A0A060D3D7_MAIZE Loading...

WD40 transcription factor

AlphaFold DB (Q3V810), UniProt , Accession A0A060D3D7, Species MAIZE (Zea mays, Maize), Gene WD40.1, Length 353 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	49.6	Very low	38.8	Very low	242 Å²	242	137.1 Å²	137.1	100%	1.192	82%	0.82	S	S	*	*				0	96.6	0	-164.8	-176.3	-82.9	0	0	104
2	D	42.5	Very low	38.2	Very low	157 Å²	157	134.9 Å²	134.9	84%	0.84	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-65.7	144.4	-174	-76.2	-35.6	0	0	0	110.6
3	P	42.7	Very low	37.6	Very low	110 Å²	110	132.9 Å²	132.9	71%	0.714	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-64.2	147.4	-175.8	25.9	-33.2	0	0	0	111.2	K5	P3-K5 PolarHBondContact O-N 3.28Å
4	P	37.6	Very low	37.2	Very low	128 Å²	128	132.1 Å²	132.1	83%	0.831	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-64.5	126.1	-178	25.8	-31.5	0	0	0	110.1
5	K	44.6	Very low	36.6	Very low	198 Å²	198	126.3 Å²	126.3	86%	0.861	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-64	133	174.5	-154.6	174.2	-173.8	-180	0	108.6	P3	P3-K5 PolarHBondContact O-N 3.28Å
6	P	37.2	Very low	36.4	Very low	106 Å²	106	126.4 Å²	126.4	69%	0.688	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-62.4	150.2	-179.7	24.5	-32.3	0	0	0	110.7	S8	P6-S8 PolarHBondContact O-N 3.35Å
7	P	35.5	Very low	36.7	Very low	125 Å²	125	130 Å²	130	81%	0.812	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-58.8	133.5	-179.5	24.1	-31.8	0	0	0	109.5	S9	P7-S9 PolarHBondContact O-N 3Å
8	S	36.4	Very low	37.3	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	80%	0.798	S	S	*	*			trans	-54.4	110.3	171.1	49.6	0	0	0	0	108.6	P6 V10	P6-S8 PolarHBondContact O-N 3.35Å; S8-V10 PolarHBondContact O-N 3Å
9	S	36.5	Very low	38.7	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	80%	0.796	S	S	*	*			trans	-55.8	110.7	165.6	53	0	0	0	0	106.9	P7 A11	P7-S9 PolarHBondContact O-N 3Å; S9-A11 PolarHBondContact O-N 3.21Å
10	V	32.2	Very low	40.5	Very low	131 Å²	131	126.3 Å²	126.3	79%	0.794	78%	0.775	S	S	*	*			trans	-56.8	111.6	166	-179.6	0	0	0	0	104.8	S8 S12	S8-V10 PolarHBondContact O-N 3Å; V10-S12 VanDerWaalsContact C-N 3.33Å; V10-S12 PolarHBondContact O-N 3.45Å
11	A	31.9	Very low	42.4	Very low	90 Å²	90	124.9 Å²	124.9	74%	0.744	77%	0.768	S	S	*	*			trans	-55.9	104.9	170.2	0	0	0	0	0	106.2	S9 S13	S9-A11 PolarHBondContact O-N 3.21Å; A11-S13 VanDerWaalsContact C-N 3.29Å; A11-S13 PolarHBondContact O-N 2.99Å
12	S	32.6	Very low	44.2	Very low	111 Å²	111	118.1 Å²	118.1	78%	0.776	73%	0.734	S	S	*	*			trans	-60.5	102.3	166.3	49.8	0	0	0	0	105.5	V10 S14	V10-S12 VanDerWaalsContact C-N 3.33Å; V10-S12 PolarHBondContact O-N 3.45Å; S12-S14 PolarHBondContact O-N 3.08Å
13	S	30.2	Very low	46.6	Very low	109 Å²	109	111.3 Å²	111.3	76%	0.762	70%	0.699	S	S	*	*			trans	-51.6	114.4	167.8	52.5	0	0	0	0	107.2	A11 G15	A11-S13 VanDerWaalsContact C-N 3.29Å; A11-S13 PolarHBondContact O-N 2.99Å; S13-G15 PolarHBondContact O-N 2.8Å
14	S	31.7	Very low	49.2	Very low	121 Å²	121	107.3 Å²	107.3	85%	0.846	67%	0.671	S	S	*	*			trans	-61.7	85	166.6	54.3	0	0	0	0	107.6	S12	S12-S14 PolarHBondContact O-N 3.08Å
15	G	28.3	Very low	51.9	Low	46 Å²	46	104.4 Å²	104.4	47%	0.474	65%	0.651	S	S	.	*			trans	-61	153.8	162.7	0	0	0	0	0	108.4	S13 E17	S13-G15 PolarHBondContact O-N 2.8Å; G15-E17 PolarHBondContact O-N 2.98Å
16	P	33	Very low	54.4	Low	128 Å²	128	95.6 Å²	95.6	83%	0.831	61%	0.614	S	S	*	*			trans	-56.7	117.7	175.3	24.9	-31.3	0	0	0	107.8	T18	P16-T18 PolarHBondContact O-N 3.24Å
17	E	41.9	Very low	57.3	Low	187 Å²	187	96.9 Å²	96.9	87%	0.874	61%	0.611	S	S	*	*			trans	-52.1	110.5	177.2	-76.7	178.9	150.8	0	0	108	G15 P19	G15-E17 PolarHBondContact O-N 2.98Å; E17-P19 WeakPolarHBondContact O-CD 3.32Å; E17-P19 VanDerWaalsContact O-N 3.16Å
18	T	47.2	Very low	60.2	Low	126 Å²	126	91.6 Å²	91.6	77%	0.773	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-59	119.1	164.7	43.8	0	0	0	0	106.3	P16 N20	P16-T18 PolarHBondContact O-N 3.24Å; T18-N20 PolarHBondContact O-N 2.86Å
19	P	63.5	Low	62.9	Low	118 Å²	118	91.1 Å²	91.1	77%	0.766	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-56.2	127.3	-176.7	18.6	-29.3	0	0	0	109.2	E17 P21	E17-P19 WeakPolarHBondContact O-CD 3.32Å; E17-P19 VanDerWaalsContact O-N 3.16Å; P19-P21 WeakPolarHBondContact O-CD 3.24Å; P19-P21 VanDerWaalsContact O-N 3.15Å
20	N	76.3	Confident	65.7	Low	71 Å²	71	88.8 Å²	88.8	38%	0.38	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-61	117.1	178.5	179.5	-12.9	0	0	0	108.3	T18 H22 A23	T18-N20 PolarHBondContact O-N 2.86Å; N20-H22 PolarHBondContact O-N 3.14Å; N20-H22 PolarHBondContact OD1-N 2.68Å; N20-A23 HydrophobicContact CB-CB 4.06Å; N20-A23 PolarHBondContact O-N 3.45Å; N20-A23 VanDerWaalsContact O-N 3.12Å
21	P	78.9	Confident	68.7	Low	97 Å²	97	85.4 Å²	85.4	63%	0.63	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-8.6	-175.1	27.2	-34.4	0	0	0	113.6	P19	P19-P21 WeakPolarHBondContact O-CD 3.24Å; P19-P21 VanDerWaalsContact O-N 3.15Å
22	H	88.1	Confident	71.8	Confident	100 Å²	100	81.4 Å²	81.4	46%	0.463	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	4.3	-179.4	-57.2	-68.2	0	0	0	113.4	N20 R352	N20-H22 PolarHBondContact O-N 3.14Å; N20-H22 PolarHBondContact OD1-N 2.68Å; H22-R352 HydrophobicContact CB-CB 4.36Å; H22-R352 PolarHBondContact O-N 2.9Å
23	A	93.4	Very high	74.9	Confident	14 Å²	14	79.5 Å²	79.5	12%	0.116	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.5	-179	0	0	0	0	0	111.4	N20 Q349 L350 L351	N20-A23 HydrophobicContact CB-CB 4.06Å; N20-A23 PolarHBondContact O-N 3.45Å; N20-A23 VanDerWaalsContact O-N 3.12Å; A23-Q349 HydrophobicContact CB-CG 4.23Å; A23-L350 CarbonylContact C-O 3.58Å; A23-L350 WeakPolarHBondContact CA-O 3.41Å; A23-L351 HydrophobicContact CB-CD2 3.62Å
24	F	95.9	Very high	78.1	Confident	26 Å²	26	74.4 Å²	74.4	11%	0.114	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.5	179.6	-54.8	-87.3	0	0	0	108.8	P67 S68 F72 W339 Q349 L350	F24-P67 HydrophobicContact CD2-CB 4.26Å; F24-P67 HydrophobicContact CE1-CB 4.23Å; F24-P67 HydrophobicContact CE2-CB 3.6Å; F24-P67 HydrophobicContact CE2-CG 4.09Å; F24-P67 HydrophobicContact CZ-CB 3.57Å; F24-P67 HydrophobicContact CZ-CG 3.92Å; F24-S68 VanDerWaalsContact CD1-C 3.45Å; F24-F72 HydrophobicContact CB-CB 3.95Å; F24-F72 HydrophobicContact CB-CD1 3.89Å; F24-F72 HydrophobicContact CB-CG 4.21Å; F24-F72 WeakPolarHBondContact O-CD1 3.47Å; F24-F72 WeakPolarHBondContact O-CE1 3.37Å; F24-W339 HydrophobicContact CD2-CH2 4.08Å; F24-W339 AromaticContact CD2-CZ3 3.88Å; F24-W339 HydrophobicContact CD2-CZ3 3.88Å; F24-W339 AromaticContact CE2-CH2 3.7Å; F24-W339 HydrophobicContact CE2-CH2 3.7Å; F24-W339 AromaticContact CE2-CZ3 3.9Å; F24-W339 HydrophobicContact CE2-CZ3 3.9Å; F24-Q349 CarbonylContact O-C 3.49Å; F24-Q349 WeakPolarHBondContact O-CA 3.25Å; F24-L350 HydrophobicContact CB-CB 4.44Å; F24-L350 PolarHBondContact N-O 2.84Å; F24-L350 PolarHBondContact O-N 3.1Å
25	T	96	Very high	81.3	Confident	68 Å²	68	68.8 Å²	68.8	42%	0.417	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.7	-175	-53.2	0	0	0	0	110.5	K347 V348 Q349	T25-K347 HydrophobicContact CG2-CB 4.04Å; T25-K347 HydrophobicContact CG2-CD 4.4Å; T25-K347 HydrophobicContact CG2-CG 4.19Å; T25-V348 WeakPolarHBondContact CA-O 3.05Å; T25-Q349 PolarHBondContact OG1-NE2 2.9Å
26	C	96.7	Very high	84.6	Confident	12 Å²	12	66.8 Å²	66.8	8%	0.081	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.2	170.7	-174.8	0	0	0	0	108.1	L60 F72 V348	C26-L60 HydrophobicContact CB-CD1 4.23Å; C26-F72 HydrophobicContact CB-CD1 3.64Å; C26-F72 HydrophobicContact CB-CE1 3.4Å; C26-F72 VanDerWaalsContact CB-CE1 3.4Å; C26-F72 HydrophobicContact CB-CG 4.36Å; C26-F72 HydrophobicContact CB-CZ 3.9Å; C26-F72 VanDerWaalsContact N-CE1 3.35Å; C26-V348 PolarHBondContact N-O 2.8Å; C26-V348 PolarHBondContact O-N 3.15Å
27	E	96.9	Very high	87.7	Confident	134 Å²	134	61.7 Å²	61.7	63%	0.626	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	131.7	176.8	-170.4	174.2	172.4	0	0	109.9	N346 K347	E27-N346 WeakPolarHBondContact CG-ND2 3.03Å; E27-N346 PolarHBondContact OE1-ND2 3.12Å; E27-K347 HydrophobicContact CB-CG 4.47Å; E27-K347 HydrophobicContact CG-CG 4.29Å
28	L	96.7	Very high	90.3	Very high	13 Å²	13	53 Å²	53	7%	0.068	30%	0.299	C	S	.	.			trans	-109.7	161.4	178.7	-69.4	178.2	0	0	0	110.9	H30 I32 S46 L60 A74 N346 V348	L28-H30 PolarHBondContact O-N 3.48Å; L28-I32 HydrophobicContact CD1-CD1 3.87Å; L28-I32 HydrophobicContact CD1-CG1 4.38Å; L28-S46 WeakPolarHBondContact CD1-OG 3.35Å; L28-L60 HydrophobicContact CD2-CD2 4.03Å; L28-A74 HydrophobicContact CD2-CB 4.35Å; L28-N346 PolarHBondContact N-O 3.16Å; L28-N346 WeakPolarHBondContact O-CB 3.44Å; L28-N346 PolarHBondContact O-ND2 3.37Å; L28-V348 HydrophobicContact CD1-CG2 4.21Å
29	P	94	Very high	92.5	Very high	100 Å²	100	48.9 Å²	48.9	65%	0.649	28%	0.275	S	S	*	.	S	Bend	trans	-64.4	-20.2	-178.5	-24.4	35.3	0	0	0	114.8
30	H	94.3	Very high	93.8	Very high	63 Å²	63	46.3 Å²	46.3	29%	0.292	26%	0.257	S	S	.	.	S	Bend	trans	-138	159.5	-170.3	-47.4	123.4	0	0	0	110.9	L28 L50 N346	L28-H30 PolarHBondContact O-N 3.48Å; H30-L50 HydrophobicContact CB-CD2 4.09Å; H30-L50 HydrophobicContact CB-CG 4.22Å; H30-N346 WeakPolarHBondContact O-CA 3.43Å; H30-N346 VanDerWaalsContact O-CB 3.31Å; H30-N346 WeakPolarHBondContact O-CB 3.47Å
31	S	96.1	Very high	94.6	Very high	59 Å²	59	43.5 Å²	43.5	41%	0.413	24%	0.243	S	C	.	.			trans	-56.7	153.3	171.8	-60.5	0	0	0	0	111.7	S48 F49 E345	S31-S48 CarbonylContact O-C 3.59Å; S31-S48 WeakPolarHBondContact O-CA 3.23Å; S31-F49 PolarHBondContact O-N 3.13Å; S31-E345 CarbonylContact C-O 3.57Å; S31-E345 VanDerWaalsContact CA-O 3.24Å; S31-E345 WeakPolarHBondContact CA-O 3.24Å
32	I	97.3	Very high	95.4	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.036	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.7	-170.6	-52.3	-177.5	0	0	0	110.4	L28 L35 G47 A343 E345 K347 V348	L28-I32 HydrophobicContact CD1-CD1 3.87Å; L28-I32 HydrophobicContact CD1-CG1 4.38Å; I32-L35 HydrophobicContact CG2-CD2 4.13Å; I32-G47 WeakPolarHBondContact CA-O 3.47Å; I32-A343 HydrophobicContact CB-CB 3.9Å; I32-A343 HydrophobicContact CD1-CB 4.25Å; I32-A343 HydrophobicContact CG2-CB 3.66Å; I32-E345 PolarHBondContact N-O 3.19Å; I32-K347 VanDerWaalsContact CD1-C 3.48Å; I32-V348 HydrophobicContact CD1-CB 4.31Å; I32-V348 HydrophobicContact CD1-CG2 3.19Å
33	Y	96.9	Very high	95.8	Very high	71 Å²	71	36 Å²	36	28%	0.278	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-37.6	-176.5	-161.8	-150.5	0	0	0	114	G47 F49 P85 P86 T87	Y33-G47 PolarHBondContact N-O 2.66Å; Y33-F49 AromaticContact CD1-CD2 3.98Å; Y33-F49 HydrophobicContact CD1-CD2 3.98Å; Y33-F49 HydrophobicContact CD2-CD2 4.02Å; Y33-F49 HydrophobicContact CE1-CD2 4.3Å; Y33-F49 HydrophobicContact CE2-CD2 4.38Å; Y33-F49 AromaticContact CG-CD2 3.85Å; Y33-F49 HydrophobicContact CG-CD2 3.85Å; Y33-P85 HydrophobicContact CD1-CB 3.78Å; Y33-P85 HydrophobicContact CE1-CB 4.13Å; Y33-P86 VanDerWaalsContact CD1-O 3.23Å; Y33-P86 WeakPolarHBondContact CD1-O 3.42Å; Y33-T87 VanDerWaalsContact CE1-CA 3.48Å; Y33-T87 HydrophobicContact CE1-CG2 3.69Å
34	A	98.1	Very high	96	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	149.5	-176.2	0	0	0	0	0	111.4	S46 G47 P86 L89	A34-S46 CarbonylContact O-C 3.58Å; A34-S46 VanDerWaalsContact O-CA 3.32Å; A34-S46 WeakPolarHBondContact O-CA 3.05Å; A34-G47 PolarHBondContact N-O 3.46Å; A34-G47 PolarHBondContact O-N 2.76Å; A34-P86 WeakPolarHBondContact CB-O 3.38Å; A34-L89 HydrophobicContact CB-CB 4.24Å; A34-L89 HydrophobicContact CB-CD1 4.04Å; A34-L89 HydrophobicContact CB-CG 3.84Å
35	L	98.4	Very high	96.1	Very high	4 Å²	4	34 Å²	34	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.4	175.4	-69.9	-179	0	0	0	109.6	I32 L44 A45 Q329 Q331 A341 A343 V348	I32-L35 HydrophobicContact CG2-CD2 4.13Å; L35-L44 HydrophobicContact CB-CD1 4.25Å; L35-L44 HydrophobicContact CD2-CD1 4.35Å; L35-L44 HydrophobicContact CD2-CD2 4.29Å; L35-L44 HydrophobicContact CD2-CG 4.37Å; L35-A45 CarbonylContact C-O 3.32Å; L35-A45 VanDerWaalsContact CA-O 3.31Å; L35-A45 WeakPolarHBondContact CA-O 3.32Å; L35-Q329 HydrophobicContact CB-CG 3.74Å; L35-Q329 HydrophobicContact CD1-CB 4.24Å; L35-Q329 HydrophobicContact CD1-CG 3.87Å; L35-Q329 HydrophobicContact CG-CB 4.27Å; L35-Q329 HydrophobicContact CG-CG 3.68Å; L35-Q331 HydrophobicContact CB-CB 4.43Å; L35-Q331 HydrophobicContact CB-CG 3.95Å; L35-A341 HydrophobicContact CD1-CB 4.05Å; L35-A343 HydrophobicContact CD1-CB 3.91Å; L35-A343 HydrophobicContact CD2-CB 4.44Å; L35-A343 HydrophobicContact CG-CB 4.23Å; L35-V348 HydrophobicContact CD2-CG1 4.19Å; L35-V348 HydrophobicContact CD2-CG2 4.05Å
36	A	98.1	Very high	96.3	Very high	3 Å²	3	30.9 Å²	30.9	3%	0.025	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	120.4	172.5	0	0	0	0	0	112.1	A45 L89 F91	A36-A45 HydrophobicContact CB-CB 4.35Å; A36-A45 PolarHBondContact N-O 3.38Å; A36-A45 PolarHBondContact O-N 3.25Å; A36-L89 HydrophobicContact CB-CB 3.73Å; A36-L89 WeakPolarHBondContact CB-O 3.21Å; A36-F91 HydrophobicContact CB-CD2 4.03Å; A36-F91 HydrophobicContact CB-CE2 4.32Å; A36-F91 WeakPolarHBondContact O-CE2 3.13Å
37	F	97.4	Very high	96.3	Very high	22 Å²	22	30.4 Å²	30.4	10%	0.096	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	139.6	170.7	-80.3	-76.9	0	0	0	111.2	L44 F62 F91 Q331 W332 A333 A341 L350	F37-L44 HydrophobicContact CD1-CB 4.09Å; F37-L44 HydrophobicContact CD1-CD1 3.95Å; F37-L44 HydrophobicContact CD2-CD1 3.87Å; F37-L44 HydrophobicContact CE1-CB 3.99Å; F37-L44 HydrophobicContact CE1-CD1 4Å; F37-L44 HydrophobicContact CE1-CD2 4.31Å; F37-L44 HydrophobicContact CE1-CG 4.34Å; F37-L44 HydrophobicContact CE2-CD1 3.9Å; F37-L44 HydrophobicContact CG-CD1 3.91Å; F37-L44 HydrophobicContact CZ-CD1 3.99Å; F37-L44 HydrophobicContact CZ-CD2 4.18Å; F37-F62 AromaticContact CD1-CE1 3.9Å; F37-F62 HydrophobicContact CD1-CE1 3.9Å; F37-F62 HydrophobicContact CD1-CZ 4.21Å; F37-F62 HydrophobicContact CE1-CD1 4.43Å; F37-F62 AromaticContact CE1-CE1 3.67Å; F37-F62 HydrophobicContact CE1-CE1 3.67Å; F37-F62 AromaticContact CE1-CZ 3.94Å; F37-F62 HydrophobicContact CE1-CZ 3.94Å; F37-F91 WeakPolarHBondContact O-CD2 3.24Å; F37-Q331 HydrophobicContact CD2-CB 4Å; F37-Q331 HydrophobicContact CE2-CB 4.19Å; F37-Q331 WeakPolarHBondContact CE2-O 3.27Å; F37-W332 WeakPolarHBondContact CD2-O 3.36Å; F37-A333 HydrophobicContact CB-CB 4.32Å; F37-A333 HydrophobicContact CD1-CB 3.66Å; F37-A333 HydrophobicContact CD2-CB 3.85Å; F37-A333 HydrophobicContact CE1-CB 3.79Å; F37-A333 HydrophobicContact CE2-CB 3.97Å; F37-A333 HydrophobicContact CG-CB 3.67Å; F37-A333 HydrophobicContact CZ-CB 3.93Å; F37-A341 HydrophobicContact CE2-CB 3.59Å; F37-A341 HydrophobicContact CZ-CB 3.51Å; F37-L350 HydrophobicContact CE1-CD1 3.99Å; F37-L350 HydrophobicContact CZ-CD1 3.72Å
38	S	96	Very high	96.4	Very high	4 Å²	4	24.4 Å²	24.4	3%	0.028	14%	0.143	C	C	.	.			trans	-75.2	136	169.5	175.3	0	0	0	0	110.5	V40 A41 V43 L115	S38-V40 VanDerWaalsContact C-N 3.31Å; S38-V40 VanDerWaalsContact OG-CG2 3.27Å; S38-V40 WeakPolarHBondContact OG-CG2 3.35Å; S38-V40 PolarHBondContact OG-N 3.18Å; S38-A41 WeakPolarHBondContact CB-O 3.33Å; S38-A41 PolarHBondContact OG-N 3.26Å; S38-V43 WeakPolarHBondContact CB-O 3.36Å; S38-V43 PolarHBondContact N-O 2.84Å; S38-L115 WeakPolarHBondContact OG-CD1 3.45Å
39	P	93.5	Very high	96.4	Very high	40 Å²	40	28 Å²	28	26%	0.26	16%	0.158	S	C	.	.	S	Bend	trans	-80.7	-10.4	174.4	30.6	-32.7	0	0	0	113.5	F91 N92	P39-F91 HydrophobicContact CG-CB 4.44Å; P39-N92 VanDerWaalsContact CG-O 3.24Å; P39-N92 WeakPolarHBondContact CG-O 3.32Å
40	V	91.5	Very high	96.5	Very high	64 Å²	64	25 Å²	25	39%	0.388	14%	0.136	S	C	.	.	S	Bend	trans	-111	-18.7	-173.5	-64.9	0	0	0	0	114.3	S38 A95 S99 L115	S38-V40 VanDerWaalsContact C-N 3.31Å; S38-V40 VanDerWaalsContact OG-CG2 3.27Å; S38-V40 WeakPolarHBondContact OG-CG2 3.35Å; S38-V40 PolarHBondContact OG-N 3.18Å; V40-A95 HydrophobicContact CG1-CB 3.78Å; V40-S99 WeakPolarHBondContact CG2-OG 3.13Å; V40-L115 HydrophobicContact CG2-CD1 3.96Å
41	A	93.1	Very high	96.2	Very high	12 Å²	12	31.1 Å²	31.1	10%	0.099	17%	0.165	C	C	.	.	S	Bend	trans	-144.9	154.4	-176.3	0	0	0	0	0	109.9	S38 V43 L115	S38-A41 WeakPolarHBondContact CB-O 3.33Å; S38-A41 PolarHBondContact OG-N 3.26Å; A41-V43 HydrophobicContact CB-CG2 4.08Å; A41-V43 PolarHBondContact O-N 2.77Å; A41-L115 HydrophobicContact CB-CB 4.05Å; A41-L115 HydrophobicContact CB-CD1 4.22Å
42	P	94.9	Very high	95.8	Very high	38 Å²	38	32 Å²	32	25%	0.247	17%	0.165	C	C	.	.	S	Bend	trans	-76	66.8	175.9	34.7	-37.1	0	0	0	110.3	F62 P64	P42-F62 VanDerWaalsContact CA-CE1 3.46Å; P42-F62 HydrophobicContact CB-CD1 4.07Å; P42-F62 HydrophobicContact CB-CD2 4.31Å; P42-F62 HydrophobicContact CB-CE1 3.88Å; P42-F62 HydrophobicContact CB-CE2 4.15Å; P42-F62 HydrophobicContact CB-CG 4.28Å; P42-F62 HydrophobicContact CB-CZ 3.94Å; P42-F62 WeakPolarHBondContact CB-O 3.48Å; P42-F62 WeakPolarHBondContact CG-O 3.4Å; P42-F62 WeakPolarHBondContact O-CD1 3.41Å; P42-F62 PolarHBondContact O-N 2.88Å; P42-P64 HydrophobicContact CB-CG 4.18Å
43	V	96.9	Very high	95.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139.7	-176.3	174.2	0	0	0	0	109.4	S38 A41 L59 L60 L75 L115 L118	S38-V43 WeakPolarHBondContact CB-O 3.36Å; S38-V43 PolarHBondContact N-O 2.84Å; A41-V43 HydrophobicContact CB-CG2 4.08Å; A41-V43 PolarHBondContact O-N 2.77Å; V43-L59 HydrophobicContact CG1-CB 4.27Å; V43-L59 HydrophobicContact CG1-CD1 3.69Å; V43-L60 CarbonylContact C-O 3.24Å; V43-L60 VanDerWaalsContact CA-O 3.23Å; V43-L60 WeakPolarHBondContact CA-O 3.49Å; V43-L75 HydrophobicContact CG2-CD1 4.32Å; V43-L115 HydrophobicContact CB-CD2 4.41Å; V43-L115 HydrophobicContact CG1-CD2 4.09Å; V43-L115 HydrophobicContact CG2-CD2 4.32Å; V43-L118 HydrophobicContact CG2-CD1 3.93Å; V43-L118 HydrophobicContact CG2-CD2 3.82Å
44	L	98	Very high	95.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.7	174.7	175.4	65.8	0	0	0	108.6	L35 F37 L60 F72 A341 V348	L35-L44 HydrophobicContact CB-CD1 4.25Å; L35-L44 HydrophobicContact CD2-CD1 4.35Å; L35-L44 HydrophobicContact CD2-CD2 4.29Å; L35-L44 HydrophobicContact CD2-CG 4.37Å; F37-L44 HydrophobicContact CD1-CB 4.09Å; F37-L44 HydrophobicContact CD1-CD1 3.95Å; F37-L44 HydrophobicContact CD2-CD1 3.87Å; F37-L44 HydrophobicContact CE1-CB 3.99Å; F37-L44 HydrophobicContact CE1-CD1 4Å; F37-L44 HydrophobicContact CE1-CD2 4.31Å; F37-L44 HydrophobicContact CE1-CG 4.34Å; F37-L44 HydrophobicContact CE2-CD1 3.9Å; F37-L44 HydrophobicContact CG-CD1 3.91Å; F37-L44 HydrophobicContact CZ-CD1 3.99Å; F37-L44 HydrophobicContact CZ-CD2 4.18Å; L44-L60 HydrophobicContact CB-CB 4.4Å; L44-L60 HydrophobicContact CD2-CD1 4.41Å; L44-L60 PolarHBondContact N-O 3.47Å; L44-L60 PolarHBondContact O-N 2.88Å; L44-F72 HydrophobicContact CD2-CE2 4.5Å; L44-A341 HydrophobicContact CD1-CB 4.31Å; L44-A341 HydrophobicContact CD2-CB 3.48Å; L44-A341 VanDerWaalsContact CD2-CB 3.48Å; L44-V348 HydrophobicContact CD2-CG1 3.55Å
45	A	98.4	Very high	95.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	141.6	168	0	0	0	0	0	109.7	L35 A36 V57 L59 L89 F91 L101	L35-A45 CarbonylContact C-O 3.32Å; L35-A45 VanDerWaalsContact CA-O 3.31Å; L35-A45 WeakPolarHBondContact CA-O 3.32Å; A36-A45 HydrophobicContact CB-CB 4.35Å; A36-A45 PolarHBondContact N-O 3.38Å; A36-A45 PolarHBondContact O-N 3.25Å; A45-V57 HydrophobicContact CB-CG1 4.37Å; A45-L59 HydrophobicContact CB-CD1 3.77Å; A45-L89 HydrophobicContact CB-CD1 4.2Å; A45-F91 HydrophobicContact CB-CE2 3.69Å; A45-F91 HydrophobicContact CB-CZ 4.01Å; A45-L101 HydrophobicContact CB-CD1 4.26Å; A45-L101 HydrophobicContact CB-CD2 4.14Å
46	S	98.4	Very high	95	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.1	175.1	60	0	0	0	0	109.3	L28 A34 V57 S58	L28-S46 WeakPolarHBondContact CD1-OG 3.35Å; A34-S46 CarbonylContact O-C 3.58Å; A34-S46 VanDerWaalsContact O-CA 3.32Å; A34-S46 WeakPolarHBondContact O-CA 3.05Å; S46-V57 CarbonylContact O-C 3.52Å; S46-V57 VanDerWaalsContact O-CA 3.26Å; S46-V57 WeakPolarHBondContact O-CA 3.37Å; S46-S58 PolarHBondContact N-O 3.18Å; S46-S58 PolarHBondContact O-N 3.26Å; S46-S58 WeakPolarHBondContact OG-CB 3.32Å; S46-S58 PolarHBondContact OG-O 3.25Å
47	G	98.3	Very high	95	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.7	176.9	0	0	0	0	0	109.8	I32 Y33 A34 P86	I32-G47 WeakPolarHBondContact CA-O 3.47Å; Y33-G47 PolarHBondContact N-O 2.66Å; A34-G47 PolarHBondContact N-O 3.46Å; A34-G47 PolarHBondContact O-N 2.76Å; G47-P86 VanDerWaalsContact CA-CG 3.41Å
48	S	98	Very high	95	Very high	9 Å²	9	42.7 Å²	42.7	6%	0.063	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	164.1	179.6	46.4	0	0	0	0	113.3	S31 N55 R56 P86	S31-S48 CarbonylContact O-C 3.59Å; S31-S48 WeakPolarHBondContact O-CA 3.23Å; S48-N55 PolarHBondContact O-OD1 2.9Å; S48-N55 VanDerWaalsContact O-OD1 3.14Å; S48-R56 PolarHBondContact N-O 2.83Å; S48-R56 WeakPolarHBondContact OG-CA 3.44Å; S48-R56 PolarHBondContact OG-N 3.21Å; S48-R56 PolarHBondContact OG-O 3.03Å; S48-P86 WeakPolarHBondContact O-CD 3.38Å
49	F	96.5	Very high	95.1	Very high	89 Å²	89	42.5 Å²	42.5	39%	0.39	22%	0.216	S	C	.	.			trans	-119.9	102.7	170	-168.6	-92	0	0	0	109.4	S31 Y33 E51 P85	S31-F49 PolarHBondContact O-N 3.13Å; Y33-F49 AromaticContact CD1-CD2 3.98Å; Y33-F49 HydrophobicContact CD1-CD2 3.98Å; Y33-F49 HydrophobicContact CD2-CD2 4.02Å; Y33-F49 HydrophobicContact CE1-CD2 4.3Å; Y33-F49 HydrophobicContact CE2-CD2 4.38Å; Y33-F49 AromaticContact CG-CD2 3.85Å; Y33-F49 HydrophobicContact CG-CD2 3.85Å; F49-E51 HydrophobicContact CE1-CG 4.49Å; F49-P85 HydrophobicContact CD2-CB 3.85Å; F49-P85 HydrophobicContact CD2-CG 4.11Å; F49-P85 HydrophobicContact CE2-CB 4.29Å; F49-P85 HydrophobicContact CE2-CG 4.29Å
50	L	95.6	Very high	95.3	Very high	35 Å²	35	40.6 Å²	40.6	18%	0.183	20%	0.204	C	C	.	.			trans	-125.3	139.2	169.3	-66.4	172.6	0	0	0	109.2	H30 D52 H54 N55 P85	H30-L50 HydrophobicContact CB-CD2 4.09Å; H30-L50 HydrophobicContact CB-CG 4.22Å; L50-D52 PolarHBondContact O-N 3.01Å; L50-H54 WeakPolarHBondContact CD1-O 3.38Å; L50-N55 PolarHBondContact N-OD1 3.47Å; L50-N55 PolarHBondContact O-ND2 2.85Å; L50-P85 VanDerWaalsContact O-CG 3.26Å; L50-P85 WeakPolarHBondContact O-CG 3.38Å
51	E	89.4	Confident	95.6	Very high	192 Å²	192	38.2 Å²	38.2	90%	0.897	19%	0.19	S	C	*	.	S	Bend	trans	-72.1	-8.2	177.3	-62.8	-176	169.3	0	0	113	F49	F49-E51 HydrophobicContact CE1-CG 4.49Å
52	D	88	Confident	95.8	Very high	79 Å²	79	38.1 Å²	38.1	42%	0.422	19%	0.187	S	C	.	.	S	Bend	trans	-102.4	-175.5	176.8	69.6	24.1	0	0	0	113	L50 H54 N55	L50-D52 PolarHBondContact O-N 3.01Å; D52-H54 VanDerWaalsContact C-N 3.26Å; D52-H54 PolarHBondContact O-N 3.3Å; D52-H54 WeakPolarHBondContact OD1-CB 3.36Å; D52-H54 IonicContact OD1-CD2 3.83Å; D52-H54 PolarHBondContact OD1-N 3.1Å; D52-H54 IonicContact OD2-CD2 3.89Å; D52-N55 PolarHBondContact O-ND2 2.63Å
53	L	86.7	Confident	95.8	Very high	109 Å²	109	38.6 Å²	38.6	57%	0.571	19%	0.188	S	C	*	.	S	Bend	trans	-86.9	12.7	-177.1	-58.2	176	0	0	0	113.6	P83 Y84	L53-P83 WeakPolarHBondContact CA-O 3.38Å; L53-P83 WeakPolarHBondContact CD2-O 3.42Å; L53-Y84 HydrophobicContact CD2-CD1 3.89Å; L53-Y84 HydrophobicContact CD2-CE1 3.4Å; L53-Y84 VanDerWaalsContact CD2-CE1 3.4Å
54	H	92.2	Very high	95.6	Very high	137 Å²	137	40.1 Å²	40.1	63%	0.634	20%	0.198	S	C	*	.			trans	-105.3	28.7	-176.9	-61.8	-63.7	0	0	0	112.9	L50 D52	L50-H54 WeakPolarHBondContact CD1-O 3.38Å; D52-H54 VanDerWaalsContact C-N 3.26Å; D52-H54 PolarHBondContact O-N 3.3Å; D52-H54 WeakPolarHBondContact OD1-CB 3.36Å; D52-H54 IonicContact OD1-CD2 3.83Å; D52-H54 PolarHBondContact OD1-N 3.1Å; D52-H54 IonicContact OD2-CD2 3.89Å
55	N	97.3	Very high	95.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	160.9	172.2	-75.8	-89.7	0	0	0	110.7	S48 L50 D52 H82 Y84 P85	S48-N55 PolarHBondContact O-OD1 2.9Å; S48-N55 VanDerWaalsContact O-OD1 3.14Å; L50-N55 PolarHBondContact N-OD1 3.47Å; L50-N55 PolarHBondContact O-ND2 2.85Å; D52-N55 PolarHBondContact O-ND2 2.63Å; N55-H82 CarbonylContact C-O 3.47Å; N55-H82 VanDerWaalsContact C-O 3.31Å; N55-H82 WeakPolarHBondContact CA-O 3.34Å; N55-H82 HydrophobicContact CB-CB 4.4Å; N55-H82 VanDerWaalsContact CB-O 3.24Å; N55-H82 WeakPolarHBondContact CB-O 3.34Å; N55-H82 PolarHBondContact N-O 2.78Å; N55-H82 PolarHBondContact O-N 2.78Å; N55-Y84 VanDerWaalsContact CB-O 3.29Å; N55-Y84 WeakPolarHBondContact CB-O 3.46Å; N55-Y84 VanDerWaalsContact CG-C 3.41Å; N55-P85 VanDerWaalsContact CG-N 3.32Å; N55-P85 VanDerWaalsContact ND2-CD 3.28Å; N55-P85 WeakPolarHBondContact ND2-CD 3.24Å; N55-P85 WeakPolarHBondContact OD1-CA 3.43Å
56	R	97.1	Very high	95	Very high	75 Å²	75	55.2 Å²	55.2	28%	0.283	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	146	-173	-161.9	-176.6	-176.8	93.2	0	110.8	S48 S79 F80 D81	S48-R56 PolarHBondContact N-O 2.83Å; S48-R56 WeakPolarHBondContact OG-CA 3.44Å; S48-R56 PolarHBondContact OG-N 3.21Å; S48-R56 PolarHBondContact OG-O 3.03Å; R56-S79 PolarHBondContact NH2-O 2.92Å; R56-S79 VanDerWaalsContact NH2-O 3.15Å; R56-F80 WeakPolarHBondContact CA-O 3.36Å; R56-F80 WeakPolarHBondContact CG-O 3.04Å; R56-D81 IonicContact NH1-OD1 3.87Å; R56-D81 PolarHBondContact NH1-OD1 2.87Å; R56-D81 VanDerWaalsContact NH1-OD1 3.15Å
57	V	98.2	Very high	94.7	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.5	162.3	179.2	0	0	0	0	108.2	A45 S46 L59 S79 F80 H82 P86 L89 L101	A45-V57 HydrophobicContact CB-CG1 4.37Å; S46-V57 CarbonylContact O-C 3.52Å; S46-V57 VanDerWaalsContact O-CA 3.26Å; S46-V57 WeakPolarHBondContact O-CA 3.37Å; V57-L59 HydrophobicContact CG1-CD2 3.87Å; V57-S79 CarbonylContact O-C 3.53Å; V57-S79 VanDerWaalsContact O-CA 3.31Å; V57-S79 WeakPolarHBondContact O-CA 3.36Å; V57-F80 HydrophobicContact CB-CD1 4.32Å; V57-F80 HydrophobicContact CB-CD2 4.32Å; V57-F80 HydrophobicContact CB-CE1 3.83Å; V57-F80 HydrophobicContact CB-CE2 3.79Å; V57-F80 HydrophobicContact CB-CZ 3.54Å; V57-F80 HydrophobicContact CG1-CE1 3.8Å; V57-F80 HydrophobicContact CG1-CE2 4.46Å; V57-F80 HydrophobicContact CG1-CZ 3.72Å; V57-F80 HydrophobicContact CG2-CE2 3.87Å; V57-F80 HydrophobicContact CG2-CZ 3.88Å; V57-F80 PolarHBondContact N-O 3.22Å; V57-F80 PolarHBondContact O-N 2.99Å; V57-H82 HydrophobicContact CG2-CB 4.26Å; V57-P86 HydrophobicContact CG2-CG 4.4Å; V57-L89 HydrophobicContact CG1-CD1 4.15Å; V57-L89 HydrophobicContact CG2-CD2 4.15Å; V57-L101 HydrophobicContact CG1-CD2 4.01Å
58	S	98	Very high	94.4	Very high	11 Å²	11	59.2 Å²	59.2	8%	0.077	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.3	178.7	-54	0	0	0	0	110.6	S46 S79	S46-S58 PolarHBondContact N-O 3.18Å; S46-S58 PolarHBondContact O-N 3.26Å; S46-S58 WeakPolarHBondContact OG-CB 3.32Å; S46-S58 PolarHBondContact OG-O 3.25Å; S58-S79 WeakPolarHBondContact CA-OG 3.23Å
59	L	98	Very high	94	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132	-179.3	-74.5	-73	0	0	0	107.8	V43 A45 V57 A74 L75 L78 S79 F80 F91 T113	V43-L59 HydrophobicContact CG1-CB 4.27Å; V43-L59 HydrophobicContact CG1-CD1 3.69Å; A45-L59 HydrophobicContact CB-CD1 3.77Å; V57-L59 HydrophobicContact CG1-CD2 3.87Å; L59-A74 CarbonylContact O-C 3.55Å; L59-A74 WeakPolarHBondContact O-CA 3.4Å; L59-L75 HydrophobicContact CB-CB 4.35Å; L59-L75 HydrophobicContact CB-CD1 4.45Å; L59-L75 WeakPolarHBondContact O-CB 3.23Å; L59-L75 PolarHBondContact O-N 2.86Å; L59-L78 HydrophobicContact CB-CB 3.97Å; L59-L78 WeakPolarHBondContact CD2-O 3.37Å; L59-L78 HydrophobicContact CG-CB 4.08Å; L59-L78 WeakPolarHBondContact CG-O 3.29Å; L59-S79 PolarHBondContact N-OG 3.32Å; L59-S79 VanDerWaalsContact N-OG 3.15Å; L59-F80 HydrophobicContact CD2-CD1 4.48Å; L59-F80 HydrophobicContact CD2-CE1 4.14Å; L59-F91 HydrophobicContact CD1-CZ 3.83Å; L59-T113 HydrophobicContact CD1-CG2 4.37Å
60	L	97.9	Very high	93.8	Very high	0 Å²	0	62 Å²	62	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.7	-178.9	-49.6	-177.2	0	0	0	109.1	C26 L28 V43 L44 F72 R73 A74 V348	C26-L60 HydrophobicContact CB-CD1 4.23Å; L28-L60 HydrophobicContact CD2-CD2 4.03Å; V43-L60 CarbonylContact C-O 3.24Å; V43-L60 VanDerWaalsContact CA-O 3.23Å; V43-L60 WeakPolarHBondContact CA-O 3.49Å; L44-L60 HydrophobicContact CB-CB 4.4Å; L44-L60 HydrophobicContact CD2-CD1 4.41Å; L44-L60 PolarHBondContact N-O 3.47Å; L44-L60 PolarHBondContact O-N 2.88Å; L60-F72 HydrophobicContact CB-CE2 3.99Å; L60-F72 HydrophobicContact CD1-CE2 3.87Å; L60-F72 HydrophobicContact CD1-CZ 3.76Å; L60-R73 CarbonylContact C-O 3.55Å; L60-R73 VanDerWaalsContact CA-O 3.23Å; L60-R73 WeakPolarHBondContact CA-O 3.48Å; L60-A74 HydrophobicContact CD2-CB 3.8Å; L60-V348 HydrophobicContact CD1-CB 3.85Å; L60-V348 HydrophobicContact CD1-CG1 4.16Å; L60-V348 HydrophobicContact CD1-CG2 3.73Å
61	S	96.9	Very high	93.7	Very high	13 Å²	13	61.3 Å²	61.3	9%	0.091	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	155.5	167.9	61.1	0	0	0	0	110.4	S71 F72 R73	S61-S71 CarbonylContact C-O 3.56Å; S61-S71 VanDerWaalsContact C-O 3.32Å; S61-S71 PolarHBondContact OG-O 2.77Å; S61-F72 VanDerWaalsContact O-CA 3.25Å; S61-F72 WeakPolarHBondContact O-CA 3.3Å; S61-F72 WeakPolarHBondContact O-CD2 3.45Å; S61-R73 PolarHBondContact N-O 3.06Å; S61-R73 PolarHBondContact O-N 3.23Å; S61-R73 WeakPolarHBondContact OG-CG 3.2Å
62	F	96.4	Very high	94.1	Very high	10 Å²	10	52.4 Å²	52.4	4%	0.044	29%	0.291	C	S	.	.			trans	-141.8	166.5	159.9	66.8	-78.4	0	0	0	110.7	F37 P42 P64 S71 F72 H336 W339 L350	F37-F62 AromaticContact CD1-CE1 3.9Å; F37-F62 HydrophobicContact CD1-CE1 3.9Å; F37-F62 HydrophobicContact CD1-CZ 4.21Å; F37-F62 HydrophobicContact CE1-CD1 4.43Å; F37-F62 AromaticContact CE1-CE1 3.67Å; F37-F62 HydrophobicContact CE1-CE1 3.67Å; F37-F62 AromaticContact CE1-CZ 3.94Å; F37-F62 HydrophobicContact CE1-CZ 3.94Å; P42-F62 VanDerWaalsContact CA-CE1 3.46Å; P42-F62 HydrophobicContact CB-CD1 4.07Å; P42-F62 HydrophobicContact CB-CD2 4.31Å; P42-F62 HydrophobicContact CB-CE1 3.88Å; P42-F62 HydrophobicContact CB-CE2 4.15Å; P42-F62 HydrophobicContact CB-CG 4.28Å; P42-F62 HydrophobicContact CB-CZ 3.94Å; P42-F62 WeakPolarHBondContact CB-O 3.48Å; P42-F62 WeakPolarHBondContact CG-O 3.4Å; P42-F62 WeakPolarHBondContact O-CD1 3.41Å; P42-F62 PolarHBondContact O-N 2.88Å; F62-P64 HydrophobicContact CD2-CB 4.37Å; F62-P64 HydrophobicContact CE2-CB 4Å; F62-P64 HydrophobicContact CE2-CG 4.42Å; F62-S71 WeakPolarHBondContact CA-O 3.2Å; F62-F72 HydrophobicContact CB-CD2 3.99Å; F62-H336 AromaticContact CZ-CD2 3.72Å; F62-W339 HydrophobicContact CE2-CG 4.35Å; F62-L350 HydrophobicContact CB-CD2 3.54Å; F62-L350 HydrophobicContact CD2-CD2 3.7Å; F62-L350 HydrophobicContact CE2-CD2 4.5Å; F62-L350 HydrophobicContact CG-CD2 3.71Å
63	D	95.3	Very high	94.5	Very high	49 Å²	49	54.8 Å²	54.8	26%	0.262	29%	0.294	S	S	.	.			trans	-114.3	106.4	172.5	-175.8	-21.1	0	0	0	108.7	V65 R66 P67	D63-V65 PolarHBondContact O-N 2.83Å; D63-V65 WeakPolarHBondContact OD1-CA 3.25Å; D63-V65 WeakPolarHBondContact OD1-CB 3.06Å; D63-V65 PolarHBondContact OD1-N 2.97Å; D63-R66 PolarHBondContact OD1-N 2.7Å; D63-P67 VanDerWaalsContact O-CA 3.22Å; D63-P67 WeakPolarHBondContact O-CA 3.49Å; D63-P67 WeakPolarHBondContact O-CB 3.34Å
64	P	93.3	Very high	95	Very high	32 Å²	32	51.4 Å²	51.4	21%	0.208	28%	0.282	C	S	.	.	S	Bend	trans	-70.3	-18.6	-179.2	27	-33.5	0	0	0	113.1	P42 F62	P42-P64 HydrophobicContact CB-CG 4.18Å; F62-P64 HydrophobicContact CD2-CB 4.37Å; F62-P64 HydrophobicContact CE2-CB 4Å; F62-P64 HydrophobicContact CE2-CG 4.42Å
65	V	92.7	Very high	95.2	Very high	124 Å²	124	45.1 Å²	45.1	75%	0.752	25%	0.253	S	S	*	.	S	Bend	trans	-92.6	-44.7	-176.5	-175.9	0	0	0	0	111.1	D63	D63-V65 PolarHBondContact O-N 2.83Å; D63-V65 WeakPolarHBondContact OD1-CA 3.25Å; D63-V65 WeakPolarHBondContact OD1-CB 3.06Å; D63-V65 PolarHBondContact OD1-N 2.97Å
66	R	91.6	Very high	95.1	Very high	193 Å²	193	49 Å²	49	73%	0.728	28%	0.278	S	S	*	.	S	Bend	trans	-129.5	74	177	-67.9	-173.2	-61.1	-164.4	-0.7	110.3	D63 S68	D63-R66 PolarHBondContact OD1-N 2.7Å; R66-S68 PolarHBondContact O-N 2.86Å
67	P	91.1	Very high	95.1	Very high	39 Å²	39	46.6 Å²	46.6	25%	0.253	28%	0.275	S	S	.	.			trans	-67	139.2	-177.6	31.6	-38.6	0	0	0	110.6	F24 D63 W339	F24-P67 HydrophobicContact CD2-CB 4.26Å; F24-P67 HydrophobicContact CE1-CB 4.23Å; F24-P67 HydrophobicContact CE2-CB 3.6Å; F24-P67 HydrophobicContact CE2-CG 4.09Å; F24-P67 HydrophobicContact CZ-CB 3.57Å; F24-P67 HydrophobicContact CZ-CG 3.92Å; D63-P67 VanDerWaalsContact O-CA 3.22Å; D63-P67 WeakPolarHBondContact O-CA 3.49Å; D63-P67 WeakPolarHBondContact O-CB 3.34Å; P67-W339 HydrophobicContact CB-CH2 3.39Å; P67-W339 HydrophobicContact CB-CZ2 3.75Å; P67-W339 HydrophobicContact CB-CZ3 4.49Å; P67-W339 HydrophobicContact CG-CH2 3.63Å; P67-W339 HydrophobicContact CG-CZ2 3.76Å
68	S	92.1	Very high	95.1	Very high	47 Å²	47	46.7 Å²	46.7	33%	0.329	28%	0.275	S	S	.	.			trans	-152	158.6	177.7	69.7	0	0	0	0	109	F24 R66 A70 S71 F72	F24-S68 VanDerWaalsContact CD1-C 3.45Å; R66-S68 PolarHBondContact O-N 2.86Å; S68-A70 PolarHBondContact O-N 3.16Å; S68-A70 VanDerWaalsContact O-N 3.15Å; S68-A70 PolarHBondContact OG-N 2.87Å; S68-S71 PolarHBondContact N-OG 2.92Å; S68-S71 PolarHBondContact O-N 3.05Å; S68-S71 VanDerWaalsContact O-N 3.08Å; S68-S71 PolarHBondContact O-OG 2.86Å; S68-S71 PolarHBondContact OG-N 3.39Å; S68-S71 PolarHBondContact OG-OG 2.9Å; S68-S71 VanDerWaalsContact OG-OG 3.11Å; S68-F72 PolarHBondContact O-N 2.83Å
69	A	90.5	Very high	95	Very high	80 Å²	80	46.7 Å²	46.7	66%	0.661	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28	173.6	0	0	0	0	0	112.3
70	A	92.4	Very high	95	Very high	76 Å²	76	47.6 Å²	47.6	63%	0.628	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-26.4	178.1	0	0	0	0	0	113.6	S68 R73	S68-A70 PolarHBondContact O-N 3.16Å; S68-A70 VanDerWaalsContact O-N 3.15Å; S68-A70 PolarHBondContact OG-N 2.87Å; A70-R73 WeakPolarHBondContact O-CD 3.36Å
71	S	93.4	Very high	94.9	Very high	22 Å²	22	53 Å²	53	15%	0.154	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-27.9	176.9	56.6	0	0	0	0	112.2	S61 F62 S68 R73	S61-S71 CarbonylContact C-O 3.56Å; S61-S71 VanDerWaalsContact C-O 3.32Å; S61-S71 PolarHBondContact OG-O 2.77Å; F62-S71 WeakPolarHBondContact CA-O 3.2Å; S68-S71 PolarHBondContact N-OG 2.92Å; S68-S71 PolarHBondContact O-N 3.05Å; S68-S71 VanDerWaalsContact O-N 3.08Å; S68-S71 PolarHBondContact O-OG 2.86Å; S68-S71 PolarHBondContact OG-N 3.39Å; S68-S71 PolarHBondContact OG-OG 2.9Å; S68-S71 VanDerWaalsContact OG-OG 3.11Å; S71-R73 PolarHBondContact O-N 3.07Å
72	F	96.5	Very high	94.9	Very high	5 Å²	5	52.5 Å²	52.5	2%	0.022	30%	0.304	C	S	.	.	S	Bend	trans	-85.9	90.6	172.1	-169.6	-129.5	0	0	0	112	F24 C26 L44 L60 S61 F62 S68 V348 L350	F24-F72 HydrophobicContact CB-CB 3.95Å; F24-F72 HydrophobicContact CB-CD1 3.89Å; F24-F72 HydrophobicContact CB-CG 4.21Å; F24-F72 WeakPolarHBondContact O-CD1 3.47Å; F24-F72 WeakPolarHBondContact O-CE1 3.37Å; C26-F72 HydrophobicContact CB-CD1 3.64Å; C26-F72 HydrophobicContact CB-CE1 3.4Å; C26-F72 VanDerWaalsContact CB-CE1 3.4Å; C26-F72 HydrophobicContact CB-CG 4.36Å; C26-F72 HydrophobicContact CB-CZ 3.9Å; C26-F72 VanDerWaalsContact N-CE1 3.35Å; L44-F72 HydrophobicContact CD2-CE2 4.5Å; L60-F72 HydrophobicContact CB-CE2 3.99Å; L60-F72 HydrophobicContact CD1-CE2 3.87Å; L60-F72 HydrophobicContact CD1-CZ 3.76Å; S61-F72 VanDerWaalsContact O-CA 3.25Å; S61-F72 WeakPolarHBondContact O-CA 3.3Å; S61-F72 WeakPolarHBondContact O-CD2 3.45Å; F62-F72 HydrophobicContact CB-CD2 3.99Å; S68-F72 PolarHBondContact O-N 2.83Å; F72-V348 HydrophobicContact CE1-CB 4.46Å; F72-V348 WeakPolarHBondContact CE1-O 3.5Å; F72-V348 HydrophobicContact CZ-CB 4.01Å; F72-V348 HydrophobicContact CZ-CG1 3.79Å; F72-L350 HydrophobicContact CD1-CB 4.21Å; F72-L350 HydrophobicContact CD2-CB 4.28Å; F72-L350 HydrophobicContact CD2-CD2 4.22Å; F72-L350 HydrophobicContact CE1-CB 3.97Å; F72-L350 HydrophobicContact CE2-CB 4.07Å; F72-L350 HydrophobicContact CG-CB 4.35Å; F72-L350 HydrophobicContact CZ-CB 3.91Å
73	R	95.9	Very high	94.7	Very high	129 Å²	129	54 Å²	54	49%	0.487	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	157.4	-171.8	64.2	175.8	-175.1	165.2	7.5	112.2	L60 S61 A70 S71	L60-R73 CarbonylContact C-O 3.55Å; L60-R73 VanDerWaalsContact CA-O 3.23Å; L60-R73 WeakPolarHBondContact CA-O 3.48Å; S61-R73 PolarHBondContact N-O 3.06Å; S61-R73 PolarHBondContact O-N 3.23Å; S61-R73 WeakPolarHBondContact OG-CG 3.2Å; A70-R73 WeakPolarHBondContact O-CD 3.36Å; S71-R73 PolarHBondContact O-N 3.07Å
74	A	97.1	Very high	94.7	Very high	37 Å²	37	56.7 Å²	56.7	31%	0.306	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	150.4	171	0	0	0	0	0	112.3	L28 L59 L60 P76	L28-A74 HydrophobicContact CD2-CB 4.35Å; L59-A74 CarbonylContact O-C 3.55Å; L59-A74 WeakPolarHBondContact O-CA 3.4Å; L60-A74 HydrophobicContact CD2-CB 3.8Å; A74-P76 WeakPolarHBondContact O-CD 3.31Å
75	L	97.1	Very high	94.9	Very high	5 Å²	5	56.4 Å²	56.4	3%	0.026	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	90.9	176.8	-61.1	172.4	0	0	0	107.9	V43 L59 A77 L78 S79 L118	V43-L75 HydrophobicContact CG2-CD1 4.32Å; L59-L75 HydrophobicContact CB-CB 4.35Å; L59-L75 HydrophobicContact CB-CD1 4.45Å; L59-L75 WeakPolarHBondContact O-CB 3.23Å; L59-L75 PolarHBondContact O-N 2.86Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 3.37Å; L75-L78 HydrophobicContact CB-CB 4.15Å; L75-L78 HydrophobicContact CB-CD1 4.41Å; L75-L78 HydrophobicContact CD1-CD1 3.93Å; L75-L78 PolarHBondContact O-N 2.96Å; L75-L78 VanDerWaalsContact O-N 3.12Å; L75-S79 PolarHBondContact O-N 3.47Å; L75-S79 VanDerWaalsContact O-N 3.16Å; L75-S79 PolarHBondContact O-OG 3.18Å; L75-L118 HydrophobicContact CD1-CB 4.38Å; L75-L118 HydrophobicContact CD1-CD2 4.08Å; L75-L118 HydrophobicContact CD2-CB 4.39Å
76	P	96.3	Very high	95.1	Very high	82 Å²	82	50.5 Å²	50.5	53%	0.532	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	-39.4	-172.8	-25.7	35.6	0	0	0	113.3	A74 L78 S79	A74-P76 WeakPolarHBondContact O-CD 3.31Å; P76-L78 PolarHBondContact O-N 3.26Å; P76-S79 PolarHBondContact O-N 2.75Å; P76-S79 VanDerWaalsContact O-N 3.16Å
77	A	96.6	Very high	95.4	Very high	25 Å²	25	42.6 Å²	42.6	21%	0.207	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	-30	178.6	0	0	0	0	0	113	L75 A122 A124	L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 3.37Å; A77-A122 HydrophobicContact CB-CB 4.37Å; A77-A124 WeakPolarHBondContact O-CA 3.41Å
78	L	97.3	Very high	95.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-1.9	179	-66.6	175.8	0	0	0	113.7	L59 L75 P76 P114 L115 L118 A122 P123 P125	L59-L78 HydrophobicContact CB-CB 3.97Å; L59-L78 WeakPolarHBondContact CD2-O 3.37Å; L59-L78 HydrophobicContact CG-CB 4.08Å; L59-L78 WeakPolarHBondContact CG-O 3.29Å; L75-L78 HydrophobicContact CB-CB 4.15Å; L75-L78 HydrophobicContact CB-CD1 4.41Å; L75-L78 HydrophobicContact CD1-CD1 3.93Å; L75-L78 PolarHBondContact O-N 2.96Å; L75-L78 VanDerWaalsContact O-N 3.12Å; P76-L78 PolarHBondContact O-N 3.26Å; L78-P114 HydrophobicContact CD2-CG 4.01Å; L78-P114 WeakPolarHBondContact CD2-O 3.17Å; L78-L115 HydrophobicContact CD1-CD2 4.3Å; L78-L118 HydrophobicContact CD1-CD2 3.71Å; L78-A122 HydrophobicContact CD2-CB 4.08Å; L78-A122 HydrophobicContact CG-CB 4.27Å; L78-P123 WeakPolarHBondContact CD2-O 3.35Å; L78-P125 HydrophobicContact CD2-CG 4.42Å; L78-P125 VanDerWaalsContact O-CG 3.24Å; L78-P125 WeakPolarHBondContact O-CG 3.41Å
79	S	96.9	Very high	96.1	Very high	12 Å²	12	40.2 Å²	40.2	8%	0.084	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	136.4	-178.6	-57.8	0	0	0	0	110.6	R56 V57 S58 L59 L75 P76	R56-S79 PolarHBondContact NH2-O 2.92Å; R56-S79 VanDerWaalsContact NH2-O 3.15Å; V57-S79 CarbonylContact O-C 3.53Å; V57-S79 VanDerWaalsContact O-CA 3.31Å; V57-S79 WeakPolarHBondContact O-CA 3.36Å; S58-S79 WeakPolarHBondContact CA-OG 3.23Å; L59-S79 PolarHBondContact N-OG 3.32Å; L59-S79 VanDerWaalsContact N-OG 3.15Å; L75-S79 PolarHBondContact O-N 3.47Å; L75-S79 VanDerWaalsContact O-N 3.16Å; L75-S79 PolarHBondContact O-OG 3.18Å; P76-S79 PolarHBondContact O-N 2.75Å; P76-S79 VanDerWaalsContact O-N 3.16Å
80	F	97.2	Very high	96.4	Very high	18 Å²	18	38 Å²	38	8%	0.079	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	158.1	-169.6	59.6	-87.2	0	0	0	112.7	R56 V57 L59 L101 W111 P125	R56-F80 WeakPolarHBondContact CA-O 3.36Å; R56-F80 WeakPolarHBondContact CG-O 3.04Å; V57-F80 HydrophobicContact CB-CD1 4.32Å; V57-F80 HydrophobicContact CB-CD2 4.32Å; V57-F80 HydrophobicContact CB-CE1 3.83Å; V57-F80 HydrophobicContact CB-CE2 3.79Å; V57-F80 HydrophobicContact CB-CZ 3.54Å; V57-F80 HydrophobicContact CG1-CE1 3.8Å; V57-F80 HydrophobicContact CG1-CE2 4.46Å; V57-F80 HydrophobicContact CG1-CZ 3.72Å; V57-F80 HydrophobicContact CG2-CE2 3.87Å; V57-F80 HydrophobicContact CG2-CZ 3.88Å; V57-F80 PolarHBondContact N-O 3.22Å; V57-F80 PolarHBondContact O-N 2.99Å; L59-F80 HydrophobicContact CD2-CD1 4.48Å; L59-F80 HydrophobicContact CD2-CE1 4.14Å; F80-L101 HydrophobicContact CE1-CD2 4.26Å; F80-L101 HydrophobicContact CZ-CD2 4.09Å; F80-W111 HydrophobicContact CD2-CD2 4.32Å; F80-W111 AromaticContact CD2-CE3 3.93Å; F80-W111 HydrophobicContact CD2-CE3 3.93Å; F80-W111 AromaticContact CD2-CH2 3.97Å; F80-W111 HydrophobicContact CD2-CH2 3.97Å; F80-W111 HydrophobicContact CD2-CZ2 4.36Å; F80-W111 AromaticContact CD2-CZ3 3.74Å; F80-W111 HydrophobicContact CD2-CZ3 3.74Å; F80-W111 AromaticContact CE2-CD2 3.53Å; F80-W111 HydrophobicContact CE2-CD2 3.53Å; F80-W111 AromaticContact CE2-CE2 3.59Å; F80-W111 AromaticContact CE2-CE3 3.62Å; F80-W111 HydrophobicContact CE2-CE3 3.62Å; F80-W111 HydrophobicContact CE2-CG 4.15Å; F80-W111 AromaticContact CE2-CH2 3.82Å; F80-W111 HydrophobicContact CE2-CH2 3.82Å; F80-W111 AromaticContact CE2-CZ2 3.76Å; F80-W111 HydrophobicContact CE2-CZ2 3.76Å; F80-W111 AromaticContact CE2-CZ3 3.75Å; F80-W111 HydrophobicContact CE2-CZ3 3.75Å; F80-W111 HydrophobicContact CZ-CB 4.49Å; F80-W111 AromaticContact CZ-CD2 3.85Å; F80-W111 HydrophobicContact CZ-CD2 3.85Å; F80-W111 HydrophobicContact CZ-CE3 4.17Å; F80-W111 AromaticContact CZ-CG 3.97Å; F80-W111 HydrophobicContact CZ-CG 3.97Å; F80-P125 HydrophobicContact CD1-CB 3.71Å; F80-P125 HydrophobicContact CD1-CG 3.65Å; F80-P125 HydrophobicContact CE1-CB 3.88Å; F80-P125 HydrophobicContact CE1-CG 3.98Å; F80-P125 HydrophobicContact CG-CB 4.42Å
81	D	96.6	Very high	96.7	Very high	113 Å²	113	35 Å²	35	60%	0.604	19%	0.187	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76	147.9	-179.1	-59.4	-24.3	0	0	0	111.4	R56	R56-D81 IonicContact NH1-OD1 3.87Å; R56-D81 PolarHBondContact NH1-OD1 2.87Å; R56-D81 VanDerWaalsContact NH1-OD1 3.15Å
82	H	97.1	Very high	96.8	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.7	-178.7	-163.5	-88.2	0	0	0	109.2	N55 V57 Y84 S103 W111	N55-H82 CarbonylContact C-O 3.47Å; N55-H82 VanDerWaalsContact C-O 3.31Å; N55-H82 WeakPolarHBondContact CA-O 3.34Å; N55-H82 HydrophobicContact CB-CB 4.4Å; N55-H82 VanDerWaalsContact CB-O 3.24Å; N55-H82 WeakPolarHBondContact CB-O 3.34Å; N55-H82 PolarHBondContact N-O 2.78Å; N55-H82 PolarHBondContact O-N 2.78Å; V57-H82 HydrophobicContact CG2-CB 4.26Å; H82-Y84 VanDerWaalsContact C-N 3.31Å; H82-Y84 PolarHBondContact ND1-O 3.37Å; H82-Y84 PolarHBondContact O-N 3.38Å; H82-S103 PolarHBondContact NE2-OG 3.17Å; H82-W111 AromaticContact CD2-CZ2 3.72Å
83	P	92.5	Very high	96.6	Very high	43 Å²	43	36.5 Å²	36.5	28%	0.279	20%	0.195	S	C	.	.	S	Bend	trans	-70.6	-20.9	-168.5	25.1	-34.8	0	0	0	115.3	L53	L53-P83 WeakPolarHBondContact CA-O 3.38Å; L53-P83 WeakPolarHBondContact CD2-O 3.42Å
84	Y	94.8	Very high	96.2	Very high	104 Å²	104	38.4 Å²	38.4	41%	0.408	20%	0.202	S	C	.	.	S	Bend	trans	-145.8	168.4	-178.4	-66.9	-73.7	0	0	0	109.7	L53 N55 H82 P86 D106	L53-Y84 HydrophobicContact CD2-CD1 3.89Å; L53-Y84 HydrophobicContact CD2-CE1 3.4Å; L53-Y84 VanDerWaalsContact CD2-CE1 3.4Å; N55-Y84 VanDerWaalsContact CB-O 3.29Å; N55-Y84 WeakPolarHBondContact CB-O 3.46Å; N55-Y84 VanDerWaalsContact CG-C 3.41Å; H82-Y84 VanDerWaalsContact C-N 3.31Å; H82-Y84 PolarHBondContact ND1-O 3.37Å; H82-Y84 PolarHBondContact O-N 3.38Å; Y84-P86 VanDerWaalsContact O-CD 3.25Å; Y84-P86 WeakPolarHBondContact O-CD 3.26Å; Y84-P86 VanDerWaalsContact O-N 3.16Å; Y84-D106 HydrophobicContact CD2-CB 3.92Å; Y84-D106 VanDerWaalsContact CD2-CG 3.49Å; Y84-D106 WeakPolarHBondContact CD2-OD1 3.26Å; Y84-D106 HydrophobicContact CE2-CB 3.92Å
85	P	97	Very high	95.2	Very high	27 Å²	27	40 Å²	40	18%	0.175	22%	0.216	C	C	.	.			trans	-58.1	120	172.2	-25.5	35.8	0	0	0	110.7	Y33 F49 L50 N55 T87	Y33-P85 HydrophobicContact CD1-CB 3.78Å; Y33-P85 HydrophobicContact CE1-CB 4.13Å; F49-P85 HydrophobicContact CD2-CB 3.85Å; F49-P85 HydrophobicContact CD2-CG 4.11Å; F49-P85 HydrophobicContact CE2-CB 4.29Å; F49-P85 HydrophobicContact CE2-CG 4.29Å; L50-P85 VanDerWaalsContact O-CG 3.26Å; L50-P85 WeakPolarHBondContact O-CG 3.38Å; N55-P85 VanDerWaalsContact CG-N 3.32Å; N55-P85 VanDerWaalsContact ND2-CD 3.28Å; N55-P85 WeakPolarHBondContact ND2-CD 3.24Å; N55-P85 WeakPolarHBondContact OD1-CA 3.43Å; P85-T87 PolarHBondContact O-N 3.06Å; P85-T87 VanDerWaalsContact O-N 3.1Å
86	P	97.7	Very high	94.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.23	C	C	.	.			trans	-67.7	109	175.7	27.7	-36.6	0	0	0	110.3	Y33 A34 G47 S48 V57 Y84 K88 L89 S104	Y33-P86 VanDerWaalsContact CD1-O 3.23Å; Y33-P86 WeakPolarHBondContact CD1-O 3.42Å; A34-P86 WeakPolarHBondContact CB-O 3.38Å; G47-P86 VanDerWaalsContact CA-CG 3.41Å; S48-P86 WeakPolarHBondContact O-CD 3.38Å; V57-P86 HydrophobicContact CG2-CG 4.4Å; Y84-P86 VanDerWaalsContact O-CD 3.25Å; Y84-P86 WeakPolarHBondContact O-CD 3.26Å; Y84-P86 VanDerWaalsContact O-N 3.16Å; P86-K88 PolarHBondContact O-N 3.32Å; P86-L89 HydrophobicContact CB-CD2 4.11Å; P86-L89 HydrophobicContact CB-CG 4.33Å; P86-S104 CarbonylContact C-O 3.58Å; P86-S104 WeakPolarHBondContact CA-O 3.47Å
87	T	97.4	Very high	93.1	Very high	27 Å²	27	41.7 Å²	41.7	17%	0.166	24%	0.238	C	C	.	.	S	Bend	trans	-63.6	-26.7	-178.8	44.2	0	0	0	0	113.2	Y33 P85 S104 L144	Y33-T87 VanDerWaalsContact CE1-CA 3.48Å; Y33-T87 HydrophobicContact CE1-CG2 3.69Å; P85-T87 PolarHBondContact O-N 3.06Å; P85-T87 VanDerWaalsContact O-N 3.1Å; T87-S104 PolarHBondContact N-O 2.89Å; T87-S104 WeakPolarHBondContact OG1-CB 3.26Å; T87-S104 PolarHBondContact OG1-O 2.96Å; T87-S104 VanDerWaalsContact OG1-O 3.11Å; T87-S104 PolarHBondContact OG1-OG 2.97Å; T87-L144 WeakPolarHBondContact CG2-O 3.37Å; T87-L144 PolarHBondContact OG1-O 3.01Å
88	K	98.5	Very high	92.4	Very high	33 Å²	33	43.6 Å²	43.6	14%	0.143	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	154.2	171.6	-162	154.9	175.2	-172.3	0	109.9	P86 S104 S146 F147 D189	P86-K88 PolarHBondContact O-N 3.32Å; K88-S104 PolarHBondContact N-OG 3.13Å; K88-S104 VanDerWaalsContact N-OG 3.09Å; K88-S104 PolarHBondContact O-N 3.36Å; K88-S104 VanDerWaalsContact O-N 3.12Å; K88-S104 PolarHBondContact O-OG 3.46Å; K88-S146 WeakPolarHBondContact CD-OG 3.35Å; K88-S146 PolarHBondContact NZ-OG 2.94Å; K88-F147 HydrophobicContact CB-CD1 3.78Å; K88-F147 HydrophobicContact CB-CE1 3.8Å; K88-F147 WeakPolarHBondContact CD-O 3.34Å; K88-F147 WeakPolarHBondContact CE-O 3.07Å; K88-F147 HydrophobicContact CG-CD1 4.26Å; K88-F147 HydrophobicContact CG-CE1 4.17Å; K88-F147 PolarHBondContact NZ-O 3.07Å; K88-F147 WeakPolarHBondContact O-CE1 3.38Å; K88-D189 IonicContact NZ-OD1 3.97Å; K88-D189 PolarHBondContact NZ-OD1 3.1Å
89	L	98.7	Very high	92.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.4	171.9	-67.8	173.3	0	0	0	107.7	A34 A36 A45 V57 P86 L101 A102 S103	A34-L89 HydrophobicContact CB-CB 4.24Å; A34-L89 HydrophobicContact CB-CD1 4.04Å; A34-L89 HydrophobicContact CB-CG 3.84Å; A36-L89 HydrophobicContact CB-CB 3.73Å; A36-L89 WeakPolarHBondContact CB-O 3.21Å; A45-L89 HydrophobicContact CB-CD1 4.2Å; V57-L89 HydrophobicContact CG1-CD1 4.15Å; V57-L89 HydrophobicContact CG2-CD2 4.15Å; P86-L89 HydrophobicContact CB-CD2 4.11Å; P86-L89 HydrophobicContact CB-CG 4.33Å; L89-L101 HydrophobicContact CB-CD1 4.41Å; L89-L101 HydrophobicContact CD2-CD1 4.48Å; L89-A102 WeakPolarHBondContact CA-O 3.41Å; L89-S103 VanDerWaalsContact CD2-CB 3.43Å
90	Q	98.3	Very high	92.1	Very high	33 Å²	33	43.9 Å²	43.9	15%	0.154	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	137.3	168.5	-69.6	-176.2	-31.2	0	0	109.3	A102 F147 D148 W149	Q90-A102 PolarHBondContact N-O 3.37Å; Q90-A102 VanDerWaalsContact N-O 3.14Å; Q90-A102 PolarHBondContact O-N 2.78Å; Q90-F147 HydrophobicContact CB-CE2 3.73Å; Q90-F147 HydrophobicContact CB-CZ 3.8Å; Q90-F147 HydrophobicContact CG-CE2 4.03Å; Q90-F147 HydrophobicContact CG-CZ 4.11Å; Q90-D148 PolarHBondContact NE2-OD1 3.24Å; Q90-D148 PolarHBondContact OE1-OD1 3.19Å; Q90-W149 HydrophobicContact CB-CE3 4.44Å; Q90-W149 WeakPolarHBondContact O-CZ3 3.34Å
91	F	97.5	Very high	92.2	Very high	14 Å²	14	43 Å²	43	6%	0.061	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	156.2	168.2	-76.7	-86.6	0	0	0	110.6	A36 F37 P39 A45 L59 P93 L100 L101 T113 L115	A36-F91 HydrophobicContact CB-CD2 4.03Å; A36-F91 HydrophobicContact CB-CE2 4.32Å; A36-F91 WeakPolarHBondContact O-CE2 3.13Å; F37-F91 WeakPolarHBondContact O-CD2 3.24Å; P39-F91 HydrophobicContact CG-CB 4.44Å; A45-F91 HydrophobicContact CB-CE2 3.69Å; A45-F91 HydrophobicContact CB-CZ 4.01Å; L59-F91 HydrophobicContact CD1-CZ 3.83Å; F91-P93 WeakPolarHBondContact O-CD 3.27Å; F91-L100 CarbonylContact C-O 3.58Å; F91-L100 WeakPolarHBondContact CA-O 3.38Å; F91-L100 WeakPolarHBondContact CD1-O 3.28Å; F91-L101 HydrophobicContact CD1-CB 4.09Å; F91-L101 HydrophobicContact CD1-CD1 4.16Å; F91-L101 HydrophobicContact CD2-CD1 3.96Å; F91-L101 HydrophobicContact CE1-CB 3.95Å; F91-L101 HydrophobicContact CE1-CD1 4.13Å; F91-L101 HydrophobicContact CE1-CG 4.45Å; F91-L101 HydrophobicContact CE2-CD1 3.95Å; F91-L101 HydrophobicContact CG-CD1 4.09Å; F91-L101 HydrophobicContact CZ-CD1 4.04Å; F91-L101 HydrophobicContact CZ-CD2 4.41Å; F91-T113 HydrophobicContact CE1-CG2 4.28Å; F91-L115 HydrophobicContact CD1-CD1 4.32Å; F91-L115 HydrophobicContact CE1-CD1 3.77Å; F91-L115 HydrophobicContact CZ-CD1 4.28Å
92	N	95.8	Very high	92.2	Very high	19 Å²	19	37.7 Å²	37.7	10%	0.102	22%	0.217	C	C	.	.			trans	-57.6	123.1	172.6	-172.4	-23.1	0	0	0	109.3	P39 R94 L100 W149	P39-N92 VanDerWaalsContact CG-O 3.24Å; P39-N92 WeakPolarHBondContact CG-O 3.32Å; N92-R94 PolarHBondContact O-N 3.39Å; N92-R94 VanDerWaalsContact O-N 3.15Å; N92-R94 VanDerWaalsContact OD1-CB 3.31Å; N92-R94 WeakPolarHBondContact OD1-CB 3.5Å; N92-R94 PolarHBondContact OD1-N 3.45Å; N92-L100 HydrophobicContact CB-CB 4.05Å; N92-L100 PolarHBondContact N-O 2.75Å; N92-W149 HydrophobicContact CB-CE3 4.5Å; N92-W149 HydrophobicContact CB-CH2 3.48Å; N92-W149 VanDerWaalsContact CB-CH2 3.48Å; N92-W149 HydrophobicContact CB-CZ2 3.5Å; N92-W149 HydrophobicContact CB-CZ3 3.98Å; N92-W149 VanDerWaalsContact CG-CZ2 3.47Å; N92-W149 VanDerWaalsContact N-CZ3 3.29Å
93	P	93.2	Very high	92.3	Very high	40 Å²	40	37.5 Å²	37.5	26%	0.26	22%	0.216	S	C	.	.	S	Bend	trans	-64.7	-19.4	-179.2	25	-33.9	0	0	0	112.7	F91 A95 W149 E151 P154	F91-P93 WeakPolarHBondContact O-CD 3.27Å; P93-A95 PolarHBondContact O-N 2.88Å; P93-A95 VanDerWaalsContact O-N 3.12Å; P93-W149 VanDerWaalsContact CD-CG 3.47Å; P93-W149 HydrophobicContact CG-CG 4.16Å; P93-E151 HydrophobicContact CB-CB 4.28Å; P93-E151 HydrophobicContact CB-CG 3.88Å; P93-E151 HydrophobicContact CG-CG 4.3Å; P93-P154 HydrophobicContact CG-CB 4.16Å; P93-P154 HydrophobicContact CG-CG 4.23Å
94	R	86.5	Confident	92.5	Very high	168 Å²	168	35.5 Å²	35.5	63%	0.634	20%	0.203	S	C	*	.	S	Bend	trans	-68.5	110.5	171.1	-169.4	179.5	179.3	163.7	-0.7	109.6	N92 A96 P154	N92-R94 PolarHBondContact O-N 3.39Å; N92-R94 VanDerWaalsContact O-N 3.15Å; N92-R94 VanDerWaalsContact OD1-CB 3.31Å; N92-R94 WeakPolarHBondContact OD1-CB 3.5Å; N92-R94 PolarHBondContact OD1-N 3.45Å; R94-A96 HydrophobicContact CG-CB 3.94Å; R94-A96 PolarHBondContact O-N 3.26Å; R94-P154 HydrophobicContact CB-CB 4.35Å; R94-P154 HydrophobicContact CB-CG 4.36Å
95	A	75.7	Confident	92.6	Very high	72 Å²	72	30.7 Å²	30.7	60%	0.595	19%	0.185	S	C	*	.			trans	-72.8	49.5	173.8	0	0	0	0	0	113.3	V40 P93	V40-A95 HydrophobicContact CG1-CB 3.78Å; P93-A95 PolarHBondContact O-N 2.88Å; P93-A95 VanDerWaalsContact O-N 3.12Å
96	A	76.5	Confident	92.4	Very high	38 Å²	38	31.5 Å²	31.5	31%	0.314	19%	0.188	S	C	.	.	S	Bend	trans	-136.2	149.4	177.9	0	0	0	0	0	110.3	R94	R94-A96 HydrophobicContact CG-CB 3.94Å; R94-A96 PolarHBondContact O-N 3.26Å
97	A	72.6	Confident	92.3	Very high	84 Å²	84	31.9 Å²	31.9	69%	0.694	19%	0.19	S	C	*	.	S	Bend	trans	-63.8	145.1	173.1	0	0	0	0	0	111.3
98	P	83.6	Confident	92.3	Very high	65 Å²	65	30.6 Å²	30.6	42%	0.422	18%	0.182	S	C	.	.	S	Bend	cis	-77.4	144.3	-0.9	31.3	-34.2	0	0	0	112.8	L100	P98-L100 HydrophobicContact CB-CD2 4.37Å; P98-L100 HydrophobicContact CG-CD2 4.16Å; P98-L100 HydrophobicContact CG-CG 4.45Å; P98-L100 PolarHBondContact O-N 3.17Å
99	S	91.4	Very high	92.3	Very high	13 Å²	13	30.1 Å²	30.1	9%	0.091	18%	0.18	C	C	.	.			trans	-68.3	115.1	171.2	-68.3	0	0	0	0	109.5	V40 T113	V40-S99 WeakPolarHBondContact CG2-OG 3.13Å; S99-T113 WeakPolarHBondContact CB-O 3.31Å; S99-T113 PolarHBondContact O-N 2.86Å
100	L	96.2	Very high	92.3	Very high	6 Å²	6	30 Å²	30	3%	0.031	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	140.1	179	-52.8	172.8	0	0	0	110.3	F91 N92 P98 I110 W111 W149	F91-L100 CarbonylContact C-O 3.58Å; F91-L100 WeakPolarHBondContact CA-O 3.38Å; F91-L100 WeakPolarHBondContact CD1-O 3.28Å; N92-L100 HydrophobicContact CB-CB 4.05Å; N92-L100 PolarHBondContact N-O 2.75Å; P98-L100 HydrophobicContact CB-CD2 4.37Å; P98-L100 HydrophobicContact CG-CD2 4.16Å; P98-L100 HydrophobicContact CG-CG 4.45Å; P98-L100 PolarHBondContact O-N 3.17Å; L100-I110 HydrophobicContact CB-CG2 4.13Å; L100-I110 HydrophobicContact CD1-CG2 4.2Å; L100-I110 HydrophobicContact CD2-CG2 4.3Å; L100-I110 HydrophobicContact CG-CG2 4.45Å; L100-W111 CarbonylContact C-O 3.52Å; L100-W111 VanDerWaalsContact CA-O 3.25Å; L100-W111 WeakPolarHBondContact CA-O 3.29Å; L100-W149 HydrophobicContact CB-CH2 3.85Å; L100-W149 HydrophobicContact CD1-CH2 4.49Å
101	L	97.7	Very high	92.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.4	170.2	176.1	62.9	0	0	0	108.3	A45 V57 F80 L89 F91 W111 T113	A45-L101 HydrophobicContact CB-CD1 4.26Å; A45-L101 HydrophobicContact CB-CD2 4.14Å; V57-L101 HydrophobicContact CG1-CD2 4.01Å; F80-L101 HydrophobicContact CE1-CD2 4.26Å; F80-L101 HydrophobicContact CZ-CD2 4.09Å; L89-L101 HydrophobicContact CB-CD1 4.41Å; L89-L101 HydrophobicContact CD2-CD1 4.48Å; F91-L101 HydrophobicContact CD1-CB 4.09Å; F91-L101 HydrophobicContact CD1-CD1 4.16Å; F91-L101 HydrophobicContact CD2-CD1 3.96Å; F91-L101 HydrophobicContact CE1-CB 3.95Å; F91-L101 HydrophobicContact CE1-CD1 4.13Å; F91-L101 HydrophobicContact CE1-CG 4.45Å; F91-L101 HydrophobicContact CE2-CD1 3.95Å; F91-L101 HydrophobicContact CG-CD1 4.09Å; F91-L101 HydrophobicContact CZ-CD1 4.04Å; F91-L101 HydrophobicContact CZ-CD2 4.41Å; L101-W111 HydrophobicContact CB-CB 4.37Å; L101-W111 PolarHBondContact N-O 3.11Å; L101-W111 VanDerWaalsContact O-CD1 3.32Å; L101-W111 PolarHBondContact O-N 3.35Å; L101-T113 WeakPolarHBondContact CB-OG1 3.31Å
102	A	98.3	Very high	92.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	139.8	170.9	0	0	0	0	0	109.7	L89 Q90 L108 R109 I110 F147 W149 I157	L89-A102 WeakPolarHBondContact CA-O 3.41Å; Q90-A102 PolarHBondContact N-O 3.37Å; Q90-A102 VanDerWaalsContact N-O 3.14Å; Q90-A102 PolarHBondContact O-N 2.78Å; A102-L108 HydrophobicContact CB-CD1 4.33Å; A102-R109 CarbonylContact C-O 3.54Å; A102-R109 VanDerWaalsContact CA-O 3.3Å; A102-R109 WeakPolarHBondContact CA-O 3.34Å; A102-I110 HydrophobicContact CB-CD1 3.76Å; A102-F147 HydrophobicContact CB-CE1 4.43Å; A102-F147 HydrophobicContact CB-CE2 3.65Å; A102-F147 HydrophobicContact CB-CZ 3.49Å; A102-F147 VanDerWaalsContact CB-CZ 3.49Å; A102-F147 WeakPolarHBondContact O-CZ 3.06Å; A102-W149 HydrophobicContact CB-CE3 3.67Å; A102-W149 HydrophobicContact CB-CH2 4.24Å; A102-W149 HydrophobicContact CB-CZ3 3.38Å; A102-I157 HydrophobicContact CB-CD1 3.93Å
103	S	98.5	Very high	92.2	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142.4	170.4	70.3	0	0	0	0	110.6	H82 L89 R109 W111	H82-S103 PolarHBondContact NE2-OG 3.17Å; L89-S103 VanDerWaalsContact CD2-CB 3.43Å; S103-R109 PolarHBondContact N-O 2.87Å; S103-R109 PolarHBondContact O-N 2.84Å; S103-W111 PolarHBondContact OG-NE1 2.78Å
104	S	97.5	Very high	92.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145	172.5	54	0	0	0	0	110.2	P86 T87 K88 F147	P86-S104 CarbonylContact C-O 3.58Å; P86-S104 WeakPolarHBondContact CA-O 3.47Å; T87-S104 PolarHBondContact N-O 2.89Å; T87-S104 WeakPolarHBondContact OG1-CB 3.26Å; T87-S104 PolarHBondContact OG1-O 2.96Å; T87-S104 VanDerWaalsContact OG1-O 3.11Å; T87-S104 PolarHBondContact OG1-OG 2.97Å; K88-S104 PolarHBondContact N-OG 3.13Å; K88-S104 VanDerWaalsContact N-OG 3.09Å; K88-S104 PolarHBondContact O-N 3.36Å; K88-S104 VanDerWaalsContact O-N 3.12Å; K88-S104 PolarHBondContact O-OG 3.46Å; S104-F147 VanDerWaalsContact OG-CD1 3.3Å; S104-F147 WeakPolarHBondContact OG-CD1 3.26Å
105	A	95.9	Very high	92.5	Very high	4 Å²	4	22.1 Å²	22.1	3%	0.033	15%	0.146	C	C	.	.	S	Bend	trans	-159.9	-114.5	165.3	0	0	0	0	0	107.8	T107 L144	A105-T107 PolarHBondContact N-O 3.07Å; A105-T107 VanDerWaalsContact N-O 3.14Å; A105-T107 PolarHBondContact O-N 2.92Å; A105-L144 WeakPolarHBondContact O-CA 3.36Å; A105-L144 VanDerWaalsContact O-CB 3.32Å; A105-L144 WeakPolarHBondContact O-CB 3.39Å; A105-L144 PolarHBondContact O-N 2.8Å
106	D	93.3	Very high	93.3	Very high	44 Å²	44	26 Å²	26	24%	0.235	16%	0.157	C	C	.	.	S	Bend	trans	-57.8	-35.5	166.2	60.6	-38.7	0	0	0	113.3	Y84 R109	Y84-D106 HydrophobicContact CD2-CB 3.92Å; Y84-D106 VanDerWaalsContact CD2-CG 3.49Å; Y84-D106 WeakPolarHBondContact CD2-OD1 3.26Å; Y84-D106 HydrophobicContact CE2-CB 3.92Å; D106-R109 VanDerWaalsContact CG-NH2 3.33Å; D106-R109 IonicContact OD1-CZ 2.93Å; D106-R109 VanDerWaalsContact OD1-CZ 3.25Å; D106-R109 IonicContact OD1-NH1 3.22Å; D106-R109 PolarHBondContact OD1-NH1 3.44Å; D106-R109 IonicContact OD1-NH2 3.78Å; D106-R109 PolarHBondContact OD1-NH2 2.79Å; D106-R109 IonicContact OD2-CZ 3.79Å; D106-R109 IonicContact OD2-NH2 2.84Å; D106-R109 PolarHBondContact OD2-NH2 2.97Å
107	T	95.6	Very high	94.1	Very high	8 Å²	8	27.1 Å²	27.1	5%	0.049	16%	0.157	C	C	.	.	S	Bend	trans	-139.4	167.5	177.6	64.3	0	0	0	0	110.4	A105 R109 V130 D132	A105-T107 PolarHBondContact N-O 3.07Å; A105-T107 VanDerWaalsContact N-O 3.14Å; A105-T107 PolarHBondContact O-N 2.92Å; T107-R109 PolarHBondContact OG1-NH1 3.03Å; T107-R109 PolarHBondContact OG1-NH2 2.92Å; T107-V130 HydrophobicContact CG2-CG1 4.37Å; T107-V130 WeakPolarHBondContact OG1-CG1 3.46Å; T107-D132 HydrophobicContact CG2-CB 3.98Å
108	L	97.7	Very high	95.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	130.4	169	175.4	68.5	0	0	0	108.9	A102 I110 L131 L144 F147 I157 T159 W169	A102-L108 HydrophobicContact CB-CD1 4.33Å; L108-I110 HydrophobicContact CG-CD1 4.46Å; L108-L131 HydrophobicContact CB-CB 4.12Å; L108-L131 HydrophobicContact CD2-CB 4.26Å; L108-L131 HydrophobicContact CD2-CD1 4.33Å; L108-L131 HydrophobicContact CD2-CD2 4.26Å; L108-L131 HydrophobicContact CG-CB 4.41Å; L108-L131 HydrophobicContact CG-CD1 4.32Å; L108-L131 PolarHBondContact N-O 2.89Å; L108-L131 VanDerWaalsContact N-O 3.14Å; L108-L131 PolarHBondContact O-N 3.35Å; L108-L144 HydrophobicContact CB-CD1 3.86Å; L108-F147 HydrophobicContact CD1-CD1 4.4Å; L108-F147 HydrophobicContact CD1-CG 4.36Å; L108-I157 HydrophobicContact CD1-CD1 4.46Å; L108-I157 HydrophobicContact CD1-CG2 4.28Å; L108-I157 HydrophobicContact CD2-CB 4.09Å; L108-I157 HydrophobicContact CD2-CD1 4.24Å; L108-I157 HydrophobicContact CD2-CG2 3.75Å; L108-T159 HydrophobicContact CB-CG2 4.26Å; L108-T159 HydrophobicContact CD1-CG2 4.45Å; L108-T159 HydrophobicContact CD2-CG2 3.96Å; L108-T159 HydrophobicContact CG-CG2 4.46Å; L108-W169 HydrophobicContact CD2-CB 4.5Å; L108-W169 HydrophobicContact CD2-CG 4.04Å
109	R	97.9	Very high	95.5	Very high	22 Å²	22	24.5 Å²	24.5	8%	0.083	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	138.8	178.4	-65.1	-178.8	179.2	75.3	3.9	110	A102 S103 D106 T107 W111 L127 S129 V130	A102-R109 CarbonylContact C-O 3.54Å; A102-R109 VanDerWaalsContact CA-O 3.3Å; A102-R109 WeakPolarHBondContact CA-O 3.34Å; S103-R109 PolarHBondContact N-O 2.87Å; S103-R109 PolarHBondContact O-N 2.84Å; D106-R109 VanDerWaalsContact CG-NH2 3.33Å; D106-R109 IonicContact OD1-CZ 2.93Å; D106-R109 VanDerWaalsContact OD1-CZ 3.25Å; D106-R109 IonicContact OD1-NH1 3.22Å; D106-R109 PolarHBondContact OD1-NH1 3.44Å; D106-R109 IonicContact OD1-NH2 3.78Å; D106-R109 PolarHBondContact OD1-NH2 2.79Å; D106-R109 IonicContact OD2-CZ 3.79Å; D106-R109 IonicContact OD2-NH2 2.84Å; D106-R109 PolarHBondContact OD2-NH2 2.97Å; T107-R109 PolarHBondContact OG1-NH1 3.03Å; T107-R109 PolarHBondContact OG1-NH2 2.92Å; R109-W111 HydrophobicContact CB-CZ2 4.11Å; R109-W111 HydrophobicContact CG-CZ2 4.48Å; R109-L127 HydrophobicContact CB-CD1 3.93Å; R109-L127 HydrophobicContact CG-CD1 4.22Å; R109-S129 WeakPolarHBondContact CA-O 3.31Å; R109-V130 HydrophobicContact CG-CG2 4.34Å
110	I	97.9	Very high	95.5	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.8	173	-48.3	-60.8	0	0	0	108	L100 A102 L108 R128 S129 L131 I157 I171	L100-I110 HydrophobicContact CB-CG2 4.13Å; L100-I110 HydrophobicContact CD1-CG2 4.2Å; L100-I110 HydrophobicContact CD2-CG2 4.3Å; L100-I110 HydrophobicContact CG-CG2 4.45Å; A102-I110 HydrophobicContact CB-CD1 3.76Å; L108-I110 HydrophobicContact CG-CD1 4.46Å; I110-R128 WeakPolarHBondContact O-CA 3.48Å; I110-R128 WeakPolarHBondContact O-CB 3.2Å; I110-R128 PolarHBondContact O-N 3.04Å; I110-S129 WeakPolarHBondContact CB-OG 3.34Å; I110-S129 WeakPolarHBondContact CG1-OG 3.27Å; I110-S129 PolarHBondContact N-O 2.91Å; I110-S129 PolarHBondContact O-N 2.94Å; I110-S129 VanDerWaalsContact O-N 3.14Å; I110-L131 HydrophobicContact CD1-CD1 4.34Å; I110-L131 HydrophobicContact CG1-CD1 3.63Å; I110-I157 HydrophobicContact CD1-CD1 3.84Å; I110-I171 HydrophobicContact CD1-CG2 4.29Å
111	W	97.6	Very high	95.4	Very high	20 Å²	20	35.2 Å²	35.2	8%	0.076	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.3	-179.2	-50.5	85.1	0	0	0	108.5	F80 H82 L100 L101 S103 R109 E126 L127	F80-W111 HydrophobicContact CD2-CD2 4.32Å; F80-W111 AromaticContact CD2-CE3 3.93Å; F80-W111 HydrophobicContact CD2-CE3 3.93Å; F80-W111 AromaticContact CD2-CH2 3.97Å; F80-W111 HydrophobicContact CD2-CH2 3.97Å; F80-W111 HydrophobicContact CD2-CZ2 4.36Å; F80-W111 AromaticContact CD2-CZ3 3.74Å; F80-W111 HydrophobicContact CD2-CZ3 3.74Å; F80-W111 AromaticContact CE2-CD2 3.53Å; F80-W111 HydrophobicContact CE2-CD2 3.53Å; F80-W111 AromaticContact CE2-CE2 3.59Å; F80-W111 AromaticContact CE2-CE3 3.62Å; F80-W111 HydrophobicContact CE2-CE3 3.62Å; F80-W111 HydrophobicContact CE2-CG 4.15Å; F80-W111 AromaticContact CE2-CH2 3.82Å; F80-W111 HydrophobicContact CE2-CH2 3.82Å; F80-W111 AromaticContact CE2-CZ2 3.76Å; F80-W111 HydrophobicContact CE2-CZ2 3.76Å; F80-W111 AromaticContact CE2-CZ3 3.75Å; F80-W111 HydrophobicContact CE2-CZ3 3.75Å; F80-W111 HydrophobicContact CZ-CB 4.49Å; F80-W111 AromaticContact CZ-CD2 3.85Å; F80-W111 HydrophobicContact CZ-CD2 3.85Å; F80-W111 HydrophobicContact CZ-CE3 4.17Å; F80-W111 AromaticContact CZ-CG 3.97Å; F80-W111 HydrophobicContact CZ-CG 3.97Å; H82-W111 AromaticContact CD2-CZ2 3.72Å; L100-W111 CarbonylContact C-O 3.52Å; L100-W111 VanDerWaalsContact CA-O 3.25Å; L100-W111 WeakPolarHBondContact CA-O 3.29Å; L101-W111 HydrophobicContact CB-CB 4.37Å; L101-W111 PolarHBondContact N-O 3.11Å; L101-W111 VanDerWaalsContact O-CD1 3.32Å; L101-W111 PolarHBondContact O-N 3.35Å; S103-W111 PolarHBondContact OG-NE1 2.78Å; R109-W111 HydrophobicContact CB-CZ2 4.11Å; R109-W111 HydrophobicContact CG-CZ2 4.48Å; W111-E126 CarbonylContact C-O 3.54Å; W111-E126 WeakPolarHBondContact CA-O 3.19Å; W111-L127 HydrophobicContact CD2-CD1 3.98Å; W111-L127 HydrophobicContact CE3-CB 3.83Å; W111-L127 HydrophobicContact CE3-CD1 3.99Å; W111-L127 HydrophobicContact CH2-CB 4.37Å; W111-L127 HydrophobicContact CH2-CD1 4.02Å; W111-L127 HydrophobicContact CZ2-CD1 3.99Å; W111-L127 HydrophobicContact CZ3-CB 3.7Å; W111-L127 HydrophobicContact CZ3-CD1 4.01Å; W111-L127 HydrophobicContact CZ3-CG 4.33Å
112	H	96.2	Very high	95.2	Very high	66 Å²	66	35.7 Å²	35.7	31%	0.306	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	117.3	162.3	175.7	-124.7	0	0	0	108	P125 E126	H112-P125 CarbonylContact O-C 3.53Å; H112-P125 WeakPolarHBondContact O-CA 3.09Å; H112-P125 WeakPolarHBondContact O-CB 3.45Å; H112-E126 PolarHBondContact N-O 2.9Å; H112-E126 PolarHBondContact O-N 3.31Å
113	T	95.7	Very high	95.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.219	C	C	.	.			trans	-117.8	100.1	-175.5	-53.7	0	0	0	0	108.6	L59 F91 S99 L101 L115 P125	L59-T113 HydrophobicContact CD1-CG2 4.37Å; F91-T113 HydrophobicContact CE1-CG2 4.28Å; S99-T113 WeakPolarHBondContact CB-O 3.31Å; S99-T113 PolarHBondContact O-N 2.86Å; L101-T113 WeakPolarHBondContact CB-OG1 3.31Å; T113-L115 HydrophobicContact CG2-CD2 3.69Å; T113-L115 HydrophobicContact CG2-CG 4.17Å; T113-L115 WeakPolarHBondContact O-CG 3.35Å; T113-L115 PolarHBondContact O-N 2.83Å; T113-P125 HydrophobicContact CG2-CB 4.48Å; T113-P125 HydrophobicContact CG2-CG 4Å
114	P	93.9	Very high	94.9	Very high	14 Å²	14	42 Å²	42	9%	0.091	24%	0.242	C	C	.	.			trans	-73.8	96.5	-174.3	29.5	-34.1	0	0	0	110.8	L78 P123	L78-P114 HydrophobicContact CD2-CG 4.01Å; L78-P114 WeakPolarHBondContact CD2-O 3.17Å; P114-P123 HydrophobicContact CB-CG 3.93Å; P114-P123 HydrophobicContact CG-CB 4.2Å; P114-P123 HydrophobicContact CG-CG 3.71Å; P114-P123 WeakPolarHBondContact CG-O 3.21Å
115	L	93.7	Very high	94.9	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.042	25%	0.246	C	C	.	.			trans	-92	3.9	-177	-61.6	-177.2	0	0	0	114.2	S38 V40 A41 V43 L78 F91 T113 L118	S38-L115 WeakPolarHBondContact OG-CD1 3.45Å; V40-L115 HydrophobicContact CG2-CD1 3.96Å; A41-L115 HydrophobicContact CB-CB 4.05Å; A41-L115 HydrophobicContact CB-CD1 4.22Å; V43-L115 HydrophobicContact CB-CD2 4.41Å; V43-L115 HydrophobicContact CG1-CD2 4.09Å; V43-L115 HydrophobicContact CG2-CD2 4.32Å; L78-L115 HydrophobicContact CD1-CD2 4.3Å; F91-L115 HydrophobicContact CD1-CD1 4.32Å; F91-L115 HydrophobicContact CE1-CD1 3.77Å; F91-L115 HydrophobicContact CZ-CD1 4.28Å; T113-L115 HydrophobicContact CG2-CD2 3.69Å; T113-L115 HydrophobicContact CG2-CG 4.17Å; T113-L115 WeakPolarHBondContact O-CG 3.35Å; T113-L115 PolarHBondContact O-N 2.83Å; L115-L118 HydrophobicContact CD2-CD2 4.49Å
116	D	91.6	Very high	95	Very high	153 Å²	153	48.5 Å²	48.5	82%	0.818	27%	0.273	S	S	*	.	S	Bend	trans	-75.4	-28.3	179.5	-60.7	-41.5	0	0	0	112.4
117	D	92.7	Very high	95.2	Very high	61 Å²	61	50.4 Å²	50.4	33%	0.326	28%	0.283	S	S	.	.			trans	-120.6	118.5	174.7	-177	10.6	0	0	0	109.2	S119 A122	D117-S119 WeakPolarHBondContact OD1-CB 3.36Å; D117-S119 PolarHBondContact OD1-N 3.11Å; D117-S119 PolarHBondContact OD1-OG 3.39Å; D117-S119 PolarHBondContact OD2-OG 3.04Å; D117-A122 HydrophobicContact CB-CB 4.12Å; D117-A122 WeakPolarHBondContact O-CB 3.48Å
118	L	93.4	Very high	95.2	Very high	51 Å²	51	56 Å²	56	27%	0.267	30%	0.303	S	S	.	.			trans	-105	15	176.9	-51.9	-177.4	0	0	0	111.9	V43 L75 L78 L115	V43-L118 HydrophobicContact CG2-CD1 3.93Å; V43-L118 HydrophobicContact CG2-CD2 3.82Å; L75-L118 HydrophobicContact CD1-CB 4.38Å; L75-L118 HydrophobicContact CD1-CD2 4.08Å; L75-L118 HydrophobicContact CD2-CB 4.39Å; L78-L118 HydrophobicContact CD1-CD2 3.71Å; L115-L118 HydrophobicContact CD2-CD2 4.49Å
119	S	93	Very high	95.1	Very high	43 Å²	43	57.5 Å²	57.5	30%	0.301	31%	0.313	S	S	.	.	S	Bend	trans	-76.9	166.9	175.4	75.6	0	0	0	0	112.1	D117 T121 A122	D117-S119 WeakPolarHBondContact OD1-CB 3.36Å; D117-S119 PolarHBondContact OD1-N 3.11Å; D117-S119 PolarHBondContact OD1-OG 3.39Å; D117-S119 PolarHBondContact OD2-OG 3.04Å; S119-T121 PolarHBondContact O-N 2.76Å; S119-T121 VanDerWaalsContact O-N 3.13Å; S119-T121 PolarHBondContact OG-N 3.03Å; S119-T121 PolarHBondContact OG-OG1 3.27Å; S119-A122 VanDerWaalsContact O-CB 3.25Å; S119-A122 WeakPolarHBondContact O-CB 3.37Å; S119-A122 PolarHBondContact O-N 3.09Å; S119-A122 VanDerWaalsContact O-N 3.1Å
120	D	91.9	Very high	95	Very high	121 Å²	121	60 Å²	60	65%	0.647	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-9.4	174.3	-60.9	-40.5	0	0	0	112.9
121	T	93.6	Very high	95	Very high	124 Å²	124	60.3 Å²	60.3	76%	0.761	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	3	175.6	52.7	0	0	0	0	113.5	S119	S119-T121 PolarHBondContact O-N 2.76Å; S119-T121 VanDerWaalsContact O-N 3.13Å; S119-T121 PolarHBondContact OG-N 3.03Å; S119-T121 PolarHBondContact OG-OG1 3.27Å
122	A	94.2	Very high	94.6	Very high	9 Å²	9	61.7 Å²	61.7	7%	0.074	34%	0.341	C	S	.	.	S	Bend	trans	-58.6	143.6	177.5	0	0	0	0	0	111.2	A77 L78 D117 S119	A77-A122 HydrophobicContact CB-CB 4.37Å; L78-A122 HydrophobicContact CD2-CB 4.08Å; L78-A122 HydrophobicContact CG-CB 4.27Å; D117-A122 HydrophobicContact CB-CB 4.12Å; D117-A122 WeakPolarHBondContact O-CB 3.48Å; S119-A122 VanDerWaalsContact O-CB 3.25Å; S119-A122 WeakPolarHBondContact O-CB 3.37Å; S119-A122 PolarHBondContact O-N 3.09Å; S119-A122 VanDerWaalsContact O-N 3.1Å
123	P	95.2	Very high	94.2	Very high	74 Å²	74	60.8 Å²	60.8	48%	0.481	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-62.7	139.3	173.9	20.4	-24.2	0	0	0	110.4	L78 P114	L78-P123 WeakPolarHBondContact CD2-O 3.35Å; P114-P123 HydrophobicContact CB-CG 3.93Å; P114-P123 HydrophobicContact CG-CB 4.2Å; P114-P123 HydrophobicContact CG-CG 3.71Å; P114-P123 WeakPolarHBondContact CG-O 3.21Å
124	A	95.4	Very high	93.6	Very high	60 Å²	60	66.5 Å²	66.5	50%	0.496	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-65.6	150	177.3	0	0	0	0	0	110.9	A77	A77-A124 WeakPolarHBondContact O-CA 3.41Å
125	P	97.3	Very high	92.8	Very high	13 Å²	13	73.6 Å²	73.6	8%	0.084	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-60	141.2	172.9	-27.7	38.3	0	0	0	111.7	L78 F80 H112 T113	L78-P125 HydrophobicContact CD2-CG 4.42Å; L78-P125 VanDerWaalsContact O-CG 3.24Å; L78-P125 WeakPolarHBondContact O-CG 3.41Å; F80-P125 HydrophobicContact CD1-CB 3.71Å; F80-P125 HydrophobicContact CD1-CG 3.65Å; F80-P125 HydrophobicContact CE1-CB 3.88Å; F80-P125 HydrophobicContact CE1-CG 3.98Å; F80-P125 HydrophobicContact CG-CB 4.42Å; H112-P125 CarbonylContact O-C 3.53Å; H112-P125 WeakPolarHBondContact O-CA 3.09Å; H112-P125 WeakPolarHBondContact O-CB 3.45Å; T113-P125 HydrophobicContact CG2-CB 4.48Å; T113-P125 HydrophobicContact CG2-CG 4Å
126	E	97	Very high	91.8	Very high	127 Å²	127	78.8 Å²	78.8	59%	0.593	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	134.5	-176.4	-65.6	-178.5	169.5	0	0	110.3	W111 H112 R128	W111-E126 CarbonylContact C-O 3.54Å; W111-E126 WeakPolarHBondContact CA-O 3.19Å; H112-E126 PolarHBondContact N-O 2.9Å; H112-E126 PolarHBondContact O-N 3.31Å; E126-R128 PolarHBondContact O-N 2.81Å; E126-R128 VanDerWaalsContact O-N 3.15Å
127	L	97.5	Very high	90.9	Very high	84 Å²	84	77.1 Å²	77.1	44%	0.44	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	111.7	173.5	-178.6	61.4	0	0	0	109.5	R109 W111 V130	R109-L127 HydrophobicContact CB-CD1 3.93Å; R109-L127 HydrophobicContact CG-CD1 4.22Å; W111-L127 HydrophobicContact CD2-CD1 3.98Å; W111-L127 HydrophobicContact CE3-CB 3.83Å; W111-L127 HydrophobicContact CE3-CD1 3.99Å; W111-L127 HydrophobicContact CH2-CB 4.37Å; W111-L127 HydrophobicContact CH2-CD1 4.02Å; W111-L127 HydrophobicContact CZ2-CD1 3.99Å; W111-L127 HydrophobicContact CZ3-CB 3.7Å; W111-L127 HydrophobicContact CZ3-CD1 4.01Å; W111-L127 HydrophobicContact CZ3-CG 4.33Å; L127-V130 HydrophobicContact CD1-CG2 4.2Å; L127-V130 HydrophobicContact CD2-CG2 3.81Å; L127-V130 HydrophobicContact CG-CG2 4.29Å
128	R	95.9	Very high	90.2	Very high	126 Å²	126	76.5 Å²	76.5	48%	0.475	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-43.5	-178.4	-178.5	-177.2	173	-162.1	-6.6	112	I110 E126	I110-R128 WeakPolarHBondContact O-CA 3.48Å; I110-R128 WeakPolarHBondContact O-CB 3.2Å; I110-R128 PolarHBondContact O-N 3.04Å; E126-R128 PolarHBondContact O-N 2.81Å; E126-R128 VanDerWaalsContact O-N 3.15Å
129	S	96	Very high	89.1	Confident	31 Å²	31	81.6 Å²	81.6	22%	0.217	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	152.4	-179.6	59.8	0	0	0	0	112.7	R109 I110 L131	R109-S129 WeakPolarHBondContact CA-O 3.31Å; I110-S129 WeakPolarHBondContact CB-OG 3.34Å; I110-S129 WeakPolarHBondContact CG1-OG 3.27Å; I110-S129 PolarHBondContact N-O 2.91Å; I110-S129 PolarHBondContact O-N 2.94Å; I110-S129 VanDerWaalsContact O-N 3.14Å; S129-L131 WeakPolarHBondContact OG-CD1 3.48Å
130	V	96.3	Very high	88.1	Confident	75 Å²	75	87.6 Å²	87.6	46%	0.455	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.6	170.4	-176.8	0	0	0	0	106.7	T107 R109 L127	T107-V130 HydrophobicContact CG2-CG1 4.37Å; T107-V130 WeakPolarHBondContact OG1-CG1 3.46Å; R109-V130 HydrophobicContact CG-CG2 4.34Å; L127-V130 HydrophobicContact CD1-CG2 4.2Å; L127-V130 HydrophobicContact CD2-CG2 3.81Å; L127-V130 HydrophobicContact CG-CG2 4.29Å
131	L	95.9	Very high	87.6	Confident	6 Å²	6	83.9 Å²	83.9	3%	0.031	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.4	-179.8	-63.9	90.2	0	0	0	108.2	L108 I110 S129 W169 I171	L108-L131 HydrophobicContact CB-CB 4.12Å; L108-L131 HydrophobicContact CD2-CB 4.26Å; L108-L131 HydrophobicContact CD2-CD1 4.33Å; L108-L131 HydrophobicContact CD2-CD2 4.26Å; L108-L131 HydrophobicContact CG-CB 4.41Å; L108-L131 HydrophobicContact CG-CD1 4.32Å; L108-L131 PolarHBondContact N-O 2.89Å; L108-L131 VanDerWaalsContact N-O 3.14Å; L108-L131 PolarHBondContact O-N 3.35Å; I110-L131 HydrophobicContact CD1-CD1 4.34Å; I110-L131 HydrophobicContact CG1-CD1 3.63Å; S129-L131 WeakPolarHBondContact OG-CD1 3.48Å; L131-W169 HydrophobicContact CB-CD2 4.06Å; L131-W169 HydrophobicContact CB-CE3 3.79Å; L131-W169 HydrophobicContact CB-CH2 4.17Å; L131-W169 HydrophobicContact CB-CZ2 4.46Å; L131-W169 HydrophobicContact CB-CZ3 3.83Å; L131-W169 HydrophobicContact CD2-CB 3.83Å; L131-W169 HydrophobicContact CD2-CD2 3.94Å; L131-W169 HydrophobicContact CD2-CE3 3.68Å; L131-W169 HydrophobicContact CD2-CG 4.03Å; L131-W169 HydrophobicContact CD2-CZ3 4.46Å; L131-W169 HydrophobicContact CG-CE3 4.3Å; L131-I171 HydrophobicContact CD2-CG2 4Å
132	D	91.2	Very high	87.5	Confident	49 Å²	49	79.1 Å²	79.1	26%	0.262	44%	0.435	S	S	.	.			trans	-138.9	127	-167.6	-179.8	-3.1	0	0	0	109.3	T107 R134 W169	T107-D132 HydrophobicContact CG2-CB 3.98Å; D132-R134 WeakPolarHBondContact OD1-CB 3.34Å; D132-R134 WeakPolarHBondContact OD1-CG 3.2Å; D132-R134 PolarHBondContact OD1-N 2.8Å; D132-R134 IonicContact OD1-NE 3.06Å; D132-R134 PolarHBondContact OD1-NE 2.87Å; D132-R134 IonicContact OD2-CZ 3.75Å; D132-R134 IonicContact OD2-NE 3.97Å; D132-R134 PolarHBondContact OD2-NE 2.85Å; D132-R134 IonicContact OD2-NH2 2.8Å; D132-R134 PolarHBondContact OD2-NH2 2.92Å; D132-W169 VanDerWaalsContact C-CH2 3.48Å
133	N	86.2	Confident	87.5	Confident	47 Å²	47	81.4 Å²	81.4	25%	0.251	45%	0.449	S	S	.	.			trans	-106.1	24	-175.4	-164.8	22.2	0	0	0	111.8	K135 T167 W169 V176 Q179	N133-K135 PolarHBondContact O-N 2.87Å; N133-T167 PolarHBondContact ND2-OG1 3.09Å; N133-W169 HydrophobicContact CB-CH2 3.6Å; N133-W169 HydrophobicContact CB-CZ2 3.89Å; N133-V176 HydrophobicContact CB-CG2 4.26Å; N133-Q179 PolarHBondContact ND2-NE2 2.88Å; N133-Q179 PolarHBondContact ND2-OE1 3.29Å
134	R	84	Confident	87.6	Confident	120 Å²	120	78.5 Å²	78.5	45%	0.453	43%	0.429	S	S	.	.			trans	-57.7	135.2	172.7	-79.8	-177.5	-64.3	166.7	2.8	111.5	D132 E139 C141	D132-R134 WeakPolarHBondContact OD1-CB 3.34Å; D132-R134 WeakPolarHBondContact OD1-CG 3.2Å; D132-R134 PolarHBondContact OD1-N 2.8Å; D132-R134 IonicContact OD1-NE 3.06Å; D132-R134 PolarHBondContact OD1-NE 2.87Å; D132-R134 IonicContact OD2-CZ 3.75Å; D132-R134 IonicContact OD2-NE 3.97Å; D132-R134 PolarHBondContact OD2-NE 2.85Å; D132-R134 IonicContact OD2-NH2 2.8Å; D132-R134 PolarHBondContact OD2-NH2 2.92Å; R134-E139 WeakPolarHBondContact CD-O 3.25Å; R134-E139 PolarHBondContact NH1-O 3.34Å; R134-C141 HydrophobicContact CG-CB 3.36Å
135	K	76	Confident	87.8	Confident	163 Å²	163	77.1 Å²	77.1	71%	0.709	41%	0.414	S	S	*	.			trans	-63.5	137.3	163.7	-66.2	179.7	-178	174.1	0	108.2	N133 S137 S138	N133-K135 PolarHBondContact O-N 2.87Å; K135-S137 PolarHBondContact O-N 3.26Å; K135-S138 PolarHBondContact O-N 3.32Å
136	A	73.8	Confident	87.8	Confident	118 Å²	118	76.7 Å²	76.7	98%	0.975	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-23	-178.8	0	0	0	0	0	114.5
137	S	72.2	Confident	87.9	Confident	117 Å²	117	70.6 Å²	70.6	82%	0.818	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-6.2	176.8	65.2	0	0	0	0	114.5	K135	K135-S137 PolarHBondContact O-N 3.26Å
138	S	77.1	Confident	88	Confident	48 Å²	48	66.9 Å²	66.9	34%	0.336	36%	0.364	S	S	.	.			trans	-112.9	128	-175.9	-174.6	0	0	0	0	109.9	K135 F140	K135-S138 PolarHBondContact O-N 3.32Å; S138-F140 PolarHBondContact OG-N 2.83Å; S138-F140 PolarHBondContact OG-O 3.46Å
139	E	71.2	Confident	88.1	Confident	159 Å²	159	61 Å²	61	74%	0.743	34%	0.341	S	S	*	.	S	Bend	trans	-74.3	-19.3	169.4	-64.1	-172.4	156.7	0	0	111.7	R134	R134-E139 WeakPolarHBondContact CD-O 3.25Å; R134-E139 PolarHBondContact NH1-O 3.34Å
140	F	72	Confident	88.1	Confident	169 Å²	169	59.6 Å²	59.6	74%	0.741	33%	0.331	S	S	*	.			trans	-105.6	133.7	-173.7	-58.7	-77.6	0	0	0	112.4	S138	S138-F140 PolarHBondContact OG-N 2.83Å; S138-F140 PolarHBondContact OG-O 3.46Å
141	C	81.7	Confident	88	Confident	42 Å²	42	60.8 Å²	60.8	28%	0.284	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-100.8	141.9	163.5	-157.2	0	0	0	0	108	R134	R134-C141 HydrophobicContact CG-CB 3.36Å
142	A	91.5	Very high	88	Confident	25 Å²	25	65.3 Å²	65.3	21%	0.207	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-65.3	133.9	163.8	0	0	0	0	0	108.8	I162 D163	A142-I162 HydrophobicContact CB-CG1 4.34Å; A142-D163 HydrophobicContact CB-CB 3.6Å
143	P	94.1	Very high	88.2	Confident	57 Å²	57	65.4 Å²	65.4	37%	0.37	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-66.8	149	179.6	25.3	-30.1	0	0	0	110.7	I162	P143-I162 HydrophobicContact CG-CG2 3.65Å; P143-I162 WeakPolarHBondContact O-CG2 3.48Å; P143-I162 PolarHBondContact O-N 2.82Å
144	L	97.8	Very high	88.7	Confident	13 Å²	13	65 Å²	65	7%	0.068	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	136.4	174.9	-53.2	-177.1	0	0	0	109.1	T87 A105 L108 T159 A160	T87-L144 WeakPolarHBondContact CG2-O 3.37Å; T87-L144 PolarHBondContact OG1-O 3.01Å; A105-L144 WeakPolarHBondContact O-CA 3.36Å; A105-L144 VanDerWaalsContact O-CB 3.32Å; A105-L144 WeakPolarHBondContact O-CB 3.39Å; A105-L144 PolarHBondContact O-N 2.8Å; L108-L144 HydrophobicContact CB-CD1 3.86Å; L144-T159 HydrophobicContact CD1-CG2 3.86Å; L144-A160 CarbonylContact C-O 3.58Å; L144-A160 VanDerWaalsContact CA-O 3.27Å; L144-A160 WeakPolarHBondContact CA-O 3.18Å
145	T	98.2	Very high	89.2	Confident	30 Å²	30	62.3 Å²	62.3	18%	0.184	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-27.6	177.1	51.2	0	0	0	0	111.7	A160 I162 V187 H188	T145-A160 PolarHBondContact N-O 3.2Å; T145-A160 VanDerWaalsContact OG1-C 3.29Å; T145-A160 WeakPolarHBondContact OG1-CB 3.32Å; T145-A160 PolarHBondContact OG1-O 2.53Å; T145-I162 HydrophobicContact CG2-CG2 3.96Å; T145-V187 VanDerWaalsContact CB-O 3.31Å; T145-V187 WeakPolarHBondContact CB-O 3.14Å; T145-V187 VanDerWaalsContact CG2-O 3.29Å; T145-V187 WeakPolarHBondContact CG2-O 3.42Å; T145-V187 PolarHBondContact OG1-O 3.03Å; T145-H188 PolarHBondContact OG1-O 3.25Å
146	S	98.4	Very high	90.3	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.028	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	174	-179.7	-171.4	0	0	0	0	110.9	K88 A160 H188 D189	K88-S146 WeakPolarHBondContact CD-OG 3.35Å; K88-S146 PolarHBondContact NZ-OG 2.94Å; S146-A160 PolarHBondContact O-N 2.92Å; S146-H188 WeakPolarHBondContact CB-O 3.42Å; S146-D189 VanDerWaalsContact CB-OD1 3.26Å; S146-D189 WeakPolarHBondContact CB-OD1 3.27Å; S146-D189 PolarHBondContact OG-OD1 3.29Å
147	F	98.8	Very high	91.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	167.1	165.8	76.5	-88.9	0	0	0	111.1	K88 Q90 A102 S104 L108 I157 G158 T159	K88-F147 HydrophobicContact CB-CD1 3.78Å; K88-F147 HydrophobicContact CB-CE1 3.8Å; K88-F147 WeakPolarHBondContact CD-O 3.34Å; K88-F147 WeakPolarHBondContact CE-O 3.07Å; K88-F147 HydrophobicContact CG-CD1 4.26Å; K88-F147 HydrophobicContact CG-CE1 4.17Å; K88-F147 PolarHBondContact NZ-O 3.07Å; K88-F147 WeakPolarHBondContact O-CE1 3.38Å; Q90-F147 HydrophobicContact CB-CE2 3.73Å; Q90-F147 HydrophobicContact CB-CZ 3.8Å; Q90-F147 HydrophobicContact CG-CE2 4.03Å; Q90-F147 HydrophobicContact CG-CZ 4.11Å; A102-F147 HydrophobicContact CB-CE1 4.43Å; A102-F147 HydrophobicContact CB-CE2 3.65Å; A102-F147 HydrophobicContact CB-CZ 3.49Å; A102-F147 VanDerWaalsContact CB-CZ 3.49Å; A102-F147 WeakPolarHBondContact O-CZ 3.06Å; S104-F147 VanDerWaalsContact OG-CD1 3.3Å; S104-F147 WeakPolarHBondContact OG-CD1 3.26Å; L108-F147 HydrophobicContact CD1-CD1 4.4Å; L108-F147 HydrophobicContact CD1-CG 4.36Å; F147-I157 HydrophobicContact CB-CG2 4.02Å; F147-I157 HydrophobicContact CD2-CG2 3.61Å; F147-I157 HydrophobicContact CE2-CG2 4.45Å; F147-I157 HydrophobicContact CG-CG2 4.15Å; F147-G158 CarbonylContact C-O 3.53Å; F147-G158 WeakPolarHBondContact CA-O 3.49Å; F147-G158 WeakPolarHBondContact CB-O 3.27Å; F147-T159 HydrophobicContact CB-CG2 3.81Å
148	D	98.7	Very high	92.7	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.027	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	136.7	165.8	-166	45	0	0	0	110.2	Q90 G158 I190 W192 R238	Q90-D148 PolarHBondContact NE2-OD1 3.24Å; Q90-D148 PolarHBondContact OE1-OD1 3.19Å; D148-G158 PolarHBondContact N-O 2.81Å; D148-G158 PolarHBondContact O-N 2.88Å; D148-I190 HydrophobicContact CB-CG2 4.41Å; D148-I190 WeakPolarHBondContact CB-O 3.24Å; D148-W192 PolarHBondContact O-NE1 3.46Å; D148-W192 PolarHBondContact OD2-N 3.11Å; D148-R238 VanDerWaalsContact CG-NH2 3.31Å; D148-R238 IonicContact OD1-NH2 2.68Å; D148-R238 PolarHBondContact OD1-NH2 3.32Å; D148-R238 IonicContact OD2-CZ 3.41Å; D148-R238 IonicContact OD2-NH1 3.47Å; D148-R238 PolarHBondContact OD2-NH1 3.1Å; D148-R238 IonicContact OD2-NH2 3.58Å; D148-R238 PolarHBondContact OD2-NH2 3.23Å
149	W	98.1	Very high	93.7	Very high	3 Å²	3	42.4 Å²	42.4	1%	0.011	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	122.9	178.1	-153.4	-35.4	0	0	0	108.9	Q90 N92 P93 L100 A102 E151 P154 I157 I171	Q90-W149 HydrophobicContact CB-CE3 4.44Å; Q90-W149 WeakPolarHBondContact O-CZ3 3.34Å; N92-W149 HydrophobicContact CB-CE3 4.5Å; N92-W149 HydrophobicContact CB-CH2 3.48Å; N92-W149 VanDerWaalsContact CB-CH2 3.48Å; N92-W149 HydrophobicContact CB-CZ2 3.5Å; N92-W149 HydrophobicContact CB-CZ3 3.98Å; N92-W149 VanDerWaalsContact CG-CZ2 3.47Å; N92-W149 VanDerWaalsContact N-CZ3 3.29Å; P93-W149 VanDerWaalsContact CD-CG 3.47Å; P93-W149 HydrophobicContact CG-CG 4.16Å; L100-W149 HydrophobicContact CB-CH2 3.85Å; L100-W149 HydrophobicContact CD1-CH2 4.49Å; A102-W149 HydrophobicContact CB-CE3 3.67Å; A102-W149 HydrophobicContact CB-CH2 4.24Å; A102-W149 HydrophobicContact CB-CZ3 3.38Å; W149-E151 PolarHBondContact O-N 2.57Å; W149-E151 VanDerWaalsContact O-N 3.14Å; W149-P154 PolarHBondContact NE1-O 3.07Å; W149-I157 HydrophobicContact CB-CG1 4.33Å; W149-I157 HydrophobicContact CD2-CD1 3.66Å; W149-I157 HydrophobicContact CD2-CG1 3.92Å; W149-I157 HydrophobicContact CE3-CD1 3.92Å; W149-I157 HydrophobicContact CG-CD1 4.04Å; W149-I157 HydrophobicContact CG-CG1 3.77Å; W149-I157 HydrophobicContact CH2-CD1 4.4Å; W149-I157 HydrophobicContact CZ2-CD1 4.22Å; W149-I157 HydrophobicContact CZ3-CD1 4.28Å; W149-I171 HydrophobicContact CH2-CD1 4.27Å; W149-I171 HydrophobicContact CZ2-CD1 3.36Å
150	N	97.5	Very high	95	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	18%	0.183	C	C	.	.			trans	-69	112.7	-176.9	-168.8	-44.3	0	0	0	110.9	V152 E153 P154 R156 W192 E194 A195	N150-V152 VanDerWaalsContact C-N 3.33Å; N150-V152 PolarHBondContact O-N 3Å; N150-V152 PolarHBondContact OD1-N 2.99Å; N150-E153 CarbonylContact O-C 3.24Å; N150-E153 VanDerWaalsContact O-C 3.3Å; N150-E153 PolarHBondContact OD1-N 3.47Å; N150-P154 WeakPolarHBondContact O-CA 3.35Å; N150-R156 HydrophobicContact CB-CB 4Å; N150-R156 WeakPolarHBondContact CB-O 3.39Å; N150-R156 PolarHBondContact N-O 3.03Å; N150-W192 HydrophobicContact CB-CD2 3.92Å; N150-W192 HydrophobicContact CB-CG 3.95Å; N150-W192 WeakPolarHBondContact ND2-CZ3 3.32Å; N150-E194 PolarHBondContact ND2-O 3.06Å; N150-A195 WeakPolarHBondContact ND2-CA 3.31Å; N150-A195 PolarHBondContact ND2-O 3.12Å
151	E	94.3	Very high	96.3	Very high	101 Å²	101	27 Å²	27	47%	0.472	15%	0.149	S	C	.	.	S	Bend	trans	-69.5	-29.9	-179.5	-64.6	-178	-168.9	0	0	113.1	P93 W149 R238	P93-E151 HydrophobicContact CB-CB 4.28Å; P93-E151 HydrophobicContact CB-CG 3.88Å; P93-E151 HydrophobicContact CG-CG 4.3Å; W149-E151 PolarHBondContact O-N 2.57Å; W149-E151 VanDerWaalsContact O-N 3.14Å; E151-R238 IonicContact OE1-CZ 3.84Å; E151-R238 IonicContact OE1-NE 3.68Å; E151-R238 PolarHBondContact OE1-NE 2.9Å; E151-R238 IonicContact OE1-NH2 3.04Å; E151-R238 IonicContact OE2-NE 3.29Å
152	V	95.6	Very high	97	Very high	100 Å²	100	29.2 Å²	29.2	61%	0.606	16%	0.157	S	C	*	.	S	Bend	trans	-80.9	-36.7	-178.9	-171.7	0	0	0	0	111.1	N150 A195	N150-V152 VanDerWaalsContact C-N 3.33Å; N150-V152 PolarHBondContact O-N 3Å; N150-V152 PolarHBondContact OD1-N 2.99Å; V152-A195 HydrophobicContact CB-CB 4.03Å; V152-A195 HydrophobicContact CG1-CB 3.77Å
153	E	95.9	Very high	97.2	Very high	52 Å²	52	31.2 Å²	31.2	24%	0.243	16%	0.164	C	C	.	.	S	Bend	trans	-129.3	79.5	177.8	-173.1	160.7	-154.3	0	0	111	N150 R155 R156 A195	N150-E153 CarbonylContact O-C 3.24Å; N150-E153 VanDerWaalsContact O-C 3.3Å; N150-E153 PolarHBondContact OD1-N 3.47Å; E153-R155 VanDerWaalsContact CD-NH2 3.3Å; E153-R155 HydrophobicContact CG-CG 3.71Å; E153-R155 PolarHBondContact O-N 3.38Å; E153-R155 IonicContact OE1-CZ 2.65Å; E153-R155 IonicContact OE1-NE 3.15Å; E153-R155 PolarHBondContact OE1-NE 3Å; E153-R155 IonicContact OE1-NH2 3.14Å; E153-R155 PolarHBondContact OE1-NH2 3.27Å; E153-R155 IonicContact OE2-NH2 3.2Å; E153-R156 HydrophobicContact CG-CG 4.48Å; E153-R156 PolarHBondContact O-N 2.8Å; E153-R156 IonicContact OE2-CZ 2.99Å; E153-R156 IonicContact OE2-NE 3.88Å; E153-R156 IonicContact OE2-NH1 2.77Å; E153-R156 PolarHBondContact OE2-NH1 2.89Å; E153-R156 IonicContact OE2-NH2 3.68Å; E153-A195 HydrophobicContact CB-CB 4.24Å
154	P	95.6	Very high	97.3	Very high	37 Å²	37	30.2 Å²	30.2	24%	0.24	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-4.8	-170.5	-25.3	35.7	0	0	0	116.5	P93 R94 W149 N150 R156	P93-P154 HydrophobicContact CG-CB 4.16Å; P93-P154 HydrophobicContact CG-CG 4.23Å; R94-P154 HydrophobicContact CB-CB 4.35Å; R94-P154 HydrophobicContact CB-CG 4.36Å; W149-P154 PolarHBondContact NE1-O 3.07Å; N150-P154 WeakPolarHBondContact O-CA 3.35Å; P154-R156 PolarHBondContact O-N 3.5Å
155	R	95.6	Very high	97.3	Very high	64 Å²	64	30.1 Å²	30.1	24%	0.242	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-10.1	168.2	68.2	169.6	-176.5	88.6	11.1	112.8	E153 D170 I171 D172 E177	E153-R155 VanDerWaalsContact CD-NH2 3.3Å; E153-R155 HydrophobicContact CG-CG 3.71Å; E153-R155 PolarHBondContact O-N 3.38Å; E153-R155 IonicContact OE1-CZ 2.65Å; E153-R155 IonicContact OE1-NE 3.15Å; E153-R155 PolarHBondContact OE1-NE 3Å; E153-R155 IonicContact OE1-NH2 3.14Å; E153-R155 PolarHBondContact OE1-NH2 3.27Å; E153-R155 IonicContact OE2-NH2 3.2Å; R155-D170 IonicContact CZ-OD2 2.83Å; R155-D170 IonicContact NH1-OD2 3.09Å; R155-D170 PolarHBondContact NH1-OD2 2.9Å; R155-D170 WeakPolarHBondContact O-CA 3.46Å; R155-I171 VanDerWaalsContact O-CG1 3.27Å; R155-I171 WeakPolarHBondContact O-CG1 3.43Å; R155-I171 PolarHBondContact O-N 3.03Å; R155-D172 WeakPolarHBondContact CB-OD2 3.11Å; R155-E177 IonicContact CZ-OE2 3.7Å; R155-E177 IonicContact NH1-OE2 3.56Å; R155-E177 PolarHBondContact NH1-OE2 2.68Å; R155-E177 IonicContact NH2-OE2 3.72Å
156	R	97.7	Very high	97.3	Very high	29 Å²	29	28.7 Å²	28.7	11%	0.109	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.2	-178.5	-74.1	-176.4	177.6	144.8	5.2	112.7	N150 E153 P154 V168 W169 E177 W192 A195	N150-R156 HydrophobicContact CB-CB 4Å; N150-R156 WeakPolarHBondContact CB-O 3.39Å; N150-R156 PolarHBondContact N-O 3.03Å; E153-R156 HydrophobicContact CG-CG 4.48Å; E153-R156 PolarHBondContact O-N 2.8Å; E153-R156 IonicContact OE2-CZ 2.99Å; E153-R156 IonicContact OE2-NE 3.88Å; E153-R156 IonicContact OE2-NH1 2.77Å; E153-R156 PolarHBondContact OE2-NH1 2.89Å; E153-R156 IonicContact OE2-NH2 3.68Å; P154-R156 PolarHBondContact O-N 3.5Å; R156-V168 HydrophobicContact CG-CG1 4.33Å; R156-W169 VanDerWaalsContact CA-O 3.28Å; R156-W169 WeakPolarHBondContact CA-O 3.26Å; R156-E177 IonicContact CZ-OE1 2.66Å; R156-E177 IonicContact CZ-OE2 2.67Å; R156-E177 VanDerWaalsContact NE-CD 3.33Å; R156-E177 IonicContact NE-OE1 2.74Å; R156-E177 PolarHBondContact NE-OE1 3.18Å; R156-E177 VanDerWaalsContact NE-OE1 3.16Å; R156-E177 IonicContact NE-OE2 3.14Å; R156-E177 PolarHBondContact NE-OE2 2.64Å; R156-E177 IonicContact NH2-OE1 2.67Å; R156-E177 PolarHBondContact NH2-OE1 3.44Å; R156-E177 IonicContact NH2-OE2 3.16Å; R156-E177 PolarHBondContact NH2-OE2 2.97Å; R156-W192 HydrophobicContact CB-CZ2 4.48Å; R156-A195 PolarHBondContact NH1-O 3.12Å
157	I	98.6	Very high	97.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.7	164.9	-66	-174.5	0	0	0	108	A102 L108 I110 F147 W149 T159 V168 W169 I171	A102-I157 HydrophobicContact CB-CD1 3.93Å; L108-I157 HydrophobicContact CD1-CD1 4.46Å; L108-I157 HydrophobicContact CD1-CG2 4.28Å; L108-I157 HydrophobicContact CD2-CB 4.09Å; L108-I157 HydrophobicContact CD2-CD1 4.24Å; L108-I157 HydrophobicContact CD2-CG2 3.75Å; I110-I157 HydrophobicContact CD1-CD1 3.84Å; F147-I157 HydrophobicContact CB-CG2 4.02Å; F147-I157 HydrophobicContact CD2-CG2 3.61Å; F147-I157 HydrophobicContact CE2-CG2 4.45Å; F147-I157 HydrophobicContact CG-CG2 4.15Å; W149-I157 HydrophobicContact CB-CG1 4.33Å; W149-I157 HydrophobicContact CD2-CD1 3.66Å; W149-I157 HydrophobicContact CD2-CG1 3.92Å; W149-I157 HydrophobicContact CE3-CD1 3.92Å; W149-I157 HydrophobicContact CG-CD1 4.04Å; W149-I157 HydrophobicContact CG-CG1 3.77Å; W149-I157 HydrophobicContact CH2-CD1 4.4Å; W149-I157 HydrophobicContact CZ2-CD1 4.22Å; W149-I157 HydrophobicContact CZ3-CD1 4.28Å; I157-T159 HydrophobicContact CG2-CG2 4.17Å; I157-V168 WeakPolarHBondContact O-CA 3.28Å; I157-W169 PolarHBondContact N-O 2.77Å; I157-W169 PolarHBondContact O-N 3.14Å; I157-I171 HydrophobicContact CB-CG2 4.21Å; I157-I171 HydrophobicContact CD1-CG2 3.81Å; I157-I171 HydrophobicContact CG1-CG2 3.86Å
158	G	98.6	Very high	97.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133.2	169.9	0	0	0	0	0	109.2	F147 D148 T167	F147-G158 CarbonylContact C-O 3.53Å; F147-G158 WeakPolarHBondContact CA-O 3.49Å; F147-G158 WeakPolarHBondContact CB-O 3.27Å; D148-G158 PolarHBondContact N-O 2.81Å; D148-G158 PolarHBondContact O-N 2.88Å; G158-T167 CarbonylContact C-O 3.56Å
159	T	98.7	Very high	97.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	140.2	179.7	52.7	0	0	0	0	110.2	L108 L144 F147 I157 C166 T167 W169	L108-T159 HydrophobicContact CB-CG2 4.26Å; L108-T159 HydrophobicContact CD1-CG2 4.45Å; L108-T159 HydrophobicContact CD2-CG2 3.96Å; L108-T159 HydrophobicContact CG-CG2 4.46Å; L144-T159 HydrophobicContact CD1-CG2 3.86Å; F147-T159 HydrophobicContact CB-CG2 3.81Å; I157-T159 HydrophobicContact CG2-CG2 4.17Å; T159-C166 CarbonylContact O-C 3.3Å; T159-C166 WeakPolarHBondContact O-CA 3.21Å; T159-T167 PolarHBondContact N-O 2.76Å; T159-T167 PolarHBondContact O-N 2.8Å; T159-T167 WeakPolarHBondContact OG1-CB 3.19Å; T159-T167 PolarHBondContact OG1-O 3.03Å; T159-W169 PolarHBondContact OG1-NE1 2.65Å
160	A	98.6	Very high	97.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	147.7	173.4	0	0	0	0	0	109.8	L144 T145 S146 V187 I190	L144-A160 CarbonylContact C-O 3.58Å; L144-A160 VanDerWaalsContact CA-O 3.27Å; L144-A160 WeakPolarHBondContact CA-O 3.18Å; T145-A160 PolarHBondContact N-O 3.2Å; T145-A160 VanDerWaalsContact OG1-C 3.29Å; T145-A160 WeakPolarHBondContact OG1-CB 3.32Å; T145-A160 PolarHBondContact OG1-O 2.53Å; S146-A160 PolarHBondContact O-N 2.92Å; A160-V187 HydrophobicContact CB-CB 3.97Å; A160-V187 HydrophobicContact CB-CG1 3.67Å; A160-I190 HydrophobicContact CB-CB 4.24Å; A160-I190 HydrophobicContact CB-CG2 4.07Å
161	S	97.8	Very high	97.1	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.028	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	155.4	-171.2	170.9	0	0	0	0	112.7	D163 T164 T165 V187	S161-D163 WeakPolarHBondContact CB-OD1 3.46Å; S161-D163 PolarHBondContact O-N 3Å; S161-D163 PolarHBondContact OG-N 3.5Å; S161-D163 PolarHBondContact OG-OD1 2.86Å; S161-T164 PolarHBondContact O-N 3.23Å; S161-T165 PolarHBondContact N-O 2.88Å; S161-V187 PolarHBondContact O-N 3Å
162	I	96.9	Very high	97.1	Very high	89 Å²	89	29.9 Å²	29.9	46%	0.456	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.6	174.5	110.8	174.1	0	0	0	111.8	A142 P143 T145 T164 A186	A142-I162 HydrophobicContact CB-CG1 4.34Å; P143-I162 HydrophobicContact CG-CG2 3.65Å; P143-I162 WeakPolarHBondContact O-CG2 3.48Å; P143-I162 PolarHBondContact O-N 2.82Å; T145-I162 HydrophobicContact CG2-CG2 3.96Å; I162-T164 PolarHBondContact O-N 2.89Å; I162-A186 HydrophobicContact CB-CB 4.35Å
163	D	95.8	Very high	97.1	Very high	66 Å²	66	34 Å²	34	35%	0.353	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	17.1	179.6	72	-2	0	0	0	114.6	A142 S161 T165	A142-D163 HydrophobicContact CB-CB 3.6Å; S161-D163 WeakPolarHBondContact CB-OD1 3.46Å; S161-D163 PolarHBondContact O-N 3Å; S161-D163 PolarHBondContact OG-N 3.5Å; S161-D163 PolarHBondContact OG-OD1 2.86Å; D163-T165 PolarHBondContact O-N 3.06Å; D163-T165 WeakPolarHBondContact OD1-CB 3.27Å; D163-T165 PolarHBondContact OD1-N 2.89Å; D163-T165 VanDerWaalsContact OD1-N 3.1Å; D163-T165 PolarHBondContact OD1-OG1 3.31Å; D163-T165 PolarHBondContact OD2-OG1 3.43Å
164	T	97.2	Very high	97.1	Very high	36 Å²	36	33.6 Å²	33.6	22%	0.221	17%	0.172	C	C	.	.	S	Bend	trans	70	4.9	179.3	94.6	0	0	0	0	115.1	S161 I162 A182 H183 K185	S161-T164 PolarHBondContact O-N 3.23Å; I162-T164 PolarHBondContact O-N 2.89Å; T164-A182 PolarHBondContact O-N 3.13Å; T164-H183 WeakPolarHBondContact CB-O 3.37Å; T164-H183 PolarHBondContact O-N 3.48Å; T164-H183 PolarHBondContact OG1-O 3.26Å; T164-H183 VanDerWaalsContact OG1-O 3.06Å; T164-K185 WeakPolarHBondContact CA-O 3.37Å; T164-K185 VanDerWaalsContact CB-O 3.3Å; T164-K185 WeakPolarHBondContact CB-O 3.23Å; T164-K185 VanDerWaalsContact CG2-C 3.47Å
165	T	97.1	Very high	97.1	Very high	12 Å²	12	34.5 Å²	34.5	7%	0.074	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	153	-178.4	75.3	0	0	0	0	113.9	S161 D163 Q179 L180	S161-T165 PolarHBondContact N-O 2.88Å; D163-T165 PolarHBondContact O-N 3.06Å; D163-T165 WeakPolarHBondContact OD1-CB 3.27Å; D163-T165 PolarHBondContact OD1-N 2.89Å; D163-T165 VanDerWaalsContact OD1-N 3.1Å; D163-T165 PolarHBondContact OD1-OG1 3.31Å; D163-T165 PolarHBondContact OD2-OG1 3.43Å; T165-Q179 HydrophobicContact CG2-CG 4.32Å; T165-Q179 PolarHBondContact OG1-NE2 3.45Å; T165-L180 CarbonylContact C-O 2.95Å; T165-L180 WeakPolarHBondContact CA-O 3.32Å; T165-L180 VanDerWaalsContact CB-O 3.27Å; T165-L180 WeakPolarHBondContact CB-O 3.47Å
166	C	98.2	Very high	97.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.6	161.2	-73.6	0	0	0	0	108.9	T159 Q179 L180 A182 I190 F198	T159-C166 CarbonylContact O-C 3.3Å; T159-C166 WeakPolarHBondContact O-CA 3.21Å; C166-Q179 WeakPolarHBondContact O-CA 3.25Å; C166-L180 PolarHBondContact N-O 2.87Å; C166-L180 PolarHBondContact O-N 2.92Å; C166-A182 HydrophobicContact CB-CB 4.04Å; C166-A182 VanDerWaalsContact SG-CB 3.58Å; C166-I190 HydrophobicContact CB-CD1 4.32Å; C166-F198 HydrophobicContact CB-CE2 4.07Å; C166-F198 HydrophobicContact CB-CZ 4.22Å
167	T	98	Very high	97.1	Very high	6 Å²	6	35.3 Å²	35.3	4%	0.037	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125	175.7	-54.2	0	0	0	0	110.1	N133 G158 T159 W169 V176	N133-T167 PolarHBondContact ND2-OG1 3.09Å; G158-T167 CarbonylContact C-O 3.56Å; T159-T167 PolarHBondContact N-O 2.76Å; T159-T167 PolarHBondContact O-N 2.8Å; T159-T167 WeakPolarHBondContact OG1-CB 3.19Å; T159-T167 PolarHBondContact OG1-O 3.03Å; T167-W169 HydrophobicContact CG2-CD2 4.07Å; T167-W169 HydrophobicContact CG2-CH2 4.3Å; T167-W169 HydrophobicContact CG2-CZ2 3.65Å; T167-V176 HydrophobicContact CG2-CB 4.43Å; T167-V176 HydrophobicContact CG2-CG1 3.76Å; T167-V176 HydrophobicContact CG2-CG2 3.96Å
168	V	98.4	Very high	97	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	125.5	172.5	-178.9	0	0	0	0	109	R156 I157 E177 T178 W192 F198 L212	R156-V168 HydrophobicContact CG-CG1 4.33Å; I157-V168 WeakPolarHBondContact O-CA 3.28Å; V168-E177 HydrophobicContact CG1-CB 4.41Å; V168-E177 PolarHBondContact O-N 2.83Å; V168-T178 HydrophobicContact CB-CG2 3.85Å; V168-T178 HydrophobicContact CG2-CG2 3.94Å; V168-T178 PolarHBondContact N-O 2.91Å; V168-T178 PolarHBondContact O-N 3.35Å; V168-W192 HydrophobicContact CG1-CH2 4.01Å; V168-W192 HydrophobicContact CG1-CZ2 4.09Å; V168-W192 HydrophobicContact CG2-CH2 4.05Å; V168-W192 HydrophobicContact CG2-CZ2 4.19Å; V168-F198 HydrophobicContact CG2-CE1 4.18Å; V168-L212 HydrophobicContact CG2-CD2 4.17Å
169	W	98.4	Very high	96.9	Very high	8 Å²	8	40.1 Å²	40.1	3%	0.03	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	142	-176.3	-58.6	93.3	0	0	0	110.8	L108 L131 D132 N133 R156 I157 T159 T167 I171 V176	L108-W169 HydrophobicContact CD2-CB 4.5Å; L108-W169 HydrophobicContact CD2-CG 4.04Å; L131-W169 HydrophobicContact CB-CD2 4.06Å; L131-W169 HydrophobicContact CB-CE3 3.79Å; L131-W169 HydrophobicContact CB-CH2 4.17Å; L131-W169 HydrophobicContact CB-CZ2 4.46Å; L131-W169 HydrophobicContact CB-CZ3 3.83Å; L131-W169 HydrophobicContact CD2-CB 3.83Å; L131-W169 HydrophobicContact CD2-CD2 3.94Å; L131-W169 HydrophobicContact CD2-CE3 3.68Å; L131-W169 HydrophobicContact CD2-CG 4.03Å; L131-W169 HydrophobicContact CD2-CZ3 4.46Å; L131-W169 HydrophobicContact CG-CE3 4.3Å; D132-W169 VanDerWaalsContact C-CH2 3.48Å; N133-W169 HydrophobicContact CB-CH2 3.6Å; N133-W169 HydrophobicContact CB-CZ2 3.89Å; R156-W169 VanDerWaalsContact CA-O 3.28Å; R156-W169 WeakPolarHBondContact CA-O 3.26Å; I157-W169 PolarHBondContact N-O 2.77Å; I157-W169 PolarHBondContact O-N 3.14Å; T159-W169 PolarHBondContact OG1-NE1 2.65Å; T167-W169 HydrophobicContact CG2-CD2 4.07Å; T167-W169 HydrophobicContact CG2-CH2 4.3Å; T167-W169 HydrophobicContact CG2-CZ2 3.65Å; W169-I171 HydrophobicContact CB-CG2 4.4Å; W169-V176 HydrophobicContact CD2-CG2 4.5Å; W169-V176 HydrophobicContact CE3-CG2 3.75Å; W169-V176 HydrophobicContact CH2-CG2 3.62Å; W169-V176 HydrophobicContact CZ2-CG2 4.36Å; W169-V176 HydrophobicContact CZ3-CB 4.4Å; W169-V176 HydrophobicContact CZ3-CG2 3.26Å
170	D	97.1	Very high	96.8	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.037	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	106	157.6	-174.1	-46	0	0	0	107.7	R155 D172 R173 G174 V175	R155-D170 IonicContact CZ-OD2 2.83Å; R155-D170 IonicContact NH1-OD2 3.09Å; R155-D170 PolarHBondContact NH1-OD2 2.9Å; R155-D170 WeakPolarHBondContact O-CA 3.46Å; D170-D172 PolarHBondContact OD1-N 2.85Å; D170-D172 VanDerWaalsContact OD1-N 3.15Å; D170-R173 HydrophobicContact CB-CB 4.27Å; D170-R173 WeakPolarHBondContact OD1-CB 3.26Å; D170-R173 PolarHBondContact OD1-N 3.5Å; D170-R173 WeakPolarHBondContact OD2-CD 3.1Å; D170-G174 WeakPolarHBondContact O-CA 3.43Å; D170-G174 PolarHBondContact O-N 2.97Å; D170-V175 HydrophobicContact CB-CG2 4.15Å; D170-V175 PolarHBondContact N-O 3.28Å; D170-V175 PolarHBondContact O-N 2.95Å; D170-V175 VanDerWaalsContact O-N 3.12Å
171	I	96	Very high	96.7	Very high	12 Å²	12	47.2 Å²	47.2	6%	0.062	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-22	-173.9	60.3	155	0	0	0	113.4	I110 L131 W149 R155 I157 W169	I110-I171 HydrophobicContact CD1-CG2 4.29Å; L131-I171 HydrophobicContact CD2-CG2 4Å; W149-I171 HydrophobicContact CH2-CD1 4.27Å; W149-I171 HydrophobicContact CZ2-CD1 3.36Å; R155-I171 VanDerWaalsContact O-CG1 3.27Å; R155-I171 WeakPolarHBondContact O-CG1 3.43Å; R155-I171 PolarHBondContact O-N 3.03Å; I157-I171 HydrophobicContact CB-CG2 4.21Å; I157-I171 HydrophobicContact CD1-CG2 3.81Å; I157-I171 HydrophobicContact CG1-CG2 3.86Å; W169-I171 HydrophobicContact CB-CG2 4.4Å
172	D	94	Very high	96.7	Very high	106 Å²	106	47 Å²	47	57%	0.567	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-36.9	177.2	-74.3	-28.6	0	0	0	110.4	R155 D170	R155-D172 WeakPolarHBondContact CB-OD2 3.11Å; D170-D172 PolarHBondContact OD1-N 2.85Å; D170-D172 VanDerWaalsContact OD1-N 3.15Å
173	R	95.7	Very high	96.7	Very high	185 Å²	185	42.8 Å²	42.8	70%	0.698	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-17.4	176.1	-64.8	175.4	63.9	-162.1	-2.1	113.2	D170 V175	D170-R173 HydrophobicContact CB-CB 4.27Å; D170-R173 WeakPolarHBondContact OD1-CB 3.26Å; D170-R173 PolarHBondContact OD1-N 3.5Å; D170-R173 WeakPolarHBondContact OD2-CD 3.1Å; R173-V175 HydrophobicContact CB-CG2 3.83Å
174	G	95.6	Very high	96.7	Very high	44 Å²	44	45.5 Å²	45.5	45%	0.454	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	36.1	-177.1	0	0	0	0	0	113.2	D170	D170-G174 WeakPolarHBondContact O-CA 3.43Å; D170-G174 PolarHBondContact O-N 2.97Å
175	V	96	Very high	96.8	Very high	56 Å²	56	47.6 Å²	47.6	34%	0.339	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	155.1	-175.5	-60.5	0	0	0	0	112	D170 R173 E177	D170-V175 HydrophobicContact CB-CG2 4.15Å; D170-V175 PolarHBondContact N-O 3.28Å; D170-V175 PolarHBondContact O-N 2.95Å; D170-V175 VanDerWaalsContact O-N 3.12Å; R173-V175 HydrophobicContact CB-CG2 3.83Å; V175-E177 PolarHBondContact O-N 2.99Å
176	V	96.8	Very high	96.8	Very high	50 Å²	50	48.2 Å²	48.2	30%	0.303	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	120.9	165.1	177.8	0	0	0	0	108.5	N133 T167 W169	N133-V176 HydrophobicContact CB-CG2 4.26Å; T167-V176 HydrophobicContact CG2-CB 4.43Å; T167-V176 HydrophobicContact CG2-CG1 3.76Å; T167-V176 HydrophobicContact CG2-CG2 3.96Å; W169-V176 HydrophobicContact CD2-CG2 4.5Å; W169-V176 HydrophobicContact CE3-CG2 3.75Å; W169-V176 HydrophobicContact CH2-CG2 3.62Å; W169-V176 HydrophobicContact CZ2-CG2 4.36Å; W169-V176 HydrophobicContact CZ3-CB 4.4Å; W169-V176 HydrophobicContact CZ3-CG2 3.26Å
177	E	96.4	Very high	96.9	Very high	61 Å²	61	48.2 Å²	48.2	29%	0.285	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-42.6	172	-170.1	-179.2	139	0	0	110.5	R155 R156 V168 V175	R155-E177 IonicContact CZ-OE2 3.7Å; R155-E177 IonicContact NH1-OE2 3.56Å; R155-E177 PolarHBondContact NH1-OE2 2.68Å; R155-E177 IonicContact NH2-OE2 3.72Å; R156-E177 IonicContact CZ-OE1 2.66Å; R156-E177 IonicContact CZ-OE2 2.67Å; R156-E177 VanDerWaalsContact NE-CD 3.33Å; R156-E177 IonicContact NE-OE1 2.74Å; R156-E177 PolarHBondContact NE-OE1 3.18Å; R156-E177 VanDerWaalsContact NE-OE1 3.16Å; R156-E177 IonicContact NE-OE2 3.14Å; R156-E177 PolarHBondContact NE-OE2 2.64Å; R156-E177 IonicContact NH2-OE1 2.67Å; R156-E177 PolarHBondContact NH2-OE1 3.44Å; R156-E177 IonicContact NH2-OE2 3.16Å; R156-E177 PolarHBondContact NH2-OE2 2.97Å; V168-E177 HydrophobicContact CG1-CB 4.41Å; V168-E177 PolarHBondContact O-N 2.83Å; V175-E177 PolarHBondContact O-N 2.99Å
178	T	96.1	Very high	96.9	Very high	16 Å²	16	50.1 Å²	50.1	10%	0.098	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	152.1	173.2	-157.1	0	0	0	0	111	V168 L180 L212 K215	V168-T178 HydrophobicContact CB-CG2 3.85Å; V168-T178 HydrophobicContact CG2-CG2 3.94Å; V168-T178 PolarHBondContact N-O 2.91Å; V168-T178 PolarHBondContact O-N 3.35Å; T178-L180 HydrophobicContact CG2-CD1 4.37Å; T178-L180 HydrophobicContact CG2-CG 4.3Å; T178-L212 HydrophobicContact CG2-CD2 3.85Å; T178-K215 WeakPolarHBondContact OG1-CD 3.41Å; T178-K215 WeakPolarHBondContact OG1-CE 3.44Å; T178-K215 PolarHBondContact OG1-NZ 2.91Å; T178-K215 VanDerWaalsContact OG1-NZ 3.12Å
179	Q	95.7	Very high	96.9	Very high	84 Å²	84	50.4 Å²	50.4	39%	0.393	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.6	167.9	-176.6	178.2	14.7	0	0	107.8	N133 T165 C166	N133-Q179 PolarHBondContact ND2-NE2 2.88Å; N133-Q179 PolarHBondContact ND2-OE1 3.29Å; T165-Q179 HydrophobicContact CG2-CG 4.32Å; T165-Q179 PolarHBondContact OG1-NE2 3.45Å; C166-Q179 WeakPolarHBondContact O-CA 3.25Å
180	L	96.7	Very high	96.9	Very high	12 Å²	12	50 Å²	50	6%	0.063	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	132	-176	-62.2	168.3	0	0	0	108.3	T165 C166 T178 A182 F198 F210 L212 K215	T165-L180 CarbonylContact C-O 2.95Å; T165-L180 WeakPolarHBondContact CA-O 3.32Å; T165-L180 VanDerWaalsContact CB-O 3.27Å; T165-L180 WeakPolarHBondContact CB-O 3.47Å; C166-L180 PolarHBondContact N-O 2.87Å; C166-L180 PolarHBondContact O-N 2.92Å; T178-L180 HydrophobicContact CG2-CD1 4.37Å; T178-L180 HydrophobicContact CG2-CG 4.3Å; L180-A182 VanDerWaalsContact C-N 3.3Å; L180-A182 PolarHBondContact O-N 2.77Å; L180-F198 HydrophobicContact CD1-CE1 3.95Å; L180-F198 HydrophobicContact CD1-CZ 3.65Å; L180-F210 HydrophobicContact CD1-CD1 4.17Å; L180-L212 HydrophobicContact CD1-CD2 4.38Å; L180-K215 HydrophobicContact CD2-CB 3.8Å; L180-K215 HydrophobicContact CD2-CG 4.22Å; L180-K215 WeakPolarHBondContact CD2-O 3.42Å
181	I	96.1	Very high	97	Very high	137 Å²	137	50 Å²	50	70%	0.703	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	96.8	163.5	-60.3	171.6	0	0	0	105.3
182	A	97.5	Very high	97.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.			trans	-80.9	-41.2	-169.3	0	0	0	0	0	110.7	T164 C166 L180 V187 R208 F210	T164-A182 PolarHBondContact O-N 3.13Å; C166-A182 HydrophobicContact CB-CB 4.04Å; C166-A182 VanDerWaalsContact SG-CB 3.58Å; L180-A182 VanDerWaalsContact C-N 3.3Å; L180-A182 PolarHBondContact O-N 2.77Å; A182-V187 HydrophobicContact CB-CG2 4.08Å; A182-R208 WeakPolarHBondContact O-CD 3.3Å; A182-R208 PolarHBondContact O-NH1 2.83Å; A182-F210 HydrophobicContact CB-CE1 4.11Å; A182-F210 HydrophobicContact CB-CE2 4.31Å; A182-F210 HydrophobicContact CB-CZ 3.62Å; A182-F210 WeakPolarHBondContact O-CZ 3.3Å
183	H	97.9	Very high	97.3	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.234	C	C	.	.			trans	-141	170.7	-170.9	-73.3	-89.4	0	0	0	111.9	T164 K185 V187 S200 S202 D204 S206	T164-H183 WeakPolarHBondContact CB-O 3.37Å; T164-H183 PolarHBondContact O-N 3.48Å; T164-H183 PolarHBondContact OG1-O 3.26Å; T164-H183 VanDerWaalsContact OG1-O 3.06Å; H183-K185 WeakPolarHBondContact CB-O 3.33Å; H183-V187 HydrophobicContact CB-CG2 4.29Å; H183-S200 PolarHBondContact CD2-OG 2.92Å; H183-S200 VanDerWaalsContact CD2-OG 3.27Å; H183-S200 PolarHBondContact NE2-OG 2.92Å; H183-S202 WeakPolarHBondContact CB-OG 3.37Å; H183-S202 WeakPolarHBondContact ND1-CB 3.31Å; H183-D204 VanDerWaalsContact CB-OD2 3.29Å; H183-D204 WeakPolarHBondContact CB-OD2 3.37Å; H183-D204 IonicContact CE1-OD1 2.65Å; H183-D204 IonicContact CG-OD2 3Å; H183-D204 IonicContact ND1-OD1 3.22Å; H183-D204 PolarHBondContact ND1-OD1 2.77Å; H183-D204 IonicContact ND1-OD2 3.05Å; H183-D204 PolarHBondContact ND1-OD2 3.42Å; H183-S206 PolarHBondContact CE1-O 3.24Å; H183-S206 PolarHBondContact CE1-OG 3.35Å; H183-S206 VanDerWaalsContact CE1-OG 3.26Å; H183-S206 PolarHBondContact ND1-OG 3.16Å
184	D	96.9	Very high	97.3	Very high	123 Å²	123	40.9 Å²	40.9	66%	0.658	22%	0.224	S	C	*	.	S	Bend	trans	-88.8	-10.6	178.4	-61.5	-61.4	0	0	0	112.5	D204 R208	D184-D204 PolarHBondContact N-OD2 2.89Å; D184-R208 IonicContact OD2-NH2 2.85Å; D184-R208 PolarHBondContact OD2-NH2 2.82Å; D184-R208 VanDerWaalsContact OD2-NH2 3.13Å
185	K	98.2	Very high	97.2	Very high	80 Å²	80	40.2 Å²	40.2	35%	0.348	21%	0.214	S	C	.	.	S	Bend	trans	-136.3	179	173.6	-59.1	-175.3	-167.5	165.2	0	110.3	T164 H183 V187 S202 A203 D204 D228	T164-K185 WeakPolarHBondContact CA-O 3.37Å; T164-K185 VanDerWaalsContact CB-O 3.3Å; T164-K185 WeakPolarHBondContact CB-O 3.23Å; T164-K185 VanDerWaalsContact CG2-C 3.47Å; H183-K185 WeakPolarHBondContact CB-O 3.33Å; K185-V187 PolarHBondContact O-N 2.65Å; K185-S202 PolarHBondContact O-OG 3Å; K185-A203 HydrophobicContact CB-CB 3.77Å; K185-A203 HydrophobicContact CD-CB 4.22Å; K185-D204 HydrophobicContact CB-CB 4.26Å; K185-D204 HydrophobicContact CD-CB 4.38Å; K185-D204 HydrophobicContact CG-CB 4.21Å; K185-D228 IonicContact NZ-OD1 3.76Å; K185-D228 PolarHBondContact NZ-OD1 2.79Å
186	A	98.2	Very high	97.3	Very high	25 Å²	25	38.4 Å²	38.4	21%	0.207	21%	0.206	C	C	.	.			trans	-47	133.8	179.8	0	0	0	0	0	112.1	I162 S202 A203	I162-A186 HydrophobicContact CB-CB 4.35Å; A186-S202 VanDerWaalsContact O-CA 3.31Å; A186-S202 WeakPolarHBondContact O-CA 3.08Å; A186-S202 WeakPolarHBondContact O-CB 3.05Å; A186-S202 PolarHBondContact O-OG 2.87Å; A186-A203 HydrophobicContact CB-CB 4.42Å; A186-A203 PolarHBondContact O-N 2.8Å
187	V	98.8	Very high	97.3	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.5	173.2	-167.3	0	0	0	0	107.2	T145 A160 S161 A182 H183 K185 V201	T145-V187 VanDerWaalsContact CB-O 3.31Å; T145-V187 WeakPolarHBondContact CB-O 3.14Å; T145-V187 VanDerWaalsContact CG2-O 3.29Å; T145-V187 WeakPolarHBondContact CG2-O 3.42Å; T145-V187 PolarHBondContact OG1-O 3.03Å; A160-V187 HydrophobicContact CB-CB 3.97Å; A160-V187 HydrophobicContact CB-CG1 3.67Å; S161-V187 PolarHBondContact O-N 3Å; A182-V187 HydrophobicContact CB-CG2 4.08Å; H183-V187 HydrophobicContact CB-CG2 4.29Å; K185-V187 PolarHBondContact O-N 2.65Å; V187-V201 CarbonylContact C-O 3.47Å; V187-V201 WeakPolarHBondContact CG1-O 3.22Å
188	H	98.7	Very high	97.4	Very high	46 Å²	46	34.1 Å²	34.1	21%	0.213	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-34.8	-176.6	-74.4	-53.9	0	0	0	113.3	T145 S146 V201 A203 L231	T145-H188 PolarHBondContact OG1-O 3.25Å; S146-H188 WeakPolarHBondContact CB-O 3.42Å; H188-V201 HydrophobicContact CB-CG2 4.46Å; H188-V201 PolarHBondContact N-O 3.4Å; H188-A203 PolarHBondContact CD2-N 2.77Å; H188-A203 VanDerWaalsContact CD2-N 3.32Å; H188-L231 WeakPolarHBondContact CB-O 3.38Å; H188-L231 PolarHBondContact CD2-O 3.12Å
189	D	98.7	Very high	97.5	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.032	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	160.6	179.3	-150.2	-4.6	0	0	0	111.8	K88 S146 S200 V201 R233 L234	K88-D189 IonicContact NZ-OD1 3.97Å; K88-D189 PolarHBondContact NZ-OD1 3.1Å; S146-D189 VanDerWaalsContact CB-OD1 3.26Å; S146-D189 WeakPolarHBondContact CB-OD1 3.27Å; S146-D189 PolarHBondContact OG-OD1 3.29Å; D189-S200 WeakPolarHBondContact O-CA 3.49Å; D189-S200 WeakPolarHBondContact O-CB 3.17Å; D189-V201 HydrophobicContact CB-CG2 3.59Å; D189-V201 PolarHBondContact N-O 2.81Å; D189-V201 PolarHBondContact O-N 3.18Å; D189-R233 WeakPolarHBondContact OD2-CA 3.37Å; D189-L234 HydrophobicContact CB-CB 4.14Å; D189-L234 PolarHBondContact OD2-N 2.95Å
190	I	98.8	Very high	97.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	143.1	178.3	-176.3	169.9	0	0	0	108.9	D148 A160 C166 F198 A199	D148-I190 HydrophobicContact CB-CG2 4.41Å; D148-I190 WeakPolarHBondContact CB-O 3.24Å; A160-I190 HydrophobicContact CB-CB 4.24Å; A160-I190 HydrophobicContact CB-CG2 4.07Å; C166-I190 HydrophobicContact CB-CD1 4.32Å; I190-F198 HydrophobicContact CD1-CD2 3.48Å; I190-F198 VanDerWaalsContact CD1-CD2 3.48Å; I190-F198 HydrophobicContact CD1-CE2 3.74Å; I190-F198 HydrophobicContact CD1-CG 4.11Å; I190-F198 HydrophobicContact CG1-CB 4.48Å; I190-F198 HydrophobicContact CG1-CD2 3.7Å; I190-F198 HydrophobicContact CG1-CE2 4.33Å; I190-F198 HydrophobicContact CG1-CG 4.37Å; I190-A199 CarbonylContact C-O 3.58Å; I190-A199 VanDerWaalsContact CA-O 3.27Å; I190-A199 WeakPolarHBondContact CA-O 3.41Å; I190-A199 WeakPolarHBondContact CG1-O 3.42Å
191	A	98.7	Very high	97.8	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.041	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	130.3	174.8	0	0	0	0	0	110.6	F198 A199 L234 W236	A191-F198 CarbonylContact O-C 3.57Å; A191-F198 VanDerWaalsContact O-CA 3.3Å; A191-F198 WeakPolarHBondContact O-CA 3.4Å; A191-F198 WeakPolarHBondContact O-CB 3.36Å; A191-A199 PolarHBondContact N-O 3.26Å; A191-A199 PolarHBondContact O-N 3.14Å; A191-L234 HydrophobicContact CB-CD2 3.76Å; A191-L234 HydrophobicContact CB-CG 3.97Å; A191-W236 HydrophobicContact CB-CB 4Å
192	W	98.4	Very high	97.9	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	145.7	170.7	-68.7	97.8	0	0	0	110.7	D148 N150 R156 V168 F198 L212 W236 R238	D148-W192 PolarHBondContact O-NE1 3.46Å; D148-W192 PolarHBondContact OD2-N 3.11Å; N150-W192 HydrophobicContact CB-CD2 3.92Å; N150-W192 HydrophobicContact CB-CG 3.95Å; N150-W192 WeakPolarHBondContact ND2-CZ3 3.32Å; R156-W192 HydrophobicContact CB-CZ2 4.48Å; V168-W192 HydrophobicContact CG1-CH2 4.01Å; V168-W192 HydrophobicContact CG1-CZ2 4.09Å; V168-W192 HydrophobicContact CG2-CH2 4.05Å; V168-W192 HydrophobicContact CG2-CZ2 4.19Å; W192-F198 HydrophobicContact CD2-CB 3.88Å; W192-F198 HydrophobicContact CE3-CB 3.67Å; W192-F198 HydrophobicContact CE3-CD1 4.28Å; W192-F198 HydrophobicContact CE3-CG 4.42Å; W192-F198 HydrophobicContact CG-CB 4.37Å; W192-F198 AromaticContact CH2-CD1 3.88Å; W192-F198 HydrophobicContact CH2-CD1 3.88Å; W192-F198 HydrophobicContact CZ3-CB 4.06Å; W192-F198 AromaticContact CZ3-CD1 3.77Å; W192-F198 HydrophobicContact CZ3-CD1 3.77Å; W192-F198 HydrophobicContact CZ3-CG 4.35Å; W192-L212 HydrophobicContact CH2-CD1 3.95Å; W192-L212 HydrophobicContact CZ3-CD1 4.11Å; W192-W236 WeakPolarHBondContact O-CB 3.49Å; W192-R238 PolarHBondContact O-NH1 2.79Å
193	G	96.5	Very high	98	Very high	6 Å²	6	23.1 Å²	23.1	6%	0.062	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-56	163.8	0	0	0	0	0	110.2	V197 L241	G193-V197 PolarHBondContact N-O 2.89Å; G193-L241 WeakPolarHBondContact O-CD1 3.49Å; G193-L241 VanDerWaalsContact O-CD2 3.22Å; G193-L241 WeakPolarHBondContact O-CD2 3.25Å
194	E	95.7	Very high	98	Very high	106 Å²	106	24.2 Å²	24.2	50%	0.495	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	178	179.8	-61	-175.3	167.2	0	0	111.1	N150 G196 V197 L241	N150-E194 PolarHBondContact ND2-O 3.06Å; E194-G196 PolarHBondContact O-N 2.82Å; E194-V197 HydrophobicContact CB-CB 4.11Å; E194-V197 HydrophobicContact CB-CG2 4.3Å; E194-V197 PolarHBondContact N-O 2.83Å; E194-V197 VanDerWaalsContact N-O 3.12Å; E194-V197 PolarHBondContact O-N 3.25Å; E194-L241 HydrophobicContact CG-CD1 3.64Å
195	A	95.1	Very high	98	Very high	30 Å²	30	18.4 Å²	18.4	25%	0.248	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-32.1	179.8	0	0	0	0	0	114.3	N150 V152 E153 R156	N150-A195 WeakPolarHBondContact ND2-CA 3.31Å; N150-A195 PolarHBondContact ND2-O 3.12Å; V152-A195 HydrophobicContact CB-CB 4.03Å; V152-A195 HydrophobicContact CG1-CB 3.77Å; E153-A195 HydrophobicContact CB-CB 4.24Å; R156-A195 PolarHBondContact NH1-O 3.12Å
196	G	96.9	Very high	98	Very high	17 Å²	17	14.7 Å²	14.7	18%	0.175	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	7.5	-178.8	0	0	0	0	0	114.4	E194 L212	E194-G196 PolarHBondContact O-N 2.82Å; G196-L212 WeakPolarHBondContact O-CG 3.21Å; G196-L212 PolarHBondContact O-N 2.85Å
197	V	97.8	Very high	98	Very high	22 Å²	22	13.5 Å²	13.5	13%	0.133	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.9	-176.2	-177.2	0	0	0	0	109.2	G193 E194 V209 F210 W236	G193-V197 PolarHBondContact N-O 2.89Å; E194-V197 HydrophobicContact CB-CB 4.11Å; E194-V197 HydrophobicContact CB-CG2 4.3Å; E194-V197 PolarHBondContact N-O 2.83Å; E194-V197 VanDerWaalsContact N-O 3.12Å; E194-V197 PolarHBondContact O-N 3.25Å; V197-V209 HydrophobicContact CG1-CG1 3.69Å; V197-F210 VanDerWaalsContact CA-O 3.3Å; V197-F210 WeakPolarHBondContact CA-O 2.82Å; V197-W236 HydrophobicContact CG1-CH2 4.06Å
198	F	98.4	Very high	98	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	163.4	175	69.8	-91.7	0	0	0	110.4	C166 V168 L180 I190 A191 W192 V209 F210 L212	C166-F198 HydrophobicContact CB-CE2 4.07Å; C166-F198 HydrophobicContact CB-CZ 4.22Å; V168-F198 HydrophobicContact CG2-CE1 4.18Å; L180-F198 HydrophobicContact CD1-CE1 3.95Å; L180-F198 HydrophobicContact CD1-CZ 3.65Å; I190-F198 HydrophobicContact CD1-CD2 3.48Å; I190-F198 VanDerWaalsContact CD1-CD2 3.48Å; I190-F198 HydrophobicContact CD1-CE2 3.74Å; I190-F198 HydrophobicContact CD1-CG 4.11Å; I190-F198 HydrophobicContact CG1-CB 4.48Å; I190-F198 HydrophobicContact CG1-CD2 3.7Å; I190-F198 HydrophobicContact CG1-CE2 4.33Å; I190-F198 HydrophobicContact CG1-CG 4.37Å; A191-F198 CarbonylContact O-C 3.57Å; A191-F198 VanDerWaalsContact O-CA 3.3Å; A191-F198 WeakPolarHBondContact O-CA 3.4Å; A191-F198 WeakPolarHBondContact O-CB 3.36Å; W192-F198 HydrophobicContact CD2-CB 3.88Å; W192-F198 HydrophobicContact CE3-CB 3.67Å; W192-F198 HydrophobicContact CE3-CD1 4.28Å; W192-F198 HydrophobicContact CE3-CG 4.42Å; W192-F198 HydrophobicContact CG-CB 4.37Å; W192-F198 AromaticContact CH2-CD1 3.88Å; W192-F198 HydrophobicContact CH2-CD1 3.88Å; W192-F198 HydrophobicContact CZ3-CB 4.06Å; W192-F198 AromaticContact CZ3-CD1 3.77Å; W192-F198 HydrophobicContact CZ3-CD1 3.77Å; W192-F198 HydrophobicContact CZ3-CG 4.35Å; F198-V209 WeakPolarHBondContact O-CA 3.3Å; F198-F210 HydrophobicContact CD1-CB 4.1Å; F198-F210 HydrophobicContact CD2-CB 4.28Å; F198-F210 AromaticContact CD2-CD2 3.92Å; F198-F210 HydrophobicContact CD2-CD2 3.92Å; F198-F210 HydrophobicContact CD2-CG 4.39Å; F198-F210 HydrophobicContact CE1-CB 3.62Å; F198-F210 HydrophobicContact CE1-CG 4.26Å; F198-F210 HydrophobicContact CE2-CB 3.82Å; F198-F210 AromaticContact CE2-CD2 3.37Å; F198-F210 HydrophobicContact CE2-CD2 3.37Å; F198-F210 HydrophobicContact CE2-CE2 4.12Å; F198-F210 AromaticContact CE2-CG 3.67Å; F198-F210 HydrophobicContact CE2-CG 3.67Å; F198-F210 HydrophobicContact CG-CB 4.41Å; F198-F210 HydrophobicContact CZ-CB 3.46Å; F198-F210 VanDerWaalsContact CZ-CB 3.46Å; F198-F210 HydrophobicContact CZ-CD1 4.27Å; F198-F210 AromaticContact CZ-CD2 3.83Å; F198-F210 HydrophobicContact CZ-CD2 3.83Å; F198-F210 AromaticContact CZ-CG 3.58Å; F198-F210 HydrophobicContact CZ-CG 3.58Å; F198-F210 PolarHBondContact N-O 2.91Å; F198-F210 VanDerWaalsContact N-O 3.12Å; F198-F210 PolarHBondContact O-N 3.18Å; F198-L212 HydrophobicContact CD1-CD2 4.41Å; F198-L212 HydrophobicContact CE1-CD2 3.84Å
199	A	98.7	Very high	98	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	154.5	174.2	0	0	0	0	0	110.3	I190 A191 V207 R208 V209 L234 W236 M244	I190-A199 CarbonylContact C-O 3.58Å; I190-A199 VanDerWaalsContact CA-O 3.27Å; I190-A199 WeakPolarHBondContact CA-O 3.41Å; I190-A199 WeakPolarHBondContact CG1-O 3.42Å; A191-A199 PolarHBondContact N-O 3.26Å; A191-A199 PolarHBondContact O-N 3.14Å; A199-V207 HydrophobicContact CB-CG1 4.49Å; A199-R208 CarbonylContact C-O 3.53Å; A199-R208 WeakPolarHBondContact CA-O 3.18Å; A199-R208 WeakPolarHBondContact CB-O 3.41Å; A199-V209 HydrophobicContact CB-CG2 4.09Å; A199-L234 HydrophobicContact CB-CD2 3.66Å; A199-L234 WeakPolarHBondContact O-CD2 3.47Å; A199-W236 HydrophobicContact CB-CE3 3.82Å; A199-W236 HydrophobicContact CB-CH2 4.38Å; A199-W236 HydrophobicContact CB-CZ3 3.37Å; A199-M244 HydrophobicContact CB-CE 3.92Å
200	S	98.8	Very high	98	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	159	173.8	59.6	0	0	0	0	111.7	H183 D189 V207 R208 F210	H183-S200 PolarHBondContact CD2-OG 2.92Å; H183-S200 VanDerWaalsContact CD2-OG 3.27Å; H183-S200 PolarHBondContact NE2-OG 2.92Å; D189-S200 WeakPolarHBondContact O-CA 3.49Å; D189-S200 WeakPolarHBondContact O-CB 3.17Å; S200-V207 WeakPolarHBondContact O-CA 3.15Å; S200-R208 PolarHBondContact N-O 2.98Å; S200-R208 PolarHBondContact O-N 3.42Å; S200-F210 WeakPolarHBondContact OG-CE2 3.41Å
201	V	98.7	Very high	97.9	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.1	176.5	-60.2	0	0	0	0	110.6	V187 H188 D189 V207 L231 L234	V187-V201 CarbonylContact C-O 3.47Å; V187-V201 WeakPolarHBondContact CG1-O 3.22Å; H188-V201 HydrophobicContact CB-CG2 4.46Å; H188-V201 PolarHBondContact N-O 3.4Å; D189-V201 HydrophobicContact CB-CG2 3.59Å; D189-V201 PolarHBondContact N-O 2.81Å; D189-V201 PolarHBondContact O-N 3.18Å; V201-V207 HydrophobicContact CG1-CB 4.29Å; V201-V207 HydrophobicContact CG1-CG1 4.12Å; V201-V207 HydrophobicContact CG1-CG2 3.79Å; V201-L231 HydrophobicContact CB-CB 3.67Å; V201-L231 HydrophobicContact CB-CD1 4.41Å; V201-L231 HydrophobicContact CG1-CB 4.28Å; V201-L231 HydrophobicContact CG1-CD1 4.4Å; V201-L231 HydrophobicContact CG2-CB 4.27Å; V201-L234 HydrophobicContact CG1-CB 3.9Å; V201-L234 HydrophobicContact CG1-CD1 3.89Å; V201-L234 HydrophobicContact CG1-CD2 4.16Å; V201-L234 HydrophobicContact CG1-CG 4.2Å; V201-L234 HydrophobicContact CG2-CB 4.15Å
202	S	98.7	Very high	97.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	163	-167.9	174.7	0	0	0	0	113.9	H183 K185 A186 D204 G205 S206 L231	H183-S202 WeakPolarHBondContact CB-OG 3.37Å; H183-S202 WeakPolarHBondContact ND1-CB 3.31Å; K185-S202 PolarHBondContact O-OG 3Å; A186-S202 VanDerWaalsContact O-CA 3.31Å; A186-S202 WeakPolarHBondContact O-CA 3.08Å; A186-S202 WeakPolarHBondContact O-CB 3.05Å; A186-S202 PolarHBondContact O-OG 2.87Å; S202-D204 WeakPolarHBondContact CB-OD1 3.34Å; S202-D204 PolarHBondContact O-N 3.36Å; S202-D204 PolarHBondContact OG-N 2.66Å; S202-D204 VanDerWaalsContact OG-N 3.1Å; S202-G205 PolarHBondContact O-N 2.82Å; S202-S206 PolarHBondContact N-O 3.05Å; S202-L231 PolarHBondContact O-N 3.22Å
203	A	98.6	Very high	97.7	Very high	17 Å²	17	27.1 Å²	27.1	14%	0.14	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-15.3	163.9	0	0	0	0	0	114.3	K185 A186 H188 G205 P230	K185-A203 HydrophobicContact CB-CB 3.77Å; K185-A203 HydrophobicContact CD-CB 4.22Å; A186-A203 HydrophobicContact CB-CB 4.42Å; A186-A203 PolarHBondContact O-N 2.8Å; H188-A203 PolarHBondContact CD2-N 2.77Å; H188-A203 VanDerWaalsContact CD2-N 3.32Å; A203-G205 PolarHBondContact O-N 2.8Å; A203-P230 HydrophobicContact CB-CB 4.49Å; A203-P230 HydrophobicContact CB-CG 4.49Å
204	D	98	Very high	97.7	Very high	24 Å²	24	30.3 Å²	30.3	13%	0.128	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-9.1	171	71.5	16.5	0	0	0	113.4	H183 D184 K185 S202 S206 R208	H183-D204 VanDerWaalsContact CB-OD2 3.29Å; H183-D204 WeakPolarHBondContact CB-OD2 3.37Å; H183-D204 IonicContact CE1-OD1 2.65Å; H183-D204 IonicContact CG-OD2 3Å; H183-D204 IonicContact ND1-OD1 3.22Å; H183-D204 PolarHBondContact ND1-OD1 2.77Å; H183-D204 IonicContact ND1-OD2 3.05Å; H183-D204 PolarHBondContact ND1-OD2 3.42Å; D184-D204 PolarHBondContact N-OD2 2.89Å; K185-D204 HydrophobicContact CB-CB 4.26Å; K185-D204 HydrophobicContact CD-CB 4.38Å; K185-D204 HydrophobicContact CG-CB 4.21Å; S202-D204 WeakPolarHBondContact CB-OD1 3.34Å; S202-D204 PolarHBondContact O-N 3.36Å; S202-D204 PolarHBondContact OG-N 2.66Å; S202-D204 VanDerWaalsContact OG-N 3.1Å; D204-S206 VanDerWaalsContact CG-OG 3.32Å; D204-S206 WeakPolarHBondContact OD1-CB 3.35Å; D204-S206 PolarHBondContact OD1-N 2.8Å; D204-S206 PolarHBondContact OD1-OG 2.78Å; D204-S206 PolarHBondContact OD2-OG 3.02Å; D204-R208 IonicContact OD2-NH2 3.96Å
205	G	97.9	Very high	97.5	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.01	15%	0.148	C	C	.	.	S	Bend	trans	83.4	11.5	177.9	0	0	0	0	0	114.6	S202 A203 E223 S224 T229 L231	S202-G205 PolarHBondContact O-N 2.82Å; A203-G205 PolarHBondContact O-N 2.8Å; G205-E223 CarbonylContact O-C 3.52Å; G205-E223 WeakPolarHBondContact O-CA 3.29Å; G205-S224 PolarHBondContact O-N 3Å; G205-T229 WeakPolarHBondContact CA-O 3.41Å; G205-L231 WeakPolarHBondContact O-CD1 3.33Å
206	S	97.8	Very high	97.3	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.014	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	148.5	178.8	70.9	0	0	0	0	113.7	H183 S202 D204 R208 Y222 L231	H183-S206 PolarHBondContact CE1-O 3.24Å; H183-S206 PolarHBondContact CE1-OG 3.35Å; H183-S206 VanDerWaalsContact CE1-OG 3.26Å; H183-S206 PolarHBondContact ND1-OG 3.16Å; S202-S206 PolarHBondContact N-O 3.05Å; D204-S206 VanDerWaalsContact CG-OG 3.32Å; D204-S206 WeakPolarHBondContact OD1-CB 3.35Å; D204-S206 PolarHBondContact OD1-N 2.8Å; D204-S206 PolarHBondContact OD1-OG 2.78Å; D204-S206 PolarHBondContact OD2-OG 3.02Å; S206-R208 PolarHBondContact OG-NE 2.9Å; S206-Y222 CarbonylContact C-O 3.54Å; S206-Y222 VanDerWaalsContact CA-O 3.32Å; S206-Y222 WeakPolarHBondContact CA-O 3.37Å; S206-L231 VanDerWaalsContact C-CD1 3.46Å
207	V	98.5	Very high	97.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	123.7	161.5	-173	0	0	0	0	107.4	A199 S200 V201 V221 Y222 L231 L234 M244 A246 L257	A199-V207 HydrophobicContact CB-CG1 4.49Å; S200-V207 WeakPolarHBondContact O-CA 3.15Å; V201-V207 HydrophobicContact CG1-CB 4.29Å; V201-V207 HydrophobicContact CG1-CG1 4.12Å; V201-V207 HydrophobicContact CG1-CG2 3.79Å; V207-V221 HydrophobicContact CB-CG2 3.74Å; V207-V221 HydrophobicContact CG1-CG2 3.54Å; V207-V221 PolarHBondContact O-N 2.89Å; V207-Y222 HydrophobicContact CG2-CD1 3.92Å; V207-Y222 HydrophobicContact CG2-CG 4.38Å; V207-Y222 PolarHBondContact N-O 3.12Å; V207-L231 HydrophobicContact CG2-CD1 3.58Å; V207-L234 HydrophobicContact CG1-CD1 4.28Å; V207-M244 HydrophobicContact CG1-SD 3.78Å; V207-A246 HydrophobicContact CG2-CB 4.35Å; V207-L257 HydrophobicContact CB-CD1 4.29Å; V207-L257 HydrophobicContact CG1-CD1 4.39Å; V207-L257 HydrophobicContact CG2-CD1 3.81Å
208	R	98.4	Very high	97.1	Very high	40 Å²	40	42.3 Å²	42.3	15%	0.151	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.7	178.2	-70.6	-179.7	-175.2	-166.7	2.4	110.8	A182 D184 A199 S200 D204 S206 F210 T219 I220	A182-R208 WeakPolarHBondContact O-CD 3.3Å; A182-R208 PolarHBondContact O-NH1 2.83Å; D184-R208 IonicContact OD2-NH2 2.85Å; D184-R208 PolarHBondContact OD2-NH2 2.82Å; D184-R208 VanDerWaalsContact OD2-NH2 3.13Å; A199-R208 CarbonylContact C-O 3.53Å; A199-R208 WeakPolarHBondContact CA-O 3.18Å; A199-R208 WeakPolarHBondContact CB-O 3.41Å; S200-R208 PolarHBondContact N-O 2.98Å; S200-R208 PolarHBondContact O-N 3.42Å; D204-R208 IonicContact OD2-NH2 3.96Å; S206-R208 PolarHBondContact OG-NE 2.9Å; R208-F210 HydrophobicContact CB-CD2 4.45Å; R208-F210 HydrophobicContact CB-CE2 3.48Å; R208-F210 VanDerWaalsContact CB-CE2 3.48Å; R208-F210 HydrophobicContact CB-CZ 3.69Å; R208-F210 WeakPolarHBondContact O-CE2 3.21Å; R208-T219 CarbonylContact C-O 3.45Å; R208-T219 WeakPolarHBondContact CA-O 3.39Å; R208-I220 HydrophobicContact CG-CG1 3.87Å
209	V	98.3	Very high	97	Very high	22 Å²	22	46.2 Å²	46.2	13%	0.133	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.6	173.1	179.2	0	0	0	0	109.1	V197 F198 A199 S218 T219 V221 W236 M244	V197-V209 HydrophobicContact CG1-CG1 3.69Å; F198-V209 WeakPolarHBondContact O-CA 3.3Å; A199-V209 HydrophobicContact CB-CG2 4.09Å; V209-S218 CarbonylContact O-C 3.56Å; V209-S218 WeakPolarHBondContact O-CA 3.42Å; V209-T219 PolarHBondContact N-O 2.86Å; V209-T219 PolarHBondContact O-N 2.92Å; V209-V221 HydrophobicContact CB-CG1 4.33Å; V209-V221 HydrophobicContact CG2-CB 4.44Å; V209-V221 HydrophobicContact CG2-CG1 3.56Å; V209-V221 HydrophobicContact CG2-CG2 3.99Å; V209-W236 HydrophobicContact CG1-CH2 4.31Å; V209-W236 HydrophobicContact CG2-CH2 4.46Å; V209-M244 HydrophobicContact CG2-CE 4.26Å
210	F	98.2	Very high	96.9	Very high	9 Å²	9	49.4 Å²	49.4	4%	0.039	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.4	-177.1	-60.2	-96.5	0	0	0	109.7	L180 A182 V197 F198 S200 R208	L180-F210 HydrophobicContact CD1-CD1 4.17Å; A182-F210 HydrophobicContact CB-CE1 4.11Å; A182-F210 HydrophobicContact CB-CE2 4.31Å; A182-F210 HydrophobicContact CB-CZ 3.62Å; A182-F210 WeakPolarHBondContact O-CZ 3.3Å; V197-F210 VanDerWaalsContact CA-O 3.3Å; V197-F210 WeakPolarHBondContact CA-O 2.82Å; F198-F210 HydrophobicContact CD1-CB 4.1Å; F198-F210 HydrophobicContact CD2-CB 4.28Å; F198-F210 AromaticContact CD2-CD2 3.92Å; F198-F210 HydrophobicContact CD2-CD2 3.92Å; F198-F210 HydrophobicContact CD2-CG 4.39Å; F198-F210 HydrophobicContact CE1-CB 3.62Å; F198-F210 HydrophobicContact CE1-CG 4.26Å; F198-F210 HydrophobicContact CE2-CB 3.82Å; F198-F210 AromaticContact CE2-CD2 3.37Å; F198-F210 HydrophobicContact CE2-CD2 3.37Å; F198-F210 HydrophobicContact CE2-CE2 4.12Å; F198-F210 AromaticContact CE2-CG 3.67Å; F198-F210 HydrophobicContact CE2-CG 3.67Å; F198-F210 HydrophobicContact CG-CB 4.41Å; F198-F210 HydrophobicContact CZ-CB 3.46Å; F198-F210 VanDerWaalsContact CZ-CB 3.46Å; F198-F210 HydrophobicContact CZ-CD1 4.27Å; F198-F210 AromaticContact CZ-CD2 3.83Å; F198-F210 HydrophobicContact CZ-CD2 3.83Å; F198-F210 AromaticContact CZ-CG 3.58Å; F198-F210 HydrophobicContact CZ-CG 3.58Å; F198-F210 PolarHBondContact N-O 2.91Å; F198-F210 VanDerWaalsContact N-O 3.12Å; F198-F210 PolarHBondContact O-N 3.18Å; S200-F210 WeakPolarHBondContact OG-CE2 3.41Å; R208-F210 HydrophobicContact CB-CD2 4.45Å; R208-F210 HydrophobicContact CB-CE2 3.48Å; R208-F210 VanDerWaalsContact CB-CE2 3.48Å; R208-F210 HydrophobicContact CB-CZ 3.69Å; R208-F210 WeakPolarHBondContact O-CE2 3.21Å
211	D	97.1	Very high	96.8	Very high	43 Å²	43	49.7 Å²	49.7	23%	0.23	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.8	170.2	-173	-28.7	0	0	0	108.6	R213 D214	D211-R213 PolarHBondContact O-N 3.24Å; D211-R213 WeakPolarHBondContact OD1-CB 3.47Å; D211-R213 VanDerWaalsContact OD1-CG 3.25Å; D211-R213 WeakPolarHBondContact OD1-CG 3.48Å; D211-R213 IonicContact OD1-CZ 3.1Å; D211-R213 PolarHBondContact OD1-N 2.85Å; D211-R213 IonicContact OD1-NE 2.71Å; D211-R213 PolarHBondContact OD1-NE 2.93Å; D211-R213 IonicContact OD2-CZ 3.81Å; D211-R213 VanDerWaalsContact OD2-CZ 3.22Å; D211-R213 IonicContact OD2-NE 3.93Å; D211-R213 PolarHBondContact OD2-NE 2.93Å; D211-R213 IonicContact OD2-NH2 2.69Å; D211-R213 PolarHBondContact OD2-NH2 2.88Å; D211-D214 CarbonylContact O-C 3.31Å; D211-D214 VanDerWaalsContact O-C 3.24Å; D211-D214 PolarHBondContact O-N 2.77Å; D211-D214 VanDerWaalsContact O-O 3.09Å
212	L	97	Very high	96.8	Very high	22 Å²	22	50 Å²	50	12%	0.115	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14	-179.4	-68.1	-172.4	0	0	0	114	V168 T178 L180 W192 G196 F198	V168-L212 HydrophobicContact CG2-CD2 4.17Å; T178-L212 HydrophobicContact CG2-CD2 3.85Å; L180-L212 HydrophobicContact CD1-CD2 4.38Å; W192-L212 HydrophobicContact CH2-CD1 3.95Å; W192-L212 HydrophobicContact CZ3-CD1 4.11Å; G196-L212 WeakPolarHBondContact O-CG 3.21Å; G196-L212 PolarHBondContact O-N 2.85Å; F198-L212 HydrophobicContact CD1-CD2 4.41Å; F198-L212 HydrophobicContact CE1-CD2 3.84Å
213	R	96.3	Very high	96.7	Very high	209 Å²	209	56 Å²	56	79%	0.789	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-24	173.1	-57.4	174.8	-66.2	-177.1	1.2	112.3	D211	D211-R213 PolarHBondContact O-N 3.24Å; D211-R213 WeakPolarHBondContact OD1-CB 3.47Å; D211-R213 VanDerWaalsContact OD1-CG 3.25Å; D211-R213 WeakPolarHBondContact OD1-CG 3.48Å; D211-R213 IonicContact OD1-CZ 3.1Å; D211-R213 PolarHBondContact OD1-N 2.85Å; D211-R213 IonicContact OD1-NE 2.71Å; D211-R213 PolarHBondContact OD1-NE 2.93Å; D211-R213 IonicContact OD2-CZ 3.81Å; D211-R213 VanDerWaalsContact OD2-CZ 3.22Å; D211-R213 IonicContact OD2-NE 3.93Å; D211-R213 PolarHBondContact OD2-NE 2.93Å; D211-R213 IonicContact OD2-NH2 2.69Å; D211-R213 PolarHBondContact OD2-NH2 2.88Å
214	D	95.8	Very high	96.6	Very high	72 Å²	72	55.9 Å²	55.9	39%	0.385	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	83.5	177.6	-172.4	-0.2	0	0	0	110.3	D211 E216 H217	D211-D214 CarbonylContact O-C 3.31Å; D211-D214 VanDerWaalsContact O-C 3.24Å; D211-D214 PolarHBondContact O-N 2.77Å; D211-D214 VanDerWaalsContact O-O 3.09Å; D214-E216 PolarHBondContact O-N 3.28Å; D214-E216 PolarHBondContact OD1-N 3.35Å; D214-H217 PolarHBondContact O-N 2.89Å; D214-H217 VanDerWaalsContact O-O 3.12Å; D214-H217 IonicContact OD1-CE1 3.56Å; D214-H217 IonicContact OD1-CG 3.5Å; D214-H217 IonicContact OD1-ND1 3.46Å; D214-H217 PolarHBondContact OD1-ND1 2.79Å; D214-H217 IonicContact OD2-CG 2.88Å; D214-H217 IonicContact OD2-ND1 3.95Å; D214-H217 PolarHBondContact OD2-ND1 2.92Å
215	K	91.6	Very high	96.4	Very high	96 Å²	96	59.5 Å²	59.5	42%	0.417	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-12.3	-175	-63	179.4	178.5	-169.2	0	114	T178 L180	T178-K215 WeakPolarHBondContact OG1-CD 3.41Å; T178-K215 WeakPolarHBondContact OG1-CE 3.44Å; T178-K215 PolarHBondContact OG1-NZ 2.91Å; T178-K215 VanDerWaalsContact OG1-NZ 3.12Å; L180-K215 HydrophobicContact CD2-CB 3.8Å; L180-K215 HydrophobicContact CD2-CG 4.22Å; L180-K215 WeakPolarHBondContact CD2-O 3.42Å
216	E	92.1	Very high	96.1	Very high	164 Å²	164	68.8 Å²	68.8	77%	0.766	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	-14.7	-177.1	-59.4	-59.5	142.1	0	0	111.8	D214	D214-E216 PolarHBondContact O-N 3.28Å; D214-E216 PolarHBondContact OD1-N 3.35Å
217	H	93.8	Very high	95.7	Very high	125 Å²	125	74.1 Å²	74.1	58%	0.579	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.1	-175.3	-55.4	94.7	0	0	0	112.1	D214	D214-H217 PolarHBondContact O-N 2.89Å; D214-H217 VanDerWaalsContact O-O 3.12Å; D214-H217 IonicContact OD1-CE1 3.56Å; D214-H217 IonicContact OD1-CG 3.5Å; D214-H217 IonicContact OD1-ND1 3.46Å; D214-H217 PolarHBondContact OD1-ND1 2.79Å; D214-H217 IonicContact OD2-CG 2.88Å; D214-H217 IonicContact OD2-ND1 3.95Å; D214-H217 PolarHBondContact OD2-ND1 2.92Å
218	S	96	Very high	95.1	Very high	42 Å²	42	79 Å²	79	29%	0.294	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153.2	167.8	68.6	0	0	0	0	109.1	V209	V209-S218 CarbonylContact O-C 3.56Å; V209-S218 WeakPolarHBondContact O-CA 3.42Å
219	T	96.6	Very high	95.1	Very high	82 Å²	82	78.7 Å²	78.7	50%	0.503	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.2	173.7	-58.9	0	0	0	0	109.4	R208 V209 V221	R208-T219 CarbonylContact C-O 3.45Å; R208-T219 WeakPolarHBondContact CA-O 3.39Å; V209-T219 PolarHBondContact N-O 2.86Å; V209-T219 PolarHBondContact O-N 2.92Å; T219-V221 HydrophobicContact CG2-CG1 4.18Å; T219-V221 PolarHBondContact O-N 2.87Å
220	I	96.8	Very high	95.1	Very high	68 Å²	68	78.5 Å²	78.5	35%	0.349	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	116.6	168.1	-62.2	170.3	0	0	0	107.4	R208 E223	R208-I220 HydrophobicContact CG-CG1 3.87Å; I220-E223 HydrophobicContact CG2-CG 3.62Å
221	V	97.3	Very high	95.1	Very high	5 Å²	5	78 Å²	78	3%	0.03	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-19.2	179.4	-63.7	0	0	0	0	112.7	V207 V209 T219 M244 P262 G263	V207-V221 HydrophobicContact CB-CG2 3.74Å; V207-V221 HydrophobicContact CG1-CG2 3.54Å; V207-V221 PolarHBondContact O-N 2.89Å; V209-V221 HydrophobicContact CB-CG1 4.33Å; V209-V221 HydrophobicContact CG2-CB 4.44Å; V209-V221 HydrophobicContact CG2-CG1 3.56Å; V209-V221 HydrophobicContact CG2-CG2 3.99Å; T219-V221 HydrophobicContact CG2-CG1 4.18Å; T219-V221 PolarHBondContact O-N 2.87Å; V221-M244 HydrophobicContact CG2-SD 4.07Å; V221-P262 HydrophobicContact CG1-CG 4.47Å; V221-P262 WeakPolarHBondContact O-CA 3.25Å; V221-G263 PolarHBondContact O-N 3.04Å
222	Y	97.8	Very high	95.2	Very high	6 Å²	6	78.2 Å²	78.2	2%	0.024	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	148.8	177.4	175.6	-99.4	0	0	0	110.9	S206 V207 P225 L231 V255 L257 P265	S206-Y222 CarbonylContact C-O 3.54Å; S206-Y222 VanDerWaalsContact CA-O 3.32Å; S206-Y222 WeakPolarHBondContact CA-O 3.37Å; V207-Y222 HydrophobicContact CG2-CD1 3.92Å; V207-Y222 HydrophobicContact CG2-CG 4.38Å; V207-Y222 PolarHBondContact N-O 3.12Å; Y222-P225 WeakPolarHBondContact OH-CD 3.3Å; Y222-L231 HydrophobicContact CD1-CD1 4.13Å; Y222-L231 HydrophobicContact CE1-CD1 4.39Å; Y222-L231 HydrophobicContact CE1-CD2 4.17Å; Y222-V255 HydrophobicContact CE1-CG2 4.26Å; Y222-L257 HydrophobicContact CD2-CD2 3.61Å; Y222-L257 HydrophobicContact CE2-CD2 4.26Å; Y222-L257 HydrophobicContact CG-CD1 4.06Å; Y222-L257 HydrophobicContact CG-CD2 3.78Å; Y222-P265 HydrophobicContact CD2-CG 3.97Å; Y222-P265 HydrophobicContact CE2-CG 3.49Å; Y222-P265 VanDerWaalsContact CE2-CG 3.49Å
223	E	97.4	Very high	95.2	Very high	128 Å²	128	80.6 Å²	80.6	60%	0.598	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.8	143.4	169.8	-65.8	-178.6	100.9	0	0	109	G205 I220	G205-E223 CarbonylContact O-C 3.52Å; G205-E223 WeakPolarHBondContact O-CA 3.29Å; I220-E223 HydrophobicContact CG2-CG 3.62Å
224	S	96.3	Very high	95.3	Very high	13 Å²	13	71 Å²	71	9%	0.091	36%	0.362	C	S	.	.			trans	-59.7	140.2	179	60.1	0	0	0	0	111.4	G205 R226 T229	G205-S224 PolarHBondContact O-N 3Å; S224-R226 PolarHBondContact O-N 3.17Å; S224-R226 PolarHBondContact OG-O 2.92Å; S224-T229 WeakPolarHBondContact CB-O 3.16Å; S224-T229 PolarHBondContact OG-N 3.41Å; S224-T229 PolarHBondContact OG-O 2.82Å
225	P	92.7	Very high	95.4	Very high	101 Å²	101	68.3 Å²	68.3	66%	0.656	35%	0.349	S	S	*	.	S	Bend	trans	-62.9	-32.1	-175.7	-24	33.4	0	0	0	113.5	Y222	Y222-P225 WeakPolarHBondContact OH-CD 3.3Å
226	R	92.9	Very high	95.8	Very high	196 Å²	196	64.3 Å²	64.3	74%	0.74	33%	0.331	S	S	*	.	S	Bend	trans	-93.4	132.4	169.5	-68	-179.4	-167.8	165	5.5	108	S224 T229	S224-R226 PolarHBondContact O-N 3.17Å; S224-R226 PolarHBondContact OG-O 2.92Å; R226-T229 WeakPolarHBondContact CB-OG1 3.18Å; R226-T229 PolarHBondContact O-N 2.97Å; R226-T229 PolarHBondContact O-OG1 3.49Å
227	P	88.8	Confident	96	Very high	113 Å²	113	56.5 Å²	56.5	73%	0.734	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	143.9	175.1	-26.1	34.2	0	0	0	111.7	T229	P227-T229 PolarHBondContact O-N 2.87Å; P227-T229 VanDerWaalsContact O-N 3.14Å
228	D	86.8	Confident	96	Very high	104 Å²	104	54.1 Å²	54.1	56%	0.556	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	24.2	174.1	-62.8	-63.8	0	0	0	115.4	K185 P230	K185-D228 IonicContact NZ-OD1 3.76Å; K185-D228 PolarHBondContact NZ-OD1 2.79Å; D228-P230 VanDerWaalsContact O-CD 3.24Å; D228-P230 WeakPolarHBondContact O-CD 3.48Å
229	T	97.2	Very high	95.9	Very high	33 Å²	33	54.7 Å²	54.7	20%	0.202	29%	0.285	C	S	.	.			trans	-85.6	111.3	173.6	-57.8	0	0	0	0	109.3	G205 S224 R226 P227 L248	G205-T229 WeakPolarHBondContact CA-O 3.41Å; S224-T229 WeakPolarHBondContact CB-O 3.16Å; S224-T229 PolarHBondContact OG-N 3.41Å; S224-T229 PolarHBondContact OG-O 2.82Å; R226-T229 WeakPolarHBondContact CB-OG1 3.18Å; R226-T229 PolarHBondContact O-N 2.97Å; R226-T229 PolarHBondContact O-OG1 3.49Å; P227-T229 PolarHBondContact O-N 2.87Å; P227-T229 VanDerWaalsContact O-N 3.14Å; T229-L248 HydrophobicContact CG2-CD2 4.42Å
230	P	98.4	Very high	95.8	Very high	17 Å²	17	52 Å²	52	11%	0.11	27%	0.267	C	S	.	.			trans	-57.7	145.2	-176.1	-30	40.8	0	0	0	113.7	A203 D228 L232 M249	A203-P230 HydrophobicContact CB-CB 4.49Å; A203-P230 HydrophobicContact CB-CG 4.49Å; D228-P230 VanDerWaalsContact O-CD 3.24Å; D228-P230 WeakPolarHBondContact O-CD 3.48Å; P230-L232 HydrophobicContact CB-CD2 4.42Å; P230-M249 HydrophobicContact CB-CB 3.93Å; P230-M249 HydrophobicContact CB-CE 4.37Å; P230-M249 HydrophobicContact CB-SD 3.98Å; P230-M249 HydrophobicContact CG-CB 4.4Å; P230-M249 HydrophobicContact CG-CE 3.62Å; P230-M249 HydrophobicContact CG-SD 3.79Å; P230-M249 WeakPolarHBondContact O-CB 3.43Å; P230-M249 PolarHBondContact O-N 2.81Å
231	L	98.6	Very high	95.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.1	166.8	-70.5	165.7	0	0	0	109.5	H188 V201 S202 G205 S206 V207 Y222 A246 L247 L248	H188-L231 WeakPolarHBondContact CB-O 3.38Å; H188-L231 PolarHBondContact CD2-O 3.12Å; V201-L231 HydrophobicContact CB-CB 3.67Å; V201-L231 HydrophobicContact CB-CD1 4.41Å; V201-L231 HydrophobicContact CG1-CB 4.28Å; V201-L231 HydrophobicContact CG1-CD1 4.4Å; V201-L231 HydrophobicContact CG2-CB 4.27Å; S202-L231 PolarHBondContact O-N 3.22Å; G205-L231 WeakPolarHBondContact O-CD1 3.33Å; S206-L231 VanDerWaalsContact C-CD1 3.46Å; V207-L231 HydrophobicContact CG2-CD1 3.58Å; Y222-L231 HydrophobicContact CD1-CD1 4.13Å; Y222-L231 HydrophobicContact CE1-CD1 4.39Å; Y222-L231 HydrophobicContact CE1-CD2 4.17Å; L231-A246 HydrophobicContact CD2-CB 4.37Å; L231-L247 CarbonylContact C-O 3.6Å; L231-L247 WeakPolarHBondContact CA-O 3.43Å; L231-L248 HydrophobicContact CD2-CB 4.37Å; L231-L248 HydrophobicContact CD2-CD1 3.53Å; L231-L248 HydrophobicContact CD2-CG 3.5Å
232	L	98.2	Very high	95.7	Very high	46 Å²	46	55.5 Å²	55.5	24%	0.241	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-32.8	-165.8	-62.6	-177.2	0	0	0	114.8	P230 L247 M249	P230-L232 HydrophobicContact CB-CD2 4.42Å; L232-L247 PolarHBondContact N-O 3.39Å; L232-M249 HydrophobicContact CD1-CB 3.82Å; L232-M249 HydrophobicContact CD1-CG 4.05Å; L232-M249 HydrophobicContact CD2-CB 4.11Å; L232-M249 HydrophobicContact CD2-CG 4.41Å; L232-M249 HydrophobicContact CD2-SD 4.49Å; L232-M249 HydrophobicContact CG-CB 3.89Å; L232-M249 HydrophobicContact CG-CG 4.47Å
233	R	98.4	Very high	95.6	Very high	73 Å²	73	56.7 Å²	56.7	28%	0.275	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.5	-175.7	-65.6	-66.5	-179.4	-96.2	0.7	111.1	D189 A246 L247 N277 V279	D189-R233 WeakPolarHBondContact OD2-CA 3.37Å; R233-A246 VanDerWaalsContact O-CA 3.26Å; R233-A246 WeakPolarHBondContact O-CA 3.47Å; R233-L247 HydrophobicContact CB-CB 4.09Å; R233-L247 HydrophobicContact CB-CD1 3.92Å; R233-L247 HydrophobicContact CB-CG 4.03Å; R233-L247 HydrophobicContact CG-CD1 4.12Å; R233-L247 PolarHBondContact O-N 3Å; R233-N277 WeakPolarHBondContact CG-O 3.46Å; R233-V279 HydrophobicContact CB-CG1 4.49Å
234	L	98.3	Very high	95.6	Very high	8 Å²	8	50.6 Å²	50.6	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	126.9	177.9	-175.6	67.6	0	0	0	109.9	D189 A191 A199 V201 V207 M244 A245 A246	D189-L234 HydrophobicContact CB-CB 4.14Å; D189-L234 PolarHBondContact OD2-N 2.95Å; A191-L234 HydrophobicContact CB-CD2 3.76Å; A191-L234 HydrophobicContact CB-CG 3.97Å; A199-L234 HydrophobicContact CB-CD2 3.66Å; A199-L234 WeakPolarHBondContact O-CD2 3.47Å; V201-L234 HydrophobicContact CG1-CB 3.9Å; V201-L234 HydrophobicContact CG1-CD1 3.89Å; V201-L234 HydrophobicContact CG1-CD2 4.16Å; V201-L234 HydrophobicContact CG1-CG 4.2Å; V201-L234 HydrophobicContact CG2-CB 4.15Å; V207-L234 HydrophobicContact CG1-CD1 4.28Å; L234-M244 HydrophobicContact CD1-CB 4.31Å; L234-M244 HydrophobicContact CD1-SD 4.2Å; L234-A245 WeakPolarHBondContact CA-O 3.38Å; L234-A246 HydrophobicContact CD1-CB 4.33Å
235	A	98.3	Very high	95.7	Very high	14 Å²	14	50 Å²	50	12%	0.116	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	114.9	171.1	0	0	0	0	0	109.4	M244 A245 V279 W281	A235-M244 CarbonylContact O-C 3.6Å; A235-M244 WeakPolarHBondContact O-CA 3.47Å; A235-A245 PolarHBondContact N-O 2.86Å; A235-A245 PolarHBondContact O-N 2.95Å; A235-V279 HydrophobicContact CB-CG1 3.89Å; A235-W281 PolarHBondContact O-NE1 2.84Å
236	W	98.2	Very high	96	Very high	12 Å²	12	45.1 Å²	45.1	5%	0.045	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	134.2	172.4	-153.7	-54.1	0	0	0	109.7	A191 W192 V197 A199 V209 R238 L241 M244 I259	A191-W236 HydrophobicContact CB-CB 4Å; W192-W236 WeakPolarHBondContact O-CB 3.49Å; V197-W236 HydrophobicContact CG1-CH2 4.06Å; A199-W236 HydrophobicContact CB-CE3 3.82Å; A199-W236 HydrophobicContact CB-CH2 4.38Å; A199-W236 HydrophobicContact CB-CZ3 3.37Å; V209-W236 HydrophobicContact CG1-CH2 4.31Å; V209-W236 HydrophobicContact CG2-CH2 4.46Å; W236-R238 PolarHBondContact O-N 2.89Å; W236-R238 VanDerWaalsContact O-N 3.16Å; W236-L241 PolarHBondContact NE1-O 2.69Å; W236-M244 HydrophobicContact CD2-CE 3.92Å; W236-M244 HydrophobicContact CE3-CE 3.71Å; W236-M244 HydrophobicContact CH2-CE 3.71Å; W236-M244 HydrophobicContact CZ2-CE 3.91Å; W236-M244 HydrophobicContact CZ3-CE 3.62Å; W236-I259 HydrophobicContact CH2-CG2 4.48Å; W236-I259 HydrophobicContact CZ2-CD1 3.95Å; W236-I259 HydrophobicContact CZ2-CG2 4.16Å
237	N	97.2	Very high	96.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.			trans	-72.3	106.4	174.2	-175.3	-16.1	0	0	0	110.7	S239 D240 L241 Y243 W281 T286	N237-S239 VanDerWaalsContact C-N 3.26Å; N237-S239 PolarHBondContact O-N 3.38Å; N237-S239 PolarHBondContact OD1-N 2.9Å; N237-D240 WeakPolarHBondContact CB-O 3.48Å; N237-D240 CarbonylContact O-C 3.53Å; N237-D240 VanDerWaalsContact O-C 3.24Å; N237-D240 PolarHBondContact O-N 2.9Å; N237-D240 PolarHBondContact OD1-N 2.78Å; N237-D240 VanDerWaalsContact OD1-N 3.09Å; N237-L241 WeakPolarHBondContact O-CD2 3.26Å; N237-L241 PolarHBondContact O-N 2.7Å; N237-Y243 WeakPolarHBondContact CB-O 3.18Å; N237-Y243 PolarHBondContact N-O 2.84Å; N237-W281 HydrophobicContact CB-CD2 3.55Å; N237-W281 HydrophobicContact CB-CE3 3.87Å; N237-W281 HydrophobicContact CB-CG 3.88Å; N237-W281 HydrophobicContact CB-CH2 4.29Å; N237-W281 HydrophobicContact CB-CZ2 4.03Å; N237-W281 HydrophobicContact CB-CZ3 4.22Å; N237-W281 WeakPolarHBondContact ND2-CZ3 3.38Å; N237-T286 PolarHBondContact ND2-O 3.16Å
238	R	94.5	Very high	96.7	Very high	75 Å²	75	31.1 Å²	31.1	28%	0.283	15%	0.153	S	C	.	.	S	Bend	trans	-66.6	-25.6	-178.7	-59.6	-63.7	-161.5	-159.7	-5.8	113.6	D148 E151 W192 W236	D148-R238 VanDerWaalsContact CG-NH2 3.31Å; D148-R238 IonicContact OD1-NH2 2.68Å; D148-R238 PolarHBondContact OD1-NH2 3.32Å; D148-R238 IonicContact OD2-CZ 3.41Å; D148-R238 IonicContact OD2-NH1 3.47Å; D148-R238 PolarHBondContact OD2-NH1 3.1Å; D148-R238 IonicContact OD2-NH2 3.58Å; D148-R238 PolarHBondContact OD2-NH2 3.23Å; E151-R238 IonicContact OE1-CZ 3.84Å; E151-R238 IonicContact OE1-NE 3.68Å; E151-R238 PolarHBondContact OE1-NE 2.9Å; E151-R238 IonicContact OE1-NH2 3.04Å; E151-R238 IonicContact OE2-NE 3.29Å; W192-R238 PolarHBondContact O-NH1 2.79Å; W236-R238 PolarHBondContact O-N 2.89Å; W236-R238 VanDerWaalsContact O-N 3.16Å
239	S	93.6	Very high	97.2	Very high	55 Å²	55	29.5 Å²	29.5	39%	0.385	14%	0.143	S	C	.	.	S	Bend	trans	-90.3	-21	-177.7	-44.6	0	0	0	0	112.7	N237 P283 T286	N237-S239 VanDerWaalsContact C-N 3.26Å; N237-S239 PolarHBondContact O-N 3.38Å; N237-S239 PolarHBondContact OD1-N 2.9Å; S239-P283 PolarHBondContact OG-O 3.39Å; S239-T286 VanDerWaalsContact CB-CG2 3.48Å
240	D	95.1	Very high	97.2	Very high	26 Å²	26	34.3 Å²	34.3	14%	0.139	17%	0.167	C	C	.	.			trans	-145	91.7	173.8	-173.6	-7.2	0	0	0	110.3	N237 R242 Y243	N237-D240 WeakPolarHBondContact CB-O 3.48Å; N237-D240 CarbonylContact O-C 3.53Å; N237-D240 VanDerWaalsContact O-C 3.24Å; N237-D240 PolarHBondContact O-N 2.9Å; N237-D240 PolarHBondContact OD1-N 2.78Å; N237-D240 VanDerWaalsContact OD1-N 3.09Å; D240-R242 PolarHBondContact O-N 3.26Å; D240-R242 WeakPolarHBondContact OD1-CB 3.31Å; D240-R242 VanDerWaalsContact OD1-CG 3.25Å; D240-R242 WeakPolarHBondContact OD1-CG 3.36Å; D240-R242 IonicContact OD1-CZ 3.77Å; D240-R242 PolarHBondContact OD1-N 3.14Å; D240-R242 IonicContact OD1-NE 3.39Å; D240-R242 PolarHBondContact OD1-NE 2.86Å; D240-R242 IonicContact OD1-NH2 3.25Å; D240-R242 IonicContact OD2-CZ 3.3Å; D240-R242 VanDerWaalsContact OD2-CZ 3.29Å; D240-R242 IonicContact OD2-NE 2.76Å; D240-R242 PolarHBondContact OD2-NE 3.12Å; D240-R242 VanDerWaalsContact OD2-NE 3.14Å; D240-R242 IonicContact OD2-NH2 2.89Å; D240-R242 PolarHBondContact OD2-NH2 2.85Å; D240-Y243 HydrophobicContact CB-CD2 4.33Å; D240-Y243 PolarHBondContact O-N 3.46Å; D240-Y243 WeakPolarHBondContact OD2-CD2 3.47Å; D240-Y243 WeakPolarHBondContact OD2-CE2 3.36Å
241	L	95.8	Very high	97.1	Very high	51 Å²	51	35 Å²	35	27%	0.267	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-4	-172.7	-60.9	179.9	0	0	0	114.5	G193 E194 W236 N237 Y243 I259	G193-L241 WeakPolarHBondContact O-CD1 3.49Å; G193-L241 VanDerWaalsContact O-CD2 3.22Å; G193-L241 WeakPolarHBondContact O-CD2 3.25Å; E194-L241 HydrophobicContact CG-CD1 3.64Å; W236-L241 PolarHBondContact NE1-O 2.69Å; N237-L241 WeakPolarHBondContact O-CD2 3.26Å; N237-L241 PolarHBondContact O-N 2.7Å; L241-Y243 PolarHBondContact O-N 3.09Å; L241-I259 WeakPolarHBondContact O-CD1 3.28Å
242	R	94.9	Very high	97	Very high	95 Å²	95	36.9 Å²	36.9	36%	0.358	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-29.4	172	-60.9	179.1	-69.4	174.3	5.4	112	D240 D258 I259	D240-R242 PolarHBondContact O-N 3.26Å; D240-R242 WeakPolarHBondContact OD1-CB 3.31Å; D240-R242 VanDerWaalsContact OD1-CG 3.25Å; D240-R242 WeakPolarHBondContact OD1-CG 3.36Å; D240-R242 IonicContact OD1-CZ 3.77Å; D240-R242 PolarHBondContact OD1-N 3.14Å; D240-R242 IonicContact OD1-NE 3.39Å; D240-R242 PolarHBondContact OD1-NE 2.86Å; D240-R242 IonicContact OD1-NH2 3.25Å; D240-R242 IonicContact OD2-CZ 3.3Å; D240-R242 VanDerWaalsContact OD2-CZ 3.29Å; D240-R242 IonicContact OD2-NE 2.76Å; D240-R242 PolarHBondContact OD2-NE 3.12Å; D240-R242 VanDerWaalsContact OD2-NE 3.14Å; D240-R242 IonicContact OD2-NH2 2.89Å; D240-R242 PolarHBondContact OD2-NH2 2.85Å; R242-D258 CarbonylContact O-C 3.56Å; R242-D258 WeakPolarHBondContact O-CA 3.43Å; R242-I259 PolarHBondContact O-N 2.91Å
243	Y	96.7	Very high	97	Very high	30 Å²	30	35 Å²	35	12%	0.118	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	143.8	-168.9	-58.6	-72.4	0	0	0	113.5	N237 D240 L241 L257 D258 V266	N237-Y243 WeakPolarHBondContact CB-O 3.18Å; N237-Y243 PolarHBondContact N-O 2.84Å; D240-Y243 HydrophobicContact CB-CD2 4.33Å; D240-Y243 PolarHBondContact O-N 3.46Å; D240-Y243 WeakPolarHBondContact OD2-CD2 3.47Å; D240-Y243 WeakPolarHBondContact OD2-CE2 3.36Å; L241-Y243 PolarHBondContact O-N 3.09Å; Y243-L257 VanDerWaalsContact CA-O 3.26Å; Y243-L257 WeakPolarHBondContact CA-O 3.47Å; Y243-D258 HydrophobicContact CD1-CB 4.22Å; Y243-D258 HydrophobicContact CE1-CB 4.01Å; Y243-V266 HydrophobicContact CD1-CG2 4.3Å; Y243-V266 HydrophobicContact CE1-CG1 4.28Å; Y243-V266 HydrophobicContact CE1-CG2 3.96Å
244	M	97.6	Very high	97	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	151.6	171	56.5	-177.1	54.7	0	0	109.7	A199 V207 V209 V221 L234 A235 W236 V256 L257 I259	A199-M244 HydrophobicContact CB-CE 3.92Å; V207-M244 HydrophobicContact CG1-SD 3.78Å; V209-M244 HydrophobicContact CG2-CE 4.26Å; V221-M244 HydrophobicContact CG2-SD 4.07Å; L234-M244 HydrophobicContact CD1-CB 4.31Å; L234-M244 HydrophobicContact CD1-SD 4.2Å; A235-M244 CarbonylContact O-C 3.6Å; A235-M244 WeakPolarHBondContact O-CA 3.47Å; W236-M244 HydrophobicContact CD2-CE 3.92Å; W236-M244 HydrophobicContact CE3-CE 3.71Å; W236-M244 HydrophobicContact CH2-CE 3.71Å; W236-M244 HydrophobicContact CZ2-CE 3.91Å; W236-M244 HydrophobicContact CZ3-CE 3.62Å; M244-V256 CarbonylContact O-C 3.53Å; M244-V256 WeakPolarHBondContact O-CA 3.22Å; M244-L257 HydrophobicContact CG-CB 3.73Å; M244-L257 HydrophobicContact CG-CD1 3.99Å; M244-L257 HydrophobicContact CG-CG 4.22Å; M244-L257 PolarHBondContact N-O 2.95Å; M244-L257 VanDerWaalsContact N-O 3.11Å; M244-L257 PolarHBondContact O-N 2.8Å; M244-L257 HydrophobicContact SD-CB 4.46Å; M244-L257 HydrophobicContact SD-CD1 4.01Å; M244-I259 HydrophobicContact CE-CG2 3.18Å; M244-I259 HydrophobicContact CG-CG2 4.42Å; M244-I259 HydrophobicContact SD-CG2 4.06Å
245	A	98.4	Very high	96.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.5	173.1	0	0	0	0	0	109.2	L234 A235 V254 V255 V279 W281	L234-A245 WeakPolarHBondContact CA-O 3.38Å; A235-A245 PolarHBondContact N-O 2.86Å; A235-A245 PolarHBondContact O-N 2.95Å; A245-V254 HydrophobicContact CB-CG1 4.29Å; A245-V255 CarbonylContact C-O 3.58Å; A245-V255 VanDerWaalsContact CA-O 3.23Å; A245-V255 WeakPolarHBondContact CA-O 3.39Å; A245-V279 HydrophobicContact CB-CG1 4.47Å; A245-V279 HydrophobicContact CB-CG2 3.79Å; A245-W281 HydrophobicContact CB-CZ2 4.02Å
246	A	98.5	Very high	96.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	153.7	175.1	0	0	0	0	0	111.2	V207 L231 R233 L234 V255	V207-A246 HydrophobicContact CG2-CB 4.35Å; L231-A246 HydrophobicContact CD2-CB 4.37Å; R233-A246 VanDerWaalsContact O-CA 3.26Å; R233-A246 WeakPolarHBondContact O-CA 3.47Å; L234-A246 HydrophobicContact CD1-CB 4.33Å; A246-V255 HydrophobicContact CB-CG2 3.77Å; A246-V255 PolarHBondContact N-O 2.98Å; A246-V255 WeakPolarHBondContact O-CG2 3.41Å; A246-V255 PolarHBondContact O-N 3.01Å
247	L	98.5	Very high	96.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.4	176.8	-54.8	-177.6	0	0	0	110.1	L231 L232 R233 V254 A276 V279	L231-L247 CarbonylContact C-O 3.6Å; L231-L247 WeakPolarHBondContact CA-O 3.43Å; L232-L247 PolarHBondContact N-O 3.39Å; R233-L247 HydrophobicContact CB-CB 4.09Å; R233-L247 HydrophobicContact CB-CD1 3.92Å; R233-L247 HydrophobicContact CB-CG 4.03Å; R233-L247 HydrophobicContact CG-CD1 4.12Å; R233-L247 PolarHBondContact O-N 3Å; L247-V254 HydrophobicContact CD2-CB 4.03Å; L247-V254 HydrophobicContact CD2-CG1 3.85Å; L247-V254 HydrophobicContact CD2-CG2 3.74Å; L247-A276 HydrophobicContact CD1-CB 4.28Å; L247-A276 HydrophobicContact CD2-CB 3.93Å; L247-V279 HydrophobicContact CD1-CB 4.15Å; L247-V279 HydrophobicContact CD1-CG1 3.97Å; L247-V279 HydrophobicContact CD2-CB 4.24Å; L247-V279 HydrophobicContact CD2-CG1 4.22Å; L247-V279 HydrophobicContact CG-CB 4.28Å; L247-V279 HydrophobicContact CG-CG1 3.85Å
248	L	98.1	Very high	96.8	Very high	14 Å²	14	30.9 Å²	30.9	7%	0.073	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	148.8	178.1	-71.9	72	0	0	0	109.6	T229 L231 V255	T229-L248 HydrophobicContact CG2-CD2 4.42Å; L231-L248 HydrophobicContact CD2-CB 4.37Å; L231-L248 HydrophobicContact CD2-CD1 3.53Å; L231-L248 HydrophobicContact CD2-CG 3.5Å; L248-V255 HydrophobicContact CD1-CG1 3.74Å; L248-V255 HydrophobicContact CD1-CG2 3.97Å
249	M	97.5	Very high	96.7	Very high	71 Å²	71	29.7 Å²	29.7	35%	0.35	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	140.6	171.4	-170.7	172	87.2	0	0	111	P230 L232 S251	P230-M249 HydrophobicContact CB-CB 3.93Å; P230-M249 HydrophobicContact CB-CE 4.37Å; P230-M249 HydrophobicContact CB-SD 3.98Å; P230-M249 HydrophobicContact CG-CB 4.4Å; P230-M249 HydrophobicContact CG-CE 3.62Å; P230-M249 HydrophobicContact CG-SD 3.79Å; P230-M249 WeakPolarHBondContact O-CB 3.43Å; P230-M249 PolarHBondContact O-N 2.81Å; L232-M249 HydrophobicContact CD1-CB 3.82Å; L232-M249 HydrophobicContact CD1-CG 4.05Å; L232-M249 HydrophobicContact CD2-CB 4.11Å; L232-M249 HydrophobicContact CD2-CG 4.41Å; L232-M249 HydrophobicContact CD2-SD 4.49Å; L232-M249 HydrophobicContact CG-CB 3.89Å; L232-M249 HydrophobicContact CG-CG 4.47Å; M249-S251 PolarHBondContact O-N 3.04Å
250	D	95.9	Very high	96.7	Very high	133 Å²	133	34.3 Å²	34.3	71%	0.711	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	32.8	-179.9	-54.5	-35.4	0	0	0	113.8
251	S	97	Very high	96.6	Very high	31 Å²	31	35.6 Å²	35.6	22%	0.217	18%	0.181	C	C	.	.			trans	-129.1	139	-176.3	-167.2	0	0	0	0	112.2	M249 A253 C275 A276	M249-S251 PolarHBondContact O-N 3.04Å; S251-A253 VanDerWaalsContact C-N 3.28Å; S251-A253 PolarHBondContact OG-N 2.77Å; S251-C275 WeakPolarHBondContact O-CA 3.14Å; S251-A276 PolarHBondContact O-N 3.14Å
252	S	97.2	Very high	96.5	Very high	40 Å²	40	36.4 Å²	36.4	28%	0.28	19%	0.19	S	C	.	.			trans	-84.1	-4.1	170.7	62.7	0	0	0	0	113.3	H272 A274	S252-H272 WeakPolarHBondContact CB-O 3.13Å; S252-A274 VanDerWaalsContact CA-O 3.24Å; S252-A274 WeakPolarHBondContact CA-O 3.39Å; S252-A274 WeakPolarHBondContact CB-O 3.31Å
253	A	96.8	Very high	96.3	Very high	6 Å²	6	34.4 Å²	34.4	5%	0.05	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-84.1	136.6	-175.4	0	0	0	0	0	111.8	S251 H270	S251-A253 VanDerWaalsContact C-N 3.28Å; S251-A253 PolarHBondContact OG-N 2.77Å; A253-H270 VanDerWaalsContact CB-CE1 3.42Å; A253-H270 WeakPolarHBondContact CB-CE1 3.3Å
254	V	98.2	Very high	96	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	117.7	163.2	-173.6	0	0	0	0	107.8	A245 L247 L269 A276 V279 L289	A245-V254 HydrophobicContact CB-CG1 4.29Å; L247-V254 HydrophobicContact CD2-CB 4.03Å; L247-V254 HydrophobicContact CD2-CG1 3.85Å; L247-V254 HydrophobicContact CD2-CG2 3.74Å; V254-L269 HydrophobicContact CB-CB 4.07Å; V254-L269 HydrophobicContact CB-CD1 4.11Å; V254-L269 HydrophobicContact CB-CG 4.36Å; V254-L269 HydrophobicContact CG1-CD1 4.23Å; V254-L269 PolarHBondContact N-O 3.14Å; V254-L269 VanDerWaalsContact N-O 3.16Å; V254-L269 PolarHBondContact O-N 2.84Å; V254-A276 HydrophobicContact CG2-CB 4.37Å; V254-V279 HydrophobicContact CG1-CG2 4.11Å; V254-L289 HydrophobicContact CG1-CD1 4.19Å
255	V	97.5	Very high	95.9	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132.3	179.5	-56.3	0	0	0	0	109.9	Y222 A245 A246 L248 L257 E268	Y222-V255 HydrophobicContact CE1-CG2 4.26Å; A245-V255 CarbonylContact C-O 3.58Å; A245-V255 VanDerWaalsContact CA-O 3.23Å; A245-V255 WeakPolarHBondContact CA-O 3.39Å; A246-V255 HydrophobicContact CB-CG2 3.77Å; A246-V255 PolarHBondContact N-O 2.98Å; A246-V255 WeakPolarHBondContact O-CG2 3.41Å; A246-V255 PolarHBondContact O-N 3.01Å; L248-V255 HydrophobicContact CD1-CG1 3.74Å; L248-V255 HydrophobicContact CD1-CG2 3.97Å; V255-L257 HydrophobicContact CG2-CD2 4.31Å; V255-E268 HydrophobicContact CG1-CG 4.28Å
256	V	97.8	Very high	95.7	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.1	176.5	-176.9	0	0	0	0	108.8	M244 P265 V266 A267 L269 W281 L289 L303	M244-V256 CarbonylContact O-C 3.53Å; M244-V256 WeakPolarHBondContact O-CA 3.22Å; V256-P265 CarbonylContact O-C 3.4Å; V256-P265 WeakPolarHBondContact O-CA 3.42Å; V256-V266 PolarHBondContact O-N 3.08Å; V256-A267 HydrophobicContact CB-CB 4.31Å; V256-A267 PolarHBondContact N-O 3.02Å; V256-A267 PolarHBondContact O-N 3.15Å; V256-L269 HydrophobicContact CG2-CD1 4.2Å; V256-L269 HydrophobicContact CG2-CG 4.47Å; V256-W281 HydrophobicContact CG1-CH2 4.08Å; V256-W281 HydrophobicContact CG1-CZ2 4.34Å; V256-L289 HydrophobicContact CG2-CD2 4.18Å; V256-L303 HydrophobicContact CG1-CD1 3.82Å; V256-L303 HydrophobicContact CG2-CD1 4.3Å; V256-L303 HydrophobicContact CG2-CD2 4.18Å
257	L	97.2	Very high	95.6	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.016	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	144.5	-172.6	-46.6	175	0	0	0	110.2	V207 Y222 Y243 M244 V255 P265	V207-L257 HydrophobicContact CB-CD1 4.29Å; V207-L257 HydrophobicContact CG1-CD1 4.39Å; V207-L257 HydrophobicContact CG2-CD1 3.81Å; Y222-L257 HydrophobicContact CD2-CD2 3.61Å; Y222-L257 HydrophobicContact CE2-CD2 4.26Å; Y222-L257 HydrophobicContact CG-CD1 4.06Å; Y222-L257 HydrophobicContact CG-CD2 3.78Å; Y243-L257 VanDerWaalsContact CA-O 3.26Å; Y243-L257 WeakPolarHBondContact CA-O 3.47Å; M244-L257 HydrophobicContact CG-CB 3.73Å; M244-L257 HydrophobicContact CG-CD1 3.99Å; M244-L257 HydrophobicContact CG-CG 4.22Å; M244-L257 PolarHBondContact N-O 2.95Å; M244-L257 VanDerWaalsContact N-O 3.11Å; M244-L257 PolarHBondContact O-N 2.8Å; M244-L257 HydrophobicContact SD-CB 4.46Å; M244-L257 HydrophobicContact SD-CD1 4.01Å; V255-L257 HydrophobicContact CG2-CD2 4.31Å; L257-P265 HydrophobicContact CD2-CB 4.13Å; L257-P265 HydrophobicContact CD2-CG 4.11Å
258	D	95.2	Very high	95.4	Very high	17 Å²	17	45 Å²	45	9%	0.091	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118	162.7	-177.3	-19.2	0	0	0	107.7	R242 Y243 R260 A261 V266	R242-D258 CarbonylContact O-C 3.56Å; R242-D258 WeakPolarHBondContact O-CA 3.43Å; Y243-D258 HydrophobicContact CD1-CB 4.22Å; Y243-D258 HydrophobicContact CE1-CB 4.01Å; D258-R260 PolarHBondContact O-N 2.81Å; D258-R260 VanDerWaalsContact OD1-CB 3.24Å; D258-R260 WeakPolarHBondContact OD1-CB 3.24Å; D258-R260 WeakPolarHBondContact OD1-CG 3.41Å; D258-R260 IonicContact OD1-CZ 3.42Å; D258-R260 PolarHBondContact OD1-N 3.24Å; D258-R260 IonicContact OD1-NE 3.61Å; D258-R260 PolarHBondContact OD1-NE 2.79Å; D258-R260 IonicContact OD1-NH2 3.53Å; D258-R260 IonicContact OD2-CZ 3.54Å; D258-R260 IonicContact OD2-NE 3.36Å; D258-R260 PolarHBondContact OD2-NE 2.84Å; D258-R260 IonicContact OD2-NH2 2.8Å; D258-R260 PolarHBondContact OD2-NH2 2.79Å; D258-A261 HydrophobicContact CB-CB 4.43Å; D258-A261 CarbonylContact O-C 3.6Å; D258-A261 PolarHBondContact O-N 2.89Å; D258-V266 HydrophobicContact CB-CG2 3.51Å
259	I	94.3	Very high	95.4	Very high	50 Å²	50	44.3 Å²	44.3	26%	0.256	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.6	-178.3	65.8	176.1	0	0	0	113.3	W236 L241 R242 M244	W236-I259 HydrophobicContact CH2-CG2 4.48Å; W236-I259 HydrophobicContact CZ2-CD1 3.95Å; W236-I259 HydrophobicContact CZ2-CG2 4.16Å; L241-I259 WeakPolarHBondContact O-CD1 3.28Å; R242-I259 PolarHBondContact O-N 2.91Å; M244-I259 HydrophobicContact CE-CG2 3.18Å; M244-I259 HydrophobicContact CG-CG2 4.42Å; M244-I259 HydrophobicContact SD-CG2 4.06Å
260	R	92.9	Very high	95.3	Very high	152 Å²	152	45.1 Å²	45.1	57%	0.574	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-10.6	179.9	-51.2	171.2	-60.6	155.4	12.6	112.3	D258 P262	D258-R260 PolarHBondContact O-N 2.81Å; D258-R260 VanDerWaalsContact OD1-CB 3.24Å; D258-R260 WeakPolarHBondContact OD1-CB 3.24Å; D258-R260 WeakPolarHBondContact OD1-CG 3.41Å; D258-R260 IonicContact OD1-CZ 3.42Å; D258-R260 PolarHBondContact OD1-N 3.24Å; D258-R260 IonicContact OD1-NE 3.61Å; D258-R260 PolarHBondContact OD1-NE 2.79Å; D258-R260 IonicContact OD1-NH2 3.53Å; D258-R260 IonicContact OD2-CZ 3.54Å; D258-R260 IonicContact OD2-NE 3.36Å; D258-R260 PolarHBondContact OD2-NE 2.84Å; D258-R260 IonicContact OD2-NH2 2.8Å; D258-R260 PolarHBondContact OD2-NH2 2.79Å; R260-P262 VanDerWaalsContact C-CD 3.47Å
261	A	92.7	Very high	95.4	Very high	53 Å²	53	42.4 Å²	42.4	44%	0.438	24%	0.241	S	C	.	.	S	Bend	trans	-127.4	70.3	176.3	0	0	0	0	0	111.2	D258	D258-A261 HydrophobicContact CB-CB 4.43Å; D258-A261 CarbonylContact O-C 3.6Å; D258-A261 PolarHBondContact O-N 2.89Å
262	P	94	Very high	95.5	Very high	68 Å²	68	41.4 Å²	41.4	44%	0.442	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	148.9	178.9	-29.5	37.8	0	0	0	114.6	V221 R260 V264	V221-P262 HydrophobicContact CG1-CG 4.47Å; V221-P262 WeakPolarHBondContact O-CA 3.25Å; R260-P262 VanDerWaalsContact C-CD 3.47Å; P262-V264 PolarHBondContact O-N 3.16Å
263	G	90.7	Very high	95.5	Very high	53 Å²	53	49.7 Å²	49.7	55%	0.546	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-17.8	168	0	0	0	0	0	115.6	V221	V221-G263 PolarHBondContact O-N 3.04Å
264	V	91.1	Very high	95.5	Very high	109 Å²	109	51.1 Å²	51.1	66%	0.661	27%	0.269	S	S	*	.	S	Bend	trans	-129.5	122.6	177.6	-175.3	0	0	0	0	110.2	P262	P262-V264 PolarHBondContact O-N 3.16Å
265	P	94.8	Very high	95.5	Very high	27 Å²	27	52.6 Å²	52.6	18%	0.175	28%	0.28	C	S	.	.			trans	-58.6	141.5	171.2	-24.1	34.7	0	0	0	111.9	Y222 V256 L257 A267 E268	Y222-P265 HydrophobicContact CD2-CG 3.97Å; Y222-P265 HydrophobicContact CE2-CG 3.49Å; Y222-P265 VanDerWaalsContact CE2-CG 3.49Å; V256-P265 CarbonylContact O-C 3.4Å; V256-P265 WeakPolarHBondContact O-CA 3.42Å; L257-P265 HydrophobicContact CD2-CB 4.13Å; L257-P265 HydrophobicContact CD2-CG 4.11Å; P265-A267 VanDerWaalsContact C-N 3.32Å; P265-E268 HydrophobicContact CB-CG 4.07Å; P265-E268 HydrophobicContact CG-CG 4.3Å
266	V	94	Very high	95.6	Very high	31 Å²	31	52.7 Å²	52.7	19%	0.188	28%	0.28	C	S	.	.	S	Bend	trans	-66.6	-40.1	169.8	171.9	0	0	0	0	110.3	Y243 V256 D258 A307	Y243-V266 HydrophobicContact CD1-CG2 4.3Å; Y243-V266 HydrophobicContact CE1-CG1 4.28Å; Y243-V266 HydrophobicContact CE1-CG2 3.96Å; V256-V266 PolarHBondContact O-N 3.08Å; D258-V266 HydrophobicContact CB-CG2 3.51Å; V266-A307 HydrophobicContact CG1-CB 3.85Å
267	A	95.4	Very high	95.6	Very high	6 Å²	6	54.2 Å²	54.2	5%	0.05	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	151.7	177.2	0	0	0	0	0	110.2	V256 P265 L269 V310 I315	V256-A267 HydrophobicContact CB-CB 4.31Å; V256-A267 PolarHBondContact N-O 3.02Å; V256-A267 PolarHBondContact O-N 3.15Å; P265-A267 VanDerWaalsContact C-N 3.32Å; A267-L269 HydrophobicContact CB-CD2 4.36Å; A267-V310 HydrophobicContact CB-CG2 4.36Å; A267-I315 HydrophobicContact CB-CD1 3.86Å
268	E	95.5	Very high	95.6	Very high	79 Å²	79	54.2 Å²	54.2	37%	0.369	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	121.7	165.9	-59.1	-174.8	175.4	0	0	108.4	V255 P265 H270	V255-E268 HydrophobicContact CG1-CG 4.28Å; P265-E268 HydrophobicContact CB-CG 4.07Å; P265-E268 HydrophobicContact CG-CG 4.3Å; E268-H270 WeakPolarHBondContact CB-NE2 3.34Å; E268-H270 PolarHBondContact O-CD2 2.96Å; E268-H270 IonicContact OE2-CE1 2.88Å; E268-H270 IonicContact OE2-NE2 2.68Å; E268-H270 PolarHBondContact OE2-NE2 3.5Å
269	L	97.8	Very high	95.8	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	110	-173.7	-47	173.7	0	0	0	109	V254 V256 A267 L289 W301 L303 I315	V254-L269 HydrophobicContact CB-CB 4.07Å; V254-L269 HydrophobicContact CB-CD1 4.11Å; V254-L269 HydrophobicContact CB-CG 4.36Å; V254-L269 HydrophobicContact CG1-CD1 4.23Å; V254-L269 PolarHBondContact N-O 3.14Å; V254-L269 VanDerWaalsContact N-O 3.16Å; V254-L269 PolarHBondContact O-N 2.84Å; V256-L269 HydrophobicContact CG2-CD1 4.2Å; V256-L269 HydrophobicContact CG2-CG 4.47Å; A267-L269 HydrophobicContact CB-CD2 4.36Å; L269-L289 HydrophobicContact CD1-CD1 4Å; L269-L289 HydrophobicContact CD1-CD2 4.23Å; L269-L289 HydrophobicContact CD1-CG 4.48Å; L269-W301 HydrophobicContact CB-CD2 4.16Å; L269-W301 HydrophobicContact CB-CE3 4.07Å; L269-W301 HydrophobicContact CB-CH2 3.67Å; L269-W301 HydrophobicContact CB-CZ2 3.85Å; L269-W301 HydrophobicContact CB-CZ3 3.83Å; L269-W301 HydrophobicContact CD1-CB 4.1Å; L269-W301 HydrophobicContact CD1-CD2 3.73Å; L269-W301 HydrophobicContact CD1-CE3 4.22Å; L269-W301 HydrophobicContact CD1-CG 3.67Å; L269-W301 HydrophobicContact CD2-CD2 4.47Å; L269-W301 HydrophobicContact CD2-CE3 4.14Å; L269-W301 HydrophobicContact CD2-CZ3 4.47Å; L269-W301 HydrophobicContact CG-CD2 4.34Å; L269-W301 HydrophobicContact CG-CE3 4.37Å; L269-L303 HydrophobicContact CD1-CD2 4.46Å; L269-L303 HydrophobicContact CD2-CD2 4.15Å; L269-I315 HydrophobicContact CD2-CB 3.87Å; L269-I315 HydrophobicContact CD2-CD1 3.69Å; L269-I315 HydrophobicContact CD2-CG1 4.34Å; L269-I315 HydrophobicContact CD2-CG2 4.22Å
270	H	95.8	Very high	95.9	Very high	88 Å²	88	52.1 Å²	52.1	41%	0.407	28%	0.28	S	S	.	.			trans	-118.2	63.9	-169	-69.3	-72.7	0	0	0	111.6	A253 E268	A253-H270 VanDerWaalsContact CB-CE1 3.42Å; A253-H270 WeakPolarHBondContact CB-CE1 3.3Å; E268-H270 WeakPolarHBondContact CB-NE2 3.34Å; E268-H270 PolarHBondContact O-CD2 2.96Å; E268-H270 IonicContact OE2-CE1 2.88Å; E268-H270 IonicContact OE2-NE2 2.68Å; E268-H270 PolarHBondContact OE2-NE2 3.5Å
271	R	97.6	Very high	96.2	Very high	76 Å²	76	45.9 Å²	45.9	29%	0.287	26%	0.257	S	S	.	.			trans	-125.4	-13.5	175.5	-57.7	-70.6	-173.2	-85.9	-2.8	115	L299 W301 E313 D316	R271-L299 HydrophobicContact CB-CD1 4.03Å; R271-W301 HydrophobicContact CB-CH2 3.46Å; R271-W301 VanDerWaalsContact CB-CH2 3.46Å; R271-W301 HydrophobicContact CB-CZ2 4.41Å; R271-W301 HydrophobicContact CB-CZ3 4.01Å; R271-W301 HydrophobicContact CG-CH2 3.67Å; R271-W301 HydrophobicContact CG-CZ3 3.72Å; R271-E313 PolarHBondContact NH2-O 3Å; R271-E313 VanDerWaalsContact NH2-O 3.08Å; R271-D316 IonicContact CZ-OD1 3.56Å; R271-D316 IonicContact NE-OD1 3.15Å; R271-D316 PolarHBondContact NE-OD1 2.95Å; R271-D316 IonicContact NH2-OD1 2.8Å; R271-D316 PolarHBondContact NH2-OD1 2.71Å; R271-D316 IonicContact NH2-OD2 3.98Å
272	H	98.1	Very high	96.4	Very high	9 Å²	9	43.4 Å²	43.4	4%	0.042	24%	0.236	C	C	.	.			trans	-63.2	142.7	166.3	-77.9	-68.5	0	0	0	110.5	S252 S291 D295 Q297	S252-H272 WeakPolarHBondContact CB-O 3.13Å; H272-S291 PolarHBondContact CD2-OG 2.68Å; H272-S291 WeakPolarHBondContact NE2-CB 3.43Å; H272-S291 PolarHBondContact NE2-OG 3.37Å; H272-D295 WeakPolarHBondContact CA-OD2 3.46Å; H272-D295 WeakPolarHBondContact CB-OD2 3.22Å; H272-D295 IonicContact CE1-OD1 3Å; H272-D295 IonicContact CG-OD2 3.13Å; H272-D295 IonicContact ND1-OD1 3.93Å; H272-D295 PolarHBondContact ND1-OD1 3.14Å; H272-D295 IonicContact ND1-OD2 2.66Å; H272-D295 PolarHBondContact ND1-OD2 3.41Å; H272-Q297 PolarHBondContact CE1-O 2.82Å
273	R	97.5	Very high	96.3	Very high	214 Å²	214	42.4 Å²	42.4	81%	0.808	23%	0.23	S	C	*	.	S	Bend	trans	-97.2	-7.9	-179.9	-60.9	-179.6	-178.3	177.3	2	113	D295	R273-D295 HydrophobicContact CB-CB 4.07Å; R273-D295 PolarHBondContact N-OD2 3.33Å
274	A	98.1	Very high	96.3	Very high	36 Å²	36	44.5 Å²	44.5	30%	0.298	23%	0.225	S	C	.	.	S	Bend	trans	-144.7	-171	174.5	0	0	0	0	0	109.3	S252 D294 D295	S252-A274 VanDerWaalsContact CA-O 3.24Å; S252-A274 WeakPolarHBondContact CA-O 3.39Å; S252-A274 WeakPolarHBondContact CB-O 3.31Å; A274-D294 HydrophobicContact CB-CB 3.67Å; A274-D295 HydrophobicContact CB-CB 4.03Å
275	C	98	Very high	96.3	Very high	32 Å²	32	40.4 Å²	40.4	22%	0.216	20%	0.202	C	C	.	.			trans	-60.3	139	-174.5	-56.9	0	0	0	0	112.1	S251 G293 D294	S251-C275 WeakPolarHBondContact O-CA 3.14Å; C275-G293 CarbonylContact O-C 3.48Å; C275-G293 WeakPolarHBondContact O-CA 3.36Å; C275-D294 WeakPolarHBondContact CB-OD2 3.42Å; C275-D294 PolarHBondContact O-N 3.23Å
276	A	98.2	Very high	96.2	Very high	3 Å²	3	42.3 Å²	42.3	3%	0.025	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.2	171.6	0	0	0	0	0	109.8	L247 S251 V254	L247-A276 HydrophobicContact CD1-CB 4.28Å; L247-A276 HydrophobicContact CD2-CB 3.93Å; S251-A276 PolarHBondContact O-N 3.14Å; V254-A276 HydrophobicContact CG2-CB 4.37Å
277	N	97.9	Very high	96.3	Very high	33 Å²	33	45.1 Å²	45.1	18%	0.176	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-29.1	-170	-62.3	-30.3	0	0	0	113.7	R233 A292 D294 I327	R233-N277 WeakPolarHBondContact CG-O 3.46Å; N277-A292 PolarHBondContact N-O 2.78Å; N277-D294 PolarHBondContact ND2-N 2.88Å; N277-D294 PolarHBondContact ND2-OD1 3.15Å; N277-I327 WeakPolarHBondContact CB-O 3.38Å; N277-I327 PolarHBondContact ND2-O 3.24Å
278	A	98	Very high	96.4	Very high	2 Å²	2	47.1 Å²	47.1	2%	0.017	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148	-176	0	0	0	0	0	111.4	S291 A292 L330	A278-S291 CarbonylContact O-C 3.54Å; A278-S291 VanDerWaalsContact O-CA 3.27Å; A278-S291 WeakPolarHBondContact O-CA 3.49Å; A278-A292 PolarHBondContact N-O 2.83Å; A278-A292 VanDerWaalsContact N-O 3.11Å; A278-A292 PolarHBondContact O-N 2.88Å; A278-L330 HydrophobicContact CB-CB 4.23Å; A278-L330 HydrophobicContact CB-CD2 3.74Å; A278-L330 HydrophobicContact CB-CG 3.78Å; A278-L330 WeakPolarHBondContact O-CD2 3.24Å
279	V	98.4	Very high	96.5	Very high	14 Å²	14	43.3 Å²	43.3	9%	0.085	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	138.3	177.8	61.3	0	0	0	0	109.8	R233 A235 A245 L247 V254 L289 C290	R233-V279 HydrophobicContact CB-CG1 4.49Å; A235-V279 HydrophobicContact CB-CG1 3.89Å; A245-V279 HydrophobicContact CB-CG1 4.47Å; A245-V279 HydrophobicContact CB-CG2 3.79Å; L247-V279 HydrophobicContact CD1-CB 4.15Å; L247-V279 HydrophobicContact CD1-CG1 3.97Å; L247-V279 HydrophobicContact CD2-CB 4.24Å; L247-V279 HydrophobicContact CD2-CG1 4.22Å; L247-V279 HydrophobicContact CG-CB 4.28Å; L247-V279 HydrophobicContact CG-CG1 3.85Å; V254-V279 HydrophobicContact CG1-CG2 4.11Å; V279-L289 HydrophobicContact CG2-CD1 3.79Å; V279-C290 CarbonylContact C-O 3.46Å; V279-C290 VanDerWaalsContact CA-O 3.28Å; V279-C290 WeakPolarHBondContact CA-O 3.45Å
280	A	98	Very high	96.5	Very high	10 Å²	10	43.3 Å²	43.3	8%	0.083	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	145.1	173.5	0	0	0	0	0	111	L289 C290 L330	A280-L289 CarbonylContact O-C 3.56Å; A280-L289 WeakPolarHBondContact O-CA 3.45Å; A280-C290 PolarHBondContact N-O 2.91Å; A280-C290 PolarHBondContact O-N 3.47Å; A280-L330 HydrophobicContact CB-CD1 3.35Å
281	W	97.9	Very high	96.6	Very high	21 Å²	21	39.1 Å²	39.1	8%	0.08	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	144.7	174.5	-67.6	90.2	0	0	0	111	A235 N237 A245 V256 L289 L303	A235-W281 PolarHBondContact O-NE1 2.84Å; N237-W281 HydrophobicContact CB-CD2 3.55Å; N237-W281 HydrophobicContact CB-CE3 3.87Å; N237-W281 HydrophobicContact CB-CG 3.88Å; N237-W281 HydrophobicContact CB-CH2 4.29Å; N237-W281 HydrophobicContact CB-CZ2 4.03Å; N237-W281 HydrophobicContact CB-CZ3 4.22Å; N237-W281 WeakPolarHBondContact ND2-CZ3 3.38Å; A245-W281 HydrophobicContact CB-CZ2 4.02Å; V256-W281 HydrophobicContact CG1-CH2 4.08Å; V256-W281 HydrophobicContact CG1-CZ2 4.34Å; W281-L289 HydrophobicContact CD2-CB 3.99Å; W281-L289 HydrophobicContact CE3-CB 3.87Å; W281-L289 HydrophobicContact CE3-CD2 4.21Å; W281-L289 HydrophobicContact CG-CB 4.45Å; W281-L289 HydrophobicContact CH2-CD2 3.78Å; W281-L289 HydrophobicContact CZ2-CD2 4.15Å; W281-L289 HydrophobicContact CZ3-CB 4.32Å; W281-L289 HydrophobicContact CZ3-CD2 3.79Å; W281-L303 HydrophobicContact CH2-CD1 3.47Å; W281-L303 VanDerWaalsContact CH2-CD1 3.47Å; W281-L303 HydrophobicContact CZ3-CD1 3.65Å
282	A	96.5	Very high	96.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.179	C	C	.	.			trans	-74.1	122.6	174.4	0	0	0	0	0	109.9	Q284 A285 H288 W332	A282-Q284 VanDerWaalsContact C-N 3.27Å; A282-Q284 PolarHBondContact O-N 2.67Å; A282-A285 PolarHBondContact O-N 2.93Å; A282-H288 HydrophobicContact CB-CB 3.68Å; A282-H288 WeakPolarHBondContact CB-O 3.42Å; A282-H288 PolarHBondContact N-O 2.81Å; A282-W332 HydrophobicContact CB-CD2 4.24Å; A282-W332 HydrophobicContact CB-CE3 4.27Å; A282-W332 HydrophobicContact CB-CH2 3.72Å; A282-W332 HydrophobicContact CB-CZ2 3.71Å; A282-W332 HydrophobicContact CB-CZ3 3.99Å
283	P	93.5	Very high	96.6	Very high	48 Å²	48	35.1 Å²	35.1	31%	0.312	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-27.7	-176.2	26.4	-34.6	0	0	0	113.7	S239 W332 P337	S239-P283 PolarHBondContact OG-O 3.39Å; P283-W332 HydrophobicContact CG-CB 4.36Å; P283-W332 HydrophobicContact CG-CE3 3.98Å; P283-P337 HydrophobicContact CG-CB 4.09Å
284	Q	89.4	Confident	96.7	Very high	97 Å²	97	27.5 Å²	27.5	45%	0.453	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-8.5	-177.3	81.1	-68.4	0.6	0	0	114.2	A282 P337	A282-Q284 VanDerWaalsContact C-N 3.27Å; A282-Q284 PolarHBondContact O-N 2.67Å; Q284-P337 HydrophobicContact CB-CB 3.84Å; Q284-P337 HydrophobicContact CB-CG 4.34Å; Q284-P337 HydrophobicContact CG-CB 4.06Å
285	A	91.9	Very high	96.7	Very high	22 Å²	22	27.4 Å²	27.4	18%	0.182	15%	0.147	C	C	.	.			trans	-144.2	112.2	-177.2	0	0	0	0	0	111.7	A282 R287 H288	A282-A285 PolarHBondContact O-N 2.93Å; A285-R287 PolarHBondContact O-N 2.66Å; A285-H288 HydrophobicContact CB-CB 4.06Å; A285-H288 WeakPolarHBondContact CB-ND1 3.42Å; A285-H288 PolarHBondContact O-N 3.31Å
286	T	93.3	Very high	96.7	Very high	68 Å²	68	26 Å²	26	42%	0.417	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.5	-171	63.8	0	0	0	0	114.6	N237 S239	N237-T286 PolarHBondContact ND2-O 3.16Å; S239-T286 VanDerWaalsContact CB-CG2 3.48Å
287	R	95.4	Very high	96.7	Very high	90 Å²	90	27.3 Å²	27.3	34%	0.34	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	1.3	-179.1	-56.3	-168.3	-50.5	-144.8	3.1	113.6	A285 E302 L303	A285-R287 PolarHBondContact O-N 2.66Å; R287-E302 IonicContact CZ-OE1 2.8Å; R287-E302 IonicContact NE-OE1 3.06Å; R287-E302 IonicContact NH2-OE1 2.95Å; R287-E302 PolarHBondContact NH2-OE1 2.75Å; R287-L303 HydrophobicContact CB-CB 4.26Å; R287-L303 VanDerWaalsContact CD-O 3.31Å; R287-L303 WeakPolarHBondContact CD-O 3.33Å; R287-L303 PolarHBondContact NE-O 2.87Å; R287-L303 PolarHBondContact O-N 2.78Å
288	H	96.6	Very high	96.7	Very high	47 Å²	47	25.8 Å²	25.8	22%	0.218	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	136.4	177.9	-67.1	116.4	0	0	0	110.8	A282 A285 W301 E302	A282-H288 HydrophobicContact CB-CB 3.68Å; A282-H288 WeakPolarHBondContact CB-O 3.42Å; A282-H288 PolarHBondContact N-O 2.81Å; A285-H288 HydrophobicContact CB-CB 4.06Å; A285-H288 WeakPolarHBondContact CB-ND1 3.42Å; A285-H288 PolarHBondContact O-N 3.31Å; H288-W301 VanDerWaalsContact CA-O 3.26Å; H288-W301 WeakPolarHBondContact CA-O 3.49Å; H288-W301 PolarHBondContact CD2-O 3.12Å; H288-W301 VanDerWaalsContact CD2-O 3.32Å; H288-E302 IonicContact NE2-OE2 2.96Å
289	L	97.6	Very high	96.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	156.9	167.8	68.5	109.1	0	0	0	109.3	V254 V256 L269 V279 A280 W281 I300 W301 L303	V254-L289 HydrophobicContact CG1-CD1 4.19Å; V256-L289 HydrophobicContact CG2-CD2 4.18Å; L269-L289 HydrophobicContact CD1-CD1 4Å; L269-L289 HydrophobicContact CD1-CD2 4.23Å; L269-L289 HydrophobicContact CD1-CG 4.48Å; V279-L289 HydrophobicContact CG2-CD1 3.79Å; A280-L289 CarbonylContact O-C 3.56Å; A280-L289 WeakPolarHBondContact O-CA 3.45Å; W281-L289 HydrophobicContact CD2-CB 3.99Å; W281-L289 HydrophobicContact CE3-CB 3.87Å; W281-L289 HydrophobicContact CE3-CD2 4.21Å; W281-L289 HydrophobicContact CG-CB 4.45Å; W281-L289 HydrophobicContact CH2-CD2 3.78Å; W281-L289 HydrophobicContact CZ2-CD2 4.15Å; W281-L289 HydrophobicContact CZ3-CB 4.32Å; W281-L289 HydrophobicContact CZ3-CD2 3.79Å; L289-I300 WeakPolarHBondContact O-CA 3.25Å; L289-W301 HydrophobicContact CD1-CG 4.36Å; L289-W301 HydrophobicContact CG-CB 4.22Å; L289-W301 HydrophobicContact CG-CG 4.45Å; L289-W301 PolarHBondContact N-O 3.15Å; L289-W301 PolarHBondContact O-N 2.83Å; L289-L303 HydrophobicContact CD2-CD1 3.81Å; L289-L303 HydrophobicContact CD2-CD2 4.15Å; L289-L303 HydrophobicContact CD2-CG 3.98Å
290	C	98.3	Very high	96.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.1	173.1	-174.1	0	0	0	0	108.9	V279 A280 L299 I300 L330 M340	V279-C290 CarbonylContact C-O 3.46Å; V279-C290 VanDerWaalsContact CA-O 3.28Å; V279-C290 WeakPolarHBondContact CA-O 3.45Å; A280-C290 PolarHBondContact N-O 2.91Å; A280-C290 PolarHBondContact O-N 3.47Å; C290-L299 CarbonylContact C-O 3.56Å; C290-L299 VanDerWaalsContact CA-O 3.26Å; C290-L299 WeakPolarHBondContact CA-O 3.46Å; C290-I300 HydrophobicContact CB-CG1 4.37Å; C290-L330 HydrophobicContact CB-CD1 4.13Å; C290-M340 HydrophobicContact CB-SD 3.87Å; C290-M340 PolarHBondContact SG-SD 2.8Å
291	S	98.5	Very high	96.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	152.4	168.6	63.4	0	0	0	0	110.5	H272 A278 A298 L299 W301	H272-S291 PolarHBondContact CD2-OG 2.68Å; H272-S291 WeakPolarHBondContact NE2-CB 3.43Å; H272-S291 PolarHBondContact NE2-OG 3.37Å; A278-S291 CarbonylContact O-C 3.54Å; A278-S291 VanDerWaalsContact O-CA 3.27Å; A278-S291 WeakPolarHBondContact O-CA 3.49Å; S291-A298 CarbonylContact O-C 3.42Å; S291-A298 VanDerWaalsContact O-CA 3.31Å; S291-A298 WeakPolarHBondContact O-CA 3.16Å; S291-L299 PolarHBondContact N-O 3.02Å; S291-L299 PolarHBondContact O-N 3.15Å; S291-W301 PolarHBondContact OG-NE1 3.49Å
292	A	98.4	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	153.7	174.8	0	0	0	0	0	111.7	N277 A278 Q297 A298 I327 L330	N277-A292 PolarHBondContact N-O 2.78Å; A278-A292 PolarHBondContact N-O 2.83Å; A278-A292 VanDerWaalsContact N-O 3.11Å; A278-A292 PolarHBondContact O-N 2.88Å; A292-Q297 WeakPolarHBondContact CA-O 3.49Å; A292-A298 HydrophobicContact CB-CB 4.2Å; A292-I327 HydrophobicContact CB-CB 3.73Å; A292-I327 HydrophobicContact CB-CD1 4.07Å; A292-I327 HydrophobicContact CB-CG2 3.43Å; A292-I327 VanDerWaalsContact CB-CG2 3.43Å; A292-L330 HydrophobicContact CB-CD2 3.54Å
293	G	98.2	Very high	96.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	-173.5	-171.3	0	0	0	0	0	116.3	C275 D295 G296 Q297 I327	C275-G293 CarbonylContact O-C 3.48Å; C275-G293 WeakPolarHBondContact O-CA 3.36Å; G293-D295 PolarHBondContact O-N 2.88Å; G293-G296 PolarHBondContact O-N 2.74Å; G293-G296 VanDerWaalsContact O-N 3.09Å; G293-Q297 PolarHBondContact N-O 2.67Å; G293-I327 PolarHBondContact O-N 3.12Å
294	D	98.4	Very high	96.5	Very high	55 Å²	55	28 Å²	28	29%	0.294	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.6	-179.8	-72.1	-13.7	0	0	0	113.1	A274 C275 N277 G296 E326	A274-D294 HydrophobicContact CB-CB 3.67Å; C275-D294 WeakPolarHBondContact CB-OD2 3.42Å; C275-D294 PolarHBondContact O-N 3.23Å; N277-D294 PolarHBondContact ND2-N 2.88Å; N277-D294 PolarHBondContact ND2-OD1 3.15Å; D294-G296 PolarHBondContact O-N 2.75Å; D294-E326 HydrophobicContact CB-CG 4.24Å
295	D	98.2	Very high	96.4	Very high	34 Å²	34	30.4 Å²	30.4	18%	0.182	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	0.6	173.3	59.5	3.3	0	0	0	112.8	H272 R273 A274 G293 Q297	H272-D295 WeakPolarHBondContact CA-OD2 3.46Å; H272-D295 WeakPolarHBondContact CB-OD2 3.22Å; H272-D295 IonicContact CE1-OD1 3Å; H272-D295 IonicContact CG-OD2 3.13Å; H272-D295 IonicContact ND1-OD1 3.93Å; H272-D295 PolarHBondContact ND1-OD1 3.14Å; H272-D295 IonicContact ND1-OD2 2.66Å; H272-D295 PolarHBondContact ND1-OD2 3.41Å; R273-D295 HydrophobicContact CB-CB 4.07Å; R273-D295 PolarHBondContact N-OD2 3.33Å; A274-D295 HydrophobicContact CB-CB 4.03Å; G293-D295 PolarHBondContact O-N 2.88Å; D295-Q297 HydrophobicContact CB-CG 4.41Å; D295-Q297 PolarHBondContact O-N 3.49Å; D295-Q297 WeakPolarHBondContact OD1-CB 3.44Å; D295-Q297 PolarHBondContact OD1-N 2.82Å; D295-Q297 VanDerWaalsContact OD1-N 3.07Å
296	G	97.8	Very high	96.1	Very high	2 Å²	2	32.9 Å²	32.9	2%	0.021	17%	0.167	C	C	.	.	S	Bend	trans	70	13.3	-178.2	0	0	0	0	0	114	G293 D294 A323 A325	G293-G296 PolarHBondContact O-N 2.74Å; G293-G296 VanDerWaalsContact O-N 3.09Å; D294-G296 PolarHBondContact O-N 2.75Å; G296-A323 PolarHBondContact O-N 2.77Å; G296-A325 WeakPolarHBondContact CA-O 3.23Å
297	Q	97.8	Very high	95.5	Very high	30 Å²	30	32.2 Å²	32.2	14%	0.14	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	140.3	-179	-55.5	-158.2	-39.6	0	0	111.4	H272 A292 G293 D295 L299 Y321	H272-Q297 PolarHBondContact CE1-O 2.82Å; A292-Q297 WeakPolarHBondContact CA-O 3.49Å; G293-Q297 PolarHBondContact N-O 2.67Å; D295-Q297 HydrophobicContact CB-CG 4.41Å; D295-Q297 PolarHBondContact O-N 3.49Å; D295-Q297 WeakPolarHBondContact OD1-CB 3.44Å; D295-Q297 PolarHBondContact OD1-N 2.82Å; D295-Q297 VanDerWaalsContact OD1-N 3.07Å; Q297-L299 HydrophobicContact CB-CD2 3.98Å; Q297-L299 HydrophobicContact CB-CG 4.31Å; Q297-Y321 CarbonylContact C-O 3.38Å; Q297-Y321 VanDerWaalsContact CA-O 3.25Å; Q297-Y321 WeakPolarHBondContact CA-O 3.23Å
298	A	98	Very high	94.9	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.008	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.8	159.2	0	0	0	0	0	108.6	S291 A292 Y321 I327 I342	S291-A298 CarbonylContact O-C 3.42Å; S291-A298 VanDerWaalsContact O-CA 3.31Å; S291-A298 WeakPolarHBondContact O-CA 3.16Å; A292-A298 HydrophobicContact CB-CB 4.2Å; A298-Y321 PolarHBondContact N-O 2.87Å; A298-Y321 PolarHBondContact O-N 2.97Å; A298-I327 HydrophobicContact CB-CD1 4.02Å; A298-I342 HydrophobicContact CB-CG2 4.39Å
299	L	98.2	Very high	94.6	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.9	-172.9	-57.4	-175.6	0	0	0	109.3	R271 C290 S291 Q297 W301 P317 V320	R271-L299 HydrophobicContact CB-CD1 4.03Å; C290-L299 CarbonylContact C-O 3.56Å; C290-L299 VanDerWaalsContact CA-O 3.26Å; C290-L299 WeakPolarHBondContact CA-O 3.46Å; S291-L299 PolarHBondContact N-O 3.02Å; S291-L299 PolarHBondContact O-N 3.15Å; Q297-L299 HydrophobicContact CB-CD2 3.98Å; Q297-L299 HydrophobicContact CB-CG 4.31Å; L299-W301 HydrophobicContact CB-CZ2 3.8Å; L299-W301 HydrophobicContact CD1-CH2 3.95Å; L299-W301 HydrophobicContact CD1-CZ2 3.49Å; L299-W301 VanDerWaalsContact CD1-CZ2 3.49Å; L299-W301 HydrophobicContact CG-CZ2 4.29Å; L299-W301 VanDerWaalsContact O-CD1 3.22Å; L299-W301 PolarHBondContact O-NE1 2.76Å; L299-P317 HydrophobicContact CB-CB 4.12Å; L299-P317 HydrophobicContact CD2-CB 4.4Å; L299-P317 HydrophobicContact CD2-CG 4.26Å; L299-V320 HydrophobicContact CD2-CB 4.12Å; L299-V320 HydrophobicContact CD2-CG1 3.7Å; L299-V320 HydrophobicContact CD2-CG2 3.77Å
300	I	97.8	Very high	94.1	Very high	14 Å²	14	35.2 Å²	35.2	7%	0.072	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.3	172.1	-56.7	-176.9	0	0	0	108.2	L289 C290 P317 V318 L319 M340 V353	L289-I300 WeakPolarHBondContact O-CA 3.25Å; C290-I300 HydrophobicContact CB-CG1 4.37Å; I300-P317 CarbonylContact O-C 3.56Å; I300-P317 WeakPolarHBondContact O-CA 3.42Å; I300-P317 WeakPolarHBondContact O-CB 3.48Å; I300-V318 HydrophobicContact CB-CG2 4.16Å; I300-V318 HydrophobicContact CG2-CG2 3.78Å; I300-V318 WeakPolarHBondContact O-CG2 3.45Å; I300-V318 PolarHBondContact O-N 3.11Å; I300-L319 HydrophobicContact CB-CB 4.09Å; I300-L319 HydrophobicContact CD1-CB 4.2Å; I300-L319 HydrophobicContact CD1-CD1 4.03Å; I300-L319 HydrophobicContact CG1-CB 4.32Å; I300-L319 PolarHBondContact N-O 2.85Å; I300-L319 PolarHBondContact O-N 2.88Å; I300-M340 HydrophobicContact CD1-CE 4.46Å; I300-V353 HydrophobicContact CD1-CB 4.34Å; I300-V353 HydrophobicContact CD1-CG1 3.29Å; I300-V353 HydrophobicContact CD1-CG2 4.07Å
301	W	97.8	Very high	93.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	142.1	-176.6	-48	89.7	0	0	0	109.8	L269 R271 H288 L289 S291 L299 I315 P317	L269-W301 HydrophobicContact CB-CD2 4.16Å; L269-W301 HydrophobicContact CB-CE3 4.07Å; L269-W301 HydrophobicContact CB-CH2 3.67Å; L269-W301 HydrophobicContact CB-CZ2 3.85Å; L269-W301 HydrophobicContact CB-CZ3 3.83Å; L269-W301 HydrophobicContact CD1-CB 4.1Å; L269-W301 HydrophobicContact CD1-CD2 3.73Å; L269-W301 HydrophobicContact CD1-CE3 4.22Å; L269-W301 HydrophobicContact CD1-CG 3.67Å; L269-W301 HydrophobicContact CD2-CD2 4.47Å; L269-W301 HydrophobicContact CD2-CE3 4.14Å; L269-W301 HydrophobicContact CD2-CZ3 4.47Å; L269-W301 HydrophobicContact CG-CD2 4.34Å; L269-W301 HydrophobicContact CG-CE3 4.37Å; R271-W301 HydrophobicContact CB-CH2 3.46Å; R271-W301 VanDerWaalsContact CB-CH2 3.46Å; R271-W301 HydrophobicContact CB-CZ2 4.41Å; R271-W301 HydrophobicContact CB-CZ3 4.01Å; R271-W301 HydrophobicContact CG-CH2 3.67Å; R271-W301 HydrophobicContact CG-CZ3 3.72Å; H288-W301 VanDerWaalsContact CA-O 3.26Å; H288-W301 WeakPolarHBondContact CA-O 3.49Å; H288-W301 PolarHBondContact CD2-O 3.12Å; H288-W301 VanDerWaalsContact CD2-O 3.32Å; L289-W301 HydrophobicContact CD1-CG 4.36Å; L289-W301 HydrophobicContact CG-CB 4.22Å; L289-W301 HydrophobicContact CG-CG 4.45Å; L289-W301 PolarHBondContact N-O 3.15Å; L289-W301 PolarHBondContact O-N 2.83Å; S291-W301 PolarHBondContact OG-NE1 3.49Å; L299-W301 HydrophobicContact CB-CZ2 3.8Å; L299-W301 HydrophobicContact CD1-CH2 3.95Å; L299-W301 HydrophobicContact CD1-CZ2 3.49Å; L299-W301 VanDerWaalsContact CD1-CZ2 3.49Å; L299-W301 HydrophobicContact CG-CZ2 4.29Å; L299-W301 VanDerWaalsContact O-CD1 3.22Å; L299-W301 PolarHBondContact O-NE1 2.76Å; W301-I315 HydrophobicContact CE3-CG2 4.29Å; W301-I315 WeakPolarHBondContact CZ3-O 3.38Å; W301-P317 HydrophobicContact CD2-CB 4.38Å; W301-P317 HydrophobicContact CE3-CB 4.11Å; W301-P317 HydrophobicContact CZ3-CB 4.34Å
302	E	96.5	Very high	93.1	Very high	77 Å²	77	44 Å²	44	36%	0.36	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.1	163.8	-173.1	177.3	176.1	0	0	108.8	R287 H288 V318	R287-E302 IonicContact CZ-OE1 2.8Å; R287-E302 IonicContact NE-OE1 3.06Å; R287-E302 IonicContact NH2-OE1 2.95Å; R287-E302 PolarHBondContact NH2-OE1 2.75Å; H288-E302 IonicContact NE2-OE2 2.96Å; E302-V318 HydrophobicContact CB-CG1 3.77Å
303	L	95.6	Very high	92.7	Very high	13 Å²	13	52.3 Å²	52.3	7%	0.068	32%	0.321	C	S	.	.			trans	-77.1	140.8	175.9	-62.7	-179.6	0	0	0	110.9	V256 L269 W281 R287 L289 I315	V256-L303 HydrophobicContact CG1-CD1 3.82Å; V256-L303 HydrophobicContact CG2-CD1 4.3Å; V256-L303 HydrophobicContact CG2-CD2 4.18Å; L269-L303 HydrophobicContact CD1-CD2 4.46Å; L269-L303 HydrophobicContact CD2-CD2 4.15Å; W281-L303 HydrophobicContact CH2-CD1 3.47Å; W281-L303 VanDerWaalsContact CH2-CD1 3.47Å; W281-L303 HydrophobicContact CZ3-CD1 3.65Å; R287-L303 HydrophobicContact CB-CB 4.26Å; R287-L303 VanDerWaalsContact CD-O 3.31Å; R287-L303 WeakPolarHBondContact CD-O 3.33Å; R287-L303 PolarHBondContact NE-O 2.87Å; R287-L303 PolarHBondContact O-N 2.78Å; L289-L303 HydrophobicContact CD2-CD1 3.81Å; L289-L303 HydrophobicContact CD2-CD2 4.15Å; L289-L303 HydrophobicContact CD2-CG 3.98Å; L303-I315 HydrophobicContact CD2-CD1 4.08Å
304	P	92.4	Very high	92.4	Very high	36 Å²	36	53.4 Å²	53.4	23%	0.234	33%	0.332	C	S	.	.			trans	-58.2	154.7	170.3	-22.8	32.8	0	0	0	111.8	T306 A309 V310 I315	P304-T306 PolarHBondContact O-N 2.88Å; P304-A309 HydrophobicContact CB-CB 3.78Å; P304-V310 HydrophobicContact CG-CG2 4.05Å; P304-I315 VanDerWaalsContact CD-CD1 3.48Å; P304-I315 HydrophobicContact CG-CD1 4.05Å; P304-I315 HydrophobicContact CG-CG1 4.32Å
305	E	88.2	Confident	92.3	Very high	149 Å²	149	51.4 Å²	51.4	70%	0.696	32%	0.322	S	S	*	.	S	Bend	trans	-62.2	-29.4	-178.7	-171.5	170.9	178.3	0	0	113.5
306	T	84.2	Confident	92.2	Very high	73 Å²	73	54.4 Å²	54.4	45%	0.448	34%	0.338	S	S	.	.	S	Bend	trans	-137.7	153.1	177.6	66	0	0	0	0	110.3	P304 A308 A309	P304-T306 PolarHBondContact O-N 2.88Å; T306-A308 PolarHBondContact O-N 3.33Å; T306-A309 WeakPolarHBondContact O-CB 3.45Å; T306-A309 PolarHBondContact O-N 2.86Å; T306-A309 PolarHBondContact OG1-N 3.25Å
307	A	80.6	Confident	92.2	Very high	55 Å²	55	55.7 Å²	55.7	46%	0.455	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-54.4	-34.6	173.4	0	0	0	0	0	112.5	V266 A309 V310	V266-A307 HydrophobicContact CG1-CB 3.85Å; A307-A309 PolarHBondContact O-N 2.75Å; A307-V310 WeakPolarHBondContact O-CG2 3.43Å; A307-V310 PolarHBondContact O-N 2.96Å
308	A	83.9	Confident	92.1	Very high	99 Å²	99	57.7 Å²	57.7	82%	0.818	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-68.6	-15.9	177.8	0	0	0	0	0	113.9	T306	T306-A308 PolarHBondContact O-N 3.33Å
309	A	89.2	Confident	92	Very high	52 Å²	52	61.8 Å²	61.8	43%	0.43	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-93.6	4	178.5	0	0	0	0	0	113.1	P304 T306 A307 P311	P304-A309 HydrophobicContact CB-CB 3.78Å; T306-A309 WeakPolarHBondContact O-CB 3.45Å; T306-A309 PolarHBondContact O-N 2.86Å; T306-A309 PolarHBondContact OG1-N 3.25Å; A307-A309 PolarHBondContact O-N 2.75Å; A309-P311 WeakPolarHBondContact O-CD 3.48Å
310	V	88.7	Confident	91.9	Very high	48 Å²	48	65.7 Å²	65.7	29%	0.291	41%	0.405	S	S	.	.			trans	-66.1	120.8	173.8	178.3	0	0	0	0	109.5	A267 P304 A307 I315	A267-V310 HydrophobicContact CB-CG2 4.36Å; P304-V310 HydrophobicContact CG-CG2 4.05Å; A307-V310 WeakPolarHBondContact O-CG2 3.43Å; A307-V310 PolarHBondContact O-N 2.96Å; V310-I315 HydrophobicContact CG1-CD1 4.34Å; V310-I315 HydrophobicContact CG1-CG1 4.37Å; V310-I315 HydrophobicContact CG2-CD1 4.46Å
311	P	88.7	Confident	91.9	Very high	68 Å²	68	67.4 Å²	67.4	44%	0.442	41%	0.411	S	S	.	.			trans	-64.4	148.7	179.7	-19.8	31.9	0	0	0	112	A309 E313 G314	A309-P311 WeakPolarHBondContact O-CD 3.48Å; P311-E313 PolarHBondContact O-N 3.17Å; P311-G314 PolarHBondContact O-N 3.06Å
312	A	87.3	Confident	91.8	Very high	117 Å²	117	72.1 Å²	72.1	97%	0.967	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.4	177.3	0	0	0	0	0	113.3	G314	A312-G314 PolarHBondContact O-N 3.46Å
313	E	89.3	Confident	91.7	Very high	174 Å²	174	69.3 Å²	69.3	81%	0.813	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	0.2	176.5	-60.6	-177.7	171.1	0	0	112.9	R271 P311	R271-E313 PolarHBondContact NH2-O 3Å; R271-E313 VanDerWaalsContact NH2-O 3.08Å; P311-E313 PolarHBondContact O-N 3.17Å
314	G	91.8	Very high	91.6	Very high	23 Å²	23	72 Å²	72	24%	0.237	46%	0.456	C	S	.	.			trans	85	-172.9	-173	0	0	0	0	0	112.7	P311 A312	P311-G314 PolarHBondContact O-N 3.06Å; A312-G314 PolarHBondContact O-N 3.46Å
315	I	96.2	Very high	91.8	Very high	13 Å²	13	71.1 Å²	71.1	7%	0.067	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-103.2	129.4	179.1	-62	163.2	0	0	0	107.4	A267 L269 W301 L303 P304 V310	A267-I315 HydrophobicContact CB-CD1 3.86Å; L269-I315 HydrophobicContact CD2-CB 3.87Å; L269-I315 HydrophobicContact CD2-CD1 3.69Å; L269-I315 HydrophobicContact CD2-CG1 4.34Å; L269-I315 HydrophobicContact CD2-CG2 4.22Å; W301-I315 HydrophobicContact CE3-CG2 4.29Å; W301-I315 WeakPolarHBondContact CZ3-O 3.38Å; L303-I315 HydrophobicContact CD2-CD1 4.08Å; P304-I315 VanDerWaalsContact CD-CD1 3.48Å; P304-I315 HydrophobicContact CG-CD1 4.05Å; P304-I315 HydrophobicContact CG-CG1 4.32Å; V310-I315 HydrophobicContact CG1-CD1 4.34Å; V310-I315 HydrophobicContact CG1-CG1 4.37Å; V310-I315 HydrophobicContact CG2-CD1 4.46Å
316	D	96.5	Very high	92.3	Very high	98 Å²	98	69.3 Å²	69.3	52%	0.524	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-89.4	146.8	169.8	-71	-48.4	0	0	0	110.3	R271	R271-D316 IonicContact CZ-OD1 3.56Å; R271-D316 IonicContact NE-OD1 3.15Å; R271-D316 PolarHBondContact NE-OD1 2.95Å; R271-D316 IonicContact NH2-OD1 2.8Å; R271-D316 PolarHBondContact NH2-OD1 2.71Å; R271-D316 IonicContact NH2-OD2 3.98Å
317	P	97.2	Very high	93	Very high	29 Å²	29	65.9 Å²	65.9	19%	0.188	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	141.9	172.6	29	-36.7	0	0	0	110.3	L299 I300 W301 V320	L299-P317 HydrophobicContact CB-CB 4.12Å; L299-P317 HydrophobicContact CD2-CB 4.4Å; L299-P317 HydrophobicContact CD2-CG 4.26Å; I300-P317 CarbonylContact O-C 3.56Å; I300-P317 WeakPolarHBondContact O-CA 3.42Å; I300-P317 WeakPolarHBondContact O-CB 3.48Å; W301-P317 HydrophobicContact CD2-CB 4.38Å; W301-P317 HydrophobicContact CE3-CB 4.11Å; W301-P317 HydrophobicContact CZ3-CB 4.34Å; P317-V320 HydrophobicContact CB-CG2 4.14Å; P317-V320 HydrophobicContact CG-CG2 3.68Å
318	V	96.4	Very high	93.8	Very high	72 Å²	72	66.2 Å²	66.2	44%	0.436	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-29.6	174.9	-65.3	0	0	0	0	111.8	I300 E302	I300-V318 HydrophobicContact CB-CG2 4.16Å; I300-V318 HydrophobicContact CG2-CG2 3.78Å; I300-V318 WeakPolarHBondContact O-CG2 3.45Å; I300-V318 PolarHBondContact O-N 3.11Å; E302-V318 HydrophobicContact CB-CG1 3.77Å
319	L	95.9	Very high	94.4	Very high	87 Å²	87	62.7 Å²	62.7	46%	0.455	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144.3	175	-65.7	169	0	0	0	110.1	I300 V353	I300-L319 HydrophobicContact CB-CB 4.09Å; I300-L319 HydrophobicContact CD1-CB 4.2Å; I300-L319 HydrophobicContact CD1-CD1 4.03Å; I300-L319 HydrophobicContact CG1-CB 4.32Å; I300-L319 PolarHBondContact N-O 2.85Å; I300-L319 PolarHBondContact O-N 2.88Å; L319-V353 HydrophobicContact CD1-CG1 4.35Å
320	V	96.5	Very high	94.8	Very high	83 Å²	83	60.2 Å²	60.2	50%	0.503	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	125.9	178.6	-179.5	0	0	0	0	108.1	L299 P317	L299-V320 HydrophobicContact CD2-CB 4.12Å; L299-V320 HydrophobicContact CD2-CG1 3.7Å; L299-V320 HydrophobicContact CD2-CG2 3.77Å; P317-V320 HydrophobicContact CB-CG2 4.14Å; P317-V320 HydrophobicContact CG-CG2 3.68Å
321	Y	96.6	Very high	95.2	Very high	50 Å²	50	60.5 Å²	60.5	20%	0.196	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	138.6	171.9	-176.7	-96.6	0	0	0	109.5	Q297 A298 A323 I342 Q349 L351	Q297-Y321 CarbonylContact C-O 3.38Å; Q297-Y321 VanDerWaalsContact CA-O 3.25Å; Q297-Y321 WeakPolarHBondContact CA-O 3.23Å; A298-Y321 PolarHBondContact N-O 2.87Å; A298-Y321 PolarHBondContact O-N 2.97Å; Y321-A323 HydrophobicContact CE1-CB 4.05Å; Y321-I342 HydrophobicContact CD1-CD1 3.91Å; Y321-I342 HydrophobicContact CE1-CD1 3.66Å; Y321-Q349 PolarHBondContact OH-NE2 3.13Å; Y321-Q349 PolarHBondContact OH-OE1 2.86Å; Y321-L351 HydrophobicContact CD1-CD1 3.68Å; Y321-L351 HydrophobicContact CD1-CD2 4.35Å; Y321-L351 HydrophobicContact CD2-CD1 4.34Å; Y321-L351 HydrophobicContact CD2-CD2 4.23Å; Y321-L351 HydrophobicContact CE1-CD1 3.96Å; Y321-L351 HydrophobicContact CE1-CD2 3.88Å; Y321-L351 HydrophobicContact CE2-CD2 3.77Å; Y321-L351 HydrophobicContact CG-CD1 3.9Å
322	D	95.9	Very high	95.6	Very high	98 Å²	98	58.1 Å²	58.1	52%	0.524	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.9	178.2	-168.8	-27.4	0	0	0	108.7	G324	D322-G324 WeakPolarHBondContact OD1-CA 3.41Å; D322-G324 PolarHBondContact OD1-N 2.83Å
323	A	95.3	Very high	96	Very high	18 Å²	18	52.6 Å²	52.6	15%	0.149	30%	0.298	C	S	.	.			trans	-87.5	-11.1	179.6	0	0	0	0	0	112.9	G296 Y321 A325 I327 I342 F344	G296-A323 PolarHBondContact O-N 2.77Å; Y321-A323 HydrophobicContact CE1-CB 4.05Å; A323-A325 PolarHBondContact O-N 3.35Å; A323-I327 HydrophobicContact CB-CD1 3.77Å; A323-I327 HydrophobicContact CB-CG1 3.87Å; A323-I342 HydrophobicContact CB-CD1 3.84Å; A323-F344 HydrophobicContact CB-CD1 3.91Å; A323-F344 HydrophobicContact CB-CE1 3.88Å; A323-F344 HydrophobicContact CB-CG 4.33Å; A323-F344 HydrophobicContact CB-CZ 4.26Å
324	G	93.7	Very high	96	Very high	69 Å²	69	47.7 Å²	47.7	71%	0.711	29%	0.288	S	S	*	.	S	Bend	trans	74.8	2.2	-176.5	0	0	0	0	0	115.4	D322	D322-G324 WeakPolarHBondContact OD1-CA 3.41Å; D322-G324 PolarHBondContact OD1-N 2.83Å
325	A	96.8	Very high	96.1	Very high	19 Å²	19	49 Å²	49	16%	0.157	30%	0.296	C	S	.	.	S	Bend	trans	-155.2	160.6	178.1	0	0	0	0	0	111.1	G296 A323 I327 F344 E345	G296-A325 WeakPolarHBondContact CA-O 3.23Å; A323-A325 PolarHBondContact O-N 3.35Å; A325-I327 PolarHBondContact O-N 2.83Å; A325-F344 HydrophobicContact CB-CB 4.32Å; A325-F344 HydrophobicContact CB-CD2 3.94Å; A325-F344 HydrophobicContact CB-CG 4.49Å; A325-E345 HydrophobicContact CB-CG 4.22Å
326	E	97.9	Very high	96	Very high	111 Å²	111	51 Å²	51	52%	0.519	31%	0.305	S	S	.	.			trans	-52.1	120.8	-179.8	-61.2	170.3	-178.6	0	0	111.8	D294 F344	D294-E326 HydrophobicContact CB-CG 4.24Å; E326-F344 WeakPolarHBondContact O-CA 3.33Å; E326-F344 WeakPolarHBondContact O-CB 3.32Å
327	I	98.4	Very high	95.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	118.5	179	-56.9	174.2	0	0	0	108.7	N277 A292 G293 A298 A323 A325 I342	N277-I327 WeakPolarHBondContact CB-O 3.38Å; N277-I327 PolarHBondContact ND2-O 3.24Å; A292-I327 HydrophobicContact CB-CB 3.73Å; A292-I327 HydrophobicContact CB-CD1 4.07Å; A292-I327 HydrophobicContact CB-CG2 3.43Å; A292-I327 VanDerWaalsContact CB-CG2 3.43Å; G293-I327 PolarHBondContact O-N 3.12Å; A298-I327 HydrophobicContact CB-CD1 4.02Å; A323-I327 HydrophobicContact CB-CD1 3.77Å; A323-I327 HydrophobicContact CB-CG1 3.87Å; A325-I327 PolarHBondContact O-N 2.83Å; I327-I342 HydrophobicContact CD1-CD1 3.87Å; I327-I342 HydrophobicContact CG1-CD1 4.42Å; I327-I342 HydrophobicContact CG2-CB 3.96Å; I327-I342 HydrophobicContact CG2-CG2 4.29Å
328	N	96.8	Very high	95.6	Very high	63 Å²	63	50.6 Å²	50.6	34%	0.337	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-23.8	-173.9	-66.3	-46	0	0	0	113.5	A343	N328-A343 PolarHBondContact N-O 2.79Å
329	Q	97.4	Very high	95.6	Very high	24 Å²	24	47.5 Å²	47.5	11%	0.112	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	144.1	-178.2	-173.9	59	-93.7	0	0	110.6	L35 I342 A343	L35-Q329 HydrophobicContact CB-CG 3.74Å; L35-Q329 HydrophobicContact CD1-CB 4.24Å; L35-Q329 HydrophobicContact CD1-CG 3.87Å; L35-Q329 HydrophobicContact CG-CB 4.27Å; L35-Q329 HydrophobicContact CG-CG 3.68Å; Q329-I342 CarbonylContact O-C 3.4Å; Q329-I342 WeakPolarHBondContact O-CA 3.39Å; Q329-A343 HydrophobicContact CB-CB 4.19Å; Q329-A343 PolarHBondContact N-O 2.92Å; Q329-A343 PolarHBondContact O-N 3.26Å
330	L	97.6	Very high	95.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	143.2	171.9	80.3	90	0	0	0	110.4	A278 A280 C290 A292 M340 A341 I342	A278-L330 HydrophobicContact CB-CB 4.23Å; A278-L330 HydrophobicContact CB-CD2 3.74Å; A278-L330 HydrophobicContact CB-CG 3.78Å; A278-L330 WeakPolarHBondContact O-CD2 3.24Å; A280-L330 HydrophobicContact CB-CD1 3.35Å; C290-L330 HydrophobicContact CB-CD1 4.13Å; A292-L330 HydrophobicContact CB-CD2 3.54Å; L330-M340 HydrophobicContact CD1-SD 4.23Å; L330-A341 CarbonylContact C-O 3.53Å; L330-A341 VanDerWaalsContact CA-O 3.27Å; L330-A341 WeakPolarHBondContact CA-O 3.46Å; L330-I342 HydrophobicContact CB-CG2 4.06Å
331	Q	97.2	Very high	95.7	Very high	55 Å²	55	39.6 Å²	39.6	26%	0.257	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	141.8	176.3	-77.8	-64.5	-64.5	0	0	110.6	L35 F37 M340 A341	L35-Q331 HydrophobicContact CB-CB 4.43Å; L35-Q331 HydrophobicContact CB-CG 3.95Å; F37-Q331 HydrophobicContact CD2-CB 4Å; F37-Q331 HydrophobicContact CE2-CB 4.19Å; F37-Q331 WeakPolarHBondContact CE2-O 3.27Å; Q331-M340 CarbonylContact O-C 3.53Å; Q331-M340 WeakPolarHBondContact O-CA 3.08Å; Q331-M340 WeakPolarHBondContact O-CG 3.27Å; Q331-A341 PolarHBondContact N-O 2.83Å; Q331-A341 PolarHBondContact O-N 3.15Å
332	W	96.6	Very high	95.8	Very high	17 Å²	17	37.2 Å²	37.2	6%	0.064	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	143.5	168.3	-86.4	64.7	0	0	0	110.8	F37 A282 P283 A334 P337 V353	F37-W332 WeakPolarHBondContact CD2-O 3.36Å; A282-W332 HydrophobicContact CB-CD2 4.24Å; A282-W332 HydrophobicContact CB-CE3 4.27Å; A282-W332 HydrophobicContact CB-CH2 3.72Å; A282-W332 HydrophobicContact CB-CZ2 3.71Å; A282-W332 HydrophobicContact CB-CZ3 3.99Å; P283-W332 HydrophobicContact CG-CB 4.36Å; P283-W332 HydrophobicContact CG-CE3 3.98Å; W332-A334 PolarHBondContact O-N 2.93Å; W332-P337 WeakPolarHBondContact CZ3-O 3.45Å; W332-V353 HydrophobicContact CH2-CB 4.24Å; W332-V353 HydrophobicContact CH2-CG1 3.95Å; W332-V353 HydrophobicContact CZ2-CG1 4.19Å; W332-V353 HydrophobicContact CZ2-CG2 4.42Å
333	A	95.3	Very high	95.9	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.008	21%	0.205	C	C	.	.			trans	-82.7	95.9	173.4	0	0	0	0	0	109.8	F37 A335 H336 P337 W339	F37-A333 HydrophobicContact CB-CB 4.32Å; F37-A333 HydrophobicContact CD1-CB 3.66Å; F37-A333 HydrophobicContact CD2-CB 3.85Å; F37-A333 HydrophobicContact CE1-CB 3.79Å; F37-A333 HydrophobicContact CE2-CB 3.97Å; F37-A333 HydrophobicContact CG-CB 3.67Å; F37-A333 HydrophobicContact CZ-CB 3.93Å; A333-A335 PolarHBondContact O-N 3.15Å; A333-A335 VanDerWaalsContact O-N 3.16Å; A333-H336 HydrophobicContact CB-CB 4.1Å; A333-H336 CarbonylContact O-C 3.59Å; A333-H336 WeakPolarHBondContact O-CA 3.35Å; A333-H336 PolarHBondContact O-N 2.92Å; A333-H336 VanDerWaalsContact O-O 3.1Å; A333-P337 WeakPolarHBondContact O-CA 3.25Å; A333-W339 HydrophobicContact CB-CB 4.11Å; A333-W339 WeakPolarHBondContact CB-O 3.31Å; A333-W339 PolarHBondContact N-O 2.88Å
334	A	91.1	Very high	96	Very high	72 Å²	72	32.3 Å²	32.3	60%	0.595	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-37.7	-177.2	0	0	0	0	0	114	W332 H336	W332-A334 PolarHBondContact O-N 2.93Å; A334-H336 VanDerWaalsContact C-N 3.33Å
335	A	92.5	Very high	96.1	Very high	49 Å²	49	33.6 Å²	33.6	41%	0.405	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-18	176.9	0	0	0	0	0	113.9	A333	A333-A335 PolarHBondContact O-N 3.15Å; A333-A335 VanDerWaalsContact O-N 3.16Å
336	H	93.8	Very high	96.1	Very high	55 Å²	55	34.3 Å²	34.3	26%	0.255	19%	0.189	S	C	.	.	S	Bend	trans	-136.4	69.8	-177.9	-62.1	-56.2	0	0	0	108.9	F62 A333 A334 D338 W339	F62-H336 AromaticContact CZ-CD2 3.72Å; A333-H336 HydrophobicContact CB-CB 4.1Å; A333-H336 CarbonylContact O-C 3.59Å; A333-H336 WeakPolarHBondContact O-CA 3.35Å; A333-H336 PolarHBondContact O-N 2.92Å; A333-H336 VanDerWaalsContact O-O 3.1Å; A334-H336 VanDerWaalsContact C-N 3.33Å; H336-D338 PolarHBondContact O-N 3.14Å; H336-W339 WeakPolarHBondContact O-CB 3.46Å; H336-W339 PolarHBondContact O-N 2.82Å
337	P	93.2	Very high	96.1	Very high	40 Å²	40	31.7 Å²	31.7	26%	0.26	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-29.6	-164.9	21.5	-33.9	0	0	0	113.1	P283 Q284 W332 A333 W339	P283-P337 HydrophobicContact CG-CB 4.09Å; Q284-P337 HydrophobicContact CB-CB 3.84Å; Q284-P337 HydrophobicContact CB-CG 4.34Å; Q284-P337 HydrophobicContact CG-CB 4.06Å; W332-P337 WeakPolarHBondContact CZ3-O 3.45Å; A333-P337 WeakPolarHBondContact O-CA 3.25Å; P337-W339 PolarHBondContact O-N 2.89Å
338	D	93.4	Very high	96.1	Very high	80 Å²	80	31.7 Å²	31.7	43%	0.428	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-2.3	175.1	-57.7	-11	0	0	0	114.2	H336 R352 V353	H336-D338 PolarHBondContact O-N 3.14Å; D338-R352 CarbonylContact O-C 3.55Å; D338-R352 VanDerWaalsContact O-CA 3.3Å; D338-R352 WeakPolarHBondContact O-CA 3.24Å; D338-V353 PolarHBondContact O-N 2.72Å
339	W	95.6	Very high	96.1	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.027	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.1	-175.4	-64.2	91.6	0	0	0	112.8	F24 F62 P67 A333 H336 P337 L350 L351 R352	F24-W339 HydrophobicContact CD2-CH2 4.08Å; F24-W339 AromaticContact CD2-CZ3 3.88Å; F24-W339 HydrophobicContact CD2-CZ3 3.88Å; F24-W339 AromaticContact CE2-CH2 3.7Å; F24-W339 HydrophobicContact CE2-CH2 3.7Å; F24-W339 AromaticContact CE2-CZ3 3.9Å; F24-W339 HydrophobicContact CE2-CZ3 3.9Å; F62-W339 HydrophobicContact CE2-CG 4.35Å; P67-W339 HydrophobicContact CB-CH2 3.39Å; P67-W339 HydrophobicContact CB-CZ2 3.75Å; P67-W339 HydrophobicContact CB-CZ3 4.49Å; P67-W339 HydrophobicContact CG-CH2 3.63Å; P67-W339 HydrophobicContact CG-CZ2 3.76Å; A333-W339 HydrophobicContact CB-CB 4.11Å; A333-W339 WeakPolarHBondContact CB-O 3.31Å; A333-W339 PolarHBondContact N-O 2.88Å; H336-W339 WeakPolarHBondContact O-CB 3.46Å; H336-W339 PolarHBondContact O-N 2.82Å; P337-W339 PolarHBondContact O-N 2.89Å; W339-L350 HydrophobicContact CB-CD1 4.37Å; W339-L350 HydrophobicContact CD2-CD2 4.39Å; W339-L350 HydrophobicContact CD2-CG 4.43Å; W339-L350 HydrophobicContact CE3-CD1 4.06Å; W339-L350 HydrophobicContact CE3-CD2 3.69Å; W339-L350 HydrophobicContact CE3-CG 3.5Å; W339-L350 HydrophobicContact CZ3-CD2 3.75Å; W339-L350 HydrophobicContact CZ3-CG 3.81Å; W339-L351 WeakPolarHBondContact CA-O 3.07Å; W339-R352 HydrophobicContact CD2-CB 4.45Å; W339-R352 HydrophobicContact CE3-CB 4Å; W339-R352 HydrophobicContact CH2-CB 4.02Å; W339-R352 HydrophobicContact CH2-CG 4.48Å; W339-R352 HydrophobicContact CZ2-CB 4.43Å; W339-R352 HydrophobicContact CZ2-CG 4.41Å; W339-R352 HydrophobicContact CZ3-CB 3.79Å
340	M	96.7	Very high	96.1	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.02	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.5	173.1	169	169.7	59.4	0	0	109.1	C290 I300 L330 Q331 L350 L351 V353	C290-M340 HydrophobicContact CB-SD 3.87Å; C290-M340 PolarHBondContact SG-SD 2.8Å; I300-M340 HydrophobicContact CD1-CE 4.46Å; L330-M340 HydrophobicContact CD1-SD 4.23Å; Q331-M340 CarbonylContact O-C 3.53Å; Q331-M340 WeakPolarHBondContact O-CA 3.08Å; Q331-M340 WeakPolarHBondContact O-CG 3.27Å; M340-L350 CarbonylContact O-C 3.6Å; M340-L351 HydrophobicContact CE-CD1 4.2Å; M340-L351 PolarHBondContact N-O 3.25Å; M340-L351 PolarHBondContact O-N 2.92Å; M340-V353 HydrophobicContact CB-CG2 4.1Å; M340-V353 HydrophobicContact CE-CG2 3.79Å
341	A	98.1	Very high	96	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	141.5	167.8	0	0	0	0	0	110.2	L35 F37 L44 L330 Q331 V348 Q349	L35-A341 HydrophobicContact CD1-CB 4.05Å; F37-A341 HydrophobicContact CE2-CB 3.59Å; F37-A341 HydrophobicContact CZ-CB 3.51Å; L44-A341 HydrophobicContact CD1-CB 4.31Å; L44-A341 HydrophobicContact CD2-CB 3.48Å; L44-A341 VanDerWaalsContact CD2-CB 3.48Å; L330-A341 CarbonylContact C-O 3.53Å; L330-A341 VanDerWaalsContact CA-O 3.27Å; L330-A341 WeakPolarHBondContact CA-O 3.46Å; Q331-A341 PolarHBondContact N-O 2.83Å; Q331-A341 PolarHBondContact O-N 3.15Å; A341-V348 HydrophobicContact CB-CG1 4.18Å; A341-Q349 VanDerWaalsContact CA-O 3.31Å; A341-Q349 WeakPolarHBondContact CA-O 3.12Å
342	I	98.1	Very high	95.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	152.5	167.1	60.4	167.5	0	0	0	109.2	A298 Y321 A323 I327 Q329 L330 F344 V348 Q349 L351	A298-I342 HydrophobicContact CB-CG2 4.39Å; Y321-I342 HydrophobicContact CD1-CD1 3.91Å; Y321-I342 HydrophobicContact CE1-CD1 3.66Å; A323-I342 HydrophobicContact CB-CD1 3.84Å; I327-I342 HydrophobicContact CD1-CD1 3.87Å; I327-I342 HydrophobicContact CG1-CD1 4.42Å; I327-I342 HydrophobicContact CG2-CB 3.96Å; I327-I342 HydrophobicContact CG2-CG2 4.29Å; Q329-I342 CarbonylContact O-C 3.4Å; Q329-I342 WeakPolarHBondContact O-CA 3.39Å; L330-I342 HydrophobicContact CB-CG2 4.06Å; I342-F344 HydrophobicContact CD1-CD1 4.06Å; I342-F344 HydrophobicContact CD1-CE1 3.92Å; I342-F344 HydrophobicContact CG1-CD1 4.28Å; I342-F344 HydrophobicContact CG1-CE1 4.2Å; I342-V348 WeakPolarHBondContact O-CA 3.17Å; I342-Q349 HydrophobicContact CD1-CB 4.34Å; I342-Q349 HydrophobicContact CG1-CB 3.85Å; I342-Q349 PolarHBondContact N-O 2.99Å; I342-Q349 PolarHBondContact O-N 2.94Å; I342-L351 HydrophobicContact CD1-CD1 3.95Å; I342-L351 HydrophobicContact CG1-CD1 4.08Å; I342-L351 HydrophobicContact CG1-CG 4.45Å; I342-L351 HydrophobicContact CG2-CD1 4.14Å
343	A	98.2	Very high	95.5	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.3	171.3	0	0	0	0	0	111.4	I32 L35 N328 Q329 K347	I32-A343 HydrophobicContact CB-CB 3.9Å; I32-A343 HydrophobicContact CD1-CB 4.25Å; I32-A343 HydrophobicContact CG2-CB 3.66Å; L35-A343 HydrophobicContact CD1-CB 3.91Å; L35-A343 HydrophobicContact CD2-CB 4.44Å; L35-A343 HydrophobicContact CG-CB 4.23Å; N328-A343 PolarHBondContact N-O 2.79Å; Q329-A343 HydrophobicContact CB-CB 4.19Å; Q329-A343 PolarHBondContact N-O 2.92Å; Q329-A343 PolarHBondContact O-N 3.26Å; A343-K347 WeakPolarHBondContact CA-O 3.48Å
344	F	97.6	Very high	95.5	Very high	11 Å²	11	36.6 Å²	36.6	5%	0.048	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	140.5	177.9	53.3	-85.7	0	0	0	107.7	A323 A325 E326 I342 N346 K347 Q349	A323-F344 HydrophobicContact CB-CD1 3.91Å; A323-F344 HydrophobicContact CB-CE1 3.88Å; A323-F344 HydrophobicContact CB-CG 4.33Å; A323-F344 HydrophobicContact CB-CZ 4.26Å; A325-F344 HydrophobicContact CB-CB 4.32Å; A325-F344 HydrophobicContact CB-CD2 3.94Å; A325-F344 HydrophobicContact CB-CG 4.49Å; E326-F344 WeakPolarHBondContact O-CA 3.33Å; E326-F344 WeakPolarHBondContact O-CB 3.32Å; I342-F344 HydrophobicContact CD1-CD1 4.06Å; I342-F344 HydrophobicContact CD1-CE1 3.92Å; I342-F344 HydrophobicContact CG1-CD1 4.28Å; I342-F344 HydrophobicContact CG1-CE1 4.2Å; F344-N346 PolarHBondContact O-N 3.31Å; F344-K347 HydrophobicContact CD2-CB 4.23Å; F344-K347 HydrophobicContact CD2-CD 4.23Å; F344-K347 HydrophobicContact CE2-CB 3.9Å; F344-K347 HydrophobicContact CE2-CD 3.58Å; F344-K347 HydrophobicContact CE2-CG 4.39Å; F344-K347 HydrophobicContact CZ-CB 4.07Å; F344-K347 HydrophobicContact CZ-CD 4.26Å; F344-K347 PolarHBondContact N-O 3.33Å; F344-K347 VanDerWaalsContact N-O 3.13Å; F344-K347 PolarHBondContact O-N 3.16Å; F344-K347 VanDerWaalsContact O-O 3.12Å; F344-Q349 HydrophobicContact CE1-CB 3.79Å; F344-Q349 HydrophobicContact CZ-CB 4.34Å
345	E	95.8	Very high	95.7	Very high	97 Å²	97	34.7 Å²	34.7	45%	0.453	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	-126.8	-172.3	-52.7	178	147.3	0	0	111.2	S31 I32 A325 K347	S31-E345 CarbonylContact C-O 3.57Å; S31-E345 VanDerWaalsContact CA-O 3.24Å; S31-E345 WeakPolarHBondContact CA-O 3.24Å; I32-E345 PolarHBondContact N-O 3.19Å; A325-E345 HydrophobicContact CB-CG 4.22Å; E345-K347 IonicContact OE2-NZ 3.9Å; E345-K347 PolarHBondContact OE2-NZ 3.28Å
346	N	96.7	Very high	95.9	Very high	33 Å²	33	33.9 Å²	33.9	18%	0.176	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	16.4	174.3	70.9	-35.4	0	0	0	113.6	E27 L28 H30 F344	E27-N346 WeakPolarHBondContact CG-ND2 3.03Å; E27-N346 PolarHBondContact OE1-ND2 3.12Å; L28-N346 PolarHBondContact N-O 3.16Å; L28-N346 WeakPolarHBondContact O-CB 3.44Å; L28-N346 PolarHBondContact O-ND2 3.37Å; H30-N346 WeakPolarHBondContact O-CA 3.43Å; H30-N346 VanDerWaalsContact O-CB 3.31Å; H30-N346 WeakPolarHBondContact O-CB 3.47Å; F344-N346 PolarHBondContact O-N 3.31Å
347	K	97.6	Very high	96	Very high	56 Å²	56	32.7 Å²	32.7	24%	0.243	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.4	-174.7	-65.8	162	-168.4	145	0	110.7	T25 E27 I32 A343 F344 E345	T25-K347 HydrophobicContact CG2-CB 4.04Å; T25-K347 HydrophobicContact CG2-CD 4.4Å; T25-K347 HydrophobicContact CG2-CG 4.19Å; E27-K347 HydrophobicContact CB-CG 4.47Å; E27-K347 HydrophobicContact CG-CG 4.29Å; I32-K347 VanDerWaalsContact CD1-C 3.48Å; A343-K347 WeakPolarHBondContact CA-O 3.48Å; F344-K347 HydrophobicContact CD2-CB 4.23Å; F344-K347 HydrophobicContact CD2-CD 4.23Å; F344-K347 HydrophobicContact CE2-CB 3.9Å; F344-K347 HydrophobicContact CE2-CD 3.58Å; F344-K347 HydrophobicContact CE2-CG 4.39Å; F344-K347 HydrophobicContact CZ-CB 4.07Å; F344-K347 HydrophobicContact CZ-CD 4.26Å; F344-K347 PolarHBondContact N-O 3.33Å; F344-K347 VanDerWaalsContact N-O 3.13Å; F344-K347 PolarHBondContact O-N 3.16Å; F344-K347 VanDerWaalsContact O-O 3.12Å; E345-K347 IonicContact OE2-NZ 3.9Å; E345-K347 PolarHBondContact OE2-NZ 3.28Å
348	V	98	Very high	96.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	135.5	160.1	-170.7	0	0	0	0	107.8	T25 C26 L28 I32 L35 L44 L60 F72 A341 I342	T25-V348 WeakPolarHBondContact CA-O 3.05Å; C26-V348 PolarHBondContact N-O 2.8Å; C26-V348 PolarHBondContact O-N 3.15Å; L28-V348 HydrophobicContact CD1-CG2 4.21Å; I32-V348 HydrophobicContact CD1-CB 4.31Å; I32-V348 HydrophobicContact CD1-CG2 3.19Å; L35-V348 HydrophobicContact CD2-CG1 4.19Å; L35-V348 HydrophobicContact CD2-CG2 4.05Å; L44-V348 HydrophobicContact CD2-CG1 3.55Å; L60-V348 HydrophobicContact CD1-CB 3.85Å; L60-V348 HydrophobicContact CD1-CG1 4.16Å; L60-V348 HydrophobicContact CD1-CG2 3.73Å; F72-V348 HydrophobicContact CE1-CB 4.46Å; F72-V348 WeakPolarHBondContact CE1-O 3.5Å; F72-V348 HydrophobicContact CZ-CB 4.01Å; F72-V348 HydrophobicContact CZ-CG1 3.79Å; A341-V348 HydrophobicContact CB-CG1 4.18Å; I342-V348 WeakPolarHBondContact O-CA 3.17Å
349	Q	97.2	Very high	96.4	Very high	17 Å²	17	29.1 Å²	29.1	8%	0.079	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.7	172.4	-164.7	170.5	25.6	0	0	110.4	A23 F24 T25 Y321 A341 I342 F344 L351	A23-Q349 HydrophobicContact CB-CG 4.23Å; F24-Q349 CarbonylContact O-C 3.49Å; F24-Q349 WeakPolarHBondContact O-CA 3.25Å; T25-Q349 PolarHBondContact OG1-NE2 2.9Å; Y321-Q349 PolarHBondContact OH-NE2 3.13Å; Y321-Q349 PolarHBondContact OH-OE1 2.86Å; A341-Q349 VanDerWaalsContact CA-O 3.31Å; A341-Q349 WeakPolarHBondContact CA-O 3.12Å; I342-Q349 HydrophobicContact CD1-CB 4.34Å; I342-Q349 HydrophobicContact CG1-CB 3.85Å; I342-Q349 PolarHBondContact N-O 2.99Å; I342-Q349 PolarHBondContact O-N 2.94Å; F344-Q349 HydrophobicContact CE1-CB 3.79Å; F344-Q349 HydrophobicContact CZ-CB 4.34Å; Q349-L351 HydrophobicContact CG-CD2 3.82Å
350	L	97.2	Very high	96.4	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	118	174.9	-174.3	73.3	0	0	0	108.6	A23 F24 F37 F62 F72 W339 M340	A23-L350 CarbonylContact C-O 3.58Å; A23-L350 WeakPolarHBondContact CA-O 3.41Å; F24-L350 HydrophobicContact CB-CB 4.44Å; F24-L350 PolarHBondContact N-O 2.84Å; F24-L350 PolarHBondContact O-N 3.1Å; F37-L350 HydrophobicContact CE1-CD1 3.99Å; F37-L350 HydrophobicContact CZ-CD1 3.72Å; F62-L350 HydrophobicContact CB-CD2 3.54Å; F62-L350 HydrophobicContact CD2-CD2 3.7Å; F62-L350 HydrophobicContact CE2-CD2 4.5Å; F62-L350 HydrophobicContact CG-CD2 3.71Å; F72-L350 HydrophobicContact CD1-CB 4.21Å; F72-L350 HydrophobicContact CD2-CB 4.28Å; F72-L350 HydrophobicContact CD2-CD2 4.22Å; F72-L350 HydrophobicContact CE1-CB 3.97Å; F72-L350 HydrophobicContact CE2-CB 4.07Å; F72-L350 HydrophobicContact CG-CB 4.35Å; F72-L350 HydrophobicContact CZ-CB 3.91Å; W339-L350 HydrophobicContact CB-CD1 4.37Å; W339-L350 HydrophobicContact CD2-CD2 4.39Å; W339-L350 HydrophobicContact CD2-CG 4.43Å; W339-L350 HydrophobicContact CE3-CD1 4.06Å; W339-L350 HydrophobicContact CE3-CD2 3.69Å; W339-L350 HydrophobicContact CE3-CG 3.5Å; W339-L350 HydrophobicContact CZ3-CD2 3.75Å; W339-L350 HydrophobicContact CZ3-CG 3.81Å; M340-L350 CarbonylContact O-C 3.6Å
351	L	96	Very high	96.4	Very high	9 Å²	9	32.7 Å²	32.7	5%	0.047	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.2	-176.8	-55.9	178.9	0	0	0	109.6	A23 Y321 W339 M340 I342 Q349	A23-L351 HydrophobicContact CB-CD2 3.62Å; Y321-L351 HydrophobicContact CD1-CD1 3.68Å; Y321-L351 HydrophobicContact CD1-CD2 4.35Å; Y321-L351 HydrophobicContact CD2-CD1 4.34Å; Y321-L351 HydrophobicContact CD2-CD2 4.23Å; Y321-L351 HydrophobicContact CE1-CD1 3.96Å; Y321-L351 HydrophobicContact CE1-CD2 3.88Å; Y321-L351 HydrophobicContact CE2-CD2 3.77Å; Y321-L351 HydrophobicContact CG-CD1 3.9Å; W339-L351 WeakPolarHBondContact CA-O 3.07Å; M340-L351 HydrophobicContact CE-CD1 4.2Å; M340-L351 PolarHBondContact N-O 3.25Å; M340-L351 PolarHBondContact O-N 2.92Å; I342-L351 HydrophobicContact CD1-CD1 3.95Å; I342-L351 HydrophobicContact CG1-CD1 4.08Å; I342-L351 HydrophobicContact CG1-CG 4.45Å; I342-L351 HydrophobicContact CG2-CD1 4.14Å; Q349-L351 HydrophobicContact CG-CD2 3.82Å
352	R	93.5	Very high	96.3	Very high	124 Å²	124	35.4 Å²	35.4	47%	0.468	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.6	166	-168.5	177.8	-178.9	175.8	2.7	109	H22 D338 W339	H22-R352 HydrophobicContact CB-CB 4.36Å; H22-R352 PolarHBondContact O-N 2.9Å; D338-R352 CarbonylContact O-C 3.55Å; D338-R352 VanDerWaalsContact O-CA 3.3Å; D338-R352 WeakPolarHBondContact O-CA 3.24Å; W339-R352 HydrophobicContact CD2-CB 4.45Å; W339-R352 HydrophobicContact CE3-CB 4Å; W339-R352 HydrophobicContact CH2-CB 4.02Å; W339-R352 HydrophobicContact CH2-CG 4.48Å; W339-R352 HydrophobicContact CZ2-CB 4.43Å; W339-R352 HydrophobicContact CZ2-CG 4.41Å; W339-R352 HydrophobicContact CZ3-CB 3.79Å
353	V	89.3	Confident	96.1	Very high	75 Å²	75	38.6 Å²	38.6	46%	0.455	18%	0.181	S	C	.	.			trans	-95.8	0	-176.4	179.2	0	0	0	0	111.4	I300 L319 W332 D338 M340	I300-V353 HydrophobicContact CD1-CB 4.34Å; I300-V353 HydrophobicContact CD1-CG1 3.29Å; I300-V353 HydrophobicContact CD1-CG2 4.07Å; L319-V353 HydrophobicContact CD1-CG1 4.35Å; W332-V353 HydrophobicContact CH2-CB 4.24Å; W332-V353 HydrophobicContact CH2-CG1 3.95Å; W332-V353 HydrophobicContact CZ2-CG1 4.19Å; W332-V353 HydrophobicContact CZ2-CG2 4.42Å; D338-V353 PolarHBondContact O-N 2.72Å; M340-V353 HydrophobicContact CB-CG2 4.1Å; M340-V353 HydrophobicContact CE-CG2 3.79Å

Retrieved 353 of 353 residues in 82.1 ms (Link to these results)

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