å; Y60-L94 VanDerWaalsContact OH-C 3.32Å; Y60-L94 PolarHBondContact OH-O 2.89Å; Y60-G96 PolarHBondContact OH-N 2.82Å
61	T	97.2	Very high	95.3	Very high	92 Å²	92	51.7 Å²	51.7	56%	0.564	29%	0.294	S	S	*	.			trans	-120.5	66.8	178.1	41	0	0	0	0	111.4	H45 H63	H45-T61 WeakPolarHBondContact CE1-CG2 3.4Å; H45-T61 VanDerWaalsContact ND1-CG2 3.33Å; H45-T61 WeakPolarHBondContact ND1-CG2 3.21Å; H45-T61 WeakPolarHBondContact NE2-CG2 3.18Å; T61-H63 PolarHBondContact O-N 2.83Å
62	P	97	Very high	95.4	Very high	27 Å²	27	51.9 Å²	51.9	18%	0.175	29%	0.294	C	S	.	.			trans	-68.1	-21.7	-179.1	28.1	-35.7	0	0	0	113.5	G44 L46 Y60 I67 V89	G44-P62 WeakPolarHBondContact O-CD 3.43Å; L46-P62 HydrophobicContact CB-CG 3.93Å; L46-P62 HydrophobicContact CD2-CG 4.43Å; Y60-P62 VanDerWaalsContact O-CD 3.28Å; Y60-P62 WeakPolarHBondContact O-CD 3.38Å; P62-I67 HydrophobicContact CG-CD1 4.01Å; P62-V89 HydrophobicContact CB-CB 4.3Å; P62-V89 HydrophobicContact CB-CG1 4.13Å
63	H	97.3	Very high	95.5	Very high	9 Å²	9	47.3 Å²	47.3	4%	0.042	27%	0.267	C	S	.	.			trans	-126.7	153.5	-173.3	-69.7	-71.8	0	0	0	111.5	G44 T61 S65 I67 T81 G83 E85 T87	G44-H63 WeakPolarHBondContact CA-O 3.35Å; T61-H63 PolarHBondContact O-N 2.83Å; H63-S65 WeakPolarHBondContact CB-O 2.96Å; H63-I67 HydrophobicContact CB-CG1 4.3Å; H63-T81 PolarHBondContact CD2-OG1 3.01Å; H63-T81 VanDerWaalsContact CD2-OG1 3.31Å; H63-T81 WeakPolarHBondContact NE2-CB 3.35Å; H63-T81 PolarHBondContact NE2-O 2.82Å; H63-T81 PolarHBondContact NE2-OG1 3.44Å; H63-G83 PolarHBondContact CE1-N 3.27Å; H63-E85 WeakPolarHBondContact CB-OE1 3.44Å; H63-E85 IonicContact CE1-OE1 3.53Å; H63-E85 IonicContact CG-OE1 3.06Å; H63-E85 IonicContact ND1-OE1 3.4Å; H63-E85 PolarHBondContact ND1-OE1 3.11Å; H63-E85 IonicContact ND1-OE2 2.86Å; H63-T87 PolarHBondContact CE1-OG1 3.48Å; H63-T87 PolarHBondContact ND1-OG1 2.84Å
64	L	96.2	Very high	95.3	Very high	166 Å²	166	45.6 Å²	45.6	87%	0.869	25%	0.252	S	S	*	.	S	Bend	trans	-91.5	-6.1	173.1	-68.7	170.8	0	0	0	112.5
65	S	96.8	Very high	95	Very high	45 Å²	45	41.9 Å²	41.9	32%	0.315	24%	0.238	S	C	.	.	S	Bend	trans	-141.9	172.9	-177.2	-61.8	0	0	0	0	109.9	G44 H63 I67 E85	G44-S65 WeakPolarHBondContact CA-O 3.22Å; G44-S65 PolarHBondContact N-O 2.84Å; H63-S65 WeakPolarHBondContact CB-O 2.96Å; S65-I67 PolarHBondContact O-N 2.79Å; S65-E85 WeakPolarHBondContact CB-OE2 3.45Å
66	A	97.5	Very high	95	Very high	25 Å²	25	38.9 Å²	38.9	21%	0.207	22%	0.218	C	C	.	.			trans	-45.7	128.3	-176.2	0	0	0	0	0	113.7	I26 C41 N42 C68 G83 A84	I26-A66 HydrophobicContact CD1-CB 3.7Å; C41-A66 WeakPolarHBondContact O-CA 3.46Å; N42-A66 VanDerWaalsContact O-CA 3.26Å; N42-A66 WeakPolarHBondContact O-CA 3.45Å; N42-A66 WeakPolarHBondContact O-CB 3.4Å; N42-A66 PolarHBondContact O-N 2.9Å; A66-C68 PolarHBondContact O-N 3.38Å; A66-G83 WeakPolarHBondContact O-CA 3.38Å; A66-A84 HydrophobicContact CB-CB 4.32Å; A66-A84 PolarHBondContact O-N 2.75Å
67	I	98.1	Very high	94.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	115.9	171.3	-55.6	-170.5	0	0	0	108.4	C41 H45 L46 P62 H63 S65 I70 T81 A82	C41-I67 PolarHBondContact O-N 2.92Å; H45-I67 VanDerWaalsContact O-CD1 3.29Å; H45-I67 WeakPolarHBondContact O-CD1 3.3Å; L46-I67 HydrophobicContact CB-CD1 3.88Å; P62-I67 HydrophobicContact CG-CD1 4.01Å; H63-I67 HydrophobicContact CB-CG1 4.3Å; S65-I67 PolarHBondContact O-N 2.79Å; I67-I70 HydrophobicContact CG2-CD1 4.27Å; I67-I70 HydrophobicContact CG2-CG1 3.84Å; I67-T81 HydrophobicContact CG2-CG2 4.34Å; I67-A82 CarbonylContact C-O 3.57Å; I67-A82 WeakPolarHBondContact CA-O 3.49Å
68	C	95.1	Very high	95	Very high	45 Å²	45	40.4 Å²	40.4	30%	0.304	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-21.5	-175.8	59.3	0	0	0	0	114	A66 A82 V108	A66-C68 PolarHBondContact O-N 3.38Å; C68-A82 PolarHBondContact N-O 2.91Å; C68-A82 PolarHBondContact SG-O 3.47Å; C68-V108 PolarHBondContact SG-O 3.2Å
69	A	95.9	Very high	95.1	Very high	11 Å²	11	37.2 Å²	37.2	9%	0.091	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	147.2	178.3	0	0	0	0	0	112	T81 A82 L111	A69-T81 WeakPolarHBondContact O-CA 3.26Å; A69-A82 HydrophobicContact CB-CB 4.32Å; A69-A82 PolarHBondContact O-N 3.23Å; A69-L111 HydrophobicContact CB-CD1 4.39Å; A69-L111 HydrophobicContact CB-CD2 4.33Å; A69-L111 HydrophobicContact CB-CG 3.8Å
70	I	97.7	Very high	95.2	Very high	11 Å²	11	33.7 Å²	33.7	6%	0.056	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	140.1	-176.8	-59	175.7	0	0	0	109.1	R29 A38 G40 L46 I67 I79 L80 T81	R29-I70 HydrophobicContact CB-CB 4.42Å; R29-I70 HydrophobicContact CB-CG2 4.27Å; R29-I70 HydrophobicContact CG-CB 4.14Å; A38-I70 HydrophobicContact CB-CD1 4.34Å; A38-I70 HydrophobicContact CB-CG2 3.93Å; G40-I70 VanDerWaalsContact N-CD1 3.33Å; L46-I70 HydrophobicContact CD1-CD1 3.96Å; I67-I70 HydrophobicContact CG2-CD1 4.27Å; I67-I70 HydrophobicContact CG2-CG1 3.84Å; I70-I79 HydrophobicContact CG2-CG2 3.72Å; I70-L80 CarbonylContact C-O 3.5Å; I70-L80 WeakPolarHBondContact CA-O 3.42Å; I70-T81 HydrophobicContact CG1-CG2 4.28Å
71	S	96.6	Very high	95.3	Very high	14 Å²	14	32.2 Å²	32.2	10%	0.098	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	132	169.8	-168.5	0	0	0	0	111.5	I79 L80 Q112 I113	S71-I79 WeakPolarHBondContact O-CA 3.3Å; S71-L80 PolarHBondContact N-O 2.97Å; S71-L80 PolarHBondContact O-N 3.4Å; S71-Q112 WeakPolarHBondContact OG-CA 3.18Å; S71-I113 WeakPolarHBondContact O-CD1 3.46Å; S71-I113 PolarHBondContact OG-N 2.77Å
72	W	95.3	Very high	95.3	Very high	23 Å²	23	27.8 Å²	27.8	9%	0.087	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	143.8	176.1	-71.9	89.9	0	0	0	111.6	R29 N31 L36 A38 I48 G76 I79 V93	R29-W72 PolarHBondContact O-NE1 3.12Å; N31-W72 HydrophobicContact CB-CD2 3.8Å; N31-W72 HydrophobicContact CB-CE3 3.89Å; N31-W72 HydrophobicContact CB-CG 4.19Å; N31-W72 HydrophobicContact CB-CH2 4.42Å; N31-W72 HydrophobicContact CB-CZ2 4.36Å; N31-W72 HydrophobicContact CB-CZ3 4.19Å; L36-W72 HydrophobicContact CB-CH2 3.85Å; L36-W72 HydrophobicContact CB-CZ2 4.13Å; L36-W72 HydrophobicContact CD1-CH2 4.03Å; L36-W72 HydrophobicContact CD1-CZ3 4.3Å; A38-W72 HydrophobicContact CB-CZ2 3.49Å; A38-W72 VanDerWaalsContact CB-CZ2 3.49Å; I48-W72 HydrophobicContact CD1-CH2 4.39Å; I48-W72 HydrophobicContact CG2-CH2 4.01Å; I48-W72 HydrophobicContact CG2-CZ2 4.41Å; W72-G76 WeakPolarHBondContact CZ3-O 3.3Å; W72-I79 HydrophobicContact CD2-CD1 4.13Å; W72-I79 HydrophobicContact CD2-CG1 3.74Å; W72-I79 HydrophobicContact CE3-CD1 3.96Å; W72-I79 HydrophobicContact CE3-CG1 3.54Å; W72-I79 HydrophobicContact CG-CG1 4.45Å; W72-I79 HydrophobicContact CH2-CD1 3.58Å; W72-I79 HydrophobicContact CH2-CG1 4.14Å; W72-I79 HydrophobicContact CZ2-CD1 3.73Å; W72-I79 HydrophobicContact CZ2-CG1 4.3Å; W72-I79 HydrophobicContact CZ3-CD1 3.7Å; W72-I79 HydrophobicContact CZ3-CG1 3.76Å; W72-V93 HydrophobicContact CE3-CG2 4.22Å; W72-V93 HydrophobicContact CH2-CG1 4.36Å; W72-V93 HydrophobicContact CH2-CG2 4.38Å; W72-V93 HydrophobicContact CZ3-CB 4.49Å; W72-V93 HydrophobicContact CZ3-CG1 4.05Å; W72-V93 HydrophobicContact CZ3-CG2 3.62Å
73	S	93.1	Very high	95.3	Very high	4 Å²	4	26.5 Å²	26.5	3%	0.028	14%	0.138	C	C	.	.			trans	-67.2	157.5	164.6	62.6	0	0	0	0	110.7	D75 G76 R77 K78	S73-D75 VanDerWaalsContact CB-OD1 3.28Å; S73-D75 WeakPolarHBondContact CB-OD1 3.39Å; S73-D75 PolarHBondContact O-N 3.17Å; S73-D75 PolarHBondContact OG-OD1 2.97Å; S73-G76 PolarHBondContact O-N 3.11Å; S73-G76 PolarHBondContact OG-N 3.21Å; S73-R77 PolarHBondContact OG-N 3.33Å; S73-K78 PolarHBondContact N-O 2.85Å; S73-K78 PolarHBondContact OG-N 3.33Å; S73-K78 PolarHBondContact OG-O 2.93Å; S73-K78 VanDerWaalsContact OG-O 3.12Å
74	R	88.4	Confident	95.3	Very high	40 Å²	40	28.2 Å²	28.2	15%	0.151	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-36.4	-178.7	-171.2	-166.5	-178.7	79.1	0.4	113.1	R32 W33 G76 P115 D383	R32-R74 WeakPolarHBondContact CD-O 3.4Å; W33-R74 WeakPolarHBondContact CH2-O 3.09Å; W33-R74 WeakPolarHBondContact CZ3-O 3.18Å; R74-G76 VanDerWaalsContact C-N 3.32Å; R74-P115 WeakPolarHBondContact CD-O 3.48Å; R74-P115 WeakPolarHBondContact CG-O 3.43Å; R74-P115 PolarHBondContact NH1-O 2.65Å; R74-D383 IonicContact CZ-OD1 3.09Å; R74-D383 IonicContact CZ-OD2 3.9Å; R74-D383 IonicContact NE-OD1 2.88Å; R74-D383 PolarHBondContact NE-OD1 2.87Å; R74-D383 IonicContact NE-OD2 2.58Å; R74-D383 PolarHBondContact NE-OD2 2.91Å; R74-D383 VanDerWaalsContact NE-OD2 3.16Å; R74-D383 IonicContact NH2-OD1 3.45Å; R74-D383 IonicContact NH2-OD2 2.68Å; R74-D383 PolarHBondContact NH2-OD2 3.45Å
75	D	88	Confident	95.3	Very high	11 Å²	11	23.1 Å²	23.1	6%	0.059	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-5.7	178.7	63.4	-1.7	0	0	0	113.1	S73 R77 R118 L387	S73-D75 VanDerWaalsContact CB-OD1 3.28Å; S73-D75 WeakPolarHBondContact CB-OD1 3.39Å; S73-D75 PolarHBondContact O-N 3.17Å; S73-D75 PolarHBondContact OG-OD1 2.97Å; D75-R77 HydrophobicContact CB-CG 4.45Å; D75-R77 PolarHBondContact O-N 2.95Å; D75-R77 PolarHBondContact OD1-N 3.14Å; D75-R118 IonicContact OD2-CZ 2.71Å; D75-R118 IonicContact OD2-NE 3.36Å; D75-R118 IonicContact OD2-NH1 3.1Å; D75-R118 PolarHBondContact OD2-NH1 3.24Å; D75-R118 IonicContact OD2-NH2 3.16Å; D75-L387 WeakPolarHBondContact O-CB 3.47Å; D75-L387 PolarHBondContact O-N 3.07Å
76	G	91.6	Very high	95.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	71.8	6.6	-178.2	0	0	0	0	0	115.2	W72 S73 R74 V93 L387	W72-G76 WeakPolarHBondContact CZ3-O 3.3Å; S73-G76 PolarHBondContact O-N 3.11Å; S73-G76 PolarHBondContact OG-N 3.21Å; R74-G76 VanDerWaalsContact C-N 3.32Å; G76-V93 WeakPolarHBondContact O-CG2 3.3Å; G76-L387 WeakPolarHBondContact O-CD2 3.44Å
77	R	91.7	Very high	95.2	Very high	112 Å²	112	24.7 Å²	24.7	42%	0.423	12%	0.123	S	C	.	.	S	Bend	trans	-88.1	-20.4	-177.2	-64.9	-175.9	-177.3	-145.8	3.6	113.9	S73 D75 V93 L387	S73-R77 PolarHBondContact OG-N 3.33Å; D75-R77 HydrophobicContact CB-CG 4.45Å; D75-R77 PolarHBondContact O-N 2.95Å; D75-R77 PolarHBondContact OD1-N 3.14Å; R77-V93 WeakPolarHBondContact O-CB 3.39Å; R77-V93 WeakPolarHBondContact O-CG2 3.3Å; R77-V93 PolarHBondContact O-N 3.27Å; R77-L387 HydrophobicContact CG-CB 3.94Å
78	K	94.3	Very high	95.2	Very high	40 Å²	40	24.7 Å²	24.7	17%	0.174	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.2	-179.4	-51.6	-62.9	179.7	-170.6	0	111.2	S73 L90 T91 D92 E99	S73-K78 PolarHBondContact N-O 2.85Å; S73-K78 PolarHBondContact OG-N 3.33Å; S73-K78 PolarHBondContact OG-O 2.93Å; S73-K78 VanDerWaalsContact OG-O 3.12Å; K78-L90 HydrophobicContact CB-CD1 3.94Å; K78-T91 VanDerWaalsContact CA-O 3.31Å; K78-T91 WeakPolarHBondContact CA-O 3.4Å; K78-D92 HydrophobicContact CD-CB 4.45Å; K78-D92 IonicContact NZ-OD2 3.95Å; K78-D92 PolarHBondContact NZ-OD2 2.85Å; K78-E99 WeakPolarHBondContact CD-OE2 3.49Å; K78-E99 VanDerWaalsContact CE-CD 3.46Å; K78-E99 WeakPolarHBondContact CE-OE1 3.05Å; K78-E99 WeakPolarHBondContact CE-OE2 3.42Å; K78-E99 IonicContact NZ-OE1 3.5Å; K78-E99 PolarHBondContact NZ-OE1 3.3Å; K78-E99 IonicContact NZ-OE2 3.77Å; K78-E99 PolarHBondContact NZ-OE2 2.76Å
79	I	97.1	Very high	95.3	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.9	170.4	-65.7	168.8	0	0	0	108.5	A38 L46 I48 I70 S71 W72 T81 L90 T91 V93	A38-I79 HydrophobicContact CB-CD1 4.14Å; L46-I79 HydrophobicContact CD2-CD1 4.12Å; L46-I79 HydrophobicContact CD2-CG2 4.15Å; I48-I79 HydrophobicContact CD1-CD1 3.75Å; I48-I79 HydrophobicContact CG1-CD1 4.32Å; I70-I79 HydrophobicContact CG2-CG2 3.72Å; S71-I79 WeakPolarHBondContact O-CA 3.3Å; W72-I79 HydrophobicContact CD2-CD1 4.13Å; W72-I79 HydrophobicContact CD2-CG1 3.74Å; W72-I79 HydrophobicContact CE3-CD1 3.96Å; W72-I79 HydrophobicContact CE3-CG1 3.54Å; W72-I79 HydrophobicContact CG-CG1 4.45Å; W72-I79 HydrophobicContact CH2-CD1 3.58Å; W72-I79 HydrophobicContact CH2-CG1 4.14Å; W72-I79 HydrophobicContact CZ2-CD1 3.73Å; W72-I79 HydrophobicContact CZ2-CG1 4.3Å; W72-I79 HydrophobicContact CZ3-CD1 3.7Å; W72-I79 HydrophobicContact CZ3-CG1 3.76Å; I79-T81 HydrophobicContact CG2-CG2 3.67Å; I79-L90 WeakPolarHBondContact O-CA 3.17Å; I79-T91 PolarHBondContact N-O 3.05Å; I79-T91 PolarHBondContact O-N 2.87Å; I79-V93 HydrophobicContact CB-CG2 4.48Å; I79-V93 HydrophobicContact CD1-CG2 3.69Å; I79-V93 HydrophobicContact CG1-CG2 3.58Å
80	L	97.8	Very high	95.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	124.7	167.2	-165.4	75.1	0	0	0	108.5	I70 S71 V88 V89 L90 L111 I113 F121	I70-L80 CarbonylContact C-O 3.5Å; I70-L80 WeakPolarHBondContact CA-O 3.42Å; S71-L80 PolarHBondContact N-O 2.97Å; S71-L80 PolarHBondContact O-N 3.4Å; L80-V88 HydrophobicContact CD1-CG1 3.47Å; L80-V88 VanDerWaalsContact CD1-CG1 3.47Å; L80-V88 HydrophobicContact CD2-CG1 4.04Å; L80-V88 HydrophobicContact CG-CG1 3.61Å; L80-V89 CarbonylContact C-O 3.51Å; L80-V89 WeakPolarHBondContact CA-O 3.28Å; L80-L90 HydrophobicContact CB-CD1 4.43Å; L80-L90 HydrophobicContact CD1-CB 3.99Å; L80-L90 HydrophobicContact CD1-CD1 4.04Å; L80-L111 HydrophobicContact CB-CD1 4.33Å; L80-L111 HydrophobicContact CD2-CB 4.34Å; L80-L111 HydrophobicContact CD2-CD1 4.17Å; L80-L111 HydrophobicContact CD2-CD2 4.11Å; L80-L111 HydrophobicContact CD2-CG 4.44Å; L80-L111 HydrophobicContact CG-CD1 4.39Å; L80-L111 HydrophobicContact CG-CD2 4.1Å; L80-I113 HydrophobicContact CB-CD1 3.83Å; L80-I113 HydrophobicContact CB-CG1 3.83Å; L80-I113 HydrophobicContact CD2-CG1 4.21Å; L80-F121 HydrophobicContact CD1-CD2 4.29Å; L80-F121 HydrophobicContact CD1-CE2 4.35Å; L80-F121 HydrophobicContact CD2-CB 3.87Å; L80-F121 HydrophobicContact CD2-CD1 4.18Å; L80-F121 HydrophobicContact CD2-CD2 4.28Å; L80-F121 HydrophobicContact CD2-CG 3.85Å
81	T	98.4	Very high	95.3	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	148.5	176.9	55.1	0	0	0	0	111	L46 H63 I67 A69 I70 I79 V88 V89	L46-T81 HydrophobicContact CD1-CG2 4.15Å; L46-T81 HydrophobicContact CD2-CG2 3.96Å; H63-T81 PolarHBondContact CD2-OG1 3.01Å; H63-T81 VanDerWaalsContact CD2-OG1 3.31Å; H63-T81 WeakPolarHBondContact NE2-CB 3.35Å; H63-T81 PolarHBondContact NE2-O 2.82Å; H63-T81 PolarHBondContact NE2-OG1 3.44Å; I67-T81 HydrophobicContact CG2-CG2 4.34Å; A69-T81 WeakPolarHBondContact O-CA 3.26Å; I70-T81 HydrophobicContact CG1-CG2 4.28Å; I79-T81 HydrophobicContact CG2-CG2 3.67Å; T81-V88 CarbonylContact O-C 3.34Å; T81-V88 WeakPolarHBondContact O-CA 3.46Å; T81-V88 WeakPolarHBondContact O-CG1 3.34Å; T81-V89 PolarHBondContact N-O 2.94Å; T81-V89 PolarHBondContact O-N 2.87Å
82	A	97.9	Very high	95.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.7	169.6	0	0	0	0	0	110.3	I67 C68 A69 T87 V88 V108 L111	I67-A82 CarbonylContact C-O 3.57Å; I67-A82 WeakPolarHBondContact CA-O 3.49Å; C68-A82 PolarHBondContact N-O 2.91Å; C68-A82 PolarHBondContact SG-O 3.47Å; A69-A82 HydrophobicContact CB-CB 4.32Å; A69-A82 PolarHBondContact O-N 3.23Å; A82-T87 WeakPolarHBondContact CA-O 3.37Å; A82-V88 HydrophobicContact CB-CG2 4.24Å; A82-V108 HydrophobicContact CB-CB 3.77Å; A82-V108 HydrophobicContact CB-CG1 3.83Å; A82-V108 HydrophobicContact CB-CG2 4.47Å; A82-L111 HydrophobicContact CB-CD2 3.5Å; A82-L111 HydrophobicContact CB-CG 4.49Å
83	G	97.4	Very high	95.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	152.9	175.5	0	0	0	0	0	112.3	H63 A66 E85 K86 T87	H63-G83 PolarHBondContact CE1-N 3.27Å; A66-G83 WeakPolarHBondContact O-CA 3.38Å; G83-E85 WeakPolarHBondContact CA-OE2 3.23Å; G83-E85 PolarHBondContact O-N 2.86Å; G83-E85 VanDerWaalsContact O-N 3.16Å; G83-K86 PolarHBondContact O-N 2.93Å; G83-T87 PolarHBondContact N-O 2.99Å
84	A	96.5	Very high	95.1	Very high	44 Å²	44	24.7 Å²	24.7	36%	0.364	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.1	175.1	0	0	0	0	0	112.8	A66 K86	A66-A84 HydrophobicContact CB-CB 4.32Å; A66-A84 PolarHBondContact O-N 2.75Å; A84-K86 PolarHBondContact O-N 3.11Å; A84-K86 VanDerWaalsContact O-N 3.16Å
85	E	95.8	Very high	95.3	Very high	60 Å²	60	26.6 Å²	26.6	28%	0.28	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	6.7	173.9	78.2	-81	-162.4	0	0	114.3	H63 S65 G83 T87	H63-E85 WeakPolarHBondContact CB-OE1 3.44Å; H63-E85 IonicContact CE1-OE1 3.53Å; H63-E85 IonicContact CG-OE1 3.06Å; H63-E85 IonicContact ND1-OE1 3.4Å; H63-E85 PolarHBondContact ND1-OE1 3.11Å; H63-E85 IonicContact ND1-OE2 2.86Å; S65-E85 WeakPolarHBondContact CB-OE2 3.45Å; G83-E85 WeakPolarHBondContact CA-OE2 3.23Å; G83-E85 PolarHBondContact O-N 2.86Å; G83-E85 VanDerWaalsContact O-N 3.16Å; E85-T87 HydrophobicContact CG-CG2 3.93Å; E85-T87 WeakPolarHBondContact CG-OG1 3.27Å; E85-T87 PolarHBondContact OE1-OG1 3.4Å
86	K	96.2	Very high	95.5	Very high	88 Å²	88	27 Å²	27	38%	0.383	14%	0.142	S	C	.	.	S	Bend	trans	72.3	29.7	174.9	-41.5	170.9	-178	-179.8	0	113.6	G83 A84 F104 S105	G83-K86 PolarHBondContact O-N 2.93Å; A84-K86 PolarHBondContact O-N 3.11Å; A84-K86 VanDerWaalsContact O-N 3.16Å; K86-F104 PolarHBondContact O-N 3.43Å; K86-S105 PolarHBondContact NZ-O 2.76Å
87	T	97	Very high	95.6	Very high	14 Å²	14	31.9 Å²	31.9	9%	0.086	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	152	173.6	57.4	0	0	0	0	109.7	H63 A82 G83 E85 H101 F102	H63-T87 PolarHBondContact CE1-OG1 3.48Å; H63-T87 PolarHBondContact ND1-OG1 2.84Å; A82-T87 WeakPolarHBondContact CA-O 3.37Å; G83-T87 PolarHBondContact N-O 2.99Å; E85-T87 HydrophobicContact CG-CG2 3.93Å; E85-T87 WeakPolarHBondContact CG-OG1 3.27Å; E85-T87 PolarHBondContact OE1-OG1 3.4Å; T87-H101 VanDerWaalsContact CG2-CE1 3.48Å; T87-H101 WeakPolarHBondContact CG2-CE1 3.45Å; T87-F102 CarbonylContact C-O 3.55Å; T87-F102 WeakPolarHBondContact CA-O 3.25Å
88	V	97.5	Very high	95.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.5	169.9	177.3	0	0	0	0	107.6	L80 T81 A82 F102 F104 V108 L111 I123	L80-V88 HydrophobicContact CD1-CG1 3.47Å; L80-V88 VanDerWaalsContact CD1-CG1 3.47Å; L80-V88 HydrophobicContact CD2-CG1 4.04Å; L80-V88 HydrophobicContact CG-CG1 3.61Å; T81-V88 CarbonylContact O-C 3.34Å; T81-V88 WeakPolarHBondContact O-CA 3.46Å; T81-V88 WeakPolarHBondContact O-CG1 3.34Å; A82-V88 HydrophobicContact CB-CG2 4.24Å; V88-F102 HydrophobicContact CB-CB 4.47Å; V88-F102 PolarHBondContact N-O 3.36Å; V88-F102 PolarHBondContact O-N 2.97Å; V88-F104 HydrophobicContact CB-CD2 4.44Å; V88-F104 HydrophobicContact CB-CE2 3.89Å; V88-F104 HydrophobicContact CG2-CD2 3.78Å; V88-F104 HydrophobicContact CG2-CE2 3.47Å; V88-F104 VanDerWaalsContact CG2-CE2 3.47Å; V88-F104 HydrophobicContact CG2-CZ 4.47Å; V88-V108 HydrophobicContact CG2-CG2 3.79Å; V88-L111 HydrophobicContact CG1-CD2 4.17Å; V88-I123 HydrophobicContact CG2-CD1 4.44Å
89	V	97.4	Very high	95.6	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133	-178	-177.7	0	0	0	0	109.4	P62 L80 T81 G100	P62-V89 HydrophobicContact CB-CB 4.3Å; P62-V89 HydrophobicContact CB-CG1 4.13Å; L80-V89 CarbonylContact C-O 3.51Å; L80-V89 WeakPolarHBondContact CA-O 3.28Å; T81-V89 PolarHBondContact N-O 2.94Å; T81-V89 PolarHBondContact O-N 2.87Å; V89-G100 CarbonylContact C-O 3.59Å; V89-G100 VanDerWaalsContact CA-O 3.3Å; V89-G100 WeakPolarHBondContact CA-O 3.49Å
90	L	97.2	Very high	95.4	Very high	5 Å²	5	34 Å²	34	3%	0.026	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	119.8	168.8	-177.5	70.9	0	0	0	108	K78 I79 L80 S98 E99 G100 F121 I135	K78-L90 HydrophobicContact CB-CD1 3.94Å; I79-L90 WeakPolarHBondContact O-CA 3.17Å; L80-L90 HydrophobicContact CB-CD1 4.43Å; L80-L90 HydrophobicContact CD1-CB 3.99Å; L80-L90 HydrophobicContact CD1-CD1 4.04Å; L90-S98 CarbonylContact O-C 3.59Å; L90-S98 WeakPolarHBondContact O-CA 3.47Å; L90-E99 HydrophobicContact CD2-CB 4.25Å; L90-E99 HydrophobicContact CG-CB 4.49Å; L90-E99 PolarHBondContact O-N 3.08Å; L90-G100 PolarHBondContact N-O 3.2Å; L90-G100 PolarHBondContact O-N 2.79Å; L90-F121 HydrophobicContact CD1-CZ 4.32Å; L90-F121 HydrophobicContact CD2-CZ 4.05Å; L90-I135 HydrophobicContact CD2-CD1 3.61Å; L90-I135 HydrophobicContact CD2-CG1 4.08Å
91	T	96.6	Very high	95.3	Very high	4 Å²	4	39.6 Å²	39.6	3%	0.025	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.6	-172.8	-59.9	0	0	0	0	110.9	K78 I79 D97	K78-T91 VanDerWaalsContact CA-O 3.31Å; K78-T91 WeakPolarHBondContact CA-O 3.4Å; I79-T91 PolarHBondContact N-O 3.05Å; I79-T91 PolarHBondContact O-N 2.87Å; T91-D97 WeakPolarHBondContact CA-O 3.13Å
92	D	94.7	Very high	95.2	Very high	25 Å²	25	40.6 Å²	40.6	13%	0.134	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.7	165.9	-172.7	-81.2	0	0	0	111	K78 L94 T95 G96 D97	K78-D92 HydrophobicContact CD-CB 4.45Å; K78-D92 IonicContact NZ-OD2 3.95Å; K78-D92 PolarHBondContact NZ-OD2 2.85Å; D92-L94 VanDerWaalsContact C-N 3.34Å; D92-L94 PolarHBondContact O-N 2.94Å; D92-L94 WeakPolarHBondContact OD1-CA 3.47Å; D92-L94 WeakPolarHBondContact OD1-CB 3.03Å; D92-L94 PolarHBondContact OD1-N 2.66Å; D92-T95 PolarHBondContact OD1-N 2.8Å; D92-G96 VanDerWaalsContact O-CA 3.22Å; D92-G96 WeakPolarHBondContact O-CA 3.23Å; D92-G96 PolarHBondContact O-N 3.03Å; D92-D97 PolarHBondContact N-O 2.87Å
93	V	94.3	Very high	95.1	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-29.1	-173.6	168.7	0	0	0	0	113.1	I48 Y60 W72 G76 R77 I79 L387 I390	I48-V93 HydrophobicContact CD1-CG1 3.91Å; Y60-V93 PolarHBondContact OH-O 3.37Å; Y60-V93 VanDerWaalsContact OH-O 3.07Å; W72-V93 HydrophobicContact CE3-CG2 4.22Å; W72-V93 HydrophobicContact CH2-CG1 4.36Å; W72-V93 HydrophobicContact CH2-CG2 4.38Å; W72-V93 HydrophobicContact CZ3-CB 4.49Å; W72-V93 HydrophobicContact CZ3-CG1 4.05Å; W72-V93 HydrophobicContact CZ3-CG2 3.62Å; G76-V93 WeakPolarHBondContact O-CG2 3.3Å; R77-V93 WeakPolarHBondContact O-CB 3.39Å; R77-V93 WeakPolarHBondContact O-CG2 3.3Å; R77-V93 PolarHBondContact O-N 3.27Å; I79-V93 HydrophobicContact CB-CG2 4.48Å; I79-V93 HydrophobicContact CD1-CG2 3.69Å; I79-V93 HydrophobicContact CG1-CG2 3.58Å; V93-L387 HydrophobicContact CB-CD2 4.25Å; V93-L387 HydrophobicContact CG1-CD2 3.78Å; V93-I390 HydrophobicContact CG1-CD1 3.66Å; V93-I390 HydrophobicContact CG1-CG1 4.38Å
94	L	92	Very high	95	Very high	72 Å²	72	44.3 Å²	44.3	38%	0.377	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-45.5	-176.4	-66.7	177.6	0	0	0	111.4	K58 Y60 D92 L387 I390	K58-L94 PolarHBondContact NZ-O 2.97Å; Y60-L94 VanDerWaalsContact OH-C 3.32Å; Y60-L94 PolarHBondContact OH-O 2.89Å; D92-L94 VanDerWaalsContact C-N 3.34Å; D92-L94 PolarHBondContact O-N 2.94Å; D92-L94 WeakPolarHBondContact OD1-CA 3.47Å; D92-L94 WeakPolarHBondContact OD1-CB 3.03Å; D92-L94 PolarHBondContact OD1-N 2.66Å; L94-L387 HydrophobicContact CD1-CD1 4.28Å; L94-L387 HydrophobicContact CD2-CD1 4.13Å; L94-L387 HydrophobicContact CD2-CD2 3.99Å; L94-L387 HydrophobicContact CG-CD1 4.48Å; L94-L387 HydrophobicContact CG-CD2 4.15Å; L94-I390 HydrophobicContact CD2-CB 4.35Å; L94-I390 HydrophobicContact CD2-CG1 4.02Å; L94-I390 HydrophobicContact CD2-CG2 3.89Å
95	T	91.8	Very high	94.8	Very high	80 Å²	80	46.2 Å²	46.2	49%	0.491	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-32.2	-176.5	72	0	0	0	0	112.4	D92 D97	D92-T95 PolarHBondContact OD1-N 2.8Å; T95-D97 VanDerWaalsContact C-N 3.27Å; T95-D97 WeakPolarHBondContact CB-OD2 3.29Å; T95-D97 WeakPolarHBondContact OG1-CB 3.24Å; T95-D97 PolarHBondContact OG1-N 2.89Å; T95-D97 VanDerWaalsContact OG1-N 3.15Å; T95-D97 PolarHBondContact OG1-OD2 3Å
96	G	91.8	Very high	94.7	Very high	20 Å²	20	44.7 Å²	44.7	21%	0.206	26%	0.26	C	S	.	.			trans	83.9	2.3	-170.7	0	0	0	0	0	113.8	Y60 D92	Y60-G96 PolarHBondContact OH-N 2.82Å; D92-G96 VanDerWaalsContact O-CA 3.22Å; D92-G96 WeakPolarHBondContact O-CA 3.23Å; D92-G96 PolarHBondContact O-N 3.03Å
97	D	94.4	Very high	94.5	Very high	102 Å²	102	42.7 Å²	42.7	55%	0.545	26%	0.255	S	S	.	.			trans	-71	138.5	-177.8	-62	-42.7	0	0	0	110.8	T91 D92 T95	T91-D97 WeakPolarHBondContact CA-O 3.13Å; D92-D97 PolarHBondContact N-O 2.87Å; T95-D97 VanDerWaalsContact C-N 3.27Å; T95-D97 WeakPolarHBondContact CB-OD2 3.29Å; T95-D97 WeakPolarHBondContact OG1-CB 3.24Å; T95-D97 PolarHBondContact OG1-N 2.89Å; T95-D97 VanDerWaalsContact OG1-N 3.15Å; T95-D97 PolarHBondContact OG1-OD2 3Å
98	S	93.9	Very high	94.4	Very high	82 Å²	82	42.1 Å²	42.1	57%	0.573	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	119.1	171.3	60.6	0	0	0	0	110.4	L90	L90-S98 CarbonylContact O-C 3.59Å; L90-S98 WeakPolarHBondContact O-CA 3.47Å
99	E	92.7	Very high	94.1	Very high	105 Å²	105	44.2 Å²	44.2	49%	0.491	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-23.9	174.9	-67.4	-166.2	152.2	0	0	112.8	K78 L90	K78-E99 WeakPolarHBondContact CD-OE2 3.49Å; K78-E99 VanDerWaalsContact CE-CD 3.46Å; K78-E99 WeakPolarHBondContact CE-OE1 3.05Å; K78-E99 WeakPolarHBondContact CE-OE2 3.42Å; K78-E99 IonicContact NZ-OE1 3.5Å; K78-E99 PolarHBondContact NZ-OE1 3.3Å; K78-E99 IonicContact NZ-OE2 3.77Å; K78-E99 PolarHBondContact NZ-OE2 2.76Å; L90-E99 HydrophobicContact CD2-CB 4.25Å; L90-E99 HydrophobicContact CG-CB 4.49Å; L90-E99 PolarHBondContact O-N 3.08Å
100	G	92.9	Very high	93.9	Very high	10 Å²	10	45.6 Å²	45.6	10%	0.103	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	137.5	179.2	0	0	0	0	0	110.8	V89 L90	V89-G100 CarbonylContact C-O 3.59Å; V89-G100 VanDerWaalsContact CA-O 3.3Å; V89-G100 WeakPolarHBondContact CA-O 3.49Å; L90-G100 PolarHBondContact N-O 3.2Å; L90-G100 PolarHBondContact O-N 2.79Å
101	H	95.2	Very high	93.8	Very high	117 Å²	117	46.1 Å²	46.1	54%	0.542	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	111.7	176.2	-176.6	-70	0	0	0	109.2	T87	T87-H101 VanDerWaalsContact CG2-CE1 3.48Å; T87-H101 WeakPolarHBondContact CG2-CE1 3.45Å
102	F	96.1	Very high	93.8	Very high	22 Å²	22	47.6 Å²	47.6	10%	0.096	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	119.4	-169.3	-49.4	-77	0	0	0	110.8	T87 V88 F104 F121 M133 I135	T87-F102 CarbonylContact C-O 3.55Å; T87-F102 WeakPolarHBondContact CA-O 3.25Å; V88-F102 HydrophobicContact CB-CB 4.47Å; V88-F102 PolarHBondContact N-O 3.36Å; V88-F102 PolarHBondContact O-N 2.97Å; F102-F104 HydrophobicContact CB-CE2 3.9Å; F102-F104 HydrophobicContact CB-CZ 4.49Å; F102-F104 WeakPolarHBondContact O-CD2 3.43Å; F102-F121 HydrophobicContact CE2-CE2 4.44Å; F102-M133 HydrophobicContact CB-CE 4.25Å; F102-M133 HydrophobicContact CB-SD 4.31Å; F102-M133 HydrophobicContact CD1-CE 3.56Å; F102-M133 HydrophobicContact CD1-SD 4.2Å; F102-M133 HydrophobicContact CD2-CE 3.4Å; F102-M133 VanDerWaalsContact CD2-CE 3.4Å; F102-M133 HydrophobicContact CD2-SD 4.49Å; F102-M133 HydrophobicContact CE1-CE 3.62Å; F102-M133 HydrophobicContact CE2-CE 3.46Å; F102-M133 VanDerWaalsContact CE2-CE 3.46Å; F102-M133 HydrophobicContact CG-CE 3.45Å; F102-M133 VanDerWaalsContact CG-CE 3.45Å; F102-M133 HydrophobicContact CG-SD 4.08Å; F102-M133 HydrophobicContact CZ-CE 3.56Å; F102-I135 WeakPolarHBondContact CZ-O 3.24Å
103	A	95.5	Very high	93.8	Very high	61 Å²	61	46.7 Å²	46.7	50%	0.504	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	142.3	176.9	0	0	0	0	0	112.1	R139	A103-R139 PolarHBondContact O-NH1 2.73Å; A103-R139 PolarHBondContact O-NH2 2.95Å
104	F	94.8	Very high	93.9	Very high	16 Å²	16	46.8 Å²	46.8	7%	0.07	28%	0.283	C	S	.	.			trans	-123.8	160.2	179.1	-71.3	-86	0	0	0	111.7	K86 V88 F102 V108 I123 Q125 M133	K86-F104 PolarHBondContact O-N 3.43Å; V88-F104 HydrophobicContact CB-CD2 4.44Å; V88-F104 HydrophobicContact CB-CE2 3.89Å; V88-F104 HydrophobicContact CG2-CD2 3.78Å; V88-F104 HydrophobicContact CG2-CE2 3.47Å; V88-F104 VanDerWaalsContact CG2-CE2 3.47Å; V88-F104 HydrophobicContact CG2-CZ 4.47Å; F102-F104 HydrophobicContact CB-CE2 3.9Å; F102-F104 HydrophobicContact CB-CZ 4.49Å; F102-F104 WeakPolarHBondContact O-CD2 3.43Å; F104-V108 HydrophobicContact CD2-CG2 4.25Å; F104-V108 HydrophobicContact CG-CG2 4.42Å; F104-I123 HydrophobicContact CE1-CD1 4.25Å; F104-I123 HydrophobicContact CE1-CG2 4.27Å; F104-I123 HydrophobicContact CE2-CD1 3.99Å; F104-I123 HydrophobicContact CZ-CD1 3.41Å; F104-I123 VanDerWaalsContact CZ-CD1 3.41Å; F104-I123 HydrophobicContact CZ-CG2 4.22Å; F104-Q125 HydrophobicContact CB-CG 4.43Å; F104-Q125 HydrophobicContact CD1-CG 4.24Å; F104-M133 HydrophobicContact CZ-SD 3.89Å
105	S	93.1	Very high	93.7	Very high	85 Å²	85	44.6 Å²	44.6	59%	0.594	27%	0.274	S	S	*	.	S	Bend	trans	-80.8	-25.5	-178.7	56.1	0	0	0	0	112.5	K86 Q125 Q128	K86-S105 PolarHBondContact NZ-O 2.76Å; S105-Q125 PolarHBondContact OG-OE1 3.14Å; S105-Q128 PolarHBondContact OG-NE2 2.96Å
106	S	93.3	Very high	93.5	Very high	27 Å²	27	44.4 Å²	44.4	19%	0.189	26%	0.264	C	S	.	.	S	Bend	trans	-128.9	161.1	178	-169.9	0	0	0	0	110.8	Q125 V126	S106-Q125 VanDerWaalsContact N-OE1 3.15Å; S106-V126 PolarHBondContact OG-O 3.26Å
107	T	93.2	Very high	93.4	Very high	47 Å²	47	47.4 Å²	47.4	29%	0.288	27%	0.271	S	S	.	.			trans	-63.8	139.7	176.3	-55.6	0	0	0	0	109.7	Q125 V126	T107-Q125 WeakPolarHBondContact O-CA 3.33Å; T107-V126 WeakPolarHBondContact O-CG2 3.34Å; T107-V126 PolarHBondContact O-N 3.08Å
108	V	94.4	Very high	92.9	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.3	176.9	174.9	0	0	0	0	108.6	C68 A82 V88 F104 C110 L111 I123 C124 Q125	C68-V108 PolarHBondContact SG-O 3.2Å; A82-V108 HydrophobicContact CB-CB 3.77Å; A82-V108 HydrophobicContact CB-CG1 3.83Å; A82-V108 HydrophobicContact CB-CG2 4.47Å; V88-V108 HydrophobicContact CG2-CG2 3.79Å; F104-V108 HydrophobicContact CD2-CG2 4.25Å; F104-V108 HydrophobicContact CG-CG2 4.42Å; V108-C110 WeakPolarHBondContact CG1-O 3.48Å; V108-L111 HydrophobicContact CG1-CB 4.3Å; V108-L111 HydrophobicContact CG1-CD2 4.49Å; V108-I123 HydrophobicContact CB-CG2 4.49Å; V108-I123 HydrophobicContact CG1-CG2 3.88Å; V108-I123 HydrophobicContact CG2-CG2 3.8Å; V108-C124 CarbonylContact C-O 3.55Å; V108-Q125 HydrophobicContact CG2-CG 4.29Å
109	A	91.3	Very high	92.7	Very high	45 Å²	45	45.5 Å²	45.5	37%	0.372	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-41.4	178.4	0	0	0	0	0	111.5	C124 V126	A109-C124 PolarHBondContact N-O 2.9Å; A109-V126 HydrophobicContact CB-CG2 4.03Å
110	C	92.5	Very high	92.8	Very high	30 Å²	30	41.5 Å²	41.5	20%	0.203	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	155.5	173.8	68.5	0	0	0	0	111	V108 C124	V108-C110 WeakPolarHBondContact CG1-O 3.48Å; C110-C124 PolarHBondContact N-O 3.04Å; C110-C124 PolarHBondContact O-N 2.94Å; C110-C124 VanDerWaalsContact SG-CB 3.56Å
111	L	95.9	Very high	93	Very high	16 Å²	16	41 Å²	41	8%	0.084	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	157.3	176.1	57	72.3	0	0	0	111.3	A69 L80 A82 V88 V108 L122 I123	A69-L111 HydrophobicContact CB-CD1 4.39Å; A69-L111 HydrophobicContact CB-CD2 4.33Å; A69-L111 HydrophobicContact CB-CG 3.8Å; L80-L111 HydrophobicContact CB-CD1 4.33Å; L80-L111 HydrophobicContact CD2-CB 4.34Å; L80-L111 HydrophobicContact CD2-CD1 4.17Å; L80-L111 HydrophobicContact CD2-CD2 4.11Å; L80-L111 HydrophobicContact CD2-CG 4.44Å; L80-L111 HydrophobicContact CG-CD1 4.39Å; L80-L111 HydrophobicContact CG-CD2 4.1Å; A82-L111 HydrophobicContact CB-CD2 3.5Å; A82-L111 HydrophobicContact CB-CG 4.49Å; V88-L111 HydrophobicContact CG1-CD2 4.17Å; V108-L111 HydrophobicContact CG1-CB 4.3Å; V108-L111 HydrophobicContact CG1-CD2 4.49Å; L111-L122 CarbonylContact C-O 3.58Å; L111-L122 VanDerWaalsContact CA-O 3.24Å; L111-L122 WeakPolarHBondContact CA-O 3.41Å; L111-I123 HydrophobicContact CB-CG1 4.45Å
112	Q	95.8	Very high	93	Very high	35 Å²	35	35.6 Å²	35.6	16%	0.164	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	132.4	175.6	-164.8	-179.2	-7.1	0	0	110.8	S71 F121 L122 S157 F158	S71-Q112 WeakPolarHBondContact OG-CA 3.18Å; Q112-F121 CarbonylContact O-C 3.48Å; Q112-F121 WeakPolarHBondContact O-CA 3.49Å; Q112-L122 PolarHBondContact N-O 2.97Å; Q112-L122 PolarHBondContact O-N 2.91Å; Q112-S157 PolarHBondContact OE1-OG 2.74Å; Q112-F158 HydrophobicContact CB-CD2 4.22Å; Q112-F158 HydrophobicContact CG-CD2 4.06Å
113	I	95.9	Very high	93	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.036	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	138.2	166	-60.8	172.8	0	0	0	108.5	S71 L80 F121	S71-I113 WeakPolarHBondContact O-CD1 3.46Å; S71-I113 PolarHBondContact OG-N 2.77Å; L80-I113 HydrophobicContact CB-CD1 3.83Å; L80-I113 HydrophobicContact CB-CG1 3.83Å; L80-I113 HydrophobicContact CD2-CG1 4.21Å; I113-F121 HydrophobicContact CB-CD1 4.3Å; I113-F121 HydrophobicContact CG1-CD1 3.87Å; I113-F121 HydrophobicContact CG1-CE1 4.18Å; I113-F121 HydrophobicContact CG2-CD1 4.19Å; I113-F121 HydrophobicContact CG2-CE1 4.31Å
114	N	94.6	Very high	93	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.011	18%	0.175	C	C	.	.			trans	-57.8	129.5	175.5	-179.3	-50.3	0	0	0	109.4	R116 K117 Q120 F158 G162	N114-R116 PolarHBondContact O-N 2.96Å; N114-R116 PolarHBondContact OD1-N 2.8Å; N114-K117 HydrophobicContact CB-CB 4.09Å; N114-K117 PolarHBondContact OD1-N 2.73Å; N114-Q120 HydrophobicContact CB-CB 4.05Å; N114-Q120 HydrophobicContact CB-CG 4.44Å; N114-Q120 VanDerWaalsContact CB-O 3.28Å; N114-Q120 WeakPolarHBondContact CB-O 2.97Å; N114-Q120 PolarHBondContact N-O 2.86Å; N114-Q120 PolarHBondContact ND2-OE1 2.75Å; N114-F158 HydrophobicContact CB-CD2 4.35Å; N114-F158 HydrophobicContact CB-CE1 4.3Å; N114-F158 HydrophobicContact CB-CE2 3.84Å; N114-F158 HydrophobicContact CB-CZ 3.81Å; N114-G162 PolarHBondContact ND2-O 2.87Å
115	P	88.7	Confident	92.9	Very high	27 Å²	27	31.3 Å²	31.3	18%	0.175	17%	0.173	C	C	.	.	S	Bend	trans	-66.4	-7.9	-173	28.1	-37.4	0	0	0	114.4	R74 F158	R74-P115 WeakPolarHBondContact CD-O 3.48Å; R74-P115 WeakPolarHBondContact CG-O 3.43Å; R74-P115 PolarHBondContact NH1-O 2.65Å; P115-F158 HydrophobicContact CG-CB 4.29Å
116	R	87.1	Confident	92.7	Very high	75 Å²	75	30.3 Å²	30.3	28%	0.283	16%	0.164	S	C	.	.	S	Bend	trans	-125.4	-42.8	176.6	-64.7	-66.4	-175.6	145.8	11.9	113	N114 R118 R161 S379	N114-R116 PolarHBondContact O-N 2.96Å; N114-R116 PolarHBondContact OD1-N 2.8Å; R116-R118 PolarHBondContact O-N 2.76Å; R116-R161 WeakPolarHBondContact CG-O 3.32Å; R116-S379 PolarHBondContact NH2-OG 2.9Å
117	K	90.4	Very high	92.3	Very high	84 Å²	84	36.9 Å²	36.9	37%	0.365	19%	0.189	S	C	.	.			trans	-92.3	96.2	-175.7	-60.3	178.5	-176.3	174.8	0	110.8	N114 G119 Q120 N180	N114-K117 HydrophobicContact CB-CB 4.09Å; N114-K117 PolarHBondContact OD1-N 2.73Å; K117-G119 PolarHBondContact O-N 3.09Å; K117-G119 VanDerWaalsContact O-N 3.08Å; K117-Q120 HydrophobicContact CB-CB 4.04Å; K117-Q120 PolarHBondContact O-N 3.13Å; K117-N180 PolarHBondContact NZ-OD1 2.84Å
118	R	83.6	Confident	92	Very high	116 Å²	116	37.6 Å²	37.6	44%	0.438	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-34.7	-171.8	-63.9	-170.1	-172.4	176.9	12.5	114.9	D75 R116 F121 E384	D75-R118 IonicContact OD2-CZ 2.71Å; D75-R118 IonicContact OD2-NE 3.36Å; D75-R118 IonicContact OD2-NH1 3.1Å; D75-R118 PolarHBondContact OD2-NH1 3.24Å; D75-R118 IonicContact OD2-NH2 3.16Å; R116-R118 PolarHBondContact O-N 2.76Å; R118-F121 WeakPolarHBondContact O-CE1 3.28Å; R118-E384 IonicContact CZ-OE2 3.57Å; R118-E384 IonicContact NH1-OE2 2.9Å; R118-E384 PolarHBondContact NH1-OE2 2.95Å; R118-E384 IonicContact NH2-OE2 2.8Å; R118-E384 PolarHBondContact NH2-OE2 3.28Å
119	G	89.9	Confident	91.7	Very high	27 Å²	27	38.7 Å²	38.7	28%	0.278	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	12.3	-178.1	0	0	0	0	0	115.1	K117 N134 I135	K117-G119 PolarHBondContact O-N 3.09Å; K117-G119 VanDerWaalsContact O-N 3.08Å; G119-N134 CarbonylContact O-C 3.1Å; G119-N134 WeakPolarHBondContact O-CA 3.16Å; G119-I135 PolarHBondContact O-N 3.38Å
120	Q	95	Very high	91.8	Very high	22 Å²	22	36.5 Å²	36.5	10%	0.103	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.2	-178.2	-174.2	176.4	72	0	0	110.9	N114 K117 L132 M133 V179	N114-Q120 HydrophobicContact CB-CB 4.05Å; N114-Q120 HydrophobicContact CB-CG 4.44Å; N114-Q120 VanDerWaalsContact CB-O 3.28Å; N114-Q120 WeakPolarHBondContact CB-O 2.97Å; N114-Q120 PolarHBondContact N-O 2.86Å; N114-Q120 PolarHBondContact ND2-OE1 2.75Å; K117-Q120 HydrophobicContact CB-CB 4.04Å; K117-Q120 PolarHBondContact O-N 3.13Å; Q120-L132 HydrophobicContact CG-CD1 3.66Å; Q120-L132 HydrophobicContact CG-CD2 4.37Å; Q120-L132 HydrophobicContact CG-CG 3.91Å; Q120-M133 CarbonylContact C-O 3.55Å; Q120-M133 WeakPolarHBondContact CA-O 3.28Å; Q120-V179 VanDerWaalsContact OE1-CG1 3.28Å
121	F	96.3	Very high	91.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.1	-173.7	-39.6	-46	0	0	0	110.5	L80 L90 F102 Q112 I113 R118 I123 L132 M133 I135	L80-F121 HydrophobicContact CD1-CD2 4.29Å; L80-F121 HydrophobicContact CD1-CE2 4.35Å; L80-F121 HydrophobicContact CD2-CB 3.87Å; L80-F121 HydrophobicContact CD2-CD1 4.18Å; L80-F121 HydrophobicContact CD2-CD2 4.28Å; L80-F121 HydrophobicContact CD2-CG 3.85Å; L90-F121 HydrophobicContact CD1-CZ 4.32Å; L90-F121 HydrophobicContact CD2-CZ 4.05Å; F102-F121 HydrophobicContact CE2-CE2 4.44Å; Q112-F121 CarbonylContact O-C 3.48Å; Q112-F121 WeakPolarHBondContact O-CA 3.49Å; I113-F121 HydrophobicContact CB-CD1 4.3Å; I113-F121 HydrophobicContact CG1-CD1 3.87Å; I113-F121 HydrophobicContact CG1-CE1 4.18Å; I113-F121 HydrophobicContact CG2-CD1 4.19Å; I113-F121 HydrophobicContact CG2-CE1 4.31Å; R118-F121 WeakPolarHBondContact O-CE1 3.28Å; F121-I123 HydrophobicContact CB-CG1 4.5Å; F121-L132 CarbonylContact O-C 3.57Å; F121-L132 WeakPolarHBondContact O-CA 3.4Å; F121-M133 HydrophobicContact CD2-CE 3.66Å; F121-M133 HydrophobicContact CE2-CE 3.96Å; F121-M133 PolarHBondContact N-O 2.91Å; F121-M133 PolarHBondContact O-N 2.88Å; F121-I135 HydrophobicContact CE2-CB 4.37Å; F121-I135 HydrophobicContact CZ-CB 4.18Å; F121-I135 HydrophobicContact CZ-CG1 4.35Å
122	L	96.7	Very high	91.8	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129.1	170.3	178.4	63	0	0	0	108.7	L111 Q112 A130 I142 A156 F158 I165	L111-L122 CarbonylContact C-O 3.58Å; L111-L122 VanDerWaalsContact CA-O 3.24Å; L111-L122 WeakPolarHBondContact CA-O 3.41Å; Q112-L122 PolarHBondContact N-O 2.97Å; Q112-L122 PolarHBondContact O-N 2.91Å; L122-A130 HydrophobicContact CD1-CB 4.26Å; L122-I142 HydrophobicContact CD1-CD1 3.53Å; L122-A156 HydrophobicContact CD1-CB 4.27Å; L122-A156 HydrophobicContact CD2-CB 3.72Å; L122-A156 HydrophobicContact CG-CB 4.18Å; L122-F158 HydrophobicContact CB-CD2 4.1Å; L122-F158 HydrophobicContact CB-CE1 4.49Å; L122-F158 HydrophobicContact CB-CE2 3.37Å; L122-F158 HydrophobicContact CB-CZ 3.61Å; L122-F158 HydrophobicContact CD2-CD2 4.33Å; L122-F158 HydrophobicContact CD2-CE2 4.32Å; L122-I165 HydrophobicContact CD1-CD1 4.35Å; L122-I165 HydrophobicContact CD1-CG2 4.09Å; L122-I165 HydrophobicContact CD2-CG2 3.79Å
123	I	95.8	Very high	91.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	126.5	-174.9	-60.4	174.8	0	0	0	108.8	V88 F104 V108 L111 F121 V131 M133	V88-I123 HydrophobicContact CG2-CD1 4.44Å; F104-I123 HydrophobicContact CE1-CD1 4.25Å; F104-I123 HydrophobicContact CE1-CG2 4.27Å; F104-I123 HydrophobicContact CE2-CD1 3.99Å; F104-I123 HydrophobicContact CZ-CD1 3.41Å; F104-I123 VanDerWaalsContact CZ-CD1 3.41Å; F104-I123 HydrophobicContact CZ-CG2 4.22Å; V108-I123 HydrophobicContact CB-CG2 4.49Å; V108-I123 HydrophobicContact CG1-CG2 3.88Å; V108-I123 HydrophobicContact CG2-CG2 3.8Å; L111-I123 HydrophobicContact CB-CG1 4.45Å; F121-I123 HydrophobicContact CB-CG1 4.5Å; I123-V131 PolarHBondContact N-O 3.31Å; I123-V131 PolarHBondContact O-N 2.92Å; I123-M133 HydrophobicContact CD1-CB 4.25Å; I123-M133 HydrophobicContact CD1-SD 4.07Å
124	C	94.1	Very high	91.7	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.8	171.5	-63.5	0	0	0	0	109.7	V108 A109 C110 A156	V108-C124 CarbonylContact C-O 3.55Å; A109-C124 PolarHBondContact N-O 2.9Å; C110-C124 PolarHBondContact N-O 3.04Å; C110-C124 PolarHBondContact O-N 2.94Å; C110-C124 VanDerWaalsContact SG-CB 3.56Å; C124-A156 WeakPolarHBondContact SG-CB 3.45Å; C124-A156 PolarHBondContact SG-N 2.95Å; C124-A156 VanDerWaalsContact SG-N 3.4Å
125	Q	92.6	Very high	91.5	Very high	8 Å²	8	38.6 Å²	38.6	4%	0.037	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	147.4	173.5	-80.7	175.4	77	0	0	110.5	F104 S105 S106 T107 V108 K127 Q128	F104-Q125 HydrophobicContact CB-CG 4.43Å; F104-Q125 HydrophobicContact CD1-CG 4.24Å; S105-Q125 PolarHBondContact OG-OE1 3.14Å; S106-Q125 VanDerWaalsContact N-OE1 3.15Å; T107-Q125 WeakPolarHBondContact O-CA 3.33Å; V108-Q125 HydrophobicContact CG2-CG 4.29Å; Q125-K127 PolarHBondContact O-N 2.66Å; Q125-Q128 HydrophobicContact CB-CB 3.96Å; Q125-Q128 HydrophobicContact CB-CG 4.29Å; Q125-Q128 VanDerWaalsContact NE2-OE1 3.15Å; Q125-Q128 PolarHBondContact O-N 3.48Å
126	V	89.1	Confident	91.6	Very high	64 Å²	64	44.2 Å²	44.2	39%	0.388	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	126.3	176.7	175.3	0	0	0	0	109.8	S106 T107 A109 Q128	S106-V126 PolarHBondContact OG-O 3.26Å; T107-V126 WeakPolarHBondContact O-CG2 3.34Å; T107-V126 PolarHBondContact O-N 3.08Å; A109-V126 HydrophobicContact CB-CG2 4.03Å; V126-Q128 VanDerWaalsContact C-N 3.27Å; V126-Q128 PolarHBondContact O-N 3.24Å
127	K	85	Confident	91.7	Very high	165 Å²	165	41.9 Å²	41.9	72%	0.717	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	23.8	179.2	-60.7	175.4	-178.4	-175.8	0	114.9	Q125	Q125-K127 PolarHBondContact O-N 2.66Å
128	Q	87.7	Confident	91.8	Very high	63 Å²	63	43.7 Å²	43.7	29%	0.294	22%	0.224	S	C	.	.	S	Bend	trans	-127.1	170.6	175.4	-63.5	-174.7	10.5	0	0	111.6	S105 Q125 V126 N153	S105-Q128 PolarHBondContact OG-NE2 2.96Å; Q125-Q128 HydrophobicContact CB-CB 3.96Å; Q125-Q128 HydrophobicContact CB-CG 4.29Å; Q125-Q128 VanDerWaalsContact NE2-OE1 3.15Å; Q125-Q128 PolarHBondContact O-N 3.48Å; V126-Q128 VanDerWaalsContact C-N 3.27Å; V126-Q128 PolarHBondContact O-N 3.24Å; Q128-N153 PolarHBondContact O-N 2.97Å
129	Q	88	Confident	92.2	Very high	23 Å²	23	43.5 Å²	43.5	11%	0.107	22%	0.223	C	C	.	.			trans	-72	153.5	170.4	-73.8	-176.3	-38	0	0	110.5	I141 H143 V150	Q129-I141 HydrophobicContact CB-CG2 3.71Å; Q129-I141 HydrophobicContact CG-CG2 4.49Å; Q129-H143 PolarHBondContact OE1-ND1 2.7Å; Q129-V150 HydrophobicContact CG-CG1 3.62Å
130	A	92.4	Very high	92.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.226	C	C	.	.			trans	-65	144.2	174.1	0	0	0	0	0	110	L122 I142 N153 A156	L122-A130 HydrophobicContact CD1-CB 4.26Å; A130-I142 HydrophobicContact CB-CD1 3.99Å; A130-I142 WeakPolarHBondContact O-CB 3.14Å; A130-I142 PolarHBondContact O-N 2.84Å; A130-N153 HydrophobicContact CB-CB 4.23Å; A130-A156 HydrophobicContact CB-CB 4.2Å
131	V	93.7	Very high	92.2	Very high	10 Å²	10	47.8 Å²	47.8	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.2	-178.6	178.6	0	0	0	0	108.7	I123 R139 T140 I141	I123-V131 PolarHBondContact N-O 3.31Å; I123-V131 PolarHBondContact O-N 2.92Å; V131-R139 HydrophobicContact CG1-CB 3.79Å; V131-R139 HydrophobicContact CG1-CG 4.15Å; V131-T140 WeakPolarHBondContact CA-O 3.08Å; V131-I141 HydrophobicContact CG2-CG1 4.41Å
132	L	95.5	Very high	91.9	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.9	164.5	-164.4	66.3	0	0	0	107.8	Q120 F121 T140 I142 F158 I165 L182	Q120-L132 HydrophobicContact CG-CD1 3.66Å; Q120-L132 HydrophobicContact CG-CD2 4.37Å; Q120-L132 HydrophobicContact CG-CG 3.91Å; F121-L132 CarbonylContact O-C 3.57Å; F121-L132 WeakPolarHBondContact O-CA 3.4Å; L132-T140 PolarHBondContact N-O 3.12Å; L132-T140 PolarHBondContact O-N 2.71Å; L132-I142 HydrophobicContact CB-CD1 4.38Å; L132-I142 HydrophobicContact CB-CG1 4.41Å; L132-F158 HydrophobicContact CD1-CE1 3.98Å; L132-F158 HydrophobicContact CD1-CZ 3.64Å; L132-I165 HydrophobicContact CD1-CD1 4.19Å; L132-L182 HydrophobicContact CD2-CD2 3.6Å
133	M	95.7	Very high	91.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.3	-177.2	-164.4	-173.7	96.9	0	0	110.1	F102 F104 Q120 F121 I123 Q138 R139	F102-M133 HydrophobicContact CB-CE 4.25Å; F102-M133 HydrophobicContact CB-SD 4.31Å; F102-M133 HydrophobicContact CD1-CE 3.56Å; F102-M133 HydrophobicContact CD1-SD 4.2Å; F102-M133 HydrophobicContact CD2-CE 3.4Å; F102-M133 VanDerWaalsContact CD2-CE 3.4Å; F102-M133 HydrophobicContact CD2-SD 4.49Å; F102-M133 HydrophobicContact CE1-CE 3.62Å; F102-M133 HydrophobicContact CE2-CE 3.46Å; F102-M133 VanDerWaalsContact CE2-CE 3.46Å; F102-M133 HydrophobicContact CG-CE 3.45Å; F102-M133 VanDerWaalsContact CG-CE 3.45Å; F102-M133 HydrophobicContact CG-SD 4.08Å; F102-M133 HydrophobicContact CZ-CE 3.56Å; F104-M133 HydrophobicContact CZ-SD 3.89Å; Q120-M133 CarbonylContact C-O 3.55Å; Q120-M133 WeakPolarHBondContact CA-O 3.28Å; F121-M133 HydrophobicContact CD2-CE 3.66Å; F121-M133 HydrophobicContact CE2-CE 3.96Å; F121-M133 PolarHBondContact N-O 2.91Å; F121-M133 PolarHBondContact O-N 2.88Å; I123-M133 HydrophobicContact CD1-CB 4.25Å; I123-M133 HydrophobicContact CD1-SD 4.07Å; M133-Q138 CarbonylContact C-O 3.52Å; M133-Q138 VanDerWaalsContact CA-O 3.26Å; M133-Q138 WeakPolarHBondContact CA-O 3.33Å; M133-Q138 WeakPolarHBondContact CG-O 3.14Å; M133-R139 HydrophobicContact CB-CG 4.48Å; M133-R139 HydrophobicContact CG-CG 3.8Å; M133-R139 HydrophobicContact SD-CG 4.24Å
134	N	93.6	Very high	90.3	Very high	46 Å²	46	53.8 Å²	53.8	25%	0.246	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	162.7	168.7	-64.7	-27.7	0	0	0	110.9	G119 D136 G137 Q138	G119-N134 CarbonylContact O-C 3.1Å; G119-N134 WeakPolarHBondContact O-CA 3.16Å; N134-D136 PolarHBondContact O-N 2.88Å; N134-G137 WeakPolarHBondContact O-CA 3.42Å; N134-G137 PolarHBondContact O-N 2.71Å; N134-Q138 PolarHBondContact N-O 3.45Å
135	I	90.8	Very high	89.1	Confident	69 Å²	69	58.8 Å²	58.8	35%	0.354	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.5	179.1	-165.8	165.6	0	0	0	112.7	L90 F102 G119 F121 G137	L90-I135 HydrophobicContact CD2-CD1 3.61Å; L90-I135 HydrophobicContact CD2-CG1 4.08Å; F102-I135 WeakPolarHBondContact CZ-O 3.24Å; G119-I135 PolarHBondContact O-N 3.38Å; F121-I135 HydrophobicContact CE2-CB 4.37Å; F121-I135 HydrophobicContact CZ-CB 4.18Å; F121-I135 HydrophobicContact CZ-CG1 4.35Å; I135-G137 PolarHBondContact O-N 3.16Å
136	D	90.4	Very high	87.6	Confident	146 Å²	146	59.7 Å²	59.7	78%	0.781	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-0.9	175	-51.8	-43.4	0	0	0	113.2	N134 Q138	N134-D136 PolarHBondContact O-N 2.88Å; D136-Q138 VanDerWaalsContact C-N 3.32Å; D136-Q138 PolarHBondContact O-N 3.1Å
137	G	88.4	Confident	86.1	Confident	25 Å²	25	66 Å²	66	26%	0.258	33%	0.329	S	S	.	.			trans	84.4	-0.5	-180	0	0	0	0	0	114.4	N134 I135 R139	N134-G137 WeakPolarHBondContact O-CA 3.42Å; N134-G137 PolarHBondContact O-N 2.71Å; I135-G137 PolarHBondContact O-N 3.16Å; G137-R139 PolarHBondContact O-N 2.87Å
138	Q	92.9	Very high	84.7	Confident	123 Å²	123	65.4 Å²	65.4	58%	0.575	33%	0.333	S	S	*	.			trans	-62.9	128.8	173.2	-172.4	-179.8	12.2	0	0	110	M133 N134 D136	M133-Q138 CarbonylContact C-O 3.52Å; M133-Q138 VanDerWaalsContact CA-O 3.26Å; M133-Q138 WeakPolarHBondContact CA-O 3.33Å; M133-Q138 WeakPolarHBondContact CG-O 3.14Å; N134-Q138 PolarHBondContact N-O 3.45Å; D136-Q138 VanDerWaalsContact C-N 3.32Å; D136-Q138 PolarHBondContact O-N 3.1Å
139	R	93.3	Very high	83.3	Confident	112 Å²	112	64.4 Å²	64.4	42%	0.423	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	131.4	-177.7	-65.7	168.3	-165.5	-164.5	-0.3	110	A103 V131 M133 G137	A103-R139 PolarHBondContact O-NH1 2.73Å; A103-R139 PolarHBondContact O-NH2 2.95Å; V131-R139 HydrophobicContact CG1-CB 3.79Å; V131-R139 HydrophobicContact CG1-CG 4.15Å; M133-R139 HydrophobicContact CB-CG 4.48Å; M133-R139 HydrophobicContact CG-CG 3.8Å; M133-R139 HydrophobicContact SD-CG 4.24Å; G137-R139 PolarHBondContact O-N 2.87Å
140	T	94.1	Very high	82.1	Confident	56 Å²	56	68.5 Å²	68.5	34%	0.344	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.4	174.3	-48.4	0	0	0	0	108.9	V131 L132 L182	V131-T140 WeakPolarHBondContact CA-O 3.08Å; L132-T140 PolarHBondContact N-O 3.12Å; L132-T140 PolarHBondContact O-N 2.71Å; T140-L182 HydrophobicContact CG2-CD1 3.37Å
141	I	90.9	Very high	81.1	Confident	82 Å²	82	69.3 Å²	69.3	42%	0.421	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	134.6	178.8	-60.7	173.1	0	0	0	108.5	Q129 V131 H143	Q129-I141 HydrophobicContact CB-CG2 3.71Å; Q129-I141 HydrophobicContact CG-CG2 4.49Å; V131-I141 HydrophobicContact CG2-CG1 4.41Å; I141-H143 PolarHBondContact O-N 2.82Å
142	I	90	Very high	80	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.377	C	S	.	.			trans	-87.4	104.2	174	-56.9	164.3	0	0	0	106.9	L122 A130 L132 I165 H177 L182	L122-I142 HydrophobicContact CD1-CD1 3.53Å; A130-I142 HydrophobicContact CB-CD1 3.99Å; A130-I142 WeakPolarHBondContact O-CB 3.14Å; A130-I142 PolarHBondContact O-N 2.84Å; L132-I142 HydrophobicContact CB-CD1 4.38Å; L132-I142 HydrophobicContact CB-CG1 4.41Å; I142-I165 HydrophobicContact CD1-CD1 3.49Å; I142-I165 VanDerWaalsContact CD1-CD1 3.49Å; I142-I165 HydrophobicContact CD1-CG2 4.23Å; I142-I165 HydrophobicContact CG1-CD1 4.34Å; I142-H177 HydrophobicContact CG2-CB 4.41Å; I142-L182 HydrophobicContact CG1-CD2 4.33Å
143	H	83.1	Confident	78.9	Confident	115 Å²	115	69.8 Å²	69.8	53%	0.532	38%	0.376	S	S	.	.			trans	-79.8	136.3	-179.5	-65.6	-56.9	0	0	0	111.1	Q129 I141 H177	Q129-H143 PolarHBondContact OE1-ND1 2.7Å; I141-H143 PolarHBondContact O-N 2.82Å; H143-H177 PolarHBondContact O-NE2 2.84Å
144	D	75.9	Confident	78.2	Confident	13 Å²	13	72 Å²	72	7%	0.07	39%	0.387	C	S	.	.			trans	-93.1	124.6	164.5	-171.8	1.7	0	0	0	107.9	S146 K173	D144-S146 PolarHBondContact O-N 3.06Å; D144-K173 IonicContact OD1-NZ 2.72Å; D144-K173 PolarHBondContact OD1-NZ 3.22Å; D144-K173 IonicContact OD2-NZ 2.72Å; D144-K173 PolarHBondContact OD2-NZ 3.29Å
145	D	67.9	Low	78.1	Confident	107 Å²	107	70.6 Å²	70.6	57%	0.572	38%	0.38	S	S	*	.			trans	-71.2	24.6	177.8	-70.8	-25.7	0	0	0	112.6	E147 L184 K234	D145-E147 PolarHBondContact O-N 3.06Å; D145-L184 HydrophobicContact CB-CD2 4.03Å; D145-K234 IonicContact OD2-NZ 3.61Å
146	S	61.4	Low	78.3	Confident	27 Å²	27	67.7 Å²	67.7	19%	0.189	37%	0.367	C	S	.	.			trans	-70.7	116	-177.4	56.6	0	0	0	0	111.5	D144 N148 G149	D144-S146 PolarHBondContact O-N 3.06Å; S146-N148 PolarHBondContact O-N 3.33Å; S146-G149 PolarHBondContact O-N 3.04Å; S146-G149 PolarHBondContact OG-O 2.72Å
147	E	57.9	Low	78.5	Confident	196 Å²	196	61.4 Å²	61.4	92%	0.916	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-22	174.6	-66.7	-175.6	157	0	0	113.6	D145 G149	D145-E147 PolarHBondContact O-N 3.06Å; E147-G149 PolarHBondContact O-N 3.38Å
148	N	55.5	Low	78.8	Confident	152 Å²	152	60.2 Å²	60.2	81%	0.813	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	24.4	-175	-72.4	-31.2	0	0	0	115.2	S146	S146-N148 PolarHBondContact O-N 3.33Å
149	G	57.7	Low	78.7	Confident	42 Å²	42	54.7 Å²	54.7	43%	0.433	30%	0.296	S	S	.	.			trans	91.6	167.6	175.5	0	0	0	0	0	113.7	S146 E147 E151	S146-G149 PolarHBondContact O-N 3.04Å; S146-G149 PolarHBondContact OG-O 2.72Å; E147-G149 PolarHBondContact O-N 3.38Å; G149-E151 PolarHBondContact O-N 3.43Å
150	V	64.1	Low	78.4	Confident	109 Å²	109	53.5 Å²	53.5	66%	0.661	29%	0.294	S	S	*	.			trans	-69.2	99.4	-173.5	174.7	0	0	0	0	110.3	Q129	Q129-V150 HydrophobicContact CG-CG1 3.62Å
151	E	70.4	Confident	78	Confident	17 Å²	17	56.9 Å²	56.9	8%	0.079	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-76.6	122.4	167.7	-65.8	-168.5	173.5	0	0	108.8	G149 N153 T169 K171 R189	G149-E151 PolarHBondContact O-N 3.43Å; E151-N153 PolarHBondContact O-N 3.03Å; E151-T169 HydrophobicContact CB-CG2 4.17Å; E151-T169 PolarHBondContact OE2-OG1 3.5Å; E151-K171 WeakPolarHBondContact OE1-CD 3.36Å; E151-K171 IonicContact OE1-NZ 3.88Å; E151-K171 PolarHBondContact OE1-NZ 2.64Å; E151-R189 IonicContact OE1-NH2 3.58Å; E151-R189 PolarHBondContact OE1-NH2 2.93Å; E151-R189 VanDerWaalsContact OE1-NH2 3.15Å; E151-R189 IonicContact OE2-NH1 3.15Å; E151-R189 IonicContact OE2-NH2 3.25Å
152	A	70.9	Confident	78	Confident	25 Å²	25	53.1 Å²	53.1	21%	0.207	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-68.3	132	176.7	0	0	0	0	0	110.3
153	N	72.5	Confident	78.1	Confident	3 Å²	3	56 Å²	56	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	128.5	172.2	-68	-26.6	0	0	0	108	Q128 A130 E151	Q128-N153 PolarHBondContact O-N 2.97Å; A130-N153 HydrophobicContact CB-CB 4.23Å; E151-N153 PolarHBondContact O-N 3.03Å
154	I	79.6	Confident	78.6	Confident	48 Å²	48	52.4 Å²	52.4	25%	0.246	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-43.1	174	-55.2	178.1	0	0	0	109.2	G168 V170 C195	I154-G168 PolarHBondContact N-O 3.46Å; I154-V170 HydrophobicContact CD1-CB 3.94Å; I154-V170 HydrophobicContact CD1-CG1 4.38Å; I154-V170 HydrophobicContact CD1-CG2 3.52Å; I154-V170 HydrophobicContact CG1-CB 4.47Å; I154-V170 HydrophobicContact CG1-CG2 3.62Å; I154-C195 WeakPolarHBondContact CD1-SG 3.21Å
155	V	91.9	Very high	79.6	Confident	15 Å²	15	51.8 Å²	51.8	9%	0.091	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.7	-175.3	-65.7	0	0	0	0	110.6	S167 G168 I196 R197 L199	V155-S167 CarbonylContact O-C 3.51Å; V155-S167 VanDerWaalsContact O-CA 3.3Å; V155-S167 WeakPolarHBondContact O-CA 3.21Å; V155-S167 WeakPolarHBondContact O-CB 3.43Å; V155-G168 PolarHBondContact N-O 2.94Å; V155-G168 PolarHBondContact O-N 2.76Å; V155-I196 HydrophobicContact CG2-CG2 3.79Å; V155-R197 VanDerWaalsContact CG1-O 3.24Å; V155-R197 WeakPolarHBondContact CG1-O 3.15Å; V155-L199 HydrophobicContact CB-CB 4.44Å; V155-L199 HydrophobicContact CG2-CB 3.94Å
156	A	94.8	Very high	80.9	Confident	9 Å²	9	46.7 Å²	46.7	7%	0.074	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	149.6	169.8	0	0	0	0	0	110.3	L122 C124 A130 I165 I166	L122-A156 HydrophobicContact CD1-CB 4.27Å; L122-A156 HydrophobicContact CD2-CB 3.72Å; L122-A156 HydrophobicContact CG-CB 4.18Å; C124-A156 WeakPolarHBondContact SG-CB 3.45Å; C124-A156 PolarHBondContact SG-N 2.95Å; C124-A156 VanDerWaalsContact SG-N 3.4Å; A130-A156 HydrophobicContact CB-CB 4.2Å; A156-I165 HydrophobicContact CB-CG2 4.28Å; A156-I166 CarbonylContact C-O 3.59Å; A156-I166 WeakPolarHBondContact CA-O 3.35Å
157	S	94.9	Very high	82.5	Confident	13 Å²	13	45.4 Å²	45.4	9%	0.091	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	148.4	176.7	-166.8	0	0	0	0	110.6	Q112 I166 L199	Q112-S157 PolarHBondContact OE1-OG 2.74Å; S157-I166 PolarHBondContact N-O 2.72Å; S157-I166 PolarHBondContact O-N 2.71Å; S157-L199 VanDerWaalsContact CB-CD2 3.49Å
158	F	94.6	Very high	84.2	Confident	1 Å²	1	36.1 Å²	36.1	0%	0.004	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	147.3	164.4	-67.2	-72.3	0	0	0	110.5	Q112 N114 P115 L122 L132 Y164 I165 V179 V201	Q112-F158 HydrophobicContact CB-CD2 4.22Å; Q112-F158 HydrophobicContact CG-CD2 4.06Å; N114-F158 HydrophobicContact CB-CD2 4.35Å; N114-F158 HydrophobicContact CB-CE1 4.3Å; N114-F158 HydrophobicContact CB-CE2 3.84Å; N114-F158 HydrophobicContact CB-CZ 3.81Å; P115-F158 HydrophobicContact CG-CB 4.29Å; L122-F158 HydrophobicContact CB-CD2 4.1Å; L122-F158 HydrophobicContact CB-CE1 4.49Å; L122-F158 HydrophobicContact CB-CE2 3.37Å; L122-F158 HydrophobicContact CB-CZ 3.61Å; L122-F158 HydrophobicContact CD2-CD2 4.33Å; L122-F158 HydrophobicContact CD2-CE2 4.32Å; L132-F158 HydrophobicContact CD1-CE1 3.98Å; L132-F158 HydrophobicContact CD1-CZ 3.64Å; F158-Y164 WeakPolarHBondContact CA-O 3.4Å; F158-I165 HydrophobicContact CD1-CG1 4.07Å; F158-I165 HydrophobicContact CE1-CD1 4.21Å; F158-I165 HydrophobicContact CE1-CG1 4.01Å; F158-V179 HydrophobicContact CD1-CG2 3.84Å; F158-V179 HydrophobicContact CE1-CG1 4.26Å; F158-V179 HydrophobicContact CE1-CG2 3.86Å; F158-V201 WeakPolarHBondContact O-CG2 3.13Å
159	D	92	Very high	85.9	Confident	7 Å²	7	28.9 Å²	28.9	4%	0.037	16%	0.158	C	C	.	.			trans	-64.4	172.7	164.6	84.7	-61.7	0	0	0	111.2	R161 G162 D163 Y164 L226	D159-R161 PolarHBondContact O-N 3.48Å; D159-R161 VanDerWaalsContact O-N 3.11Å; D159-R161 PolarHBondContact OD2-N 2.73Å; D159-G162 PolarHBondContact O-N 3.35Å; D159-G162 VanDerWaalsContact O-N 3.11Å; D159-G162 VanDerWaalsContact OD1-CA 3.3Å; D159-G162 WeakPolarHBondContact OD1-CA 3.12Å; D159-G162 PolarHBondContact OD1-N 2.88Å; D159-D163 PolarHBondContact OD1-N 3.3Å; D159-Y164 HydrophobicContact CB-CD2 4.46Å; D159-Y164 PolarHBondContact N-O 2.89Å; D159-Y164 PolarHBondContact OD1-N 2.82Å; D159-L226 HydrophobicContact CB-CD2 3.66Å
160	K	85.6	Confident	87.4	Confident	86 Å²	86	30 Å²	30	37%	0.374	16%	0.156	S	C	.	.	S	Bend	trans	-54.3	-34.7	-178.2	176.1	176.5	173.7	172.1	0	113.1	V201 R203 G205	K160-V201 HydrophobicContact CB-CG1 4.47Å; K160-R203 WeakPolarHBondContact CD-O 3.27Å; K160-R203 WeakPolarHBondContact CE-O 3.22Å; K160-R203 PolarHBondContact NZ-O 3.05Å; K160-R203 VanDerWaalsContact NZ-O 3.08Å; K160-G205 PolarHBondContact NZ-O 2.88Å; K160-G205 VanDerWaalsContact NZ-O 3.14Å
161	R	86.6	Confident	88.6	Confident	128 Å²	128	30.3 Å²	30.3	48%	0.483	15%	0.148	S	C	.	.	S	Bend	trans	-92.3	-18.7	-178.8	-71.2	-174.9	142.6	-176.4	-8.7	113.7	R116 D159 D163	R116-R161 WeakPolarHBondContact CG-O 3.32Å; D159-R161 PolarHBondContact O-N 3.48Å; D159-R161 VanDerWaalsContact O-N 3.11Å; D159-R161 PolarHBondContact OD2-N 2.73Å; R161-D163 VanDerWaalsContact C-N 3.35Å; R161-D163 VanDerWaalsContact CB-OD2 3.3Å; R161-D163 WeakPolarHBondContact CB-OD2 3.45Å
162	G	90.9	Very high	89.6	Confident	3 Å²	3	29.5 Å²	29.5	3%	0.031	14%	0.144	C	C	.	.	S	Bend	trans	78.9	22.9	-175.3	0	0	0	0	0	113	N114 D159 V179	N114-G162 PolarHBondContact ND2-O 2.87Å; D159-G162 PolarHBondContact O-N 3.35Å; D159-G162 VanDerWaalsContact O-N 3.11Å; D159-G162 VanDerWaalsContact OD1-CA 3.3Å; D159-G162 WeakPolarHBondContact OD1-CA 3.12Å; D159-G162 PolarHBondContact OD1-N 2.88Å; G162-V179 WeakPolarHBondContact O-CG2 3.47Å
163	D	91.5	Very high	90.6	Very high	61 Å²	61	28.6 Å²	28.6	33%	0.326	14%	0.136	S	C	.	.	S	Bend	trans	-89.5	-29.5	176.1	-62.7	-32.2	0	0	0	111	D159 R161 V179	D159-D163 PolarHBondContact OD1-N 3.3Å; R161-D163 VanDerWaalsContact C-N 3.35Å; R161-D163 VanDerWaalsContact CB-OD2 3.3Å; R161-D163 WeakPolarHBondContact CB-OD2 3.45Å; D163-V179 VanDerWaalsContact C-CG2 3.43Å; D163-V179 WeakPolarHBondContact O-CB 3.32Å; D163-V179 WeakPolarHBondContact O-CG2 3.43Å; D163-V179 PolarHBondContact O-N 3.31Å
164	Y	95	Very high	91.6	Very high	38 Å²	38	28.4 Å²	28.4	15%	0.149	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.3	-177.5	-50.5	-73	0	0	0	112.7	F158 D159 I176 H177 L185 L226 R230	F158-Y164 WeakPolarHBondContact CA-O 3.4Å; D159-Y164 HydrophobicContact CB-CD2 4.46Å; D159-Y164 PolarHBondContact N-O 2.89Å; D159-Y164 PolarHBondContact OD1-N 2.82Å; Y164-I176 HydrophobicContact CD1-CG2 4.45Å; Y164-I176 HydrophobicContact CG-CG2 4.45Å; Y164-H177 CarbonylContact C-O 3.59Å; Y164-H177 WeakPolarHBondContact CA-O 3.37Å; Y164-L185 HydrophobicContact CD1-CD1 3.68Å; Y164-L185 HydrophobicContact CE1-CD1 3.57Å; Y164-L226 HydrophobicContact CD2-CD2 4.04Å; Y164-R230 VanDerWaalsContact CZ-NH2 3.33Å; Y164-R230 PolarHBondContact OH-NH1 2.99Å; Y164-R230 PolarHBondContact OH-NH2 3.49Å
165	I	95.7	Very high	92.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.4	170.9	-52.3	179.5	0	0	0	108.2	L122 L132 I142 A156 F158 I176 H177 V179 L182	L122-I165 HydrophobicContact CD1-CD1 4.35Å; L122-I165 HydrophobicContact CD1-CG2 4.09Å; L122-I165 HydrophobicContact CD2-CG2 3.79Å; L132-I165 HydrophobicContact CD1-CD1 4.19Å; I142-I165 HydrophobicContact CD1-CD1 3.49Å; I142-I165 VanDerWaalsContact CD1-CD1 3.49Å; I142-I165 HydrophobicContact CD1-CG2 4.23Å; I142-I165 HydrophobicContact CG1-CD1 4.34Å; A156-I165 HydrophobicContact CB-CG2 4.28Å; F158-I165 HydrophobicContact CD1-CG1 4.07Å; F158-I165 HydrophobicContact CE1-CD1 4.21Å; F158-I165 HydrophobicContact CE1-CG1 4.01Å; I165-I176 CarbonylContact O-C 3.56Å; I165-I176 WeakPolarHBondContact O-CA 3.31Å; I165-H177 HydrophobicContact CB-CB 4.37Å; I165-H177 PolarHBondContact N-O 2.89Å; I165-H177 PolarHBondContact O-N 3.27Å; I165-V179 HydrophobicContact CD1-CG2 4.11Å; I165-V179 HydrophobicContact CG1-CG2 3.49Å; I165-V179 VanDerWaalsContact CG1-CG2 3.49Å; I165-L182 HydrophobicContact CD1-CD2 4.32Å
166	I	95.4	Very high	92.4	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.7	174.6	-44.8	178.9	0	0	0	107.1	A156 S157 V174 T175 I176 L199 V201 F212 L226	A156-I166 CarbonylContact C-O 3.59Å; A156-I166 WeakPolarHBondContact CA-O 3.35Å; S157-I166 PolarHBondContact N-O 2.72Å; S157-I166 PolarHBondContact O-N 2.71Å; I166-V174 HydrophobicContact CG2-CG1 4Å; I166-T175 WeakPolarHBondContact CA-O 3.4Å; I166-I176 HydrophobicContact CB-CD1 4.18Å; I166-I176 HydrophobicContact CG1-CD1 4.01Å; I166-I176 HydrophobicContact CG2-CD1 3.67Å; I166-L199 HydrophobicContact CB-CD1 4.14Å; I166-L199 HydrophobicContact CB-CD2 4.12Å; I166-L199 HydrophobicContact CG2-CD1 3.52Å; I166-L199 HydrophobicContact CG2-CD2 4.19Å; I166-L199 HydrophobicContact CG2-CG 4.42Å; I166-V201 HydrophobicContact CD1-CG2 3.98Å; I166-F212 HydrophobicContact CD1-CB 3.99Å; I166-F212 HydrophobicContact CD1-CD1 3.91Å; I166-F212 HydrophobicContact CD1-CD2 4.43Å; I166-F212 HydrophobicContact CD1-CE1 4.49Å; I166-F212 HydrophobicContact CD1-CG 3.86Å; I166-F212 HydrophobicContact CG2-CD2 4.14Å; I166-F212 HydrophobicContact CG2-CE2 4.04Å; I166-F212 HydrophobicContact CG2-CZ 4.37Å; I166-L226 HydrophobicContact CD1-CD1 3.91Å; I166-L226 HydrophobicContact CD1-CD2 4.33Å; I166-L226 HydrophobicContact CG1-CD1 4.14Å
167	S	94.4	Very high	92.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.2	177.1	49.5	0	0	0	0	112.8	V155 V174 T175	V155-S167 CarbonylContact O-C 3.51Å; V155-S167 VanDerWaalsContact O-CA 3.3Å; V155-S167 WeakPolarHBondContact O-CA 3.21Å; V155-S167 WeakPolarHBondContact O-CB 3.43Å; S167-V174 VanDerWaalsContact O-CA 3.3Å; S167-V174 WeakPolarHBondContact O-CA 3.1Å; S167-T175 PolarHBondContact N-O 3.19Å; S167-T175 PolarHBondContact O-N 3.16Å; S167-T175 PolarHBondContact OG-OG1 3.02Å
168	G	93.2	Very high	92.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.6	-179.2	0	0	0	0	0	112.2	I154 V155 K173	I154-G168 PolarHBondContact N-O 3.46Å; V155-G168 PolarHBondContact N-O 2.94Å; V155-G168 PolarHBondContact O-N 2.76Å; G168-K173 WeakPolarHBondContact CA-O 3.31Å
169	T	91.2	Very high	92.5	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	167.3	-179.1	79.2	0	0	0	0	113.3	E151 K171 G172 K173 I196	E151-T169 HydrophobicContact CB-CG2 4.17Å; E151-T169 PolarHBondContact OE2-OG1 3.5Å; T169-K171 PolarHBondContact O-N 2.8Å; T169-K171 VanDerWaalsContact O-N 3.14Å; T169-K171 PolarHBondContact OG1-N 3.01Å; T169-G172 PolarHBondContact O-N 2.79Å; T169-G172 VanDerWaalsContact O-N 3.11Å; T169-K173 HydrophobicContact CG2-CB 4.05Å; T169-K173 PolarHBondContact N-O 2.93Å; T169-K173 WeakPolarHBondContact OG1-CB 2.96Å; T169-K173 PolarHBondContact OG1-N 3.01Å; T169-I196 PolarHBondContact O-N 3.39Å
170	V	89.5	Confident	92.5	Very high	64 Å²	64	30.6 Å²	30.6	39%	0.388	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.9	173.8	-167.9	0	0	0	0	112.7	I154 C195	I154-V170 HydrophobicContact CD1-CB 3.94Å; I154-V170 HydrophobicContact CD1-CG1 4.38Å; I154-V170 HydrophobicContact CD1-CG2 3.52Å; I154-V170 HydrophobicContact CG1-CB 4.47Å; I154-V170 HydrophobicContact CG1-CG2 3.62Å; V170-C195 HydrophobicContact CG1-CB 4.31Å; V170-C195 WeakPolarHBondContact O-CA 3.17Å; V170-C195 VanDerWaalsContact O-CB 3.23Å; V170-C195 WeakPolarHBondContact O-CB 3.15Å; V170-C195 PolarHBondContact O-N 2.82Å
171	K	89.3	Confident	92.9	Very high	116 Å²	116	30.4 Å²	30.4	50%	0.504	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	18.5	-178.8	-59.5	-176.4	-170.5	164	0	112.8	E151 T169 K173 R189 G193	E151-K171 WeakPolarHBondContact OE1-CD 3.36Å; E151-K171 IonicContact OE1-NZ 3.88Å; E151-K171 PolarHBondContact OE1-NZ 2.64Å; T169-K171 PolarHBondContact O-N 2.8Å; T169-K171 VanDerWaalsContact O-N 3.14Å; T169-K171 PolarHBondContact OG1-N 3.01Å; K171-K173 VanDerWaalsContact C-N 3.3Å; K171-K173 PolarHBondContact O-N 3.22Å; K171-R189 PolarHBondContact O-NH1 3.12Å; K171-G193 CarbonylContact C-O 3.5Å; K171-G193 WeakPolarHBondContact CA-O 3.2Å; K171-G193 CarbonylContact O-C 3.37Å; K171-G193 VanDerWaalsContact O-CA 3.22Å; K171-G193 WeakPolarHBondContact O-CA 3.34Å; K171-G193 VanDerWaalsContact O-O 3.14Å
172	G	91.1	Very high	93.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	71.9	19.8	176	0	0	0	0	0	114.8	T169 Q190 Y194	T169-G172 PolarHBondContact O-N 2.79Å; T169-G172 VanDerWaalsContact O-N 3.11Å; G172-Q190 WeakPolarHBondContact O-CG 3.21Å; G172-Q190 PolarHBondContact O-N 2.94Å; G172-Y194 WeakPolarHBondContact CA-O 3.38Å; G172-Y194 PolarHBondContact N-O 3.03Å
173	K	92.4	Very high	93.2	Very high	6 Å²	6	32.2 Å²	32.2	3%	0.026	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	132.3	171	-168.8	-175.8	175.8	-168.1	0	108.6	D144 G168 T169 K171 T175 Y187 F188	D144-K173 IonicContact OD1-NZ 2.72Å; D144-K173 PolarHBondContact OD1-NZ 3.22Å; D144-K173 IonicContact OD2-NZ 2.72Å; D144-K173 PolarHBondContact OD2-NZ 3.29Å; G168-K173 WeakPolarHBondContact CA-O 3.31Å; T169-K173 HydrophobicContact CG2-CB 4.05Å; T169-K173 PolarHBondContact N-O 2.93Å; T169-K173 WeakPolarHBondContact OG1-CB 2.96Å; T169-K173 PolarHBondContact OG1-N 3.01Å; K171-K173 VanDerWaalsContact C-N 3.3Å; K171-K173 PolarHBondContact O-N 3.22Å; K173-T175 HydrophobicContact CD-CG2 4.07Å; K173-T175 HydrophobicContact CG-CG2 4.17Å; K173-Y187 HydrophobicContact CD-CD2 4.4Å; K173-Y187 HydrophobicContact CG-CD2 4.41Å; K173-F188 WeakPolarHBondContact CA-O 3.3Å
174	V	94.1	Very high	93.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.8	171.2	180	0	0	0	0	107.9	I166 S167 I176 Y187 F188 Q190 I196 F212 T214	I166-V174 HydrophobicContact CG2-CG1 4Å; S167-V174 VanDerWaalsContact O-CA 3.3Å; S167-V174 WeakPolarHBondContact O-CA 3.1Å; V174-I176 HydrophobicContact CG1-CD1 4.35Å; V174-Y187 WeakPolarHBondContact O-CA 3.37Å; V174-Y187 WeakPolarHBondContact O-CB 3.46Å; V174-F188 HydrophobicContact CB-CD1 4.06Å; V174-F188 HydrophobicContact CB-CE1 3.57Å; V174-F188 HydrophobicContact CB-CE2 4.19Å; V174-F188 HydrophobicContact CB-CZ 3.65Å; V174-F188 HydrophobicContact CG1-CD1 4.44Å; V174-F188 HydrophobicContact CG1-CE1 3.66Å; V174-F188 HydrophobicContact CG1-CZ 3.95Å; V174-F188 HydrophobicContact CG2-CE1 4.2Å; V174-F188 HydrophobicContact CG2-CE2 4.06Å; V174-F188 HydrophobicContact CG2-CZ 3.74Å; V174-F188 PolarHBondContact N-O 2.51Å; V174-F188 PolarHBondContact O-N 3.45Å; V174-Q190 HydrophobicContact CG2-CG 4.31Å; V174-I196 HydrophobicContact CG2-CD1 3.55Å; V174-F212 HydrophobicContact CG1-CE2 4.09Å; V174-F212 HydrophobicContact CG1-CZ 4.17Å; V174-T214 HydrophobicContact CG2-CG2 4.29Å
175	T	93.9	Very high	93.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.8	-178.4	51.9	0	0	0	0	110.8	I166 S167 K173 H177 L184	I166-T175 WeakPolarHBondContact CA-O 3.4Å; S167-T175 PolarHBondContact N-O 3.19Å; S167-T175 PolarHBondContact O-N 3.16Å; S167-T175 PolarHBondContact OG-OG1 3.02Å; K173-T175 HydrophobicContact CD-CG2 4.07Å; K173-T175 HydrophobicContact CG-CG2 4.17Å; T175-H177 PolarHBondContact OG1-CE1 2.82Å; T175-L184 HydrophobicContact CG2-CD1 4.02Å
176	I	95.2	Very high	93.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.1	178.6	-46	-57.2	0	0	0	108.7	Y164 I165 I166 V174 L185 A186 L226 V229 R230	Y164-I176 HydrophobicContact CD1-CG2 4.45Å; Y164-I176 HydrophobicContact CG-CG2 4.45Å; I165-I176 CarbonylContact O-C 3.56Å; I165-I176 WeakPolarHBondContact O-CA 3.31Å; I166-I176 HydrophobicContact CB-CD1 4.18Å; I166-I176 HydrophobicContact CG1-CD1 4.01Å; I166-I176 HydrophobicContact CG2-CD1 3.67Å; V174-I176 HydrophobicContact CG1-CD1 4.35Å; I176-L185 PolarHBondContact O-N 2.77Å; I176-A186 HydrophobicContact CB-CB 4.27Å; I176-A186 HydrophobicContact CG1-CB 4.22Å; I176-A186 PolarHBondContact N-O 3.26Å; I176-A186 PolarHBondContact O-N 3.06Å; I176-L226 HydrophobicContact CD1-CD1 3.66Å; I176-L226 HydrophobicContact CG1-CD1 4.15Å; I176-L226 HydrophobicContact CG2-CD1 3.94Å; I176-V229 HydrophobicContact CD1-CG1 4.25Å; I176-V229 HydrophobicContact CG1-CG1 3.72Å; I176-R230 HydrophobicContact CG2-CG 4.09Å
177	H	94.8	Very high	93	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148.9	176.7	-56.5	82.4	0	0	0	110.6	I142 H143 Y164 I165 T175 Q183 L184	I142-H177 HydrophobicContact CG2-CB 4.41Å; H143-H177 PolarHBondContact O-NE2 2.84Å; Y164-H177 CarbonylContact C-O 3.59Å; Y164-H177 WeakPolarHBondContact CA-O 3.37Å; I165-H177 HydrophobicContact CB-CB 4.37Å; I165-H177 PolarHBondContact N-O 2.89Å; I165-H177 PolarHBondContact O-N 3.27Å; T175-H177 PolarHBondContact OG1-CE1 2.82Å; H177-Q183 VanDerWaalsContact CA-O 3.27Å; H177-Q183 WeakPolarHBondContact CA-O 3.39Å; H177-L184 WeakPolarHBondContact NE2-CD1 3.46Å
178	D	94.7	Very high	92.9	Very high	28 Å²	28	33.5 Å²	33.5	15%	0.15	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	134	167.7	179.4	-93.5	0	0	0	110.3	N180 T181 L182 Q183 L185	D178-N180 VanDerWaalsContact C-N 3.35Å; D178-N180 PolarHBondContact O-N 2.88Å; D178-N180 WeakPolarHBondContact OD1-CA 3.3Å; D178-N180 WeakPolarHBondContact OD1-CB 3.48Å; D178-N180 PolarHBondContact OD1-N 2.94Å; D178-T181 VanDerWaalsContact CB-OG1 3.31Å; D178-T181 WeakPolarHBondContact CB-OG1 3.39Å; D178-T181 PolarHBondContact OD1-N 3.23Å; D178-T181 PolarHBondContact OD1-OG1 2.99Å; D178-L182 WeakPolarHBondContact O-CA 3.47Å; D178-L182 PolarHBondContact O-N 3.37Å; D178-Q183 PolarHBondContact N-O 3.16Å; D178-L185 HydrophobicContact CB-CD1 4.02Å; D178-L185 HydrophobicContact CB-CD2 4.39Å; D178-L185 HydrophobicContact CB-CG 4.22Å
179	V	95.1	Very high	92.9	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-30.9	-175.8	170.3	0	0	0	0	112.6	Q120 F158 G162 D163 I165	Q120-V179 VanDerWaalsContact OE1-CG1 3.28Å; F158-V179 HydrophobicContact CD1-CG2 3.84Å; F158-V179 HydrophobicContact CE1-CG1 4.26Å; F158-V179 HydrophobicContact CE1-CG2 3.86Å; G162-V179 WeakPolarHBondContact O-CG2 3.47Å; D163-V179 VanDerWaalsContact C-CG2 3.43Å; D163-V179 WeakPolarHBondContact O-CB 3.32Å; D163-V179 WeakPolarHBondContact O-CG2 3.43Å; D163-V179 PolarHBondContact O-N 3.31Å; I165-V179 HydrophobicContact CD1-CG2 4.11Å; I165-V179 HydrophobicContact CG1-CG2 3.49Å; I165-V179 VanDerWaalsContact CG1-CG2 3.49Å
180	N	92.5	Very high	92.9	Very high	108 Å²	108	39 Å²	39	58%	0.578	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-43.4	-174.3	-61.6	-51.7	0	0	0	111.7	K117 D178	K117-N180 PolarHBondContact NZ-OD1 2.84Å; D178-N180 VanDerWaalsContact C-N 3.35Å; D178-N180 PolarHBondContact O-N 2.88Å; D178-N180 WeakPolarHBondContact OD1-CA 3.3Å; D178-N180 WeakPolarHBondContact OD1-CB 3.48Å; D178-N180 PolarHBondContact OD1-N 2.94Å
181	T	93.6	Very high	92.8	Very high	81 Å²	81	38.8 Å²	38.8	50%	0.497	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-16.8	-175.9	62.7	0	0	0	0	113	D178 Q183	D178-T181 VanDerWaalsContact CB-OG1 3.31Å; D178-T181 WeakPolarHBondContact CB-OG1 3.39Å; D178-T181 PolarHBondContact OD1-N 3.23Å; D178-T181 PolarHBondContact OD1-OG1 2.99Å; T181-Q183 PolarHBondContact O-N 3.04Å; T181-Q183 VanDerWaalsContact O-N 3.13Å; T181-Q183 PolarHBondContact OG1-N 2.9Å
182	L	92	Very high	92.7	Very high	41 Å²	41	36.3 Å²	36.3	22%	0.215	20%	0.199	C	C	.	.			trans	57.4	17	-172.8	-55.9	172.9	0	0	0	114.2	L132 T140 I142 I165 D178	L132-L182 HydrophobicContact CD2-CD2 3.6Å; T140-L182 HydrophobicContact CG2-CD1 3.37Å; I142-L182 HydrophobicContact CG1-CD2 4.33Å; I165-L182 HydrophobicContact CD1-CD2 4.32Å; D178-L182 WeakPolarHBondContact O-CA 3.47Å; D178-L182 PolarHBondContact O-N 3.37Å
183	Q	92.7	Very high	92.6	Very high	128 Å²	128	37.5 Å²	37.5	60%	0.598	21%	0.21	S	C	*	.			trans	-75.9	138.1	177.4	-69.3	-173.9	-7.2	0	0	111	H177 D178 T181 L185	H177-Q183 VanDerWaalsContact CA-O 3.27Å; H177-Q183 WeakPolarHBondContact CA-O 3.39Å; D178-Q183 PolarHBondContact N-O 3.16Å; T181-Q183 PolarHBondContact O-N 3.04Å; T181-Q183 VanDerWaalsContact O-N 3.13Å; T181-Q183 PolarHBondContact OG1-N 2.9Å; Q183-L185 PolarHBondContact O-N 3.31Å
184	L	92.7	Very high	92.5	Very high	11 Å²	11	42.4 Å²	42.4	6%	0.058	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	113	169.7	178.9	67.3	0	0	0	109.5	D145 T175 H177 A186 Y187 K234	D145-L184 HydrophobicContact CB-CD2 4.03Å; T175-L184 HydrophobicContact CG2-CD1 4.02Å; H177-L184 WeakPolarHBondContact NE2-CD1 3.46Å; L184-A186 WeakPolarHBondContact CD1-O 3.37Å; L184-Y187 HydrophobicContact CD2-CD1 3.92Å; L184-K234 WeakPolarHBondContact O-CE 3.22Å; L184-K234 PolarHBondContact O-NZ 2.56Å; L184-K234 VanDerWaalsContact O-NZ 3.15Å
185	L	93.2	Very high	92.4	Very high	62 Å²	62	43.4 Å²	43.4	33%	0.325	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-45.5	-179.6	-61.9	-178.5	0	0	0	112.1	Y164 I176 D178 Q183	Y164-L185 HydrophobicContact CD1-CD1 3.68Å; Y164-L185 HydrophobicContact CE1-CD1 3.57Å; I176-L185 PolarHBondContact O-N 2.77Å; D178-L185 HydrophobicContact CB-CD1 4.02Å; D178-L185 HydrophobicContact CB-CD2 4.39Å; D178-L185 HydrophobicContact CB-CG 4.22Å; Q183-L185 PolarHBondContact O-N 3.31Å
186	A	93.8	Very high	92.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	152.2	-175.7	0	0	0	0	0	110.8	I176 L184 V229 G233	I176-A186 HydrophobicContact CB-CB 4.27Å; I176-A186 HydrophobicContact CG1-CB 4.22Å; I176-A186 PolarHBondContact N-O 3.26Å; I176-A186 PolarHBondContact O-N 3.06Å; L184-A186 WeakPolarHBondContact CD1-O 3.37Å; A186-V229 HydrophobicContact CB-CG1 4.27Å; A186-G233 WeakPolarHBondContact CB-O 3.46Å
187	Y	93.2	Very high	92.1	Very high	54 Å²	54	47.2 Å²	47.2	21%	0.212	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	154.5	168.4	75.4	-95.5	0	0	0	111	K173 V174 L184 G233 K234 D235 S236	K173-Y187 HydrophobicContact CD-CD2 4.4Å; K173-Y187 HydrophobicContact CG-CD2 4.41Å; V174-Y187 WeakPolarHBondContact O-CA 3.37Å; V174-Y187 WeakPolarHBondContact O-CB 3.46Å; L184-Y187 HydrophobicContact CD2-CD1 3.92Å; Y187-G233 PolarHBondContact N-O 3.33Å; Y187-K234 HydrophobicContact CD1-CB 3.87Å; Y187-K234 HydrophobicContact CD1-CG 4.06Å; Y187-K234 HydrophobicContact CE1-CB 3.7Å; Y187-K234 HydrophobicContact CE1-CD 4.5Å; Y187-K234 HydrophobicContact CE1-CG 4.22Å; Y187-D235 HydrophobicContact CE1-CB 4.3Å; Y187-D235 HydrophobicContact CE2-CB 3.74Å; Y187-D235 VanDerWaalsContact CE2-OD1 3.27Å; Y187-D235 WeakPolarHBondContact CE2-OD1 2.99Å; Y187-D235 PolarHBondContact O-N 2.92Å; Y187-D235 VanDerWaalsContact OH-CB 3.26Å; Y187-D235 WeakPolarHBondContact OH-CB 3.19Å; Y187-S236 PolarHBondContact O-N 3.32Å
188	F	93.4	Very high	91.8	Very high	1 Å²	1	48.7 Å²	48.7	0%	0.004	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	161.6	171	66.5	-83.7	0	0	0	109.8	K173 V174 Q190 F212 Y224 V229 S236 V238	K173-F188 WeakPolarHBondContact CA-O 3.3Å; V174-F188 HydrophobicContact CB-CD1 4.06Å; V174-F188 HydrophobicContact CB-CE1 3.57Å; V174-F188 HydrophobicContact CB-CE2 4.19Å; V174-F188 HydrophobicContact CB-CZ 3.65Å; V174-F188 HydrophobicContact CG1-CD1 4.44Å; V174-F188 HydrophobicContact CG1-CE1 3.66Å; V174-F188 HydrophobicContact CG1-CZ 3.95Å; V174-F188 HydrophobicContact CG2-CE1 4.2Å; V174-F188 HydrophobicContact CG2-CE2 4.06Å; V174-F188 HydrophobicContact CG2-CZ 3.74Å; V174-F188 PolarHBondContact N-O 2.51Å; V174-F188 PolarHBondContact O-N 3.45Å; F188-Q190 HydrophobicContact CE2-CG 4.13Å; F188-F212 HydrophobicContact CE1-CZ 4.36Å; F188-F212 HydrophobicContact CZ-CZ 4.38Å; F188-Y224 HydrophobicContact CE2-CD1 4.21Å; F188-Y224 AromaticContact CE2-CE1 3.55Å; F188-Y224 HydrophobicContact CE2-CE1 3.55Å; F188-Y224 HydrophobicContact CE2-CE2 4.33Å; F188-Y224 AromaticContact CE2-CZ 3.62Å; F188-Y224 AromaticContact CZ-CD1 3.84Å; F188-Y224 HydrophobicContact CZ-CD1 3.84Å; F188-Y224 HydrophobicContact CZ-CD2 4.29Å; F188-Y224 AromaticContact CZ-CE1 3.64Å; F188-Y224 HydrophobicContact CZ-CE1 3.64Å; F188-Y224 HydrophobicContact CZ-CE2 4.11Å; F188-Y224 HydrophobicContact CZ-CG 4.15Å; F188-Y224 AromaticContact CZ-CZ 3.77Å; F188-V229 HydrophobicContact CD1-CG1 3.77Å; F188-V229 HydrophobicContact CD1-CG2 4.31Å; F188-V229 HydrophobicContact CE1-CB 4.43Å; F188-V229 HydrophobicContact CE1-CG1 3.74Å; F188-V229 HydrophobicContact CE1-CG2 3.72Å; F188-V229 HydrophobicContact CZ-CG2 4.43Å; F188-S236 WeakPolarHBondContact CB-O 3.5Å; F188-V238 HydrophobicContact CB-CB 4.28Å; F188-V238 HydrophobicContact CB-CG2 3.86Å; F188-V238 HydrophobicContact CD1-CB 4.13Å; F188-V238 HydrophobicContact CD1-CG2 3.78Å; F188-V238 HydrophobicContact CD2-CB 3.92Å; F188-V238 HydrophobicContact CD2-CG2 4.33Å; F188-V238 HydrophobicContact CE1-CB 4.42Å; F188-V238 HydrophobicContact CE1-CG2 4.37Å; F188-V238 HydrophobicContact CE2-CB 4.22Å; F188-V238 HydrophobicContact CG-CB 3.86Å; F188-V238 HydrophobicContact CG-CG2 3.74Å; F188-V238 HydrophobicContact CZ-CB 4.46Å
189	R	92.2	Very high	91.7	Very high	113 Å²	113	48.5 Å²	48.5	43%	0.426	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.2	172.5	-165.1	175.5	-69.7	-86.9	5.5	109.5	E151 K171	E151-R189 IonicContact OE1-NH2 3.58Å; E151-R189 PolarHBondContact OE1-NH2 2.93Å; E151-R189 VanDerWaalsContact OE1-NH2 3.15Å; E151-R189 IonicContact OE2-NH1 3.15Å; E151-R189 IonicContact OE2-NH2 3.25Å; K171-R189 PolarHBondContact O-NH1 3.12Å
190	Q	92	Very high	91.4	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.019	27%	0.268	C	S	.	.			trans	-63.4	145.9	176.6	-63.4	-165.6	-17.2	0	0	110.9	G172 V174 F188 G192 G193 T214 S216 Y224	G172-Q190 WeakPolarHBondContact O-CG 3.21Å; G172-Q190 PolarHBondContact O-N 2.94Å; V174-Q190 HydrophobicContact CG2-CG 4.31Å; F188-Q190 HydrophobicContact CE2-CG 4.13Å; Q190-G192 PolarHBondContact O-N 2.77Å; Q190-G193 PolarHBondContact O-N 2.84Å; Q190-T214 PolarHBondContact NE2-OG1 2.87Å; Q190-S216 PolarHBondContact OE1-OG 2.7Å; Q190-Y224 PolarHBondContact NE2-OH 3.23Å; Q190-Y224 VanDerWaalsContact NE2-OH 3.12Å
191	P	87.1	Confident	91.2	Very high	58 Å²	58	45.9 Å²	45.9	38%	0.377	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	127.5	173.1	-25.1	33.7	0	0	0	111.2	G193	P191-G193 VanDerWaalsContact C-N 3.34Å
192	G	87.1	Confident	90.7	Very high	65 Å²	65	42.6 Å²	42.6	67%	0.67	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.5	-16.6	-177.6	0	0	0	0	0	115.3	Q190 Y194	Q190-G192 PolarHBondContact O-N 2.77Å; G192-Y194 VanDerWaalsContact C-N 3.29Å; G192-Y194 PolarHBondContact O-N 3.31Å
193	G	88.7	Confident	89.8	Confident	24 Å²	24	48.4 Å²	48.4	25%	0.247	25%	0.246	C	C	.	.			trans	65	30	177.4	0	0	0	0	0	114.3	K171 Q190 P191	K171-G193 CarbonylContact C-O 3.5Å; K171-G193 WeakPolarHBondContact CA-O 3.2Å; K171-G193 CarbonylContact O-C 3.37Å; K171-G193 VanDerWaalsContact O-CA 3.22Å; K171-G193 WeakPolarHBondContact O-CA 3.34Å; K171-G193 VanDerWaalsContact O-O 3.14Å; Q190-G193 PolarHBondContact O-N 2.84Å; P191-G193 VanDerWaalsContact C-N 3.34Å
194	Y	91.7	Very high	88.6	Confident	109 Å²	109	45.2 Å²	45.2	43%	0.427	23%	0.228	S	C	.	.			trans	-71.2	143.7	179.8	-59.6	-71.5	0	0	0	112.1	G172 G192 I196 D218	G172-Y194 WeakPolarHBondContact CA-O 3.38Å; G172-Y194 PolarHBondContact N-O 3.03Å; G192-Y194 VanDerWaalsContact C-N 3.29Å; G192-Y194 PolarHBondContact O-N 3.31Å; Y194-I196 PolarHBondContact O-N 3.41Å; Y194-D218 HydrophobicContact CD1-CB 4.09Å; Y194-D218 HydrophobicContact CD2-CB 3.6Å; Y194-D218 VanDerWaalsContact CD2-CG 3.48Å; Y194-D218 VanDerWaalsContact CD2-OD2 3.27Å; Y194-D218 WeakPolarHBondContact CD2-OD2 3.43Å; Y194-D218 HydrophobicContact CE1-CB 4.2Å; Y194-D218 HydrophobicContact CE2-CB 3.71Å; Y194-D218 HydrophobicContact CG-CB 3.8Å
195	C	92	Very high	87	Confident	21 Å²	21	46.4 Å²	46.4	14%	0.142	24%	0.242	C	C	.	.			trans	-53.1	128	174.8	173.7	0	0	0	0	112.2	I154 V170 S216 N217	I154-C195 WeakPolarHBondContact CD1-SG 3.21Å; V170-C195 HydrophobicContact CG1-CB 4.31Å; V170-C195 WeakPolarHBondContact O-CA 3.17Å; V170-C195 VanDerWaalsContact O-CB 3.23Å; V170-C195 WeakPolarHBondContact O-CB 3.15Å; V170-C195 PolarHBondContact O-N 2.82Å; C195-S216 CarbonylContact O-C 3.57Å; C195-S216 WeakPolarHBondContact O-CA 3.29Å; C195-N217 HydrophobicContact CB-CB 4.2Å; C195-N217 PolarHBondContact O-N 2.97Å
196	I	92.8	Very high	85.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	113.1	174.4	-61.6	160.4	0	0	0	108.2	V155 T169 V174 Y194 S198 T214 N215	V155-I196 HydrophobicContact CG2-CG2 3.79Å; T169-I196 PolarHBondContact O-N 3.39Å; V174-I196 HydrophobicContact CG2-CD1 3.55Å; Y194-I196 PolarHBondContact O-N 3.41Å; I196-S198 WeakPolarHBondContact CG2-O 3.41Å; I196-T214 HydrophobicContact CG2-CG2 4.47Å; I196-N215 CarbonylContact C-O 3.47Å
197	R	88.5	Confident	83.3	Confident	80 Å²	80	51.2 Å²	51.2	30%	0.302	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-36.2	-178.6	-67.5	-162.7	-56.4	-67.1	-8.6	113.6	V155 N215 S216 N217 S247	V155-R197 VanDerWaalsContact CG1-O 3.24Å; V155-R197 WeakPolarHBondContact CG1-O 3.15Å; R197-N215 PolarHBondContact N-O 2.88Å; R197-N215 PolarHBondContact NH2-OD1 3.07Å; R197-S216 PolarHBondContact NH1-O 2.88Å; R197-N217 WeakPolarHBondContact CD-OD1 3.47Å; R197-N217 WeakPolarHBondContact CG-OD1 3.4Å; R197-N217 VanDerWaalsContact NH1-N 3.13Å; R197-N217 PolarHBondContact NH1-OD1 2.79Å; R197-S247 PolarHBondContact NH2-O 3.19Å
198	S	89.5	Confident	81.4	Confident	31 Å²	31	58 Å²	58	22%	0.217	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	152.5	-179.1	59.9	0	0	0	0	110.6	I196 T214 N215 N249	I196-S198 WeakPolarHBondContact CG2-O 3.41Å; S198-T214 WeakPolarHBondContact O-CA 3.37Å; S198-N215 PolarHBondContact N-O 3.12Å; S198-N215 PolarHBondContact O-N 3.19Å; S198-N215 WeakPolarHBondContact OG-CB 3.37Å; S198-N249 PolarHBondContact OG-OD1 2.84Å
199	L	91.6	Very high	80.1	Confident	24 Å²	24	60 Å²	60	13%	0.126	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	129.6	177.7	-168.4	149	0	0	0	107.9	V155 S157 I166 V201 M213 T214	V155-L199 HydrophobicContact CB-CB 4.44Å; V155-L199 HydrophobicContact CG2-CB 3.94Å; S157-L199 VanDerWaalsContact CB-CD2 3.49Å; I166-L199 HydrophobicContact CB-CD1 4.14Å; I166-L199 HydrophobicContact CB-CD2 4.12Å; I166-L199 HydrophobicContact CG2-CD1 3.52Å; I166-L199 HydrophobicContact CG2-CD2 4.19Å; I166-L199 HydrophobicContact CG2-CG 4.42Å; L199-V201 HydrophobicContact CD2-CG2 4.12Å; L199-M213 WeakPolarHBondContact CA-O 3.36Å; L199-T214 HydrophobicContact CD1-CG2 4.37Å
200	E	89.4	Confident	79.7	Confident	40 Å²	40	55.5 Å²	55.5	19%	0.187	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	135.6	-179	-171.8	-179.1	-168.4	0	0	110	F212 M213 N249 S250 G251	E200-F212 CarbonylContact O-C 3.36Å; E200-F212 VanDerWaalsContact O-CA 3.29Å; E200-F212 WeakPolarHBondContact O-CA 3.18Å; E200-M213 HydrophobicContact CB-CE 4.28Å; E200-M213 HydrophobicContact CG-CE 4.32Å; E200-M213 PolarHBondContact N-O 2.76Å; E200-M213 PolarHBondContact O-N 2.99Å; E200-M213 WeakPolarHBondContact OE2-CE 3.4Å; E200-N249 VanDerWaalsContact CB-ND2 3.32Å; E200-N249 WeakPolarHBondContact CB-ND2 3.24Å; E200-N249 PolarHBondContact OE2-ND2 2.68Å; E200-S250 WeakPolarHBondContact OE1-CA 3.43Å; E200-S250 PolarHBondContact OE1-OG 2.91Å; E200-S250 WeakPolarHBondContact OE2-CA 3.33Å; E200-G251 PolarHBondContact OE1-N 2.98Å; E200-G251 PolarHBondContact OE2-N 2.93Å
201	V	89.1	Confident	79.6	Confident	16 Å²	16	56 Å²	56	10%	0.097	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.9	178.3	-179	0	0	0	0	109.1	F158 K160 I166 L199 R203 F212	F158-V201 WeakPolarHBondContact O-CG2 3.13Å; K160-V201 HydrophobicContact CB-CG1 4.47Å; I166-V201 HydrophobicContact CD1-CG2 3.98Å; L199-V201 HydrophobicContact CD2-CG2 4.12Å; V201-R203 PolarHBondContact O-N 2.58Å; V201-F212 HydrophobicContact CG2-CB 4.1Å
202	A	83.1	Confident	79.9	Confident	13 Å²	13	53.2 Å²	53.2	11%	0.107	30%	0.298	C	S	.	.			trans	-63.5	123	177.8	0	0	0	0	0	110.2	L211	A202-L211 HydrophobicContact CB-CB 4.1Å; A202-L211 WeakPolarHBondContact CB-O 3.32Å; A202-L211 PolarHBondContact N-O 2.82Å
203	R	72.2	Confident	80.1	Confident	163 Å²	163	50.7 Å²	50.7	62%	0.615	27%	0.269	S	S	*	.	S	Bend	trans	-81.8	-34	179.8	-62.9	-156.9	-179.7	-166.3	3.1	112.5	K160 V201	K160-R203 WeakPolarHBondContact CD-O 3.27Å; K160-R203 WeakPolarHBondContact CE-O 3.22Å; K160-R203 PolarHBondContact NZ-O 3.05Å; K160-R203 VanDerWaalsContact NZ-O 3.08Å; V201-R203 PolarHBondContact O-N 2.58Å
204	R	67.5	Low	80.3	Confident	61 Å²	61	49.5 Å²	49.5	23%	0.23	26%	0.257	C	S	.	.	S	Bend	trans	-94.6	151.6	171.8	-79.7	178.5	155.2	163.9	-16.4	109.7	S253 P295 V296 F377	R204-S253 VanDerWaalsContact C-CB 3.5Å; R204-S253 WeakPolarHBondContact CB-OG 3.47Å; R204-S253 VanDerWaalsContact O-CB 3.3Å; R204-S253 WeakPolarHBondContact O-CB 3.34Å; R204-P295 PolarHBondContact NH1-O 3.34Å; R204-V296 VanDerWaalsContact NH1-CA 3.33Å; R204-F377 VanDerWaalsContact CZ-CZ 3.5Å
205	G	59.3	Low	80.2	Confident	35 Å²	35	44.3 Å²	44.3	36%	0.361	24%	0.237	S	C	.	.	S	Bend	trans	147.2	147.8	-173.8	0	0	0	0	0	111.1	K160	K160-G205 PolarHBondContact NZ-O 2.88Å; K160-G205 VanDerWaalsContact NZ-O 3.14Å
206	S	56.3	Low	80.2	Confident	73 Å²	73	43.3 Å²	43.3	51%	0.51	23%	0.23	S	C	.	.			trans	-50	146.9	172.3	171.7	0	0	0	0	110.5	Y208 S209	S206-Y208 PolarHBondContact O-N 2.57Å; S206-Y208 WeakPolarHBondContact OG-CD2 3.08Å; S206-Y208 PolarHBondContact OG-N 2.79Å; S206-S209 PolarHBondContact O-N 2.77Å; S206-S209 VanDerWaalsContact O-O 3.14Å
207	A	52.5	Low	80	Confident	90 Å²	90	46.5 Å²	46.5	74%	0.744	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-20.9	174.2	0	0	0	0	0	112.9
208	Y	53.1	Low	80.1	Confident	198 Å²	198	44.6 Å²	44.6	78%	0.776	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-11.6	-177.6	-56.3	-73.6	0	0	0	114.9	S206 N227	S206-Y208 PolarHBondContact O-N 2.57Å; S206-Y208 WeakPolarHBondContact OG-CD2 3.08Å; S206-Y208 PolarHBondContact OG-N 2.79Å; Y208-N227 PolarHBondContact O-ND2 2.87Å
209	S	67.4	Low	79.9	Confident	42 Å²	42	50.2 Å²	50.2	29%	0.294	26%	0.259	S	S	.	.			trans	-127.7	115.9	179.4	-172.8	0	0	0	0	110.7	S206 L211 D225	S206-S209 PolarHBondContact O-N 2.77Å; S206-S209 VanDerWaalsContact O-O 3.14Å; S209-L211 WeakPolarHBondContact OG-CD2 2.92Å; S209-D225 PolarHBondContact OG-OD2 3.23Å
210	S	83.9	Confident	79.8	Confident	19 Å²	19	50.5 Å²	50.5	13%	0.133	26%	0.262	C	S	.	.			trans	-110.8	87.2	178.2	179.1	0	0	0	0	108.4	L226	S210-L226 WeakPolarHBondContact O-CB 3.47Å; S210-L226 PolarHBondContact O-N 3.18Å
211	L	89.7	Confident	79.8	Confident	13 Å²	13	48.6 Å²	48.6	7%	0.068	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	145.1	-177.5	-57.7	177.4	0	0	0	111.3	A202 S209 Y224 D225 I241	A202-L211 HydrophobicContact CB-CB 4.1Å; A202-L211 WeakPolarHBondContact CB-O 3.32Å; A202-L211 PolarHBondContact N-O 2.82Å; S209-L211 WeakPolarHBondContact OG-CD2 2.92Å; L211-Y224 VanDerWaalsContact CA-O 3.3Å; L211-Y224 WeakPolarHBondContact CA-O 3.44Å; L211-D225 HydrophobicContact CD2-CB 3.88Å; L211-I241 HydrophobicContact CD2-CD1 3.98Å
212	F	91.8	Very high	79.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	156	168.5	72.2	-85.3	0	0	0	110.8	I166 V174 F188 E200 V201 T214 Y224 L226 V229	I166-F212 HydrophobicContact CD1-CB 3.99Å; I166-F212 HydrophobicContact CD1-CD1 3.91Å; I166-F212 HydrophobicContact CD1-CD2 4.43Å; I166-F212 HydrophobicContact CD1-CE1 4.49Å; I166-F212 HydrophobicContact CD1-CG 3.86Å; I166-F212 HydrophobicContact CG2-CD2 4.14Å; I166-F212 HydrophobicContact CG2-CE2 4.04Å; I166-F212 HydrophobicContact CG2-CZ 4.37Å; V174-F212 HydrophobicContact CG1-CE2 4.09Å; V174-F212 HydrophobicContact CG1-CZ 4.17Å; F188-F212 HydrophobicContact CE1-CZ 4.36Å; F188-F212 HydrophobicContact CZ-CZ 4.38Å; E200-F212 CarbonylContact O-C 3.36Å; E200-F212 VanDerWaalsContact O-CA 3.29Å; E200-F212 WeakPolarHBondContact O-CA 3.18Å; V201-F212 HydrophobicContact CG2-CB 4.1Å; F212-T214 HydrophobicContact CD2-CG2 4.12Å; F212-T214 HydrophobicContact CE2-CG2 3.91Å; F212-Y224 HydrophobicContact CD2-CD2 4.35Å; F212-Y224 VanDerWaalsContact CE1-CB 3.48Å; F212-Y224 HydrophobicContact CE1-CG 4.39Å; F212-Y224 AromaticContact CE2-CD2 3.7Å; F212-Y224 HydrophobicContact CE2-CD2 3.7Å; F212-Y224 HydrophobicContact CE2-CG 4.15Å; F212-Y224 VanDerWaalsContact CZ-CB 3.45Å; F212-Y224 AromaticContact CZ-CD2 3.92Å; F212-Y224 HydrophobicContact CZ-CD2 3.92Å; F212-Y224 AromaticContact CZ-CG 3.87Å; F212-Y224 HydrophobicContact CZ-CG 3.87Å; F212-Y224 PolarHBondContact N-O 2.8Å; F212-Y224 PolarHBondContact O-N 2.9Å; F212-L226 HydrophobicContact CD1-CB 4.18Å; F212-L226 HydrophobicContact CE1-CB 4.38Å; F212-L226 HydrophobicContact CE1-CD1 4.39Å; F212-V229 HydrophobicContact CE1-CG2 4.12Å; F212-V229 HydrophobicContact CZ-CG2 4.21Å
213	M	91.4	Very high	80.3	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.059	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.1	-178.1	-57.9	-170.7	-71.5	0	0	109.9	L199 E200 I221 R222 V223 I256	L199-M213 WeakPolarHBondContact CA-O 3.36Å; E200-M213 HydrophobicContact CB-CE 4.28Å; E200-M213 HydrophobicContact CG-CE 4.32Å; E200-M213 PolarHBondContact N-O 2.76Å; E200-M213 PolarHBondContact O-N 2.99Å; E200-M213 WeakPolarHBondContact OE2-CE 3.4Å; M213-I221 HydrophobicContact CB-CG2 4.34Å; M213-I221 HydrophobicContact SD-CG2 4.42Å; M213-R222 CarbonylContact C-O 3.35Å; M213-R222 VanDerWaalsContact CA-O 3.25Å; M213-R222 WeakPolarHBondContact CA-O 3.39Å; M213-V223 HydrophobicContact CG-CG1 4.49Å; M213-V223 HydrophobicContact CG-CG2 4.08Å; M213-V223 HydrophobicContact SD-CG2 4.31Å; M213-I256 HydrophobicContact SD-CB 4.47Å; M213-I256 HydrophobicContact SD-CD1 4.18Å; M213-I256 HydrophobicContact SD-CG1 3.89Å; M213-I256 HydrophobicContact SD-CG2 3.95Å
214	T	92.8	Very high	81.3	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.2	171.2	62.3	0	0	0	0	109.1	V174 Q190 I196 S198 L199 F212 I221 R222 Y224	V174-T214 HydrophobicContact CG2-CG2 4.29Å; Q190-T214 PolarHBondContact NE2-OG1 2.87Å; I196-T214 HydrophobicContact CG2-CG2 4.47Å; S198-T214 WeakPolarHBondContact O-CA 3.37Å; L199-T214 HydrophobicContact CD1-CG2 4.37Å; F212-T214 HydrophobicContact CD2-CG2 4.12Å; F212-T214 HydrophobicContact CE2-CG2 3.91Å; T214-I221 CarbonylContact O-C 3.56Å; T214-I221 WeakPolarHBondContact O-CA 3.42Å; T214-R222 PolarHBondContact N-O 2.94Å; T214-R222 PolarHBondContact O-N 2.99Å; T214-Y224 HydrophobicContact CG2-CD2 4.39Å; T214-Y224 HydrophobicContact CG2-CE2 4.16Å
215	N	90.4	Very high	82.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.2	169.6	-161.2	-27.6	0	0	0	110.5	I196 R197 S198 I221 D246 S247 V248	I196-N215 CarbonylContact C-O 3.47Å; R197-N215 PolarHBondContact N-O 2.88Å; R197-N215 PolarHBondContact NH2-OD1 3.07Å; S198-N215 PolarHBondContact N-O 3.12Å; S198-N215 PolarHBondContact O-N 3.19Å; S198-N215 WeakPolarHBondContact OG-CB 3.37Å; N215-I221 HydrophobicContact CB-CG1 4.19Å; N215-I221 WeakPolarHBondContact ND2-CG1 3.12Å; N215-D246 PolarHBondContact ND2-O 2.78Å; N215-D246 VanDerWaalsContact ND2-O 3.12Å; N215-D246 PolarHBondContact OD1-O 2.84Å; N215-D246 VanDerWaalsContact OD1-O 3.07Å; N215-S247 PolarHBondContact ND2-O 2.83Å; N215-V248 PolarHBondContact ND2-N 2.79Å
216	S	91.6	Very high	84	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	160	-172.1	-58.1	0	0	0	0	112.8	Q190 C195 R197 D218 R219 V220	Q190-S216 PolarHBondContact OE1-OG 2.7Å; C195-S216 CarbonylContact O-C 3.57Å; C195-S216 WeakPolarHBondContact O-CA 3.29Å; R197-S216 PolarHBondContact NH1-O 2.88Å; S216-D218 VanDerWaalsContact CB-OD1 3.23Å; S216-D218 WeakPolarHBondContact CB-OD1 3.15Å; S216-D218 PolarHBondContact O-N 3.14Å; S216-R219 PolarHBondContact O-N 3.34Å; S216-V220 PolarHBondContact N-O 3.47Å
217	N	89.4	Confident	85.6	Confident	67 Å²	67	35.6 Å²	35.6	36%	0.358	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-15	-176.7	-89.9	8	0	0	0	116.4	C195 R197 R219	C195-N217 HydrophobicContact CB-CB 4.2Å; C195-N217 PolarHBondContact O-N 2.97Å; R197-N217 WeakPolarHBondContact CD-OD1 3.47Å; R197-N217 WeakPolarHBondContact CG-OD1 3.4Å; R197-N217 VanDerWaalsContact NH1-N 3.13Å; R197-N217 PolarHBondContact NH1-OD1 2.79Å; N217-R219 PolarHBondContact O-N 2.92Å
218	D	89.6	Confident	87.5	Confident	39 Å²	39	34.4 Å²	34.4	21%	0.209	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	4.4	169	61.9	-14.4	0	0	0	113.9	Y194 S216 V220 R222	Y194-D218 HydrophobicContact CD1-CB 4.09Å; Y194-D218 HydrophobicContact CD2-CB 3.6Å; Y194-D218 VanDerWaalsContact CD2-CG 3.48Å; Y194-D218 VanDerWaalsContact CD2-OD2 3.27Å; Y194-D218 WeakPolarHBondContact CD2-OD2 3.43Å; Y194-D218 HydrophobicContact CE1-CB 4.2Å; Y194-D218 HydrophobicContact CE2-CB 3.71Å; Y194-D218 HydrophobicContact CG-CB 3.8Å; S216-D218 VanDerWaalsContact CB-OD1 3.23Å; S216-D218 WeakPolarHBondContact CB-OD1 3.15Å; S216-D218 PolarHBondContact O-N 3.14Å; D218-V220 PolarHBondContact O-N 2.83Å; D218-V220 PolarHBondContact OD1-N 2.93Å; D218-R222 IonicContact OD1-NH1 2.65Å; D218-R222 PolarHBondContact OD1-NH1 3.47Å; D218-R222 VanDerWaalsContact OD1-NH1 3.09Å; D218-R222 IonicContact OD2-CZ 3.45Å; D218-R222 VanDerWaalsContact OD2-CZ 3.29Å; D218-R222 IonicContact OD2-NH1 3.23Å; D218-R222 PolarHBondContact OD2-NH1 3.46Å; D218-R222 IonicContact OD2-NH2 3.29Å; D218-R222 PolarHBondContact OD2-NH2 2.8Å
219	R	86.6	Confident	89.4	Confident	149 Å²	149	25 Å²	25	56%	0.562	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.9	31.9	-177	-46.6	179.3	-139	166.8	4	112.3	S216 N217 Q245 D246	S216-R219 PolarHBondContact O-N 3.34Å; N217-R219 PolarHBondContact O-N 2.92Å; R219-Q245 CarbonylContact O-C 3.57Å; R219-Q245 WeakPolarHBondContact O-CA 3.46Å; R219-Q245 WeakPolarHBondContact O-CG 3.37Å; R219-D246 CarbonylContact C-O 3.5Å; R219-D246 PolarHBondContact O-N 3.15Å
220	V	88.9	Confident	90.6	Very high	30 Å²	30	26.7 Å²	26.7	18%	0.182	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	116.3	176.8	-179.3	0	0	0	0	109.2	S216 D218 R222 K243 V244	S216-V220 PolarHBondContact N-O 3.47Å; D218-V220 PolarHBondContact O-N 2.83Å; D218-V220 PolarHBondContact OD1-N 2.93Å; V220-R222 HydrophobicContact CG1-CG 4.06Å; V220-R222 PolarHBondContact O-NH1 2.94Å; V220-R222 VanDerWaalsContact O-NH1 3.13Å; V220-K243 HydrophobicContact CG1-CB 3.93Å; V220-K243 HydrophobicContact CG1-CD 4.41Å; V220-K243 HydrophobicContact CG1-CG 4.28Å; V220-V244 CarbonylContact C-O 3.55Å; V220-V244 WeakPolarHBondContact CA-O 3.36Å
221	I	89.5	Confident	90.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	132.3	167.3	-60.5	163.1	0	0	0	107.7	M213 T214 N215 K243 V244 D246 N249 I256 A258	M213-I221 HydrophobicContact CB-CG2 4.34Å; M213-I221 HydrophobicContact SD-CG2 4.42Å; T214-I221 CarbonylContact O-C 3.56Å; T214-I221 WeakPolarHBondContact O-CA 3.42Å; N215-I221 HydrophobicContact CB-CG1 4.19Å; N215-I221 WeakPolarHBondContact ND2-CG1 3.12Å; I221-K243 WeakPolarHBondContact O-CA 3.37Å; I221-V244 HydrophobicContact CB-CG2 3.77Å; I221-V244 HydrophobicContact CD1-CG2 4.34Å; I221-V244 HydrophobicContact CG2-CG2 4.1Å; I221-V244 PolarHBondContact N-O 2.71Å; I221-V244 PolarHBondContact O-N 2.98Å; I221-D246 HydrophobicContact CD1-CB 4.15Å; I221-N249 HydrophobicContact CD1-CB 3.99Å; I221-I256 HydrophobicContact CG2-CG2 4.45Å; I221-A258 HydrophobicContact CD1-CB 3.54Å
222	R	91.4	Very high	90.9	Very high	9 Å²	9	37.3 Å²	37.3	3%	0.034	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.8	-177.8	-62.9	178	173.3	70	-4.8	109.5	M213 T214 D218 V220 Y224 P240 Q242 K243	M213-R222 CarbonylContact C-O 3.35Å; M213-R222 VanDerWaalsContact CA-O 3.25Å; M213-R222 WeakPolarHBondContact CA-O 3.39Å; T214-R222 PolarHBondContact N-O 2.94Å; T214-R222 PolarHBondContact O-N 2.99Å; D218-R222 IonicContact OD1-NH1 2.65Å; D218-R222 PolarHBondContact OD1-NH1 3.47Å; D218-R222 VanDerWaalsContact OD1-NH1 3.09Å; D218-R222 IonicContact OD2-CZ 3.45Å; D218-R222 VanDerWaalsContact OD2-CZ 3.29Å; D218-R222 IonicContact OD2-NH1 3.23Å; D218-R222 PolarHBondContact OD2-NH1 3.46Å; D218-R222 IonicContact OD2-NH2 3.29Å; D218-R222 PolarHBondContact OD2-NH2 2.8Å; V220-R222 HydrophobicContact CG1-CG 4.06Å; V220-R222 PolarHBondContact O-NH1 2.94Å; V220-R222 VanDerWaalsContact O-NH1 3.13Å; R222-Y224 HydrophobicContact CB-CD2 4.42Å; R222-Y224 HydrophobicContact CB-CE2 3.57Å; R222-Y224 WeakPolarHBondContact CD-OH 3.42Å; R222-P240 HydrophobicContact CB-CB 3.88Å; R222-P240 HydrophobicContact CB-CG 4.46Å; R222-P240 HydrophobicContact CG-CB 4.33Å; R222-P240 HydrophobicContact CG-CG 4.38Å; R222-Q242 WeakPolarHBondContact CA-O 3.26Å; R222-K243 HydrophobicContact CG-CG 4.39Å
223	V	91.3	Very high	90.8	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.6	177.9	-171.5	0	0	0	0	109.5	M213 P240 I241 Q242 I256	M213-V223 HydrophobicContact CG-CG1 4.49Å; M213-V223 HydrophobicContact CG-CG2 4.08Å; M213-V223 HydrophobicContact SD-CG2 4.31Å; V223-P240 CarbonylContact O-C 3.49Å; V223-P240 VanDerWaalsContact O-CA 3.3Å; V223-P240 WeakPolarHBondContact O-CA 3.13Å; V223-P240 WeakPolarHBondContact O-CB 3.5Å; V223-I241 PolarHBondContact O-N 3.45Å; V223-Q242 HydrophobicContact CB-CB 4.12Å; V223-Q242 HydrophobicContact CG2-CB 3.95Å; V223-Q242 PolarHBondContact N-O 3.07Å; V223-I256 HydrophobicContact CG2-CD1 3.65Å
224	Y	92.2	Very high	90.8	Very high	1 Å²	1	42.6 Å²	42.6	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	153.7	178.4	-60.4	-85.1	0	0	0	110.7	F188 Q190 L211 F212 T214 R222 V238 P240	F188-Y224 HydrophobicContact CE2-CD1 4.21Å; F188-Y224 AromaticContact CE2-CE1 3.55Å; F188-Y224 HydrophobicContact CE2-CE1 3.55Å; F188-Y224 HydrophobicContact CE2-CE2 4.33Å; F188-Y224 AromaticContact CE2-CZ 3.62Å; F188-Y224 AromaticContact CZ-CD1 3.84Å; F188-Y224 HydrophobicContact CZ-CD1 3.84Å; F188-Y224 HydrophobicContact CZ-CD2 4.29Å; F188-Y224 AromaticContact CZ-CE1 3.64Å; F188-Y224 HydrophobicContact CZ-CE1 3.64Å; F188-Y224 HydrophobicContact CZ-CE2 4.11Å; F188-Y224 HydrophobicContact CZ-CG 4.15Å; F188-Y224 AromaticContact CZ-CZ 3.77Å; Q190-Y224 PolarHBondContact NE2-OH 3.23Å; Q190-Y224 VanDerWaalsContact NE2-OH 3.12Å; L211-Y224 VanDerWaalsContact CA-O 3.3Å; L211-Y224 WeakPolarHBondContact CA-O 3.44Å; F212-Y224 HydrophobicContact CD2-CD2 4.35Å; F212-Y224 VanDerWaalsContact CE1-CB 3.48Å; F212-Y224 HydrophobicContact CE1-CG 4.39Å; F212-Y224 AromaticContact CE2-CD2 3.7Å; F212-Y224 HydrophobicContact CE2-CD2 3.7Å; F212-Y224 HydrophobicContact CE2-CG 4.15Å; F212-Y224 VanDerWaalsContact CZ-CB 3.45Å; F212-Y224 AromaticContact CZ-CD2 3.92Å; F212-Y224 HydrophobicContact CZ-CD2 3.92Å; F212-Y224 AromaticContact CZ-CG 3.87Å; F212-Y224 HydrophobicContact CZ-CG 3.87Å; F212-Y224 PolarHBondContact N-O 2.8Å; F212-Y224 PolarHBondContact O-N 2.9Å; T214-Y224 HydrophobicContact CG2-CD2 4.39Å; T214-Y224 HydrophobicContact CG2-CE2 4.16Å; R222-Y224 HydrophobicContact CB-CD2 4.42Å; R222-Y224 HydrophobicContact CB-CE2 3.57Å; R222-Y224 WeakPolarHBondContact CD-OH 3.42Å; Y224-V238 HydrophobicContact CD1-CG1 3.78Å; Y224-V238 HydrophobicContact CE1-CG1 4.11Å; Y224-P240 HydrophobicContact CD1-CB 4.18Å; Y224-P240 HydrophobicContact CE1-CB 3.7Å; Y224-P240 HydrophobicContact CE1-CG 4.45Å; Y224-P240 HydrophobicContact CE2-CB 4.46Å
225	D	91.3	Very high	90.5	Very high	27 Å²	27	48.2 Å²	48.2	14%	0.144	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.7	165.3	-166.7	-43.5	0	0	0	109.7	S209 L211 N227 E228 V229 I241	S209-D225 PolarHBondContact OG-OD2 3.23Å; L211-D225 HydrophobicContact CD2-CB 3.88Å; D225-N227 VanDerWaalsContact C-N 3.26Å; D225-N227 PolarHBondContact O-N 3.49Å; D225-N227 WeakPolarHBondContact OD1-CB 3.28Å; D225-N227 PolarHBondContact OD1-N 3.22Å; D225-E228 HydrophobicContact CB-CB 4.13Å; D225-E228 PolarHBondContact O-N 2.87Å; D225-V229 WeakPolarHBondContact O-CG2 3.42Å; D225-V229 PolarHBondContact O-N 2.92Å; D225-I241 HydrophobicContact CB-CD1 3.76Å
226	L	92.6	Very high	90.2	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-37.1	178.9	-178.9	62	0	0	0	112.1	D159 Y164 I166 I176 S210 F212 V229 R230	D159-L226 HydrophobicContact CB-CD2 3.66Å; Y164-L226 HydrophobicContact CD2-CD2 4.04Å; I166-L226 HydrophobicContact CD1-CD1 3.91Å; I166-L226 HydrophobicContact CD1-CD2 4.33Å; I166-L226 HydrophobicContact CG1-CD1 4.14Å; I176-L226 HydrophobicContact CD1-CD1 3.66Å; I176-L226 HydrophobicContact CG1-CD1 4.15Å; I176-L226 HydrophobicContact CG2-CD1 3.94Å; S210-L226 WeakPolarHBondContact O-CB 3.47Å; S210-L226 PolarHBondContact O-N 3.18Å; F212-L226 HydrophobicContact CD1-CB 4.18Å; F212-L226 HydrophobicContact CE1-CB 4.38Å; F212-L226 HydrophobicContact CE1-CD1 4.39Å; L226-V229 PolarHBondContact O-N 2.6Å; L226-R230 HydrophobicContact CD1-CG 4.33Å; L226-R230 HydrophobicContact CG-CG 4.48Å; L226-R230 WeakPolarHBondContact O-CB 3.5Å; L226-R230 WeakPolarHBondContact O-CG 3.33Å; L226-R230 PolarHBondContact O-N 2.86Å
227	N	90.9	Very high	89.9	Confident	49 Å²	49	53.8 Å²	53.8	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-68.8	-39.4	-179.9	-67.7	-31.2	0	0	0	110.8	Y208 D225 R230 N231	Y208-N227 PolarHBondContact O-ND2 2.87Å; D225-N227 VanDerWaalsContact C-N 3.26Å; D225-N227 PolarHBondContact O-N 3.49Å; D225-N227 WeakPolarHBondContact OD1-CB 3.28Å; D225-N227 PolarHBondContact OD1-N 3.22Å; N227-R230 PolarHBondContact O-N 3.22Å; N227-N231 WeakPolarHBondContact O-CB 3.37Å; N227-N231 PolarHBondContact O-N 2.95Å; N227-N231 PolarHBondContact O-ND2 2.9Å
228	E	91.2	Very high	89.8	Confident	65 Å²	65	50.9 Å²	50.9	30%	0.304	25%	0.253	S	S	.	.	H	α-helix	trans	-62.3	-49.2	174.2	-170.6	-173.5	165.8	0	0	111	D225 R230 N231 R232	D225-E228 HydrophobicContact CB-CB 4.13Å; D225-E228 PolarHBondContact O-N 2.87Å; E228-R230 VanDerWaalsContact C-N 3.29Å; E228-R230 PolarHBondContact O-N 3.24Å; E228-N231 PolarHBondContact O-N 2.83Å; E228-R232 WeakPolarHBondContact O-CG 3.47Å; E228-R232 PolarHBondContact O-N 2.96Å; E228-R232 VanDerWaalsContact O-N 3.09Å; E228-R232 IonicContact OE1-CZ 3.39Å; E228-R232 IonicContact OE1-NE 2.72Å; E228-R232 PolarHBondContact OE1-NE 3.39Å; E228-R232 IonicContact OE1-NH2 2.73Å; E228-R232 PolarHBondContact OE1-NH2 3.43Å
229	V	93.3	Very high	89.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.2	-45.8	178.3	173.7	0	0	0	0	110.9	I176 A186 F188 F212 D225 L226 R232 G233 V238	I176-V229 HydrophobicContact CD1-CG1 4.25Å; I176-V229 HydrophobicContact CG1-CG1 3.72Å; A186-V229 HydrophobicContact CB-CG1 4.27Å; F188-V229 HydrophobicContact CD1-CG1 3.77Å; F188-V229 HydrophobicContact CD1-CG2 4.31Å; F188-V229 HydrophobicContact CE1-CB 4.43Å; F188-V229 HydrophobicContact CE1-CG1 3.74Å; F188-V229 HydrophobicContact CE1-CG2 3.72Å; F188-V229 HydrophobicContact CZ-CG2 4.43Å; F212-V229 HydrophobicContact CE1-CG2 4.12Å; F212-V229 HydrophobicContact CZ-CG2 4.21Å; D225-V229 WeakPolarHBondContact O-CG2 3.42Å; D225-V229 PolarHBondContact O-N 2.92Å; L226-V229 PolarHBondContact O-N 2.6Å; V229-R232 PolarHBondContact O-N 3.33Å; V229-G233 PolarHBondContact O-N 2.81Å; V229-V238 HydrophobicContact CG2-CG1 3.89Å; V229-V238 HydrophobicContact CG2-CG2 4.26Å
230	R	92.1	Very high	89.8	Confident	78 Å²	78	48.3 Å²	48.3	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-63.9	-43.8	179.3	-74.6	175.7	64.3	-141	-3.4	112.3	Y164 I176 L226 N227 E228 R232 G233	Y164-R230 VanDerWaalsContact CZ-NH2 3.33Å; Y164-R230 PolarHBondContact OH-NH1 2.99Å; Y164-R230 PolarHBondContact OH-NH2 3.49Å; I176-R230 HydrophobicContact CG2-CG 4.09Å; L226-R230 HydrophobicContact CD1-CG 4.33Å; L226-R230 HydrophobicContact CG-CG 4.48Å; L226-R230 WeakPolarHBondContact O-CB 3.5Å; L226-R230 WeakPolarHBondContact O-CG 3.33Å; L226-R230 PolarHBondContact O-N 2.86Å; N227-R230 PolarHBondContact O-N 3.22Å; E228-R230 VanDerWaalsContact C-N 3.29Å; E228-R230 PolarHBondContact O-N 3.24Å; R230-R232 VanDerWaalsContact C-N 3.25Å; R230-R232 PolarHBondContact O-N 2.9Å; R230-G233 PolarHBondContact O-N 3.5Å
231	N	90.9	Very high	89.7	Confident	140 Å²	140	50.7 Å²	50.7	75%	0.749	26%	0.261	S	S	*	.	H	α-helix	trans	-65.2	-29.7	-179.6	-71.5	-16.1	0	0	0	112.6	N227 E228	N227-N231 WeakPolarHBondContact O-CB 3.37Å; N227-N231 PolarHBondContact O-N 2.95Å; N227-N231 PolarHBondContact O-ND2 2.9Å; E228-N231 PolarHBondContact O-N 2.83Å
232	R	90.5	Very high	89.4	Confident	114 Å²	114	52.7 Å²	52.7	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-77.2	-24.8	175.4	-63.5	-160.7	-168.9	-142.5	-5.6	113.7	E228 V229 R230 S236 S237	E228-R232 WeakPolarHBondContact O-CG 3.47Å; E228-R232 PolarHBondContact O-N 2.96Å; E228-R232 VanDerWaalsContact O-N 3.09Å; E228-R232 IonicContact OE1-CZ 3.39Å; E228-R232 IonicContact OE1-NE 2.72Å; E228-R232 PolarHBondContact OE1-NE 3.39Å; E228-R232 IonicContact OE1-NH2 2.73Å; E228-R232 PolarHBondContact OE1-NH2 3.43Å; V229-R232 PolarHBondContact O-N 3.33Å; R230-R232 VanDerWaalsContact C-N 3.25Å; R230-R232 PolarHBondContact O-N 2.9Å; R232-S236 WeakPolarHBondContact CB-OG 3.34Å; R232-S237 WeakPolarHBondContact CD-O 3.34Å; R232-S237 PolarHBondContact NH1-O 3.33Å
233	G	89.7	Confident	89	Confident	17 Å²	17	57.3 Å²	57.3	18%	0.175	29%	0.291	C	S	.	.			trans	77.7	-151.3	175	0	0	0	0	0	114.7	A186 Y187 V229 R230 S236	A186-G233 WeakPolarHBondContact CB-O 3.46Å; Y187-G233 PolarHBondContact N-O 3.33Å; V229-G233 PolarHBondContact O-N 2.81Å; R230-G233 PolarHBondContact O-N 3.5Å; G233-S236 PolarHBondContact O-OG 2.88Å
234	K	90.9	Very high	88.6	Confident	107 Å²	107	57.7 Å²	57.7	47%	0.465	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-79.8	140.5	-173.5	-63.9	-173.1	-178.6	-170.1	0	112.1	D145 L184 Y187 S236	D145-K234 IonicContact OD2-NZ 3.61Å; L184-K234 WeakPolarHBondContact O-CE 3.22Å; L184-K234 PolarHBondContact O-NZ 2.56Å; L184-K234 VanDerWaalsContact O-NZ 3.15Å; Y187-K234 HydrophobicContact CD1-CB 3.87Å; Y187-K234 HydrophobicContact CD1-CG 4.06Å; Y187-K234 HydrophobicContact CE1-CB 3.7Å; Y187-K234 HydrophobicContact CE1-CD 4.5Å; Y187-K234 HydrophobicContact CE1-CG 4.22Å; K234-S236 PolarHBondContact O-N 2.75Å
235	D	86.5	Confident	87.9	Confident	118 Å²	118	64.2 Å²	64.2	63%	0.631	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	29.9	178.6	-144.7	18.7	0	0	0	115.7	Y187	Y187-D235 HydrophobicContact CE1-CB 4.3Å; Y187-D235 HydrophobicContact CE2-CB 3.74Å; Y187-D235 VanDerWaalsContact CE2-OD1 3.27Å; Y187-D235 WeakPolarHBondContact CE2-OD1 2.99Å; Y187-D235 PolarHBondContact O-N 2.92Å; Y187-D235 VanDerWaalsContact OH-CB 3.26Å; Y187-D235 WeakPolarHBondContact OH-CB 3.19Å
236	S	83.2	Confident	86.8	Confident	22 Å²	22	63.5 Å²	63.5	15%	0.154	32%	0.32	C	S	.	.			trans	-86.5	146.5	-179.5	58.9	0	0	0	0	111.1	Y187 F188 R232 G233 K234 V238	Y187-S236 PolarHBondContact O-N 3.32Å; F188-S236 WeakPolarHBondContact CB-O 3.5Å; R232-S236 WeakPolarHBondContact CB-OG 3.34Å; G233-S236 PolarHBondContact O-OG 2.88Å; K234-S236 PolarHBondContact O-N 2.75Å; S236-V238 PolarHBondContact O-N 2.83Å
237	S	85.9	Confident	85.3	Confident	94 Å²	94	64.3 Å²	64.3	66%	0.657	33%	0.326	S	S	*	.			trans	-74.7	119	167.3	69.7	0	0	0	0	108.4	R232	R232-S237 WeakPolarHBondContact CD-O 3.34Å; R232-S237 PolarHBondContact NH1-O 3.33Å
238	V	88.2	Confident	83.7	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.036	32%	0.324	C	S	.	.			trans	-113.6	126.2	173.5	-176.5	0	0	0	0	107.5	F188 Y224 V229 S236	F188-V238 HydrophobicContact CB-CB 4.28Å; F188-V238 HydrophobicContact CB-CG2 3.86Å; F188-V238 HydrophobicContact CD1-CB 4.13Å; F188-V238 HydrophobicContact CD1-CG2 3.78Å; F188-V238 HydrophobicContact CD2-CB 3.92Å; F188-V238 HydrophobicContact CD2-CG2 4.33Å; F188-V238 HydrophobicContact CE1-CB 4.42Å; F188-V238 HydrophobicContact CE1-CG2 4.37Å; F188-V238 HydrophobicContact CE2-CB 4.22Å; F188-V238 HydrophobicContact CG-CB 3.86Å; F188-V238 HydrophobicContact CG-CG2 3.74Å; F188-V238 HydrophobicContact CZ-CB 4.46Å; Y224-V238 HydrophobicContact CD1-CG1 3.78Å; Y224-V238 HydrophobicContact CE1-CG1 4.11Å; V229-V238 HydrophobicContact CG2-CG1 3.89Å; V229-V238 HydrophobicContact CG2-CG2 4.26Å; S236-V238 PolarHBondContact O-N 2.83Å
239	L	88	Confident	82.4	Confident	117 Å²	117	61.4 Å²	61.4	61%	0.613	31%	0.314	S	S	*	.			trans	-92.1	138.4	172	-65	177.2	0	0	0	108.8
240	P	86.8	Confident	80.7	Confident	17 Å²	17	61.8 Å²	61.8	11%	0.11	32%	0.316	C	S	.	.			trans	-69.1	142.6	173.4	30.2	-34.2	0	0	0	110.1	R222 V223 Y224 Q242 K243	R222-P240 HydrophobicContact CB-CB 3.88Å; R222-P240 HydrophobicContact CB-CG 4.46Å; R222-P240 HydrophobicContact CG-CB 4.33Å; R222-P240 HydrophobicContact CG-CG 4.38Å; V223-P240 CarbonylContact O-C 3.49Å; V223-P240 VanDerWaalsContact O-CA 3.3Å; V223-P240 WeakPolarHBondContact O-CA 3.13Å; V223-P240 WeakPolarHBondContact O-CB 3.5Å; Y224-P240 HydrophobicContact CD1-CB 4.18Å; Y224-P240 HydrophobicContact CE1-CB 3.7Å; Y224-P240 HydrophobicContact CE1-CG 4.45Å; Y224-P240 HydrophobicContact CE2-CB 4.46Å; P240-Q242 VanDerWaalsContact C-N 3.31Å; P240-K243 HydrophobicContact CB-CG 4.39Å; P240-K243 HydrophobicContact CG-CD 4.11Å; P240-K243 HydrophobicContact CG-CG 3.75Å
241	I	87	Confident	79.1	Confident	80 Å²	80	58.6 Å²	58.6	41%	0.41	31%	0.308	S	S	.	.	S	Bend	trans	-63.4	-43.1	175.8	-62.5	169.9	0	0	0	109.6	L211 V223 D225	L211-I241 HydrophobicContact CD2-CD1 3.98Å; V223-I241 PolarHBondContact O-N 3.45Å; D225-I241 HydrophobicContact CB-CD1 3.76Å
242	Q	82.9	Confident	78	Confident	43 Å²	43	53.4 Å²	53.4	20%	0.201	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.3	-179.8	-167.9	55.5	46.9	0	0	110.8	R222 V223 P240 V244	R222-Q242 WeakPolarHBondContact CA-O 3.26Å; V223-Q242 HydrophobicContact CB-CB 4.12Å; V223-Q242 HydrophobicContact CG2-CB 3.95Å; V223-Q242 PolarHBondContact N-O 3.07Å; P240-Q242 VanDerWaalsContact C-N 3.31Å; Q242-V244 HydrophobicContact CG-CG1 4.4Å
243	K	83.9	Confident	76.9	Confident	105 Å²	105	49 Å²	49	46%	0.457	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.9	170.3	-61.2	-178.7	-175.3	172.4	0	109.2	V220 I221 R222 P240	V220-K243 HydrophobicContact CG1-CB 3.93Å; V220-K243 HydrophobicContact CG1-CD 4.41Å; V220-K243 HydrophobicContact CG1-CG 4.28Å; I221-K243 WeakPolarHBondContact O-CA 3.37Å; R222-K243 HydrophobicContact CG-CG 4.39Å; P240-K243 HydrophobicContact CB-CG 4.39Å; P240-K243 HydrophobicContact CG-CD 4.11Å; P240-K243 HydrophobicContact CG-CG 3.75Å
244	V	82.1	Confident	76.4	Confident	9 Å²	9	52.9 Å²	52.9	6%	0.055	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	154	172.5	-69.7	0	0	0	0	109.2	V220 I221 Q242 I256 W269	V220-V244 CarbonylContact C-O 3.55Å; V220-V244 WeakPolarHBondContact CA-O 3.36Å; I221-V244 HydrophobicContact CB-CG2 3.77Å; I221-V244 HydrophobicContact CD1-CG2 4.34Å; I221-V244 HydrophobicContact CG2-CG2 4.1Å; I221-V244 PolarHBondContact N-O 2.71Å; I221-V244 PolarHBondContact O-N 2.98Å; Q242-V244 HydrophobicContact CG-CG1 4.4Å; V244-I256 HydrophobicContact CG2-CD1 3.95Å; V244-I256 HydrophobicContact CG2-CG2 4.17Å; V244-W269 HydrophobicContact CB-CD2 4.04Å; V244-W269 HydrophobicContact CB-CG 4.12Å; V244-W269 HydrophobicContact CB-CZ2 4.49Å; V244-W269 HydrophobicContact CG1-CB 4.1Å; V244-W269 HydrophobicContact CG1-CD2 4.13Å; V244-W269 HydrophobicContact CG1-CG 3.67Å; V244-W269 HydrophobicContact CG2-CD2 4.35Å
245	Q	78.1	Confident	76.2	Confident	138 Å²	138	49.1 Å²	49.1	65%	0.645	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	107.7	-169.1	-171.4	179	3.1	0	0	110.9	R219	R219-Q245 CarbonylContact O-C 3.57Å; R219-Q245 WeakPolarHBondContact O-CA 3.46Å; R219-Q245 WeakPolarHBondContact O-CG 3.37Å
246	D	67.5	Low	76.2	Confident	13 Å²	13	43.6 Å²	43.6	7%	0.07	23%	0.234	C	C	.	.			trans	-176	-171.2	163.8	-141.1	-19.1	0	0	0	116.5	N215 R219 I221 A258 G259 S260 Y267 W269	N215-D246 PolarHBondContact ND2-O 2.78Å; N215-D246 VanDerWaalsContact ND2-O 3.12Å; N215-D246 PolarHBondContact OD1-O 2.84Å; N215-D246 VanDerWaalsContact OD1-O 3.07Å; R219-D246 CarbonylContact C-O 3.5Å; R219-D246 PolarHBondContact O-N 3.15Å; I221-D246 HydrophobicContact CD1-CB 4.15Å; D246-A258 HydrophobicContact CB-CB 3.44Å; D246-A258 VanDerWaalsContact CB-CB 3.44Å; D246-G259 VanDerWaalsContact OD2-C 3.29Å; D246-S260 WeakPolarHBondContact OD1-CA 3.29Å; D246-S260 PolarHBondContact OD2-N 3.33Å; D246-Y267 WeakPolarHBondContact OD2-CD2 3.06Å; D246-W269 HydrophobicContact CB-CH2 3.83Å
247	S	61.8	Low	76.5	Confident	18 Å²	18	42.6 Å²	42.6	13%	0.126	23%	0.227	C	C	.	.	S	Bend	trans	-109.9	-34.2	-161.2	82.4	0	0	0	0	118.5	R197 N215 G259 S261	R197-S247 PolarHBondContact NH2-O 3.19Å; N215-S247 PolarHBondContact ND2-O 2.83Å; S247-G259 PolarHBondContact N-O 3.42Å; S247-G259 PolarHBondContact OG-O 2.98Å; S247-S261 WeakPolarHBondContact OG-CA 3.19Å; S247-S261 PolarHBondContact OG-N 2.88Å
248	V	57.9	Low	76.6	Confident	37 Å²	37	38.1 Å²	38.1	22%	0.224	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.7	178.6	179.6	0	0	0	0	108	N215 A258 G259 M291	N215-V248 PolarHBondContact ND2-N 2.79Å; V248-A258 CarbonylContact O-C 3.55Å; V248-A258 WeakPolarHBondContact O-CA 3.21Å; V248-A258 WeakPolarHBondContact O-CB 3.48Å; V248-G259 PolarHBondContact N-O 3.44Å; V248-G259 PolarHBondContact O-N 3.12Å; V248-M291 HydrophobicContact CG1-CB 4.43Å
249	N	62.4	Low	76.6	Confident	16 Å²	16	37.8 Å²	37.8	9%	0.086	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.1	-175.1	61.5	-68	0	0	0	113.4	S198 E200 I221 C257	S198-N249 PolarHBondContact OG-OD1 2.84Å; E200-N249 VanDerWaalsContact CB-ND2 3.32Å; E200-N249 WeakPolarHBondContact CB-ND2 3.24Å; E200-N249 PolarHBondContact OE2-ND2 2.68Å; I221-N249 HydrophobicContact CD1-CB 3.99Å; N249-C257 WeakPolarHBondContact CA-O 3.44Å
250	S	58.1	Low	76.3	Confident	8 Å²	8	33 Å²	33	6%	0.056	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	144.2	158	-167.8	0	0	0	0	108	E200 C257 W293	E200-S250 WeakPolarHBondContact OE1-CA 3.43Å; E200-S250 PolarHBondContact OE1-OG 2.91Å; E200-S250 WeakPolarHBondContact OE2-CA 3.33Å; S250-C257 PolarHBondContact N-O 2.81Å; S250-C257 CarbonylContact O-C 3.52Å; S250-C257 VanDerWaalsContact O-CA 3.27Å; S250-C257 WeakPolarHBondContact O-CA 3.15Å; S250-C257 WeakPolarHBondContact O-CB 3.44Å; S250-C257 PolarHBondContact O-N 3.4Å; S250-W293 WeakPolarHBondContact OG-CB 3.49Å; S250-W293 PolarHBondContact OG-N 2.65Å
251	G	59.2	Low	75.7	Confident	11 Å²	11	36.1 Å²	36.1	11%	0.113	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	155.2	-179.2	0	0	0	0	0	113.9	E200 Y255	E200-G251 PolarHBondContact OE1-N 2.98Å; E200-G251 PolarHBondContact OE2-N 2.93Å; G251-Y255 WeakPolarHBondContact CA-O 3.29Å
252	D	67.5	Low	75.4	Confident	31 Å²	31	34.1 Å²	34.1	17%	0.166	19%	0.191	C	C	.	.			trans	-94.1	-161.6	164.4	73.9	8.7	0	0	0	109.9	E254 Y255	D252-E254 VanDerWaalsContact C-N 3.32Å; D252-E254 PolarHBondContact OD1-N 3.35Å; D252-Y255 PolarHBondContact N-O 3.38Å; D252-Y255 VanDerWaalsContact N-O 3.14Å; D252-Y255 PolarHBondContact OD1-N 3.46Å
253	S	67.7	Low	75.6	Confident	23 Å²	23	35.3 Å²	35.3	16%	0.161	20%	0.201	C	C	.	.	S	Bend	trans	-79.5	-11.7	179.4	51.3	0	0	0	0	114.8	R204 R271	R204-S253 VanDerWaalsContact C-CB 3.5Å; R204-S253 WeakPolarHBondContact CB-OG 3.47Å; R204-S253 VanDerWaalsContact O-CB 3.3Å; R204-S253 WeakPolarHBondContact O-CB 3.34Å; S253-R271 PolarHBondContact O-NE 3.15Å; S253-R271 PolarHBondContact O-NH2 3.27Å
254	E	79.8	Confident	75.8	Confident	97 Å²	97	30.7 Å²	30.7	45%	0.453	18%	0.181	S	C	.	.	S	Bend	trans	-119.3	-32.2	-171	-66.7	-173.7	173.3	0	0	111.9	D252 R271	D252-E254 VanDerWaalsContact C-N 3.32Å; D252-E254 PolarHBondContact OD1-N 3.35Å; E254-R271 WeakPolarHBondContact O-CB 3.45Å; E254-R271 PolarHBondContact O-N 2.86Å
255	Y	86	Confident	76.2	Confident	29 Å²	29	30.5 Å²	30.5	11%	0.114	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	145.4	-177.6	-59.6	-83.3	0	0	0	111.6	N10 Y11 G251 D252 I268 W269 E270 V277	N10-Y255 HydrophobicContact CB-CE2 3.67Å; Y11-Y255 AromaticContact CD1-CE1 3.95Å; Y11-Y255 HydrophobicContact CD1-CE1 3.95Å; G251-Y255 WeakPolarHBondContact CA-O 3.29Å; D252-Y255 PolarHBondContact N-O 3.38Å; D252-Y255 VanDerWaalsContact N-O 3.14Å; D252-Y255 PolarHBondContact OD1-N 3.46Å; Y255-I268 HydrophobicContact CD1-CG2 4.01Å; Y255-I268 HydrophobicContact CG-CG2 4.39Å; Y255-W269 CarbonylContact C-O 3.56Å; Y255-W269 WeakPolarHBondContact CA-O 3.27Å; Y255-E270 HydrophobicContact CE1-CB 4.48Å; Y255-V277 HydrophobicContact CE1-CG2 4.34Å
256	I	87.3	Confident	76.8	Confident	2 Å²	2	24 Å²	24	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.3	169.7	-54.1	172.2	0	0	0	105.9	M213 I221 V223 V244 I268 W269 R271	M213-I256 HydrophobicContact SD-CB 4.47Å; M213-I256 HydrophobicContact SD-CD1 4.18Å; M213-I256 HydrophobicContact SD-CG1 3.89Å; M213-I256 HydrophobicContact SD-CG2 3.95Å; I221-I256 HydrophobicContact CG2-CG2 4.45Å; V223-I256 HydrophobicContact CG2-CD1 3.65Å; V244-I256 HydrophobicContact CG2-CD1 3.95Å; V244-I256 HydrophobicContact CG2-CG2 4.17Å; I256-I268 CarbonylContact O-C 3.59Å; I256-I268 WeakPolarHBondContact O-CA 3.47Å; I256-W269 HydrophobicContact CB-CB 4.45Å; I256-W269 HydrophobicContact CB-CE3 4.5Å; I256-W269 HydrophobicContact CG2-CE3 4.45Å; I256-W269 PolarHBondContact N-O 3.41Å; I256-W269 PolarHBondContact O-N 2.99Å; I256-R271 HydrophobicContact CD1-CG 4.4Å; I256-R271 HydrophobicContact CG1-CB 4.36Å
257	C	88.9	Confident	77.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.7	168.7	-164.5	0	0	0	0	108.9	N249 S250 Y267 I268 M291 W293	N249-C257 WeakPolarHBondContact CA-O 3.44Å; S250-C257 PolarHBondContact N-O 2.81Å; S250-C257 CarbonylContact O-C 3.52Å; S250-C257 VanDerWaalsContact O-CA 3.27Å; S250-C257 WeakPolarHBondContact O-CA 3.15Å; S250-C257 WeakPolarHBondContact O-CB 3.44Å; S250-C257 PolarHBondContact O-N 3.4Å; C257-Y267 CarbonylContact C-O 3.55Å; C257-Y267 VanDerWaalsContact CA-O 3.32Å; C257-Y267 WeakPolarHBondContact CA-O 3.41Å; C257-I268 HydrophobicContact CB-CG1 4.46Å; C257-M291 HydrophobicContact CB-CE 4.05Å; C257-M291 HydrophobicContact CB-SD 4.19Å; C257-M291 WeakPolarHBondContact O-CE 3.22Å; C257-M291 PolarHBondContact SG-SD 3.17Å; C257-W293 HydrophobicContact CB-CE3 3.57Å; C257-W293 HydrophobicContact CB-CZ3 3.67Å
258	A	88.2	Confident	79.3	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	145.8	172	0	0	0	0	0	114	I221 D246 V248 L266 Y267 W269	I221-A258 HydrophobicContact CD1-CB 3.54Å; D246-A258 HydrophobicContact CB-CB 3.44Å; D246-A258 VanDerWaalsContact CB-CB 3.44Å; V248-A258 CarbonylContact O-C 3.55Å; V248-A258 WeakPolarHBondContact O-CA 3.21Å; V248-A258 WeakPolarHBondContact O-CB 3.48Å; A258-L266 CarbonylContact O-C 3.58Å; A258-L266 VanDerWaalsContact O-CA 3.26Å; A258-L266 WeakPolarHBondContact O-CA 3.34Å; A258-Y267 PolarHBondContact N-O 3.06Å; A258-Y267 PolarHBondContact O-N 3.09Å; A258-W269 HydrophobicContact CB-CH2 3.85Å; A258-W269 HydrophobicContact CB-CZ3 3.42Å; A258-W269 VanDerWaalsContact CB-CZ3 3.42Å
259	G	86.4	Confident	80.8	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	135	173.1	0	0	0	0	0	111.6	D246 S247 V248 A265	D246-G259 VanDerWaalsContact OD2-C 3.29Å; S247-G259 PolarHBondContact N-O 3.42Å; S247-G259 PolarHBondContact OG-O 2.98Å; V248-G259 PolarHBondContact N-O 3.44Å; V248-G259 PolarHBondContact O-N 3.12Å; G259-A265 WeakPolarHBondContact CA-O 3.27Å
260	S	83.4	Confident	82	Confident	17 Å²	17	27.1 Å²	27.1	12%	0.119	16%	0.157	C	C	.	.			trans	-62.3	136.9	175.3	-169.5	0	0	0	0	112.3	D246 G262 T263 A265	D246-S260 WeakPolarHBondContact OD1-CA 3.29Å; D246-S260 PolarHBondContact OD2-N 3.33Å; S260-G262 PolarHBondContact O-N 2.93Å; S260-G262 VanDerWaalsContact O-N 3.12Å; S260-T263 VanDerWaalsContact CB-OG1 3.23Å; S260-T263 WeakPolarHBondContact CB-OG1 3.36Å; S260-T263 PolarHBondContact OG-OG1 2.86Å; S260-A265 WeakPolarHBondContact CB-O 3.44Å; S260-A265 PolarHBondContact N-O 2.79Å
261	S	74.3	Confident	83.2	Confident	82 Å²	82	30.2 Å²	30.2	57%	0.573	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	108.9	169.2	173.9	0	0	0	0	110.6	S247	S247-S261 WeakPolarHBondContact OG-CA 3.19Å; S247-S261 PolarHBondContact OG-N 2.88Å
262	G	79.9	Confident	84.3	Confident	37 Å²	37	33.7 Å²	33.7	38%	0.381	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	-0.6	169.3	0	0	0	0	0	115.6	S260	S260-G262 PolarHBondContact O-N 2.93Å; S260-G262 VanDerWaalsContact O-N 3.12Å
263	T	86.3	Confident	85.2	Confident	68 Å²	68	35.1 Å²	35.1	42%	0.417	20%	0.202	S	C	.	.	S	Bend	trans	-135.2	153.6	171.2	58.3	0	0	0	0	110.6	S260 A265 E286	S260-T263 VanDerWaalsContact CB-OG1 3.23Å; S260-T263 WeakPolarHBondContact CB-OG1 3.36Å; S260-T263 PolarHBondContact OG-OG1 2.86Å; T263-A265 PolarHBondContact O-N 2.82Å; T263-E286 CarbonylContact C-O 3.53Å; T263-E286 WeakPolarHBondContact CA-O 3.24Å
264	H	88.2	Confident	85.9	Confident	8 Å²	8	34.8 Å²	34.8	4%	0.037	20%	0.203	C	C	.	.	S	Bend	trans	-78.6	70.2	169.9	-170.7	-168.7	0	0	0	109.3	G282 S283 E286 S302 S304 W311	H264-G282 VanDerWaalsContact O-CA 3.31Å; H264-G282 WeakPolarHBondContact O-CA 3.23Å; H264-G282 PolarHBondContact O-N 2.77Å; H264-S283 WeakPolarHBondContact CB-O 3.41Å; H264-S283 PolarHBondContact ND1-N 2.93Å; H264-S283 VanDerWaalsContact ND1-N 3.11Å; H264-E286 HydrophobicContact CB-CB 4.05Å; H264-E286 PolarHBondContact N-O 3.18Å; H264-E286 IonicContact ND1-OE2 3.55Å; H264-S302 PolarHBondContact NE2-OG 2.77Å; H264-S304 PolarHBondContact CE1-OG 2.89Å; H264-S304 PolarHBondContact ND1-OG 3.02Å; H264-W311 AromaticContact NE2-CZ2 3.87Å
265	A	90.5	Very high	86.3	Confident	6 Å²	6	32.8 Å²	32.8	5%	0.05	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	138.9	174.8	0	0	0	0	0	109.6	G259 S260 T263 Y267 L280	G259-A265 WeakPolarHBondContact CA-O 3.27Å; S260-A265 WeakPolarHBondContact CB-O 3.44Å; S260-A265 PolarHBondContact N-O 2.79Å; T263-A265 PolarHBondContact O-N 2.82Å; A265-Y267 HydrophobicContact CB-CE2 4.5Å; A265-L280 CarbonylContact C-O 3.43Å; A265-L280 VanDerWaalsContact CA-O 3.23Å; A265-L280 WeakPolarHBondContact CA-O 3.38Å
266	L	91.8	Very high	86.5	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139.9	173.8	-45.4	177.7	0	0	0	109.5	A258 L280 V288 M291 V300 W311	A258-L266 CarbonylContact O-C 3.58Å; A258-L266 VanDerWaalsContact O-CA 3.26Å; A258-L266 WeakPolarHBondContact O-CA 3.34Å; L266-L280 HydrophobicContact CB-CB 4.07Å; L266-L280 HydrophobicContact CB-CD1 4.33Å; L266-L280 HydrophobicContact CD1-CD1 4.23Å; L266-L280 PolarHBondContact N-O 2.82Å; L266-L280 PolarHBondContact O-N 2.94Å; L266-V288 HydrophobicContact CD2-CG1 4.4Å; L266-V288 HydrophobicContact CD2-CG2 3.76Å; L266-M291 HydrophobicContact CD1-SD 4.18Å; L266-M291 HydrophobicContact CD2-SD 3.75Å; L266-M291 HydrophobicContact CG-SD 4.48Å; L266-V300 HydrophobicContact CD1-CG1 4.06Å; L266-W311 HydrophobicContact CD1-CD2 4.24Å; L266-W311 HydrophobicContact CD1-CG 4.02Å
267	Y	91.1	Very high	86.6	Confident	66 Å²	66	36.6 Å²	36.6	26%	0.259	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138	176.5	-63.1	-96.9	0	0	0	108.3	D246 C257 A258 A265 W269 F279	D246-Y267 WeakPolarHBondContact OD2-CD2 3.06Å; C257-Y267 CarbonylContact C-O 3.55Å; C257-Y267 VanDerWaalsContact CA-O 3.32Å; C257-Y267 WeakPolarHBondContact CA-O 3.41Å; A258-Y267 PolarHBondContact N-O 3.06Å; A258-Y267 PolarHBondContact O-N 3.09Å; A265-Y267 HydrophobicContact CB-CE2 4.5Å; Y267-W269 HydrophobicContact CD2-CH2 4.33Å; Y267-W269 AromaticContact CG-CH2 3.82Å; Y267-W269 HydrophobicContact CG-CH2 3.82Å; Y267-W269 HydrophobicContact CG-CZ2 4.19Å; Y267-W269 HydrophobicContact CG-CZ3 4.49Å; Y267-W269 WeakPolarHBondContact O-CZ3 3.27Å; Y267-F279 AromaticContact CD1-CD1 3.21Å; Y267-F279 HydrophobicContact CD1-CD1 3.21Å; Y267-F279 AromaticContact CD1-CE1 3.35Å; Y267-F279 HydrophobicContact CD1-CE1 3.35Å; Y267-F279 HydrophobicContact CD1-CG 4.38Å; Y267-F279 AromaticContact CE1-CD1 3.26Å; Y267-F279 HydrophobicContact CE1-CD1 3.26Å; Y267-F279 AromaticContact CE1-CE1 3.37Å; Y267-F279 HydrophobicContact CE1-CE1 3.37Å; Y267-F279 HydrophobicContact CG-CD1 4.36Å
268	I	91	Very high	86.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.9	179.5	-58.8	175	0	0	0	107.9	P12 Y255 I256 C257 V277 K278 L280 W293	P12-I268 HydrophobicContact CG-CD1 3.63Å; Y255-I268 HydrophobicContact CD1-CG2 4.01Å; Y255-I268 HydrophobicContact CG-CG2 4.39Å; I256-I268 CarbonylContact O-C 3.59Å; I256-I268 WeakPolarHBondContact O-CA 3.47Å; C257-I268 HydrophobicContact CB-CG1 4.46Å; I268-V277 PolarHBondContact O-N 3.46Å; I268-K278 HydrophobicContact CB-CB 4.29Å; I268-K278 HydrophobicContact CD1-CB 4.39Å; I268-K278 PolarHBondContact N-O 2.88Å; I268-K278 PolarHBondContact O-N 3.33Å; I268-L280 HydrophobicContact CD1-CD1 3.94Å; I268-L280 HydrophobicContact CD1-CG 4.47Å; I268-W293 HydrophobicContact CD1-CH2 4.46Å; I268-W293 HydrophobicContact CD1-CZ3 4.26Å; I268-W293 HydrophobicContact CG1-CZ3 4.46Å; I268-W293 HydrophobicContact CG2-CH2 4.46Å; I268-W293 HydrophobicContact CG2-CZ3 4.46Å
269	W	88.7	Confident	86.9	Confident	14 Å²	14	44.5 Å²	44.5	5%	0.053	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	145.7	175.5	-61.9	-100.5	0	0	0	110.5	V244 D246 Y255 I256 A258 Y267 S275 V276	V244-W269 HydrophobicContact CB-CD2 4.04Å; V244-W269 HydrophobicContact CB-CG 4.12Å; V244-W269 HydrophobicContact CB-CZ2 4.49Å; V244-W269 HydrophobicContact CG1-CB 4.1Å; V244-W269 HydrophobicContact CG1-CD2 4.13Å; V244-W269 HydrophobicContact CG1-CG 3.67Å; V244-W269 HydrophobicContact CG2-CD2 4.35Å; D246-W269 HydrophobicContact CB-CH2 3.83Å; Y255-W269 CarbonylContact C-O 3.56Å; Y255-W269 WeakPolarHBondContact CA-O 3.27Å; I256-W269 HydrophobicContact CB-CB 4.45Å; I256-W269 HydrophobicContact CB-CE3 4.5Å; I256-W269 HydrophobicContact CG2-CE3 4.45Å; I256-W269 PolarHBondContact N-O 3.41Å; I256-W269 PolarHBondContact O-N 2.99Å; A258-W269 HydrophobicContact CB-CH2 3.85Å; A258-W269 HydrophobicContact CB-CZ3 3.42Å; A258-W269 VanDerWaalsContact CB-CZ3 3.42Å; Y267-W269 HydrophobicContact CD2-CH2 4.33Å; Y267-W269 AromaticContact CG-CH2 3.82Å; Y267-W269 HydrophobicContact CG-CH2 3.82Å; Y267-W269 HydrophobicContact CG-CZ2 4.19Å; Y267-W269 HydrophobicContact CG-CZ3 4.49Å; Y267-W269 WeakPolarHBondContact O-CZ3 3.27Å; W269-S275 CarbonylContact C-O 3.47Å; W269-S275 WeakPolarHBondContact CA-O 3.26Å; W269-S275 WeakPolarHBondContact CB-O 3.48Å; W269-V276 HydrophobicContact CG-CG2 4.49Å
270	E	87.2	Confident	87.2	Confident	70 Å²	70	44.7 Å²	44.7	33%	0.327	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	127.5	163.4	-172	-169.2	-163.3	0	0	108.6	Y255 S272 S273 G274 S275 V277	Y255-E270 HydrophobicContact CE1-CB 4.48Å; E270-S272 WeakPolarHBondContact CG-OG 3.4Å; E270-S272 PolarHBondContact O-N 2.83Å; E270-S272 PolarHBondContact OE1-OG 2.8Å; E270-S273 VanDerWaalsContact OE2-CB 3.3Å; E270-S273 WeakPolarHBondContact OE2-CB 3.47Å; E270-S273 PolarHBondContact OE2-OG 3.2Å; E270-G274 WeakPolarHBondContact O-CA 3.41Å; E270-G274 PolarHBondContact O-N 2.9Å; E270-S275 PolarHBondContact N-O 3.25Å; E270-V277 HydrophobicContact CB-CG2 3.76Å
271	R	84	Confident	87.7	Confident	72 Å²	72	50.9 Å²	50.9	27%	0.272	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-38.2	-174.8	-175.9	-173.1	63.2	78.1	0.3	112.8	S253 E254 I256	S253-R271 PolarHBondContact O-NE 3.15Å; S253-R271 PolarHBondContact O-NH2 3.27Å; E254-R271 WeakPolarHBondContact O-CB 3.45Å; E254-R271 PolarHBondContact O-N 2.86Å; I256-R271 HydrophobicContact CD1-CG 4.4Å; I256-R271 HydrophobicContact CG1-CB 4.36Å
272	S	82.4	Confident	88.3	Confident	84 Å²	84	48 Å²	48	59%	0.587	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-44.9	-175.8	52.5	0	0	0	0	111.8	E270	E270-S272 WeakPolarHBondContact CG-OG 3.4Å; E270-S272 PolarHBondContact O-N 2.83Å; E270-S272 PolarHBondContact OE1-OG 2.8Å
273	S	86	Confident	88.7	Confident	61 Å²	61	49 Å²	49	43%	0.427	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-23.8	-177.7	66.7	0	0	0	0	113.2	E270 S275	E270-S273 VanDerWaalsContact OE2-CB 3.3Å; E270-S273 WeakPolarHBondContact OE2-CB 3.47Å; E270-S273 PolarHBondContact OE2-OG 3.2Å; S273-S275 PolarHBondContact O-N 2.9Å; S273-S275 WeakPolarHBondContact OG-CB 3.42Å; S273-S275 PolarHBondContact OG-N 3.42Å; S273-S275 PolarHBondContact OG-OG 2.91Å
274	G	83.2	Confident	88.7	Confident	17 Å²	17	55.8 Å²	55.8	18%	0.175	30%	0.296	C	S	.	.			trans	70.4	8.7	-170.8	0	0	0	0	0	114	E270	E270-G274 WeakPolarHBondContact O-CA 3.41Å; E270-G274 PolarHBondContact O-N 2.9Å
275	S	87.8	Confident	88.6	Confident	55 Å²	55	59.3 Å²	59.3	39%	0.385	33%	0.334	S	S	.	.			trans	-78.1	146.3	179.8	67.2	0	0	0	0	111.1	W269 E270 S273	W269-S275 CarbonylContact C-O 3.47Å; W269-S275 WeakPolarHBondContact CA-O 3.26Å; W269-S275 WeakPolarHBondContact CB-O 3.48Å; E270-S275 PolarHBondContact N-O 3.25Å; S273-S275 PolarHBondContact O-N 2.9Å; S273-S275 WeakPolarHBondContact OG-CB 3.42Å; S273-S275 PolarHBondContact OG-N 3.42Å; S273-S275 PolarHBondContact OG-OG 2.91Å
276	V	89.6	Confident	88.6	Confident	62 Å²	62	61.1 Å²	61.1	38%	0.376	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	126.6	171.9	-174	0	0	0	0	108.2	W269 F279	W269-V276 HydrophobicContact CG-CG2 4.49Å; V276-F279 HydrophobicContact CB-CE2 4.34Å; V276-F279 HydrophobicContact CB-CZ 4.02Å; V276-F279 HydrophobicContact CG1-CD1 4.34Å; V276-F279 HydrophobicContact CG1-CD2 4.14Å; V276-F279 HydrophobicContact CG1-CE1 3.79Å; V276-F279 HydrophobicContact CG1-CE2 3.56Å; V276-F279 HydrophobicContact CG1-CG 4.5Å; V276-F279 HydrophobicContact CG1-CZ 3.37Å; V276-F279 HydrophobicContact CG2-CZ 4.29Å
277	V	90.2	Very high	88.5	Confident	49 Å²	49	65.9 Å²	65.9	30%	0.297	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-42.7	-179.6	-175.4	0	0	0	0	110.9	Y11 Y255 I268 E270	Y11-V277 HydrophobicContact CD1-CG1 3.81Å; Y11-V277 HydrophobicContact CD2-CG1 4.39Å; Y11-V277 HydrophobicContact CE1-CG1 3.41Å; Y11-V277 VanDerWaalsContact CE1-CG1 3.41Å; Y11-V277 HydrophobicContact CE2-CG1 4.07Å; Y11-V277 HydrophobicContact CG-CG1 4.29Å; Y255-V277 HydrophobicContact CE1-CG2 4.34Å; I268-V277 PolarHBondContact O-N 3.46Å; E270-V277 HydrophobicContact CB-CG2 3.76Å
278	K	90.9	Very high	88.5	Confident	52 Å²	52	63.4 Å²	63.4	23%	0.226	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	148.8	-175.7	-160.2	73.4	170.2	-152.5	0	112.4	Y11 E13 I268 L280	Y11-K278 HydrophobicContact CD2-CB 4.19Å; Y11-K278 HydrophobicContact CD2-CG 4.5Å; Y11-K278 HydrophobicContact CE2-CB 4.22Å; Y11-K278 HydrophobicContact CE2-CD 4.19Å; Y11-K278 HydrophobicContact CE2-CG 4.39Å; E13-K278 IonicContact OE1-NZ 3.79Å; E13-K278 PolarHBondContact OE1-NZ 3.38Å; E13-K278 IonicContact OE2-NZ 3.93Å; E13-K278 PolarHBondContact OE2-NZ 3.18Å; I268-K278 HydrophobicContact CB-CB 4.29Å; I268-K278 HydrophobicContact CD1-CB 4.39Å; I268-K278 PolarHBondContact N-O 2.88Å; I268-K278 PolarHBondContact O-N 3.33Å; K278-L280 HydrophobicContact CG-CD2 3.86Å; K278-L280 HydrophobicContact CG-CG 4.42Å
279	F	91.6	Very high	88.5	Confident	113 Å²	113	67.3 Å²	67.3	50%	0.496	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	114.5	171.4	-57.2	-95.3	0	0	0	108.8	Y267 V276	Y267-F279 AromaticContact CD1-CD1 3.21Å; Y267-F279 HydrophobicContact CD1-CD1 3.21Å; Y267-F279 AromaticContact CD1-CE1 3.35Å; Y267-F279 HydrophobicContact CD1-CE1 3.35Å; Y267-F279 HydrophobicContact CD1-CG 4.38Å; Y267-F279 AromaticContact CE1-CD1 3.26Å; Y267-F279 HydrophobicContact CE1-CD1 3.26Å; Y267-F279 AromaticContact CE1-CE1 3.37Å; Y267-F279 HydrophobicContact CE1-CE1 3.37Å; Y267-F279 HydrophobicContact CG-CD1 4.36Å; V276-F279 HydrophobicContact CB-CE2 4.34Å; V276-F279 HydrophobicContact CB-CZ 4.02Å; V276-F279 HydrophobicContact CG1-CD1 4.34Å; V276-F279 HydrophobicContact CG1-CD2 4.14Å; V276-F279 HydrophobicContact CG1-CE1 3.79Å; V276-F279 HydrophobicContact CG1-CE2 3.56Å; V276-F279 HydrophobicContact CG1-CG 4.5Å; V276-F279 HydrophobicContact CG1-CZ 3.37Å; V276-F279 HydrophobicContact CG2-CZ 4.29Å
280	L	93	Very high	88.7	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.021	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.7	178	-55.9	177.2	0	0	0	109.2	P12 E13 A265 L266 I268 K278 W311	P12-L280 HydrophobicContact CB-CD1 4.48Å; P12-L280 HydrophobicContact CG-CD1 4.23Å; E13-L280 WeakPolarHBondContact O-CD2 3.27Å; A265-L280 CarbonylContact C-O 3.43Å; A265-L280 VanDerWaalsContact CA-O 3.23Å; A265-L280 WeakPolarHBondContact CA-O 3.38Å; L266-L280 HydrophobicContact CB-CB 4.07Å; L266-L280 HydrophobicContact CB-CD1 4.33Å; L266-L280 HydrophobicContact CD1-CD1 4.23Å; L266-L280 PolarHBondContact N-O 2.82Å; L266-L280 PolarHBondContact O-N 2.94Å; I268-L280 HydrophobicContact CD1-CD1 3.94Å; I268-L280 HydrophobicContact CD1-CG 4.47Å; K278-L280 HydrophobicContact CG-CD2 3.86Å; K278-L280 HydrophobicContact CG-CG 4.42Å; L280-W311 HydrophobicContact CB-CD2 4.39Å; L280-W311 HydrophobicContact CB-CE3 3.86Å; L280-W311 HydrophobicContact CB-CH2 4.44Å; L280-W311 HydrophobicContact CB-CZ3 3.89Å; L280-W311 HydrophobicContact CD1-CB 4.05Å; L280-W311 HydrophobicContact CD1-CD2 4.1Å; L280-W311 HydrophobicContact CD1-CE3 3.96Å; L280-W311 HydrophobicContact CD1-CG 4.14Å; L280-W311 HydrophobicContact CD2-CE3 4.31Å; L280-W311 HydrophobicContact CG-CE3 4.27Å
281	H	93.1	Very high	88.9	Confident	148 Å²	148	64.3 Å²	64.3	69%	0.685	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.7	-178.3	-67.1	79.7	0	0	0	109.7	W311	H281-W311 WeakPolarHBondContact O-CH2 3.49Å
282	G	88.5	Confident	89.3	Confident	20 Å²	20	61.6 Å²	61.6	21%	0.206	35%	0.354	C	S	.	.			trans	-89.8	-154.2	171.5	0	0	0	0	0	112.7	H264 K284	H264-G282 VanDerWaalsContact O-CA 3.31Å; H264-G282 WeakPolarHBondContact O-CA 3.23Å; H264-G282 PolarHBondContact O-N 2.77Å; G282-K284 PolarHBondContact O-N 2.91Å
283	S	87.7	Confident	89.7	Confident	59 Å²	59	58.2 Å²	58.2	41%	0.413	33%	0.329	S	S	.	.			trans	-66.5	127.8	-174.7	-64.6	0	0	0	0	111.6	H264 G285 E286	H264-S283 WeakPolarHBondContact CB-O 3.41Å; H264-S283 PolarHBondContact ND1-N 2.93Å; H264-S283 VanDerWaalsContact ND1-N 3.11Å; S283-G285 PolarHBondContact O-N 3.4Å; S283-E286 VanDerWaalsContact CB-CD 3.49Å; S283-E286 WeakPolarHBondContact CB-OE2 3.23Å; S283-E286 PolarHBondContact O-N 3.33Å
284	K	87.1	Confident	90	Very high	211 Å²	211	55.5 Å²	55.5	92%	0.917	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	133.7	177.6	-70.7	-175.8	179.6	177.6	0	110.7	G282 E286	G282-K284 PolarHBondContact O-N 2.91Å; K284-E286 VanDerWaalsContact C-N 3.29Å
285	G	85.8	Confident	90	Very high	81 Å²	81	56 Å²	56	84%	0.835	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-5.1	178	0	0	0	0	0	114.6	S283	S283-G285 PolarHBondContact O-N 3.4Å
286	E	90.4	Very high	89.6	Confident	45 Å²	45	54.6 Å²	54.6	21%	0.21	30%	0.298	C	S	.	.			trans	-92.7	166.7	172.4	-58.1	-169.9	164.6	0	0	111	T263 H264 S283 K284 S304 N305	T263-E286 CarbonylContact C-O 3.53Å; T263-E286 WeakPolarHBondContact CA-O 3.24Å; H264-E286 HydrophobicContact CB-CB 4.05Å; H264-E286 PolarHBondContact N-O 3.18Å; H264-E286 IonicContact ND1-OE2 3.55Å; S283-E286 VanDerWaalsContact CB-CD 3.49Å; S283-E286 WeakPolarHBondContact CB-OE2 3.23Å; S283-E286 PolarHBondContact O-N 3.33Å; K284-E286 VanDerWaalsContact C-N 3.29Å; E286-S304 PolarHBondContact OE2-OG 2.85Å; E286-N305 VanDerWaalsContact CD-CB 3.45Å; E286-N305 HydrophobicContact CG-CB 4.07Å; E286-N305 WeakPolarHBondContact OE1-CB 3.09Å; E286-N305 PolarHBondContact OE1-ND2 3.2Å
287	Q	89.7	Confident	89.4	Confident	101 Å²	101	57 Å²	57	47%	0.472	30%	0.301	S	S	.	.			trans	-127.7	147.1	178	-58.5	-175.7	4.6	0	0	109.6	L289 S304	Q287-L289 PolarHBondContact O-N 3.42Å; Q287-S304 WeakPolarHBondContact O-CA 3.32Å; Q287-S304 WeakPolarHBondContact O-CB 3.32Å
288	V	91.3	Very high	89.2	Confident	14 Å²	14	56.9 Å²	56.9	9%	0.085	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	117.3	171.7	-176.6	0	0	0	0	108.7	L266 D290 M291	L266-V288 HydrophobicContact CD2-CG1 4.4Å; L266-V288 HydrophobicContact CD2-CG2 3.76Å; V288-D290 WeakPolarHBondContact CG1-O 3.25Å; V288-M291 HydrophobicContact CG1-CB 4.32Å
289	L	90.4	Very high	89.2	Confident	82 Å²	82	54.6 Å²	54.6	43%	0.429	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-45	176.1	-60.9	-179.8	0	0	0	111.3	Y24 Q287 V303	Y24-L289 HydrophobicContact CE1-CD1 4.19Å; Q287-L289 PolarHBondContact O-N 3.42Å; L289-V303 HydrophobicContact CB-CB 4.44Å; L289-V303 HydrophobicContact CB-CG1 4.37Å; L289-V303 HydrophobicContact CD1-CG1 4.39Å; L289-V303 PolarHBondContact N-O 2.95Å
290	D	92.1	Very high	89.3	Confident	17 Å²	17	49.2 Å²	49.2	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	160.4	179.4	-170.2	24.4	0	0	0	109.4	I26 C27 C28 R29 V288 S302 V303	I26-D290 WeakPolarHBondContact O-CB 3.4Å; C27-D290 WeakPolarHBondContact CA-OD2 3.2Å; C27-D290 HydrophobicContact CB-CB 4.49Å; C27-D290 WeakPolarHBondContact CB-OD2 3.31Å; C28-D290 PolarHBondContact N-OD2 3.39Å; R29-D290 IonicContact CZ-OD1 3.55Å; R29-D290 IonicContact CZ-OD2 2.73Å; R29-D290 IonicContact NH1-OD1 2.7Å; R29-D290 PolarHBondContact NH1-OD1 2.9Å; R29-D290 IonicContact NH1-OD2 3.33Å; R29-D290 PolarHBondContact NH1-OD2 2.9Å; R29-D290 IonicContact NH2-OD1 2.75Å; R29-D290 PolarHBondContact NH2-OD1 3.29Å; R29-D290 IonicContact NH2-OD2 3.42Å; V288-D290 WeakPolarHBondContact CG1-O 3.25Å; D290-S302 WeakPolarHBondContact O-CA 3.47Å; D290-V303 HydrophobicContact CB-CB 4.38Å; D290-V303 HydrophobicContact CB-CG2 4.28Å; D290-V303 PolarHBondContact O-N 3.12Å
291	M	91.6	Very high	89.4	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.02	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	143.5	-179.6	-179.3	-179.2	58.5	0	0	110.3	V248 C257 L266 V288 V300 F301	V248-M291 HydrophobicContact CG1-CB 4.43Å; C257-M291 HydrophobicContact CB-CE 4.05Å; C257-M291 HydrophobicContact CB-SD 4.19Å; C257-M291 WeakPolarHBondContact O-CE 3.22Å; C257-M291 PolarHBondContact SG-SD 3.17Å; L266-M291 HydrophobicContact CD1-SD 4.18Å; L266-M291 HydrophobicContact CD2-SD 3.75Å; L266-M291 HydrophobicContact CG-SD 4.48Å; V288-M291 HydrophobicContact CG1-CB 4.32Å; M291-V300 HydrophobicContact CG-CG1 3.54Å; M291-V300 HydrophobicContact SD-CG1 3.81Å; M291-F301 CarbonylContact C-O 3.51Å; M291-F301 VanDerWaalsContact CA-O 3.24Å; M291-F301 WeakPolarHBondContact CA-O 3.49Å; M291-F301 WeakPolarHBondContact CG-O 3.34Å
292	V	92.8	Very high	89.5	Confident	14 Å²	14	42.1 Å²	42.1	9%	0.085	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	127.9	174.7	68.4	0	0	0	0	111	C28 F30 L37 F301	C28-V292 VanDerWaalsContact SG-CG1 3.55Å; F30-V292 HydrophobicContact CD2-CB 4.39Å; F30-V292 HydrophobicContact CD2-CG1 3.75Å; F30-V292 HydrophobicContact CD2-CG2 3.81Å; F30-V292 HydrophobicContact CE2-CG1 3.84Å; L37-V292 HydrophobicContact CD1-CG1 3.98Å; V292-F301 HydrophobicContact CG1-CB 3.98Å; V292-F301 PolarHBondContact N-O 2.92Å; V292-F301 PolarHBondContact O-N 2.85Å
293	W	91.2	Very high	89.8	Confident	14 Å²	14	41.2 Å²	41.2	5%	0.053	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	137.2	171.6	-164.5	-69.4	0	0	0	110.4	P12 S250 C257 I268 R297 V300	P12-W293 HydrophobicContact CG-CH2 4.19Å; P12-W293 HydrophobicContact CG-CZ3 4.4Å; S250-W293 WeakPolarHBondContact OG-CB 3.49Å; S250-W293 PolarHBondContact OG-N 2.65Å; C257-W293 HydrophobicContact CB-CE3 3.57Å; C257-W293 HydrophobicContact CB-CZ3 3.67Å; I268-W293 HydrophobicContact CD1-CH2 4.46Å; I268-W293 HydrophobicContact CD1-CZ3 4.26Å; I268-W293 HydrophobicContact CG1-CZ3 4.46Å; I268-W293 HydrophobicContact CG2-CH2 4.46Å; I268-W293 HydrophobicContact CG2-CZ3 4.46Å; W293-R297 PolarHBondContact NE1-O 2.84Å; W293-V300 HydrophobicContact CB-CG2 4.22Å; W293-V300 HydrophobicContact CD2-CG2 3.45Å; W293-V300 VanDerWaalsContact CD2-CG2 3.45Å; W293-V300 HydrophobicContact CE3-CG2 3.15Å; W293-V300 HydrophobicContact CG-CG2 3.93Å; W293-V300 HydrophobicContact CH2-CG2 4.46Å; W293-V300 HydrophobicContact CZ3-CG2 3.71Å
294	H	91.3	Very high	90.1	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.019	21%	0.206	C	C	.	.			trans	-68.4	124.3	178.7	-177.3	-78.5	0	0	0	110.6	F30 G34 F51 V296 R297 A299	F30-H294 HydrophobicContact CD2-CB 4.41Å; F30-H294 AromaticContact CE1-CD2 3.6Å; F30-H294 HydrophobicContact CE2-CB 3.78Å; F30-H294 HydrophobicContact CZ-CB 3.97Å; F30-H294 AromaticContact CZ-CD2 3.55Å; G34-H294 PolarHBondContact O-CD2 3.09Å; G34-H294 PolarHBondContact O-NE2 2.96Å; F51-H294 AromaticContact CD1-CD2 3.93Å; F51-H294 AromaticContact CD1-NE2 3.61Å; F51-H294 AromaticContact CD2-CD2 3.98Å; F51-H294 AromaticContact CE1-CD2 3.75Å; F51-H294 AromaticContact CE1-NE2 3.63Å; F51-H294 AromaticContact CE2-CD2 3.79Å; F51-H294 AromaticContact CZ-CD2 3.67Å; H294-V296 PolarHBondContact ND1-N 2.95Å; H294-V296 VanDerWaalsContact ND1-N 3.18Å; H294-V296 PolarHBondContact O-N 2.93Å; H294-R297 WeakPolarHBondContact ND1-CB 3.33Å; H294-R297 PolarHBondContact ND1-N 2.89Å; H294-R297 PolarHBondContact O-N 2.77Å; H294-R297 VanDerWaalsContact O-O 3.08Å; H294-A299 HydrophobicContact CB-CB 4Å; H294-A299 VanDerWaalsContact CB-O 3.29Å; H294-A299 WeakPolarHBondContact CB-O 3.46Å; H294-A299 PolarHBondContact N-O 2.86Å
295	P	84.2	Confident	90.4	Very high	26 Å²	26	32.7 Å²	32.7	17%	0.169	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.1	-166.5	24.2	-35.3	0	0	0	114.4	G34 R204	G34-P295 VanDerWaalsContact N-CG 3.34Å; R204-P295 PolarHBondContact NH1-O 3.34Å
296	V	80	Confident	90.8	Very high	26 Å²	26	29 Å²	29	16%	0.158	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-9.2	-174.4	-31.7	0	0	0	0	116.5	M1 R204 H294 F377	M1-V296 HydrophobicContact CE-CG2 4.38Å; R204-V296 VanDerWaalsContact NH1-CA 3.33Å; H294-V296 PolarHBondContact ND1-N 2.95Å; H294-V296 VanDerWaalsContact ND1-N 3.18Å; H294-V296 PolarHBondContact O-N 2.93Å; V296-F377 HydrophobicContact CB-CE1 4.44Å; V296-F377 HydrophobicContact CB-CE2 4.14Å; V296-F377 HydrophobicContact CB-CZ 3.59Å; V296-F377 HydrophobicContact CG1-CD1 4.46Å; V296-F377 HydrophobicContact CG1-CE1 3.48Å; V296-F377 VanDerWaalsContact CG1-CE1 3.48Å; V296-F377 HydrophobicContact CG1-CE2 3.73Å; V296-F377 HydrophobicContact CG1-CZ 3.04Å
297	R	84.1	Confident	91	Very high	113 Å²	113	31.2 Å²	31.2	43%	0.426	16%	0.156	S	C	.	.	S	Bend	trans	-132.4	159.7	-171.4	-66.8	178.8	-178	-168.8	4.8	109.1	W293 H294 A299	W293-R297 PolarHBondContact NE1-O 2.84Å; H294-R297 WeakPolarHBondContact ND1-CB 3.33Å; H294-R297 PolarHBondContact ND1-N 2.89Å; H294-R297 PolarHBondContact O-N 2.77Å; H294-R297 VanDerWaalsContact O-O 3.08Å; R297-A299 PolarHBondContact O-N 3.17Å
298	T	87.4	Confident	91.3	Very high	46 Å²	46	26.4 Å²	26.4	28%	0.282	13%	0.133	S	C	.	.	S	Bend	trans	-78.5	63.1	176.2	50.9	0	0	0	0	110.7	N10	N10-T298 WeakPolarHBondContact O-CG2 3.4Å
299	A	90.9	Very high	91.6	Very high	4 Å²	4	26 Å²	26	3%	0.033	13%	0.131	C	C	.	.			trans	-140.5	143.3	-177.3	0	0	0	0	0	111.2	F51 H294 R297 L310 W311	F51-A299 HydrophobicContact CZ-CB 4.12Å; H294-A299 HydrophobicContact CB-CB 4Å; H294-A299 VanDerWaalsContact CB-O 3.29Å; H294-A299 WeakPolarHBondContact CB-O 3.46Å; H294-A299 PolarHBondContact N-O 2.86Å; R297-A299 PolarHBondContact O-N 3.17Å; A299-L310 HydrophobicContact CB-CD1 4.07Å; A299-W311 CarbonylContact C-O 3.5Å; A299-W311 WeakPolarHBondContact CA-O 3.42Å
300	V	93.7	Very high	91.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134.4	179.1	173.8	0	0	0	0	108.9	P12 L266 M291 W293 W311	P12-V300 HydrophobicContact CG-CB 4.47Å; P12-V300 HydrophobicContact CG-CG2 3.93Å; L266-V300 HydrophobicContact CD1-CG1 4.06Å; M291-V300 HydrophobicContact CG-CG1 3.54Å; M291-V300 HydrophobicContact SD-CG1 3.81Å; W293-V300 HydrophobicContact CB-CG2 4.22Å; W293-V300 HydrophobicContact CD2-CG2 3.45Å; W293-V300 VanDerWaalsContact CD2-CG2 3.45Å; W293-V300 HydrophobicContact CE3-CG2 3.15Å; W293-V300 HydrophobicContact CG-CG2 3.93Å; W293-V300 HydrophobicContact CH2-CG2 4.46Å; W293-V300 HydrophobicContact CZ3-CG2 3.71Å; V300-W311 HydrophobicContact CB-CB 4.32Å; V300-W311 PolarHBondContact N-O 2.79Å; V300-W311 PolarHBondContact O-N 2.84Å
301	F	94.8	Very high	91.9	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.018	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134.6	162.6	-85.3	-77.7	0	0	0	110	L19 F30 L37 F51 M291 V292 L308 A309 L310	L19-F301 HydrophobicContact CD1-CE1 3.65Å; L19-F301 HydrophobicContact CD1-CZ 3.76Å; L19-F301 HydrophobicContact CG-CE1 4.2Å; F30-F301 HydrophobicContact CE1-CD2 4.38Å; F30-F301 HydrophobicContact CE1-CE2 4.3Å; F30-F301 AromaticContact CE2-CD2 3.89Å; F30-F301 HydrophobicContact CE2-CD2 3.89Å; F30-F301 AromaticContact CZ-CD2 3.45Å; F30-F301 HydrophobicContact CZ-CD2 3.45Å; F30-F301 VanDerWaalsContact CZ-CD2 3.45Å; F30-F301 AromaticContact CZ-CE2 3.67Å; F30-F301 HydrophobicContact CZ-CE2 3.67Å; L37-F301 HydrophobicContact CD1-CD2 4.44Å; L37-F301 HydrophobicContact CD2-CD1 4.26Å; L37-F301 HydrophobicContact CD2-CD2 3.76Å; L37-F301 HydrophobicContact CD2-CE1 4.27Å; L37-F301 HydrophobicContact CD2-CE2 3.78Å; L37-F301 HydrophobicContact CD2-CG 4Å; L37-F301 HydrophobicContact CD2-CZ 4.04Å; F51-F301 AromaticContact CD2-CE2 3.87Å; F51-F301 HydrophobicContact CD2-CE2 3.87Å; F51-F301 AromaticContact CE2-CE2 3.8Å; F51-F301 HydrophobicContact CE2-CE2 3.8Å; F51-F301 HydrophobicContact CE2-CZ 4.49Å; M291-F301 CarbonylContact C-O 3.51Å; M291-F301 VanDerWaalsContact CA-O 3.24Å; M291-F301 WeakPolarHBondContact CA-O 3.49Å; M291-F301 WeakPolarHBondContact CG-O 3.34Å; V292-F301 HydrophobicContact CG1-CB 3.98Å; V292-F301 PolarHBondContact N-O 2.92Å; V292-F301 PolarHBondContact O-N 2.85Å; F301-L308 HydrophobicContact CD1-CB 3.91Å; F301-L308 HydrophobicContact CD1-CD2 4.43Å; F301-L308 HydrophobicContact CE1-CB 4.19Å; F301-A309 CarbonylContact C-O 3.5Å; F301-A309 VanDerWaalsContact CA-O 3.31Å; F301-A309 WeakPolarHBondContact CA-O 3.31Å; F301-L310 HydrophobicContact CD1-CB 4.12Å; F301-L310 HydrophobicContact CD2-CD1 4.15Å; F301-L310 HydrophobicContact CE1-CB 3.6Å; F301-L310 HydrophobicContact CE1-CD1 4.21Å; F301-L310 HydrophobicContact CE1-CG 4.37Å; F301-L310 HydrophobicContact CE2-CD1 3.79Å; F301-L310 HydrophobicContact CZ-CB 3.91Å; F301-L310 HydrophobicContact CZ-CD1 3.83Å; F301-L310 HydrophobicContact CZ-CD2 4.24Å; F301-L310 HydrophobicContact CZ-CG 4.21Å
302	S	94.6	Very high	91.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	139	164.8	66.3	0	0	0	0	109.6	H264 D290 A309 W311	H264-S302 PolarHBondContact NE2-OG 2.77Å; D290-S302 WeakPolarHBondContact O-CA 3.47Å; S302-A309 PolarHBondContact N-O 2.99Å; S302-A309 PolarHBondContact O-N 2.84Å; S302-W311 PolarHBondContact OG-NE1 3.44Å
303	V	94.6	Very high	91.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123	172.8	-176.2	0	0	0	0	108.7	A25 C28 L289 D290 K307 L308	A25-V303 HydrophobicContact CB-CG1 3.95Å; A25-V303 WeakPolarHBondContact O-CG1 3.29Å; C28-V303 HydrophobicContact CB-CG2 4.17Å; L289-V303 HydrophobicContact CB-CB 4.44Å; L289-V303 HydrophobicContact CB-CG1 4.37Å; L289-V303 HydrophobicContact CD1-CG1 4.39Å; L289-V303 PolarHBondContact N-O 2.95Å; D290-V303 HydrophobicContact CB-CB 4.38Å; D290-V303 HydrophobicContact CB-CG2 4.28Å; D290-V303 PolarHBondContact O-N 3.12Å; V303-K307 WeakPolarHBondContact CA-O 3.24Å; V303-L308 HydrophobicContact CG2-CD2 4.32Å; V303-L308 HydrophobicContact CG2-CG 4.4Å
304	S	93.6	Very high	90.6	Very high	5 Å²	5	25.6 Å²	25.6	4%	0.035	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	137.2	173.5	70.8	0	0	0	0	109.6	H264 E286 Q287 G306 K307	H264-S304 PolarHBondContact CE1-OG 2.89Å; H264-S304 PolarHBondContact ND1-OG 3.02Å; E286-S304 PolarHBondContact OE2-OG 2.85Å; Q287-S304 WeakPolarHBondContact O-CA 3.32Å; Q287-S304 WeakPolarHBondContact O-CB 3.32Å; S304-G306 PolarHBondContact O-N 2.91Å; S304-K307 PolarHBondContact N-O 3.15Å; S304-K307 PolarHBondContact O-N 3.11Å
305	N	93.4	Very high	89.7	Confident	86 Å²	86	35 Å²	35	46%	0.46	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	39.1	175.3	-165.5	25.6	0	0	0	114.4	E286 K307	E286-N305 VanDerWaalsContact CD-CB 3.45Å; E286-N305 HydrophobicContact CG-CB 4.07Å; E286-N305 WeakPolarHBondContact OE1-CB 3.09Å; E286-N305 PolarHBondContact OE1-ND2 3.2Å; N305-K307 VanDerWaalsContact C-N 3.3Å; N305-K307 PolarHBondContact O-N 3.3Å
306	G	94.4	Very high	89.1	Confident	3 Å²	3	38.2 Å²	38.2	3%	0.031	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	79.1	0.9	-179.9	0	0	0	0	0	116	A25 S304	A25-G306 VanDerWaalsContact CB-O 3.31Å; A25-G306 WeakPolarHBondContact CB-O 3.5Å; A25-G306 PolarHBondContact N-O 3Å; A25-G306 WeakPolarHBondContact O-CA 3.4Å; S304-G306 PolarHBondContact O-N 2.91Å
307	K	95.8	Very high	88.9	Confident	93 Å²	93	43.8 Å²	43.8	40%	0.404	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	157.5	-178.9	-62.5	-172.9	177.8	-166.5	0	111.7	T18 D20 V303 S304 N305	T18-K307 HydrophobicContact CG2-CB 4.08Å; T18-K307 HydrophobicContact CG2-CD 4.18Å; D20-K307 VanDerWaalsContact OD2-CE 3.3Å; D20-K307 WeakPolarHBondContact OD2-CE 3.43Å; D20-K307 IonicContact OD2-NZ 3.88Å; V303-K307 WeakPolarHBondContact CA-O 3.24Å; S304-K307 PolarHBondContact N-O 3.15Å; S304-K307 PolarHBondContact O-N 3.11Å; N305-K307 VanDerWaalsContact C-N 3.3Å; N305-K307 PolarHBondContact O-N 3.3Å
308	L	96.1	Very high	88.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	120.2	176	-57.9	101.2	0	0	0	110.1	T18 L19 A25 C28 L37 V39 F301 V303	T18-L308 CarbonylContact C-O 3.55Å; T18-L308 VanDerWaalsContact CA-O 3.32Å; T18-L308 WeakPolarHBondContact CA-O 3.48Å; L19-L308 HydrophobicContact CB-CB 4.26Å; L19-L308 PolarHBondContact N-O 2.92Å; L19-L308 PolarHBondContact O-N 2.79Å; A25-L308 HydrophobicContact CB-CD1 4.11Å; A25-L308 HydrophobicContact CB-CG 4.48Å; C28-L308 HydrophobicContact CB-CD2 3.87Å; L37-L308 HydrophobicContact CD2-CD2 3.73Å; V39-L308 HydrophobicContact CG1-CD1 4.03Å; V39-L308 HydrophobicContact CG1-CD2 4.24Å; V39-L308 HydrophobicContact CG2-CD1 4.09Å; V39-L308 HydrophobicContact CG2-CD2 3.55Å; V39-L308 HydrophobicContact CG2-CG 4.47Å; F301-L308 HydrophobicContact CD1-CB 3.91Å; F301-L308 HydrophobicContact CD1-CD2 4.43Å; F301-L308 HydrophobicContact CE1-CB 4.19Å; V303-L308 HydrophobicContact CG2-CD2 4.32Å; V303-L308 HydrophobicContact CG2-CG 4.4Å
309	A	95.8	Very high	88.1	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.033	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.9	172.5	0	0	0	0	0	109.8	L15 F301 S302 W311	L15-A309 HydrophobicContact CD1-CB 3.6Å; F301-A309 CarbonylContact C-O 3.5Å; F301-A309 VanDerWaalsContact CA-O 3.31Å; F301-A309 WeakPolarHBondContact CA-O 3.31Å; S302-A309 PolarHBondContact N-O 2.99Å; S302-A309 PolarHBondContact O-N 2.84Å; A309-W311 HydrophobicContact CB-CZ2 4.43Å
310	L	95.5	Very high	87.7	Confident	1 Å²	1	48 Å²	48	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	117.2	174.1	175.9	58	0	0	0	109.6	E16 A17 F51 A299 F301	E16-L310 HydrophobicContact CB-CG 4.37Å; E16-L310 PolarHBondContact N-O 3.43Å; E16-L310 WeakPolarHBondContact OE2-CD2 3.31Å; A17-L310 HydrophobicContact CB-CB 4.31Å; A17-L310 HydrophobicContact CB-CD2 4.48Å; A17-L310 PolarHBondContact N-O 3.07Å; A17-L310 PolarHBondContact O-N 3.02Å; F51-L310 HydrophobicContact CE2-CD1 4.1Å; A299-L310 HydrophobicContact CB-CD1 4.07Å; F301-L310 HydrophobicContact CD1-CB 4.12Å; F301-L310 HydrophobicContact CD2-CD1 4.15Å; F301-L310 HydrophobicContact CE1-CB 3.6Å; F301-L310 HydrophobicContact CE1-CD1 4.21Å; F301-L310 HydrophobicContact CE1-CG 4.37Å; F301-L310 HydrophobicContact CE2-CD1 3.79Å; F301-L310 HydrophobicContact CZ-CB 3.91Å; F301-L310 HydrophobicContact CZ-CD1 3.83Å; F301-L310 HydrophobicContact CZ-CD2 4.24Å; F301-L310 HydrophobicContact CZ-CG 4.21Å
311	W	94.7	Very high	87.2	Confident	5 Å²	5	52 Å²	52	2%	0.019	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.3	173.3	-52.9	87.4	0	0	0	109.3	P12 E14 L15 H264 L266 L280 H281 A299 V300 S302 A309	P12-W311 HydrophobicContact CB-CB 4.12Å; E14-W311 CarbonylContact O-C 3.52Å; E14-W311 VanDerWaalsContact O-CA 3.25Å; E14-W311 WeakPolarHBondContact O-CA 3.49Å; L15-W311 HydrophobicContact CB-CE3 3.95Å; L15-W311 HydrophobicContact CB-CH2 4.06Å; L15-W311 HydrophobicContact CB-CZ3 3.65Å; L15-W311 HydrophobicContact CD1-CD2 4.28Å; L15-W311 HydrophobicContact CD1-CE3 4.43Å; L15-W311 HydrophobicContact CD1-CH2 4.28Å; L15-W311 HydrophobicContact CD1-CZ2 4.13Å; L15-W311 HydrophobicContact CD1-CZ3 4.44Å; H264-W311 AromaticContact NE2-CZ2 3.87Å; L266-W311 HydrophobicContact CD1-CD2 4.24Å; L266-W311 HydrophobicContact CD1-CG 4.02Å; L280-W311 HydrophobicContact CB-CD2 4.39Å; L280-W311 HydrophobicContact CB-CE3 3.86Å; L280-W311 HydrophobicContact CB-CH2 4.44Å; L280-W311 HydrophobicContact CB-CZ3 3.89Å; L280-W311 HydrophobicContact CD1-CB 4.05Å; L280-W311 HydrophobicContact CD1-CD2 4.1Å; L280-W311 HydrophobicContact CD1-CE3 3.96Å; L280-W311 HydrophobicContact CD1-CG 4.14Å; L280-W311 HydrophobicContact CD2-CE3 4.31Å; L280-W311 HydrophobicContact CG-CE3 4.27Å; H281-W311 WeakPolarHBondContact O-CH2 3.49Å; A299-W311 CarbonylContact C-O 3.5Å; A299-W311 WeakPolarHBondContact CA-O 3.42Å; V300-W311 HydrophobicContact CB-CB 4.32Å; V300-W311 PolarHBondContact N-O 2.79Å; V300-W311 PolarHBondContact O-N 2.84Å; S302-W311 PolarHBondContact OG-NE1 3.44Å; A309-W311 HydrophobicContact CB-CZ2 4.43Å
312	S	91.5	Very high	86.8	Confident	12 Å²	12	59.3 Å²	59.3	8%	0.084	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	-175	177.9	81.4	0	0	0	0	111.6	E13 E14 E16	E13-S312 PolarHBondContact N-O 3.36Å; E14-S312 PolarHBondContact N-O 3Å; E14-S312 VanDerWaalsContact N-O 3.11Å; E14-S312 PolarHBondContact O-N 3.02Å; E16-S312 WeakPolarHBondContact CB-OG 3.23Å; E16-S312 WeakPolarHBondContact OE2-CB 3.2Å; E16-S312 PolarHBondContact OE2-OG 3.23Å
313	H	83.7	Confident	86.4	Confident	51 Å²	51	61.3 Å²	61.3	24%	0.236	32%	0.316	C	S	.	.			trans	-78.9	138.6	177.3	-172.3	-89	0	0	0	110.7	Q9 R315	Q9-H313 PolarHBondContact OE1-NE2 3.44Å; H313-R315 PolarHBondContact O-N 2.76Å; H313-R315 VanDerWaalsContact O-N 3.11Å
314	C	73.4	Confident	85.8	Confident	55 Å²	55	67.1 Å²	67.1	37%	0.372	35%	0.354	S	S	.	.			trans	-68.6	106	174.2	-169.7	0	0	0	0	109.1	E14 S316	E14-C314 VanDerWaalsContact CD-CB 3.4Å; E14-C314 VanDerWaalsContact CD-SG 3.57Å; E14-C314 HydrophobicContact CG-CB 4.09Å; E14-C314 VanDerWaalsContact OE1-CA 3.24Å; E14-C314 WeakPolarHBondContact OE1-CA 3.49Å; E14-C314 WeakPolarHBondContact OE1-CB 3.16Å; E14-C314 PolarHBondContact OE1-SG 3.05Å; C314-S316 PolarHBondContact O-N 2.92Å; C314-S316 VanDerWaalsContact O-N 3.09Å
315	R	70.9	Confident	85.4	Confident	202 Å²	202	74.7 Å²	74.7	76%	0.762	39%	0.394	S	S	*	.			trans	-70.9	108.7	176.6	-68	-174	-179.4	178	1.4	109.3	H313	H313-R315 PolarHBondContact O-N 2.76Å; H313-R315 VanDerWaalsContact O-N 3.11Å
316	S	72.9	Confident	85	Confident	92 Å²	92	76.1 Å²	76.1	64%	0.643	40%	0.396	S	S	*	.			trans	-74.4	122.5	160.9	53.6	0	0	0	0	108.7	C314 N318	C314-S316 PolarHBondContact O-N 2.92Å; C314-S316 VanDerWaalsContact O-N 3.09Å; S316-N318 PolarHBondContact O-N 3.06Å
317	E	75	Confident	84.4	Confident	144 Å²	144	83.7 Å²	83.7	67%	0.673	43%	0.429	S	S	*	.			trans	-65.3	120	170.7	-66.6	-175	162.2	0	0	109
318	N	75.9	Confident	83.7	Confident	65 Å²	65	83.6 Å²	83.6	35%	0.348	43%	0.43	S	S	.	.			trans	-87.5	110.1	173.3	-179.7	-2.6	0	0	0	108.7	S316 S320 A321	S316-N318 PolarHBondContact O-N 3.06Å; N318-S320 PolarHBondContact ND2-OG 3.5Å; N318-S320 VanDerWaalsContact ND2-OG 3.11Å; N318-S320 PolarHBondContact O-N 3.16Å; N318-S320 WeakPolarHBondContact OD1-CB 3.45Å; N318-S320 PolarHBondContact OD1-N 3.4Å; N318-S320 PolarHBondContact OD1-OG 2.7Å; N318-A321 VanDerWaalsContact O-CB 3.27Å; N318-A321 WeakPolarHBondContact O-CB 3.37Å; N318-A321 PolarHBondContact O-N 2.75Å; N318-A321 VanDerWaalsContact O-N 3.09Å
319	W	78.9	Confident	83.2	Confident	154 Å²	154	88.5 Å²	88.5	58%	0.583	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-68.9	-20.9	-178.4	-63	83.5	0	0	0	112.4	A321 F322 E328	W319-A321 PolarHBondContact O-N 3.03Å; W319-A321 VanDerWaalsContact O-N 3.14Å; W319-F322 AromaticContact CE3-CD2 3.97Å; W319-F322 HydrophobicContact CE3-CD2 3.97Å; W319-F322 AromaticContact CE3-CE2 3.9Å; W319-F322 HydrophobicContact CE3-CE2 3.9Å; W319-F322 HydrophobicContact CZ3-CE2 4.26Å; W319-F322 PolarHBondContact O-N 2.95Å; W319-F322 VanDerWaalsContact O-N 3.07Å; W319-E328 WeakPolarHBondContact CA-OE1 3.14Å; W319-E328 WeakPolarHBondContact CB-OE1 3.33Å; W319-E328 VanDerWaalsContact CD1-OE1 3.23Å; W319-E328 PolarHBondContact N-OE1 3.29Å
320	S	83.6	Confident	82.7	Confident	32 Å²	32	93.6 Å²	93.6	22%	0.224	50%	0.498	C	S	.	.	G	3₁₀ helix	trans	-62.4	-16.8	172.6	98.1	0	0	0	0	112.8	N318 F322 A323 F326	N318-S320 PolarHBondContact ND2-OG 3.5Å; N318-S320 VanDerWaalsContact ND2-OG 3.11Å; N318-S320 PolarHBondContact O-N 3.16Å; N318-S320 WeakPolarHBondContact OD1-CB 3.45Å; N318-S320 PolarHBondContact OD1-N 3.4Å; N318-S320 PolarHBondContact OD1-OG 2.7Å; S320-F322 VanDerWaalsContact C-N 3.28Å; S320-F322 PolarHBondContact O-N 3.33Å; S320-A323 CarbonylContact O-C 3.57Å; S320-F326 WeakPolarHBondContact CB-O 3.41Å
321	A	83	Confident	82.5	Confident	84 Å²	84	101.3 Å²	101.3	69%	0.694	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-70.7	-21.7	174.3	0	0	0	0	0	113.3	N318 W319	N318-A321 VanDerWaalsContact O-CB 3.27Å; N318-A321 WeakPolarHBondContact O-CB 3.37Å; N318-A321 PolarHBondContact O-N 2.75Å; N318-A321 VanDerWaalsContact O-N 3.09Å; W319-A321 PolarHBondContact O-N 3.03Å; W319-A321 VanDerWaalsContact O-N 3.14Å
322	F	86.2	Confident	82.4	Confident	157 Å²	157	109.3 Å²	109.3	69%	0.689	58%	0.577	S	S	*	*	S	Bend	trans	-80.7	-22.4	179.8	-68.1	-76.7	0	0	0	113.5	W319 S320	W319-F322 AromaticContact CE3-CD2 3.97Å; W319-F322 HydrophobicContact CE3-CD2 3.97Å; W319-F322 AromaticContact CE3-CE2 3.9Å; W319-F322 HydrophobicContact CE3-CE2 3.9Å; W319-F322 HydrophobicContact CZ3-CE2 4.26Å; W319-F322 PolarHBondContact O-N 2.95Å; W319-F322 VanDerWaalsContact O-N 3.07Å; S320-F322 VanDerWaalsContact C-N 3.28Å; S320-F322 PolarHBondContact O-N 3.33Å
323	A	86.1	Confident	82.4	Confident	42 Å²	42	113.5 Å²	113.5	35%	0.347	60%	0.602	S	S	.	*			trans	-142.9	111.8	178.9	0	0	0	0	0	109	S320 D325 F326	S320-A323 CarbonylContact O-C 3.57Å; A323-D325 PolarHBondContact O-N 3.42Å; A323-D325 VanDerWaalsContact O-N 3.12Å; A323-F326 HydrophobicContact CB-CB 3.92Å; A323-F326 VanDerWaalsContact O-CB 3.28Å; A323-F326 WeakPolarHBondContact O-CB 3.42Å; A323-F326 PolarHBondContact O-N 2.74Å
324	P	82.2	Confident	82.8	Confident	123 Å²	123	120 Å²	120	80%	0.799	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-23.2	-174	24.5	-33.4	0	0	0	113.5	F326	P324-F326 VanDerWaalsContact C-N 3.29Å
325	D	84.4	Confident	83.5	Confident	163 Å²	163	124 Å²	124	87%	0.872	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-10.4	177.4	-49.8	-30.9	0	0	0	112.4	A323	A323-D325 PolarHBondContact O-N 3.42Å; A323-D325 VanDerWaalsContact O-N 3.12Å
326	F	84.3	Confident	84.4	Confident	116 Å²	116	122.9 Å²	122.9	51%	0.509	64%	0.644	S	S	.	*			trans	-87.5	140.8	179.3	-165.3	-102.5	0	0	0	110.2	S320 A323 P324 E328	S320-F326 WeakPolarHBondContact CB-O 3.41Å; A323-F326 HydrophobicContact CB-CB 3.92Å; A323-F326 VanDerWaalsContact O-CB 3.28Å; A323-F326 WeakPolarHBondContact O-CB 3.42Å; A323-F326 PolarHBondContact O-N 2.74Å; P324-F326 VanDerWaalsContact C-N 3.29Å; F326-E328 HydrophobicContact CD1-CG 4.49Å; F326-E328 HydrophobicContact CE1-CG 4.02Å
327	K	83	Confident	85	Confident	163 Å²	163	125.1 Å²	125.1	71%	0.709	64%	0.644	S	S	*	*			trans	-133.3	122.7	174.7	-172.2	176.1	180	-178.3	0	109
328	E	81.2	Confident	85.5	Confident	90 Å²	90	124.9 Å²	124.9	42%	0.421	64%	0.637	S	S	.	*			trans	-71.1	136.9	170.5	-70.6	-176.2	-179.9	0	0	110.1	W319 F326	W319-E328 WeakPolarHBondContact CA-OE1 3.14Å; W319-E328 WeakPolarHBondContact CB-OE1 3.33Å; W319-E328 VanDerWaalsContact CD1-OE1 3.23Å; W319-E328 PolarHBondContact N-OE1 3.29Å; F326-E328 HydrophobicContact CD1-CG 4.49Å; F326-E328 HydrophobicContact CE1-CG 4.02Å
329	L	84.1	Confident	85.9	Confident	103 Å²	103	130 Å²	130	54%	0.539	66%	0.659	S	S	.	*			trans	-116.6	128.2	177.1	-62.8	175.7	0	0	0	108.6	E331 V333	L329-E331 VanDerWaalsContact C-N 3.33Å; L329-E331 WeakPolarHBondContact CB-O 3.31Å; L329-V333 HydrophobicContact CD1-CB 4.13Å; L329-V333 HydrophobicContact CD1-CG2 4Å; L329-V333 HydrophobicContact CD2-CG2 3.86Å; L329-V333 HydrophobicContact CG-CG2 4.44Å
330	A	85.6	Confident	86.3	Confident	112 Å²	112	123 Å²	123	93%	0.926	63%	0.633	S	S	*	*	S	Bend	trans	-74.3	-28	175.7	0	0	0	0	0	112.2
331	E	92.6	Very high	86.3	Confident	162 Å²	162	125.4 Å²	125.4	76%	0.757	64%	0.641	S	S	*	*	S	Bend	trans	-137.2	157.6	178.9	-63.6	-176.3	176.5	0	0	109.2	L329 V333	L329-E331 VanDerWaalsContact C-N 3.33Å; L329-E331 WeakPolarHBondContact CB-O 3.31Å; E331-V333 PolarHBondContact O-N 2.83Å
332	N	92	Very high	86.4	Confident	173 Å²	173	129.2 Å²	129.2	93%	0.925	64%	0.642	S	S	*	*			trans	-61.7	130.2	176.1	-68	-20.7	0	0	0	109.8
333	V	92.1	Very high	86.5	Confident	101 Å²	101	126.2 Å²	126.2	61%	0.612	63%	0.633	S	S	*	*			trans	-106	125.2	173.8	177.8	0	0	0	0	107.7	L329 E331 Y335	L329-V333 HydrophobicContact CD1-CB 4.13Å; L329-V333 HydrophobicContact CD1-CG2 4Å; L329-V333 HydrophobicContact CD2-CG2 3.86Å; L329-V333 HydrophobicContact CG-CG2 4.44Å; E331-V333 PolarHBondContact O-N 2.83Å; V333-Y335 PolarHBondContact O-N 3.18Å
334	E	91.3	Very high	86.4	Confident	186 Å²	186	133 Å²	133	87%	0.869	66%	0.663	S	S	*	*			trans	-68.3	124.2	169.9	-71.6	-176.7	175.5	0	0	108.7	E336	E334-E336 PolarHBondContact O-N 3.38Å
335	Y	88.9	Confident	86.3	Confident	140 Å²	140	134.2 Å²	134.2	55%	0.549	66%	0.658	S	S	.	*			trans	-78.1	121.1	178.5	173.5	-107.7	0	0	0	109.2	V333 E337 E341	V333-Y335 PolarHBondContact O-N 3.18Å; Y335-E337 HydrophobicContact CD1-CG 3.89Å; Y335-E337 HydrophobicContact CE1-CB 4.19Å; Y335-E337 HydrophobicContact CE1-CG 3.77Å; Y335-E337 PolarHBondContact O-N 3.46Å; Y335-E341 WeakPolarHBondContact CE1-OE2 3.38Å; Y335-E341 VanDerWaalsContact CZ-OE2 3.26Å; Y335-E341 VanDerWaalsContact OH-CD 3.32Å; Y335-E341 PolarHBondContact OH-OE2 2.77Å
336	E	88.6	Confident	86.1	Confident	179 Å²	179	129.7 Å²	129.7	84%	0.836	63%	0.634	S	S	*	*			trans	-83.2	105.4	169.2	-70.3	-176.1	170.3	0	0	108.4	E334 R338	E334-E336 PolarHBondContact O-N 3.38Å; E336-R338 PolarHBondContact O-N 3.35Å
337	E	85.5	Confident	85.7	Confident	138 Å²	138	131.8 Å²	131.8	65%	0.645	65%	0.645	S	S	*	*			trans	-57	132.4	177.5	-63.9	178.1	-177	0	0	110.4	Y335	Y335-E337 HydrophobicContact CD1-CG 3.89Å; Y335-E337 HydrophobicContact CE1-CB 4.19Å; Y335-E337 HydrophobicContact CE1-CG 3.77Å; Y335-E337 PolarHBondContact O-N 3.46Å
338	R	85.4	Confident	85.3	Confident	140 Å²	140	128 Å²	128	53%	0.528	63%	0.633	S	S	.	*			trans	-81.8	151.1	174.9	-63.3	-175.7	-171.5	152.6	3.9	109.7	E336 S340 E341	E336-R338 PolarHBondContact O-N 3.35Å; R338-S340 VanDerWaalsContact C-N 3.29Å; R338-S340 PolarHBondContact O-N 3.26Å; R338-E341 WeakPolarHBondContact O-CB 3.45Å; R338-E341 PolarHBondContact O-N 3.26Å
339	E	85.5	Confident	85	Confident	173 Å²	173	130.6 Å²	130.6	81%	0.808	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-60.2	-41.7	179.2	-174	173.8	-171.6	0	0	111.2	E341	E339-E341 VanDerWaalsContact C-N 3.3Å; E339-E341 PolarHBondContact O-N 3.41Å
340	S	86	Confident	84.3	Confident	5 Å²	5	129.8 Å²	129.8	4%	0.035	65%	0.646	C	S	.	*	G	3₁₀ helix	trans	-74	-0.6	178.1	64.4	0	0	0	0	116.7	R338 F342 D343 D346 D348	R338-S340 VanDerWaalsContact C-N 3.29Å; R338-S340 PolarHBondContact O-N 3.26Å; S340-F342 VanDerWaalsContact C-N 3.25Å; S340-F342 PolarHBondContact O-N 3.33Å; S340-D343 PolarHBondContact O-N 3.42Å; S340-D343 VanDerWaalsContact O-N 3.12Å; S340-D346 WeakPolarHBondContact CB-OD1 3.24Å; S340-D346 PolarHBondContact OG-OD1 3.34Å; S340-D348 PolarHBondContact N-OD2 3.39Å
341	E	84.4	Confident	83.4	Confident	83 Å²	83	129.7 Å²	129.7	39%	0.388	64%	0.636	S	S	.	*	G	3₁₀ helix	trans	-63.5	-30	-170.7	179.4	166.2	172.9	0	0	114	Y335 R338 E339	Y335-E341 WeakPolarHBondContact CE1-OE2 3.38Å; Y335-E341 VanDerWaalsContact CZ-OE2 3.26Å; Y335-E341 VanDerWaalsContact OH-CD 3.32Å; Y335-E341 PolarHBondContact OH-OE2 2.77Å; R338-E341 WeakPolarHBondContact O-CB 3.45Å; R338-E341 PolarHBondContact O-N 3.26Å; E339-E341 VanDerWaalsContact C-N 3.3Å; E339-E341 PolarHBondContact O-N 3.41Å
342	F	85.6	Confident	82.1	Confident	164 Å²	164	126.6 Å²	126.6	72%	0.719	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-100.9	2.8	179.8	-63	-81	0	0	0	113.2	S340	S340-F342 VanDerWaalsContact C-N 3.25Å; S340-F342 PolarHBondContact O-N 3.33Å
343	D	87.9	Confident	80.9	Confident	94 Å²	94	122.9 Å²	122.9	50%	0.503	61%	0.609	S	S	.	*	S	Bend	trans	-84.3	155.5	177.9	-66.9	-29.3	0	0	0	111.3	S340 E345	S340-D343 PolarHBondContact O-N 3.42Å; S340-D343 VanDerWaalsContact O-N 3.12Å; D343-E345 VanDerWaalsContact C-N 3.28Å; D343-E345 WeakPolarHBondContact CB-O 3.18Å
344	L	84.8	Confident	79.5	Confident	186 Å²	186	124.8 Å²	124.8	97%	0.974	62%	0.615	S	S	*	*	S	Bend	trans	-71.2	-28.1	176.5	-74.2	170.4	0	0	0	112.2
345	E	79.4	Confident	78.1	Confident	147 Å²	147	122.5 Å²	122.5	69%	0.687	61%	0.605	S	S	*	*	S	Bend	trans	-120.1	127.2	177.7	-64.2	-176.6	-170	0	0	107.7	D343 E347	D343-E345 VanDerWaalsContact C-N 3.28Å; D343-E345 WeakPolarHBondContact CB-O 3.18Å; E345-E347 VanDerWaalsContact C-N 3.26Å; E345-E347 PolarHBondContact O-N 3.06Å
346	D	79	Confident	77	Confident	69 Å²	69	121.1 Å²	121.1	37%	0.369	60%	0.603	S	S	.	*			trans	-77.4	79.1	179.8	-172.8	6.8	0	0	0	109.2	S340 D348 K349	S340-D346 WeakPolarHBondContact CB-OD1 3.24Å; S340-D346 PolarHBondContact OG-OD1 3.34Å; D346-D348 PolarHBondContact O-N 3.09Å; D346-K349 HydrophobicContact CB-CB 4.09Å; D346-K349 VanDerWaalsContact O-CB 3.25Å; D346-K349 WeakPolarHBondContact O-CB 3.34Å; D346-K349 PolarHBondContact O-N 3.11Å; D346-K349 VanDerWaalsContact O-N 3.17Å; D346-K349 PolarHBondContact OD1-N 3.11Å; D346-K349 WeakPolarHBondContact OD2-CB 3.33Å
347	E	75.9	Confident	75.9	Confident	159 Å²	159	114.2 Å²	114.2	74%	0.743	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-29.5	-176.5	-66.3	-168.5	-178.8	0	0	112.3	E345 K349	E345-E347 VanDerWaalsContact C-N 3.26Å; E345-E347 PolarHBondContact O-N 3.06Å; E347-K349 VanDerWaalsContact C-N 3.33Å
348	D	76.3	Confident	74.9	Confident	84 Å²	84	108.7 Å²	108.7	45%	0.449	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.4	6.7	179	-58.3	-37.1	0	0	0	113.5	S340 D346 S350	S340-D348 PolarHBondContact N-OD2 3.39Å; D346-D348 PolarHBondContact O-N 3.09Å; D348-S350 PolarHBondContact O-N 3.11Å
349	K	73.8	Confident	74	Confident	144 Å²	144	106.9 Å²	106.9	63%	0.626	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-58	120	178.4	-167.2	167.9	-177.6	170.2	0	109.4	D346 E347	D346-K349 HydrophobicContact CB-CB 4.09Å; D346-K349 VanDerWaalsContact O-CB 3.25Å; D346-K349 WeakPolarHBondContact O-CB 3.34Å; D346-K349 PolarHBondContact O-N 3.11Å; D346-K349 VanDerWaalsContact O-N 3.17Å; D346-K349 PolarHBondContact OD1-N 3.11Å; D346-K349 WeakPolarHBondContact OD2-CB 3.33Å; E347-K349 VanDerWaalsContact C-N 3.33Å
350	S	70.4	Confident	73.3	Confident	87 Å²	87	106.9 Å²	106.9	61%	0.608	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-50.5	131.3	173.7	54.8	0	0	0	0	109.3	D348	D348-S350 PolarHBondContact O-N 3.11Å
351	P	66.8	Low	72.7	Confident	110 Å²	110	113 Å²	113	71%	0.714	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-54.4	143.8	-179.3	21.6	-31.9	0	0	0	109.7	N353	P351-N353 PolarHBondContact O-N 3.05Å
352	P	64.6	Low	72.1	Confident	97 Å²	97	112 Å²	112	63%	0.63	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-52.6	135.9	177.5	22.3	-31.7	0	0	0	108.7	L354	P352-L354 PolarHBondContact O-N 3.17Å; P352-L354 VanDerWaalsContact O-N 3.09Å
353	N	66.7	Low	71.8	Confident	94 Å²	94	108.4 Å²	108.4	50%	0.503	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-52.4	121.5	-175.1	-167.5	2.8	0	0	0	108.8	P351 E355 E356 S357	P351-N353 PolarHBondContact O-N 3.05Å; N353-E355 PolarHBondContact O-N 2.55Å; N353-E356 HydrophobicContact CB-CB 4.3Å; N353-E356 HydrophobicContact CB-CG 4.15Å; N353-E356 WeakPolarHBondContact O-CA 3.25Å; N353-E356 WeakPolarHBondContact O-CB 3.43Å; N353-E356 PolarHBondContact O-N 2.84Å; N353-S357 PolarHBondContact O-N 3.24Å; N353-S357 PolarHBondContact O-OG 2.91Å
354	L	63.5	Low	71.4	Confident	141 Å²	141	107.1 Å²	107.1	74%	0.738	59%	0.585	S	S	*	*	H	α-helix	trans	-56.4	-32.7	-168.9	-78.5	165.7	0	0	0	111.9	P352 S357 A358	P352-L354 PolarHBondContact O-N 3.17Å; P352-L354 VanDerWaalsContact O-N 3.09Å; L354-S357 VanDerWaalsContact C-OG 3.32Å; L354-S357 VanDerWaalsContact CA-OG 3.29Å; L354-S357 WeakPolarHBondContact CA-OG 3.45Å; L354-S357 PolarHBondContact O-OG 3.39Å; L354-A358 WeakPolarHBondContact O-CB 3.47Å; L354-A358 PolarHBondContact O-N 3.11Å
355	E	62.2	Low	71.2	Confident	139 Å²	139	107.6 Å²	107.6	65%	0.65	58%	0.582	S	S	*	*	H	α-helix	trans	-65.9	-43.8	173.4	-69.2	-177.7	163.2	0	0	112.5	N353 S357 A358 I359	N353-E355 PolarHBondContact O-N 2.55Å; E355-S357 VanDerWaalsContact C-N 3.34Å; E355-S357 PolarHBondContact O-N 2.59Å; E355-A358 PolarHBondContact O-N 2.76Å; E355-I359 WeakPolarHBondContact O-CB 3.28Å; E355-I359 WeakPolarHBondContact O-CD1 3.05Å; E355-I359 WeakPolarHBondContact O-CG1 3.32Å; E355-I359 PolarHBondContact O-N 3.5Å
356	E	64.9	Low	71.3	Confident	110 Å²	110	105.4 Å²	105.4	51%	0.514	58%	0.578	S	S	.	*	H	α-helix	trans	-64.3	-39	176.4	-74.5	-173.7	167.3	0	0	112.1	N353 K360	N353-E356 HydrophobicContact CB-CB 4.3Å; N353-E356 HydrophobicContact CB-CG 4.15Å; N353-E356 WeakPolarHBondContact O-CA 3.25Å; N353-E356 WeakPolarHBondContact O-CB 3.43Å; N353-E356 PolarHBondContact O-N 2.84Å; E356-K360 WeakPolarHBondContact O-CB 3.46Å; E356-K360 WeakPolarHBondContact O-CG 3.44Å; E356-K360 PolarHBondContact O-N 3.34Å
357	S	64.8	Low	71.5	Confident	35 Å²	35	107 Å²	107	25%	0.245	59%	0.587	C	S	.	*	H	α-helix	trans	-66.4	-42.1	173.5	47.4	0	0	0	0	111.8	N353 L354 E355 I359 K360 D361	N353-S357 PolarHBondContact O-N 3.24Å; N353-S357 PolarHBondContact O-OG 2.91Å; L354-S357 VanDerWaalsContact C-OG 3.32Å; L354-S357 VanDerWaalsContact CA-OG 3.29Å; L354-S357 WeakPolarHBondContact CA-OG 3.45Å; L354-S357 PolarHBondContact O-OG 3.39Å; E355-S357 VanDerWaalsContact C-N 3.34Å; E355-S357 PolarHBondContact O-N 2.59Å; S357-I359 VanDerWaalsContact C-N 3.32Å; S357-I359 PolarHBondContact O-N 2.84Å; S357-K360 PolarHBondContact O-N 2.79Å; S357-D361 WeakPolarHBondContact O-CB 3.15Å; S357-D361 PolarHBondContact O-N 2.86Å
358	A	65.5	Low	71.9	Confident	22 Å²	22	106.7 Å²	106.7	18%	0.182	59%	0.589	C	S	.	*	H	α-helix	trans	-65.5	-35.5	179.4	0	0	0	0	0	112.4	L354 E355 G362 S363 V364	L354-A358 WeakPolarHBondContact O-CB 3.47Å; L354-A358 PolarHBondContact O-N 3.11Å; E355-A358 PolarHBondContact O-N 2.76Å; A358-G362 PolarHBondContact O-N 3.36Å; A358-S363 VanDerWaalsContact CA-OG 3.27Å; A358-S363 WeakPolarHBondContact CA-OG 3.44Å; A358-S363 WeakPolarHBondContact CB-OG 3.39Å; A358-S363 PolarHBondContact O-N 3.23Å; A358-S363 PolarHBondContact O-OG 3.21Å; A358-V364 HydrophobicContact CB-CG2 3.67Å; A358-V364 PolarHBondContact O-N 3.2Å
359	I	66.6	Low	72.3	Confident	102 Å²	102	110.9 Å²	110.9	52%	0.523	61%	0.606	S	S	.	*	H	α-helix	trans	-66.6	-45.5	172.5	-67.9	163.4	0	0	0	110.4	E355 S357 D361 G362 V364	E355-I359 WeakPolarHBondContact O-CB 3.28Å; E355-I359 WeakPolarHBondContact O-CD1 3.05Å; E355-I359 WeakPolarHBondContact O-CG1 3.32Å; E355-I359 PolarHBondContact O-N 3.5Å; S357-I359 VanDerWaalsContact C-N 3.32Å; S357-I359 PolarHBondContact O-N 2.84Å; I359-D361 VanDerWaalsContact C-N 3.3Å; I359-D361 PolarHBondContact O-N 3.25Å; I359-G362 PolarHBondContact O-N 3.01Å; I359-G362 VanDerWaalsContact O-N 3.12Å; I359-V364 HydrophobicContact CG1-CB 4.1Å; I359-V364 HydrophobicContact CG1-CG1 4.43Å; I359-V364 HydrophobicContact CG1-CG2 3.94Å
360	K	69.5	Low	72.8	Confident	173 Å²	173	107.8 Å²	107.8	75%	0.752	60%	0.602	S	S	*	*	H	α-helix	trans	-62.8	-36.2	177.5	-79.9	175.8	179.3	169.1	0	112.9	E356 S357 G362	E356-K360 WeakPolarHBondContact O-CB 3.46Å; E356-K360 WeakPolarHBondContact O-CG 3.44Å; E356-K360 PolarHBondContact O-N 3.34Å; S357-K360 PolarHBondContact O-N 2.79Å; K360-G362 PolarHBondContact O-N 2.94Å
361	D	75.2	Confident	73	Confident	134 Å²	134	108 Å²	108	72%	0.717	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	2.8	178.3	-66.8	-16.6	0	0	0	112.9	S357 I359 S363	S357-D361 WeakPolarHBondContact O-CB 3.15Å; S357-D361 PolarHBondContact O-N 2.86Å; I359-D361 VanDerWaalsContact C-N 3.3Å; I359-D361 PolarHBondContact O-N 3.25Å; D361-S363 PolarHBondContact O-N 3.45Å
362	G	70.9	Confident	73.2	Confident	62 Å²	62	110.6 Å²	110.6	64%	0.639	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.1	14.6	177.7	0	0	0	0	0	114.3	A358 I359 K360 V364	A358-G362 PolarHBondContact O-N 3.36Å; I359-G362 PolarHBondContact O-N 3.01Å; I359-G362 VanDerWaalsContact O-N 3.12Å; K360-G362 PolarHBondContact O-N 2.94Å; G362-V364 VanDerWaalsContact C-N 3.31Å
363	S	78.4	Confident	73	Confident	88 Å²	88	112 Å²	112	62%	0.615	60%	0.601	S	S	*	*			trans	-81.9	-10.2	-178.7	64.5	0	0	0	0	113.6	A358 D361	A358-S363 VanDerWaalsContact CA-OG 3.27Å; A358-S363 WeakPolarHBondContact CA-OG 3.44Å; A358-S363 WeakPolarHBondContact CB-OG 3.39Å; A358-S363 PolarHBondContact O-N 3.23Å; A358-S363 PolarHBondContact O-OG 3.21Å; D361-S363 PolarHBondContact O-N 3.45Å
364	V	81.4	Confident	72.6	Confident	67 Å²	67	111.8 Å²	111.8	41%	0.406	60%	0.598	S	S	.	*	S	Bend	trans	-95.7	119.1	174	-179.1	0	0	0	0	109.2	A358 I359 G362 V366	A358-V364 HydrophobicContact CB-CG2 3.67Å; A358-V364 PolarHBondContact O-N 3.2Å; I359-V364 HydrophobicContact CG1-CB 4.1Å; I359-V364 HydrophobicContact CG1-CG1 4.43Å; I359-V364 HydrophobicContact CG1-CG2 3.94Å; G362-V364 VanDerWaalsContact C-N 3.31Å; V364-V366 HydrophobicContact CG1-CG2 4.25Å; V364-V366 PolarHBondContact O-N 3.06Å
365	E	79.6	Confident	72.2	Confident	196 Å²	196	116 Å²	116	92%	0.916	60%	0.604	S	S	*	*			trans	-74.3	113.5	172.3	-166.4	168.4	-166	0	0	108.9
366	V	81.8	Confident	71.7	Confident	100 Å²	100	113.7 Å²	113.7	61%	0.606	60%	0.599	S	S	*	*			trans	-103.9	117.7	-179.7	-179.5	0	0	0	0	108.7	V364 I368	V364-V366 HydrophobicContact CG1-CG2 4.25Å; V364-V366 PolarHBondContact O-N 3.06Å; V366-I368 HydrophobicContact CG1-CG2 4.15Å
367	D	83.4	Confident	71.1	Confident	102 Å²	102	110 Å²	110	55%	0.545	58%	0.582	S	S	.	*			trans	-84.9	120.1	172.7	-175	-1.1	0	0	0	110.1	E369 S370	D367-E369 PolarHBondContact OD1-N 3.08Å; D367-S370 PolarHBondContact OD1-N 3.5Å; D367-S370 WeakPolarHBondContact OD2-CB 3.12Å; D367-S370 PolarHBondContact OD2-OG 3.32Å
368	I	83.8	Confident	70.5	Confident	153 Å²	153	111.3 Å²	111.3	79%	0.785	58%	0.583	S	S	*	*	S	Bend	trans	-108.7	-4.9	178	61	171.1	0	0	0	112.7	V366	V366-I368 HydrophobicContact CG1-CG2 4.15Å
369	E	85.2	Confident	69.9	Low	173 Å²	173	112 Å²	112	81%	0.808	59%	0.587	S	S	*	*	S	Bend	trans	-103.7	-30.1	-174.1	-62.4	-170.2	164.9	0	0	112.1	D367	D367-E369 PolarHBondContact OD1-N 3.08Å
370	S	83.5	Confident	69.1	Low	78 Å²	78	112.6 Å²	112.6	55%	0.545	60%	0.6	S	S	.	*			trans	-69.1	141.4	178.8	65.6	0	0	0	0	112.8	D367	D367-S370 PolarHBondContact OD1-N 3.5Å; D367-S370 WeakPolarHBondContact OD2-CB 3.12Å; D367-S370 PolarHBondContact OD2-OG 3.32Å
371	V	74.7	Confident	67.9	Low	91 Å²	91	108.9 Å²	108.9	55%	0.552	59%	0.588	S	S	*	*			trans	-101.3	114.6	176.2	-179.6	0	0	0	0	108.2	Y373	V371-Y373 HydrophobicContact CB-CE1 4.42Å; V371-Y373 HydrophobicContact CB-CE2 3.9Å; V371-Y373 HydrophobicContact CG1-CD1 4.16Å; V371-Y373 HydrophobicContact CG1-CD2 4.4Å; V371-Y373 HydrophobicContact CG1-CE1 3.79Å; V371-Y373 HydrophobicContact CG1-CE2 4.05Å; V371-Y373 HydrophobicContact CG1-CG 4.46Å; V371-Y373 WeakPolarHBondContact O-CD2 3.27Å; V371-Y373 VanDerWaalsContact O-CE2 3.31Å; V371-Y373 WeakPolarHBondContact O-CE2 3.3Å; V371-Y373 PolarHBondContact O-N 3.48Å
372	D	70.6	Confident	66.6	Low	165 Å²	165	110.3 Å²	110.3	88%	0.882	60%	0.596	S	S	*	*			trans	-77.4	104.1	174.3	-120	-12.1	0	0	0	110
373	Y	61.8	Low	65.9	Low	128 Å²	128	109.6 Å²	109.6	50%	0.502	58%	0.578	S	S	.	*			trans	-82	131.1	-178.3	-64.1	-83.6	0	0	0	111.6	V371 R375 F378	V371-Y373 HydrophobicContact CB-CE1 4.42Å; V371-Y373 HydrophobicContact CB-CE2 3.9Å; V371-Y373 HydrophobicContact CG1-CD1 4.16Å; V371-Y373 HydrophobicContact CG1-CD2 4.4Å; V371-Y373 HydrophobicContact CG1-CE1 3.79Å; V371-Y373 HydrophobicContact CG1-CE2 4.05Å; V371-Y373 HydrophobicContact CG1-CG 4.46Å; V371-Y373 WeakPolarHBondContact O-CD2 3.27Å; V371-Y373 VanDerWaalsContact O-CE2 3.31Å; V371-Y373 WeakPolarHBondContact O-CE2 3.3Å; V371-Y373 PolarHBondContact O-N 3.48Å; Y373-R375 PolarHBondContact O-N 3.29Å; Y373-F378 HydrophobicContact CD1-CE1 4.49Å; Y373-F378 AromaticContact CD1-CE2 3.92Å; Y373-F378 HydrophobicContact CD1-CE2 3.92Å; Y373-F378 AromaticContact CD1-CZ 3.84Å; Y373-F378 HydrophobicContact CD1-CZ 3.84Å; Y373-F378 HydrophobicContact CE1-CZ 4.45Å
374	M	57	Low	64.8	Low	88 Å²	88	111.1 Å²	111.1	43%	0.433	58%	0.575	S	S	.	*			trans	-70.5	98.2	178.1	-163.7	169.9	-130.4	0	0	111.2	M1 T376 F377	M1-M374 HydrophobicContact CE-CE 3.88Å; M1-M374 HydrophobicContact CE-SD 4.18Å; M1-M374 HydrophobicContact CG-CE 4.3Å; M1-M374 HydrophobicContact SD-CE 4.1Å; M374-T376 PolarHBondContact O-N 3.35Å; M374-F377 HydrophobicContact CB-CD2 4.16Å; M374-F377 HydrophobicContact CG-CD2 4.02Å; M374-F377 HydrophobicContact CG-CE2 4.21Å; M374-F377 PolarHBondContact O-N 2.82Å; M374-F377 HydrophobicContact SD-CD2 3.97Å; M374-F377 HydrophobicContact SD-CE2 3.62Å
375	R	54.8	Low	63.9	Low	230 Å²	230	113.6 Å²	113.6	87%	0.868	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	-28.9	-174.5	-72.4	-176	179.3	167.1	1.6	114.8	Y373 F377 F378	Y373-R375 PolarHBondContact O-N 3.29Å; R375-F377 PolarHBondContact O-N 2.6Å; R375-F377 VanDerWaalsContact O-N 3.12Å; R375-F378 PolarHBondContact O-N 2.91Å
376	T	52.3	Low	63.4	Low	90 Å²	90	104.9 Å²	104.9	55%	0.552	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.3	178.4	44.7	0	0	0	0	114.1	M374	M374-T376 PolarHBondContact O-N 3.35Å
377	F	52.5	Low	62.8	Low	32 Å²	32	101.2 Å²	101.2	14%	0.14	52%	0.523	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-19.8	-179.4	-62.6	-68.2	0	0	0	113.7	R32 R204 V296 M374 R375	R32-F377 PolarHBondContact NH2-O 3.09Å; R204-F377 VanDerWaalsContact CZ-CZ 3.5Å; V296-F377 HydrophobicContact CB-CE1 4.44Å; V296-F377 HydrophobicContact CB-CE2 4.14Å; V296-F377 HydrophobicContact CB-CZ 3.59Å; V296-F377 HydrophobicContact CG1-CD1 4.46Å; V296-F377 HydrophobicContact CG1-CE1 3.48Å; V296-F377 VanDerWaalsContact CG1-CE1 3.48Å; V296-F377 HydrophobicContact CG1-CE2 3.73Å; V296-F377 HydrophobicContact CG1-CZ 3.04Å; M374-F377 HydrophobicContact CB-CD2 4.16Å; M374-F377 HydrophobicContact CG-CD2 4.02Å; M374-F377 HydrophobicContact CG-CE2 4.21Å; M374-F377 PolarHBondContact O-N 2.82Å; M374-F377 HydrophobicContact SD-CD2 3.97Å; M374-F377 HydrophobicContact SD-CE2 3.62Å; R375-F377 PolarHBondContact O-N 2.6Å; R375-F377 VanDerWaalsContact O-N 3.12Å
378	F	52.6	Low	62.2	Low	64 Å²	64	101.5 Å²	101.5	28%	0.281	52%	0.516	S	S	.	.			trans	-98.3	107.1	-179.9	-73.6	-91.6	0	0	0	109.5	Y373 R375 D383	Y373-F378 HydrophobicContact CD1-CE1 4.49Å; Y373-F378 AromaticContact CD1-CE2 3.92Å; Y373-F378 HydrophobicContact CD1-CE2 3.92Å; Y373-F378 AromaticContact CD1-CZ 3.84Å; Y373-F378 HydrophobicContact CD1-CZ 3.84Å; Y373-F378 HydrophobicContact CE1-CZ 4.45Å; R375-F378 PolarHBondContact O-N 2.91Å; F378-D383 HydrophobicContact CE1-CB 4.5Å
379	S	53.1	Low	61.6	Low	36 Å²	36	99 Å²	99	25%	0.252	50%	0.504	S	S	.	.			trans	-80.8	121.5	159.6	173	0	0	0	0	106	R116 D381	R116-S379 PolarHBondContact NH2-OG 2.9Å; S379-D381 PolarHBondContact O-N 3.12Å
380	S	49.2	Very low	61.1	Low	114 Å²	114	91.1 Å²	91.1	80%	0.797	47%	0.467	S	S	*	.	S	Bend	trans	-15.6	-19.3	177.1	-175.7	0	0	0	0	121.3
381	D	44.3	Very low	60.3	Low	95 Å²	95	92.8 Å²	92.8	51%	0.508	48%	0.478	S	S	.	.	S	Bend	trans	-121.9	109.6	-166.2	-47.7	-35.4	0	0	0	109.1	S379	S379-D381 PolarHBondContact O-N 3.12Å
382	D	47.8	Very low	59.7	Low	165 Å²	165	92 Å²	92	88%	0.882	48%	0.476	S	S	*	.			trans	40.4	94.1	162	-61.7	-32.2	0	0	0	117.3
383	D	55.4	Low	58.9	Low	47 Å²	47	91.7 Å²	91.7	25%	0.251	47%	0.471	S	S	.	.			trans	-128.9	115.5	166.7	-79.8	-33.6	0	0	0	110.7	R32 R74 F378	R32-D383 IonicContact CZ-OD2 3.06Å; R32-D383 IonicContact NH1-OD2 3.6Å; R32-D383 PolarHBondContact NH1-OD2 3.14Å; R32-D383 VanDerWaalsContact NH1-OD2 3.1Å; R32-D383 IonicContact NH2-OD2 3.04Å; R32-D383 PolarHBondContact NH2-OD2 3.09Å; R74-D383 IonicContact CZ-OD1 3.09Å; R74-D383 IonicContact CZ-OD2 3.9Å; R74-D383 IonicContact NE-OD1 2.88Å; R74-D383 PolarHBondContact NE-OD1 2.87Å; R74-D383 IonicContact NE-OD2 2.58Å; R74-D383 PolarHBondContact NE-OD2 2.91Å; R74-D383 VanDerWaalsContact NE-OD2 3.16Å; R74-D383 IonicContact NH2-OD1 3.45Å; R74-D383 IonicContact NH2-OD2 2.68Å; R74-D383 PolarHBondContact NH2-OD2 3.45Å; F378-D383 HydrophobicContact CE1-CB 4.5Å
384	E	56.2	Low	58.6	Low	119 Å²	119	90.4 Å²	90.4	56%	0.556	48%	0.478	S	S	*	.			trans	-51	155.1	164.8	-70	-176	150.6	0	0	112.3	R118 P386	R118-E384 IonicContact CZ-OE2 3.57Å; R118-E384 IonicContact NH1-OE2 2.9Å; R118-E384 PolarHBondContact NH1-OE2 2.95Å; R118-E384 IonicContact NH2-OE2 2.8Å; R118-E384 PolarHBondContact NH2-OE2 3.28Å; E384-P386 VanDerWaalsContact O-CD 3.28Å; E384-P386 WeakPolarHBondContact O-CD 3.44Å; E384-P386 VanDerWaalsContact O-N 3.14Å
385	D	61.8	Low	58.5	Low	119 Å²	119	95.2 Å²	95.2	64%	0.636	50%	0.5	S	S	*	.			trans	-61.7	115.7	177.6	-113.3	-22.8	0	0	0	110.9
386	P	69	Low	58.6	Low	13 Å²	13	88.6 Å²	88.6	8%	0.084	48%	0.481	C	S	.	.			trans	-82.5	155.9	-170.3	33.1	-37.8	0	0	0	113	W33 E384 R388	W33-P386 HydrophobicContact CD2-CB 4.46Å; W33-P386 HydrophobicContact CD2-CG 4.12Å; W33-P386 HydrophobicContact CE3-CB 3.84Å; W33-P386 HydrophobicContact CE3-CG 3.97Å; W33-P386 HydrophobicContact CH2-CB 2.85Å; W33-P386 HydrophobicContact CH2-CG 3.16Å; W33-P386 HydrophobicContact CZ2-CB 3.55Å; W33-P386 HydrophobicContact CZ2-CG 3.23Å; W33-P386 HydrophobicContact CZ3-CB 3.02Å; W33-P386 HydrophobicContact CZ3-CG 3.55Å; E384-P386 VanDerWaalsContact O-CD 3.28Å; E384-P386 WeakPolarHBondContact O-CD 3.44Å; E384-P386 VanDerWaalsContact O-N 3.14Å; P386-R388 HydrophobicContact CG-CG 4.05Å; P386-R388 PolarHBondContact O-N 3.24Å
387	L	70.6	Confident	58.7	Low	23 Å²	23	93.3 Å²	93.3	12%	0.12	50%	0.496	C	S	.	.			trans	-68.3	98.5	171.6	-165.5	73.6	0	0	0	109.9	D75 G76 R77 V93 L94 L389 I390	D75-L387 WeakPolarHBondContact O-CB 3.47Å; D75-L387 PolarHBondContact O-N 3.07Å; G76-L387 WeakPolarHBondContact O-CD2 3.44Å; R77-L387 HydrophobicContact CG-CB 3.94Å; V93-L387 HydrophobicContact CB-CD2 4.25Å; V93-L387 HydrophobicContact CG1-CD2 3.78Å; L94-L387 HydrophobicContact CD1-CD1 4.28Å; L94-L387 HydrophobicContact CD2-CD1 4.13Å; L94-L387 HydrophobicContact CD2-CD2 3.99Å; L94-L387 HydrophobicContact CG-CD1 4.48Å; L94-L387 HydrophobicContact CG-CD2 4.15Å; L387-L389 WeakPolarHBondContact CD1-O 3.38Å; L387-I390 HydrophobicContact CD2-CG1 4.28Å
388	R	69.4	Low	58.8	Low	108 Å²	108	96.6 Å²	96.6	41%	0.408	52%	0.515	S	S	.	.			trans	-95.1	-30.7	175.6	-62.6	-177.8	-171.1	179.3	8.3	112	W33 S35 P386	W33-R388 HydrophobicContact CD2-CG 4.37Å; W33-R388 HydrophobicContact CE3-CG 4.37Å; S35-R388 WeakPolarHBondContact CB-O 3.27Å; S35-R388 PolarHBondContact OG-O 3.13Å; P386-R388 HydrophobicContact CG-CG 4.05Å; P386-R388 PolarHBondContact O-N 3.24Å
389	L	71.8	Confident	59	Low	101 Å²	101	97.5 Å²	97.5	53%	0.529	53%	0.527	S	S	.	.			trans	-133.6	144	-176.5	-162.5	83.3	0	0	0	108.6	L387	L387-L389 WeakPolarHBondContact CD1-O 3.38Å
390	I	74.6	Confident	59.3	Low	7 Å²	7	104 Å²	104	4%	0.036	55%	0.554	C	S	.	*			trans	-100	110.7	164.4	-60.3	175.6	0	0	0	105.5	L36 I48 K58 V93 L94 L387 C392	L36-I390 HydrophobicContact CD1-CD1 3.92Å; L36-I390 HydrophobicContact CD1-CG1 3.92Å; L36-I390 HydrophobicContact CD2-CD1 4.31Å; L36-I390 HydrophobicContact CD2-CG1 4.33Å; I48-I390 HydrophobicContact CG2-CD1 4.16Å; K58-I390 HydrophobicContact CG-CD1 4.25Å; V93-I390 HydrophobicContact CG1-CD1 3.66Å; V93-I390 HydrophobicContact CG1-CG1 4.38Å; L94-I390 HydrophobicContact CD2-CB 4.35Å; L94-I390 HydrophobicContact CD2-CG1 4.02Å; L94-I390 HydrophobicContact CD2-CG2 3.89Å; L387-I390 HydrophobicContact CD2-CG1 4.28Å; I390-C392 PolarHBondContact O-N 3.28Å; I390-C392 VanDerWaalsContact O-N 3.09Å
391	C	67	Low	59.5	Low	114 Å²	114	105.1 Å²	105.1	77%	0.77	55%	0.546	S	S	*	.			trans	-70.9	106.1	171.2	-60.3	0	0	0	0	107.8
392	C	61.8	Low	59.7	Low	74 Å²	74	102.9 Å²	102.9	50%	0.5	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-81	128.6	166.8	29.4	0	0	0	0	108.4	I390	I390-C392 PolarHBondContact O-N 3.28Å; I390-C392 VanDerWaalsContact O-N 3.09Å
393	M	54.8	Low	59.8	Low	158 Å²	158	99.3 Å²	99.3	78%	0.778	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-66.1	131.3	161.1	-162.4	174.2	76.4	0	0	106	E395	M393-E395 PolarHBondContact O-N 3.47Å
394	P	54.3	Low	59.2	Low	101 Å²	101	100.1 Å²	100.1	66%	0.656	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-54.8	132.1	178.6	21.7	-31.5	0	0	0	108.9	I396	P394-I396 PolarHBondContact O-N 3.33Å; P394-I396 VanDerWaalsContact O-N 3.08Å
395	E	55.3	Low	58.7	Low	190 Å²	190	101.7 Å²	101.7	89%	0.888	54%	0.539	S	S	*	.			trans	-61	114.1	167.9	-74.6	-177.9	166.9	0	0	106.8	M393 E397	M393-E395 PolarHBondContact O-N 3.47Å; E395-E397 PolarHBondContact O-N 3.08Å
396	I	56.2	Low	58	Low	91 Å²	91	102 Å²	102	47%	0.467	55%	0.545	S	S	.	.			trans	-78.1	108.6	174.2	-54.2	172.6	0	0	0	104.9	P394 D398	P394-I396 PolarHBondContact O-N 3.33Å; P394-I396 VanDerWaalsContact O-N 3.08Å; I396-D398 WeakPolarHBondContact CG2-O 3.33Å; I396-D398 PolarHBondContact O-N 3.42Å; I396-D398 VanDerWaalsContact O-N 3.08Å
397	E	55.2	Low	56.7	Low	189 Å²	189	108.1 Å²	108.1	88%	0.883	58%	0.576	S	S	*	*	S	Bend	trans	-57.7	-23.3	-177.1	-80.3	-176.2	147.1	0	0	112.4	E395	E395-E397 PolarHBondContact O-N 3.08Å
398	D	55.6	Low	55.2	Low	100 Å²	100	112.2 Å²	112.2	54%	0.535	60%	0.603	S	S	.	*			trans	-148.1	102.8	168.2	-83.5	-56.7	0	0	0	111.8	I396 E400 E401	I396-D398 WeakPolarHBondContact CG2-O 3.33Å; I396-D398 PolarHBondContact O-N 3.42Å; I396-D398 VanDerWaalsContact O-N 3.08Å; D398-E400 PolarHBondContact O-N 3.16Å; D398-E400 VanDerWaalsContact O-N 3.16Å; D398-E401 PolarHBondContact O-N 3.43Å
399	P	56.4	Low	53.6	Low	83 Å²	83	115.3 Å²	115.3	54%	0.539	62%	0.621	S	S	.	*	H	α-helix	trans	-65.7	-17.7	-178.3	24.6	-32.3	0	0	0	113.5	S402 V403	P399-S402 PolarHBondContact O-OG 2.62Å; P399-V403 WeakPolarHBondContact O-CG2 3.07Å
400	E	59.2	Low	52	Low	172 Å²	172	119.2 Å²	119.2	80%	0.804	64%	0.637	S	S	*	*	H	α-helix	trans	-82.5	-31.4	-179.2	-63.6	-169.8	180	0	0	113.5	D398	D398-E400 PolarHBondContact O-N 3.16Å; D398-E400 VanDerWaalsContact O-N 3.16Å
401	E	53.9	Low	50.2	Low	138 Å²	138	125 Å²	125	65%	0.645	67%	0.674	S	S	*	*	H	α-helix	trans	-74.9	-40.2	178.8	-74.6	-165.2	157.1	0	0	112	D398 V403 S404 E405	D398-E401 PolarHBondContact O-N 3.43Å; E401-V403 VanDerWaalsContact C-N 3.28Å; E401-V403 PolarHBondContact O-N 3.39Å; E401-S404 WeakPolarHBondContact O-CB 3.47Å; E401-S404 PolarHBondContact O-N 3.29Å; E401-S404 PolarHBondContact O-OG 3.21Å; E401-E405 PolarHBondContact O-N 3.39Å
402	S	47.7	Very low	48.4	Very low	48 Å²	48	128.9 Å²	128.9	34%	0.336	68%	0.681	S	S	.	*	H	α-helix	trans	-64.7	-27.5	-178.4	56.2	0	0	0	0	114.1	P399	P399-S402 PolarHBondContact O-OG 2.62Å
403	V	48.8	Very low	47.2	Very low	91 Å²	91	130.1 Å²	130.1	55%	0.552	70%	0.697	S	S	*	*	H	α-helix	trans	-79.1	-23.5	175.2	-174.7	0	0	0	0	111.7	P399 E401 L407	P399-V403 WeakPolarHBondContact O-CG2 3.07Å; E401-V403 VanDerWaalsContact C-N 3.28Å; E401-V403 PolarHBondContact O-N 3.39Å; V403-L407 HydrophobicContact CG1-CD1 4.37Å
404	S	44.6	Very low	46.1	Very low	64 Å²	64	130.1 Å²	130.1	45%	0.448	70%	0.7	S	S	.	*	H	α-helix	trans	-78.8	-28.9	179.9	74.7	0	0	0	0	113.6	E401 T408	E401-S404 WeakPolarHBondContact O-CB 3.47Å; E401-S404 PolarHBondContact O-N 3.29Å; E401-S404 PolarHBondContact O-OG 3.21Å; S404-T408 PolarHBondContact O-OG1 3.12Å
405	E	45.6	Very low	45	Very low	151 Å²	151	134.1 Å²	134.1	71%	0.706	71%	0.712	S	S	*	*	H	α-helix	trans	-74.9	-27.6	176.8	-70.9	-169.5	152.6	0	0	113.1	E401 L407 T408	E401-E405 PolarHBondContact O-N 3.39Å; E405-L407 VanDerWaalsContact C-N 3.34Å; E405-T408 PolarHBondContact O-OG1 3.21Å
406	V	47.1	Very low	43.9	Very low	126 Å²	126	130.9 Å²	130.9	76%	0.764	71%	0.708	S	S	*	*	H	α-helix	trans	-80.1	-17.4	177.9	-178.1	0	0	0	0	112.4
407	L	40.2	Very low	42.7	Very low	141 Å²	141	138.6 Å²	138.6	74%	0.738	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	2.4	-179.6	-71.7	170.6	0	0	0	114.3	V403 E405	V403-L407 HydrophobicContact CG1-CD1 4.37Å; E405-L407 VanDerWaalsContact C-N 3.34Å
408	T	38.9	Very low	41.5	Very low	110 Å²	110	135.3 Å²	135.3	68%	0.675	73%	0.729	S	S	*	*	S	Bend	trans	-105.9	7.4	-175.5	37.9	0	0	0	0	115.6	S404 E405	S404-T408 PolarHBondContact O-OG1 3.12Å; E405-T408 PolarHBondContact O-OG1 3.21Å
409	E	36.1	Very low	40.2	Very low	172 Å²	172	135.3 Å²	135.3	80%	0.804	74%	0.736	S	S	*	*			trans	-105.7	63.1	168.8	-71	-162.1	160.6	0	0	113.1
410	H	38.4	Very low	39.1	Very low	184 Å²	184	139.2 Å²	139.2	85%	0.852	75%	0.753	S	S	*	*			trans	-152.2	116.4	154.3	-87.4	-57.2	0	0	0	110.9	E412	H410-E412 PolarHBondContact O-N 2.68Å
411	P	37.1	Very low	37.6	Very low	127 Å²	127	135.1 Å²	135.1	83%	0.825	75%	0.749	S	S	*	*			trans	-75.3	119.6	173	28.8	-28.7	0	0	0	110.1
412	E	30.1	Very low	36.4	Very low	196 Å²	196	137.6 Å²	137.6	92%	0.916	76%	0.762	S	S	*	*			trans	12.3	110.1	160	-62	-175.7	156.5	0	0	118.3	H410	H410-E412 PolarHBondContact O-N 2.68Å
413	A	35.1	Very low	35.3	Very low	100 Å²	100	142.9 Å²	142.9	83%	0.826	79%	0.787	S	S	*	*			trans	-128.7	99.4	152	0	0	0	0	0	110.2
414	N	32	Very low	34.5	Very low	158 Å²	158	145.5 Å²	145.5	85%	0.845	80%	0.803	S	S	*	*			trans	12.9	116.7	156.5	-73.5	-31.5	0	0	0	119
415	M	32	Very low	33.5	Very low	186 Å²	186	147.2 Å²	147.2	92%	0.916	81%	0.814	S	S	*	*				-175.9	154.5	121.2	-98.7	-158.7	-144.9	0	0	113
416	P	31.8	Very low	32.8	Very low	121 Å²	121	144.6 Å²	144.6	79%	0.786	81%	0.813	S	S	*	*			trans	-89	149.9	-163	35.3	-33.2	0	0	0	114.1
417	R	30	Very low	31.9	Very low	254 Å²	254	147.3 Å²	147.3	96%	0.958	82%	0.815	S	S	*	*			trans	-63.8	137.5	179.2	-71.9	178.7	172.9	175.3	-2.6	112.9
418	S	31.5	Very low	31.4	Very low	120 Å²	120	146.3 Å²	146.3	84%	0.839	82%	0.817	S	S	*	*			trans	-138.4	148.1	148.5	75.5	0	0	0	0	111
419	S	28.6	Very low	31	Very low	99 Å²	99	149.4 Å²	149.4	69%	0.692	82%	0.821	S	S	*	*			trans	-66.4	146.5	-165.7	49.4	0	0	0	0	116.3
420	N	31.8	Very low	30.5	Very low	166 Å²	166	151.2 Å²	151.2	89%	0.888	82%	0.821	S	S	*	*				-172.7	149.7	120.3	-92.9	-21.5	0	0	0	113
421	A	27.5	Very low	30.1	Very low	86 Å²	86	147.9 Å²	147.9	71%	0.711	81%	0.808	S	S	*	*			trans	-66.1	158.9	-170	0	0	0	0	0	116.1
422	M	29.1	Very low	29.5	Very low	190 Å²	190	147.8 Å²	147.8	94%	0.936	80%	0.8	S	S	*	*				175.4	145.7	105.8	-91.1	-173.9	-165.3	0	0	113
423	N	24.9	Very low	29.4	Very low	159 Å²	159	145.5 Å²	145.5	85%	0.85	79%	0.794	S	S	*	*			trans	-42.7	143	174.5	-76.1	-31.2	0	0	0	115.9
424	V	32	Very low	29	Very low	146 Å²	146	145 Å²	145	89%	0.885	78%	0.783	S	S	*	*			trans	-141	120.2	133.3	-170.2	0	0	0	0	109.1
425	S	23.8	Very low	28.6	Very low	99 Å²	99	142.6 Å²	142.6	69%	0.692	78%	0.784	S	S	*	*			trans	-75.9	166.9	171.1	47.7	0	0	0	0	112.4
426	S	30.5	Very low	28.3	Very low	97 Å²	97	141.3 Å²	141.3	68%	0.678	77%	0.774	S	S	*	*			trans	104.4	133	154.3	94.9	0	0	0	0	115.1
427	F	28.9	Very low	27.9	Very low	182 Å²	182	141.2 Å²	141.2	80%	0.798	78%	0.776	S	S	*	*			cis	-156.9	148.6	1.2	-89.6	-75.2	0	0	0	107.7
428	P	29.8	Very low	27.7	Very low	120 Å²	120	139.2 Å²	139.2	78%	0.779	77%	0.77	S	S	*	*			trans	-102.8	128.8	160.8	34	-22.6	0	0	0	110.1
429	F	30.2	Very low	27.4	Very low	175 Å²	175	137.9 Å²	137.9	77%	0.768	77%	0.767	S	S	*	*			trans	-131.4	98.4	162.8	-111	-83.3	0	0	0	109.2	I431	F429-I431 HydrophobicContact CD1-CD1 3.77Å; F429-I431 HydrophobicContact CD1-CG1 3.62Å; F429-I431 HydrophobicContact CE1-CD1 3.81Å; F429-I431 HydrophobicContact CE1-CG1 3.96Å
430	R	24.8	Very low	27.2	Very low	210 Å²	210	140.1 Å²	140.1	79%	0.792	77%	0.769	S	S	*	*			trans	-107.8	111.1	160.8	-174.8	179.9	178.5	157.5	6.3	105.6	D432	R430-D432 IonicContact NE-OD1 3.7Å; R430-D432 IonicContact NE-OD2 3.47Å; R430-D432 PolarHBondContact NE-OD2 3.01Å
431	I	31.1	Very low	26.9	Very low	115 Å²	115	138.1 Å²	138.1	59%	0.59	77%	0.766	S	S	*	*			trans	-102.3	99.5	170.1	-58.5	-177.5	0	0	0	106.5	F429 L433	F429-I431 HydrophobicContact CD1-CD1 3.77Å; F429-I431 HydrophobicContact CD1-CG1 3.62Å; F429-I431 HydrophobicContact CE1-CD1 3.81Å; F429-I431 HydrophobicContact CE1-CG1 3.96Å; I431-L433 HydrophobicContact CG2-CB 4.42Å; I431-L433 HydrophobicContact CG2-CD1 3.69Å; I431-L433 HydrophobicContact CG2-CG 3.62Å
432	D	24.6	Very low	26.8	Very low	124 Å²	124	139.6 Å²	139.6	66%	0.663	77%	0.766	S	S	*	*			trans	-78.8	120.6	156.8	-66.2	-45.1	0	0	0	106.9	R430	R430-D432 IonicContact NE-OD1 3.7Å; R430-D432 IonicContact NE-OD2 3.47Å; R430-D432 PolarHBondContact NE-OD2 3.01Å
433	L	28.2	Very low	26.7	Very low	148 Å²	148	137.4 Å²	137.4	78%	0.775	76%	0.758	S	S	*	*			trans	-125.3	143.3	167.4	-83	170.9	0	0	0	110.8	I431	I431-L433 HydrophobicContact CG2-CB 4.42Å; I431-L433 HydrophobicContact CG2-CD1 3.69Å; I431-L433 HydrophobicContact CG2-CG 3.62Å
434	P	25.5	Very low	26.8	Very low	91 Å²	91	136 Å²	136	59%	0.591	76%	0.757	S	S	*	*			trans	-83.4	150.5	-163	33.8	-34.5	0	0	0	112.6	F436	P434-F436 HydrophobicContact CG-CD2 4.45Å; P434-F436 HydrophobicContact CG-CE2 4.09Å; P434-F436 PolarHBondContact O-N 3.26Å
435	A	24.4	Very low	26.5	Very low	107 Å²	107	131 Å²	131	88%	0.884	74%	0.736	S	S	*	*			trans	-54.8	108.8	171.3	0	0	0	0	0	111.3
436	F	26.2	Very low	26.6	Very low	158 Å²	158	133.5 Å²	133.5	69%	0.693	74%	0.741	S	S	*	*			trans	-96.2	107	163.3	-87.4	-82.1	0	0	0	109	P434 Y438	P434-F436 HydrophobicContact CG-CD2 4.45Å; P434-F436 HydrophobicContact CG-CE2 4.09Å; P434-F436 PolarHBondContact O-N 3.26Å; F436-Y438 HydrophobicContact CB-CD2 4.21Å; F436-Y438 HydrophobicContact CB-CE2 4.25Å; F436-Y438 HydrophobicContact CD1-CE2 4.34Å; F436-Y438 PolarHBondContact O-N 3.37Å
437	S	22.1	Very low	26.3	Very low	120 Å²	120	140 Å²	140	84%	0.839	75%	0.752	S	S	*	*			trans	-66.6	107.3	163.9	59	0	0	0	0	108.9
438	Y	26.8	Very low	26.1	Very low	211 Å²	211	135.6 Å²	135.6	83%	0.827	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-102.7	128.7	161.8	-89.6	-83	0	0	0	110	F436	F436-Y438 HydrophobicContact CB-CD2 4.21Å; F436-Y438 HydrophobicContact CB-CE2 4.25Å; F436-Y438 HydrophobicContact CD1-CE2 4.34Å; F436-Y438 PolarHBondContact O-N 3.37Å
439	A	25.2	Very low	26.1	Very low	93 Å²	93	140 Å²	140	77%	0.769	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-59.6	136.4	-174.7	0	0	0	0	0	112.3	P441	A439-P441 WeakPolarHBondContact O-CD 3.49Å
440	I	24.4	Very low	25.9	Very low	145 Å²	145	138.2 Å²	138.2	74%	0.744	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-54.7	121.1	169.2	-56.1	160.9	0	0	0	109.3	T442	I440-T442 HydrophobicContact CG2-CG2 3.8Å; I440-T442 PolarHBondContact O-N 3.38Å
441	P	25.1	Very low	25.9	Very low	125 Å²	125	134.4 Å²	134.4	81%	0.812	76%	0.756	S	S	*	*			trans	-86.6	98.9	155.7	17.1	-0.2	0	0	0	107.7	A439 N443	A439-P441 WeakPolarHBondContact O-CD 3.49Å; P441-N443 PolarHBondContact O-N 2.9Å; P441-N443 VanDerWaalsContact O-N 3.11Å
442	T	25.5	Very low	25.6	Very low	117 Å²	117	135.5 Å²	135.5	72%	0.718	77%	0.765	S	S	*	*			trans	-66.3	98	163.9	38.6	0	0	0	0	109	I440	I440-T442 HydrophobicContact CG2-CG2 3.8Å; I440-T442 PolarHBondContact O-N 3.38Å
443	N	26.5	Very low	25.7	Very low	144 Å²	144	136.2 Å²	136.2	77%	0.77	77%	0.771	S	S	*	*			trans	-169.4	103.8	154	-112	-28.9	0	0	0	112.3	P441 G445	P441-N443 PolarHBondContact O-N 2.9Å; P441-N443 VanDerWaalsContact O-N 3.11Å; N443-G445 PolarHBondContact O-N 3.35Å
444	P	27.5	Very low	25.5	Very low	128 Å²	128	135.4 Å²	135.4	83%	0.831	77%	0.771	S	S	*	*			trans	-82.7	77.9	153.6	33.3	-24	0	0	0	107
445	G	25.3	Very low	25.6	Very low	43 Å²	43	138.4 Å²	138.4	44%	0.443	78%	0.783	S	S	.	*			trans	-117.3	109	179.5	0	0	0	0	0	110.8	N443	N443-G445 PolarHBondContact O-N 3.35Å
446	L	25.7	Very low	25.6	Very low	151 Å²	151	140.6 Å²	140.6	79%	0.791	78%	0.776	S	S	*	*			trans	54.9	93.8	153.1	-70.2	114.2	0	0	0	118.2
447	Y	25.4	Very low	25.6	Very low	233 Å²	233	139.3 Å²	139.3	91%	0.914	78%	0.782	S	S	*	*			trans	-122.8	70.6	130.7	-76	-77.9	0	0	0	109.2
448	C	24	Very low	25.9	Very low	89 Å²	89	140.9 Å²	140.9	60%	0.601	78%	0.777	S	S	*	*			trans	-115.4	90.5	151.2	-95	0	0	0	0	106.1
449	L	29.3	Very low	25.8	Very low	212 Å²	212	134.5 Å²	134.5	100%	1.11	77%	0.773	S	S	*	*			trans	-159.9	0	148.7	-94.9	176.9	0	0	0	108.4

Retrieved 449 of 449 residues in 396.5 ms (Link to these results)

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