A0A087YPB9_POEFO Loading...

Protein phosphatase

AlphaFold DB , UniProt , Accession A0A087YPB9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 297 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	39.3	Very low	40.4	Very low	244 Å²	244	145.4 Å²	145.4	100%	1.202	77%	0.772	S	S	*	*				0	87.1	0	-67.6	-175.1	-151.4	0	0	108.5
2	L	39.9	Very low	40.1	Very low	187 Å²	187	138.3 Å²	138.3	98%	0.979	75%	0.75	S	S	*	*			trans	-113.1	90.8	171.2	-86.7	152.9	0	0	0	105.1
3	S	47.5	Very low	39.9	Very low	100 Å²	100	144.3 Å²	144.3	70%	0.699	76%	0.755	S	S	*	*			trans	-151.9	144.7	-175.3	-174.8	0	0	0	0	110.3
4	V	41.9	Very low	39.6	Very low	121 Å²	121	139.2 Å²	139.2	73%	0.733	74%	0.744	S	S	*	*	S	Bend	trans	90.6	-34.6	163.2	-158.6	0	0	0	0	118.9
5	L	42.5	Very low	39.5	Very low	166 Å²	166	137.8 Å²	137.8	87%	0.869	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-15.8	-169.8	-86.1	158	0	0	0	117.1
6	S	40.3	Very low	39.5	Very low	94 Å²	94	137.1 Å²	137.1	66%	0.657	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-28.4	-176.9	-167.4	0	0	0	0	113.9
7	Y	39.4	Very low	39.2	Very low	193 Å²	193	132.8 Å²	132.8	76%	0.757	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-15.8	-176.8	-79.5	-85.4	0	0	0	114	R9	Y7-R9 VanDerWaalsContact C-N 3.33Å; Y7-R9 PolarHBondContact O-N 3.42Å
8	G	36.7	Very low	38.8	Very low	50 Å²	50	129.6 Å²	129.6	52%	0.515	74%	0.735	S	S	.	*	H	α-helix	trans	-72.1	-20.3	178.9	0	0	0	0	0	114.9
9	R	40.5	Very low	39	Very low	220 Å²	220	130.4 Å²	130.4	83%	0.83	74%	0.736	S	S	*	*	H	α-helix	trans	-92.1	-17.7	-179.3	-80.5	-175.4	173.8	-178.4	-1.2	114.6	Y7	Y7-R9 VanDerWaalsContact C-N 3.33Å; Y7-R9 PolarHBondContact O-N 3.42Å
10	L	36.6	Very low	39.2	Very low	132 Å²	132	128.4 Å²	128.4	69%	0.691	73%	0.731	S	S	*	*	H	α-helix	trans	-86.6	-31.6	176.7	-101.4	141.2	0	0	0	112.3
11	V	40.1	Very low	39.2	Very low	92 Å²	92	131.7 Å²	131.7	56%	0.558	74%	0.74	S	S	*	*	H	α-helix	trans	-77.9	-31.8	177	-177	0	0	0	0	111.9	R13 A14 V15	V11-R13 PolarHBondContact O-N 3.24Å; V11-A14 PolarHBondContact O-N 3.15Å; V11-A14 VanDerWaalsContact O-N 3.15Å; V11-V15 HydrophobicContact CG1-CG2 4.34Å; V11-V15 PolarHBondContact O-N 3.25Å
12	A	37	Very low	39.6	Very low	61 Å²	61	125.1 Å²	125.1	50%	0.504	71%	0.714	S	S	.	*	H	α-helix	trans	-66.5	-20.4	175.1	0	0	0	0	0	113.7
13	R	36.8	Very low	40	Very low	216 Å²	216	122.7 Å²	122.7	82%	0.815	70%	0.702	S	S	*	*	H	α-helix	trans	-89.4	-18.9	173.6	-98.7	-177.4	164.5	175.1	-4.9	113.9	V11	V11-R13 PolarHBondContact O-N 3.24Å
14	A	36.7	Very low	40.5	Very low	73 Å²	73	121.5 Å²	121.5	60%	0.603	71%	0.706	S	S	*	*	H	α-helix	trans	-87.8	-26.3	178.5	0	0	0	0	0	112.9	V11 G17	V11-A14 PolarHBondContact O-N 3.15Å; V11-A14 VanDerWaalsContact O-N 3.15Å; A14-G17 PolarHBondContact O-N 3.29Å
15	V	37.5	Very low	42.3	Very low	118 Å²	118	122.9 Å²	122.9	72%	0.715	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-82.6	-13.8	177.4	-178.2	0	0	0	0	112.8	V11	V11-V15 HydrophobicContact CG1-CG2 4.34Å; V11-V15 PolarHBondContact O-N 3.25Å
16	L	39.7	Very low	44.6	Very low	126 Å²	126	117.9 Å²	117.9	66%	0.66	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-83.3	0.3	166.8	-75.1	163.7	0	0	0	113	G18	L16-G18 PolarHBondContact O-N 3.08Å
17	G	33.6	Very low	47.2	Very low	65 Å²	65	115 Å²	115	67%	0.67	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-80.5	11.2	177.3	0	0	0	0	0	115	A14 L19	A14-G17 PolarHBondContact O-N 3.29Å; G17-L19 VanDerWaalsContact C-N 3.35Å
18	G	33.3	Very low	49.9	Very low	75 Å²	75	106 Å²	106	77%	0.773	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-95.7	18.8	169.9	0	0	0	0	0	113.3	L16 S20	L16-G18 PolarHBondContact O-N 3.08Å; G18-S20 PolarHBondContact O-N 3.31Å; G18-S20 VanDerWaalsContact O-N 3.08Å
19	L	41.8	Very low	52.7	Low	145 Å²	145	103.6 Å²	103.6	76%	0.759	59%	0.587	S	S	*	*			trans	-68.6	105.1	165.6	-75	165.6	0	0	0	107.1	G17 Q21	G17-L19 VanDerWaalsContact C-N 3.35Å; L19-Q21 PolarHBondContact O-N 2.77Å; L19-Q21 VanDerWaalsContact O-N 3.09Å
20	S	43.5	Very low	55.4	Low	90 Å²	90	95.1 Å²	95.1	63%	0.629	56%	0.558	S	S	*	*			trans	-31.6	118.2	154.5	176.6	0	0	0	0	108.4	G18 T22	G18-S20 PolarHBondContact O-N 3.31Å; G18-S20 VanDerWaalsContact O-N 3.08Å; S20-T22 PolarHBondContact O-N 3.09Å
21	Q	39.5	Very low	58.3	Low	198 Å²	198	89.4 Å²	89.4	93%	0.925	53%	0.529	S	S	*	.			trans	-63.5	81.2	161.1	-82.8	179.6	-24	0	0	106.3	L19 D23	L19-Q21 PolarHBondContact O-N 2.77Å; L19-Q21 VanDerWaalsContact O-N 3.09Å; Q21-D23 PolarHBondContact O-N 3.16Å; Q21-D23 VanDerWaalsContact O-N 3.16Å
22	T	46.3	Very low	61	Low	106 Å²	106	85 Å²	85	65%	0.65	50%	0.502	S	S	*	.			trans	-69.4	109.2	164.2	53.5	0	0	0	0	105	S20 G24	S20-T22 PolarHBondContact O-N 3.09Å; T22-G24 PolarHBondContact O-N 3.09Å; T22-G24 VanDerWaalsContact O-N 3.09Å
23	D	49.6	Very low	63.8	Low	135 Å²	135	83 Å²	83	72%	0.722	49%	0.485	S	S	*	.			trans	-45.5	117.7	175.3	-155.3	1.3	0	0	0	108.9	Q21 R25	Q21-D23 PolarHBondContact O-N 3.16Å; Q21-D23 VanDerWaalsContact O-N 3.16Å; D23-R25 PolarHBondContact O-N 2.89Å
24	G	57.2	Low	66.6	Low	76 Å²	76	75.8 Å²	75.8	78%	0.784	46%	0.458	S	S	*	.	S	Bend	trans	-79.8	35.9	-152.5	0	0	0	0	0	116	T22	T22-G24 PolarHBondContact O-N 3.09Å; T22-G24 VanDerWaalsContact O-N 3.09Å
25	R	79.8	Confident	69.4	Low	149 Å²	149	72.8 Å²	72.8	56%	0.562	43%	0.434	S	S	*	.			trans	-128.1	123	178.2	-61.4	-174.1	-165.7	178.6	8	110.5	D23 H142 E294	D23-R25 PolarHBondContact O-N 2.89Å; R25-H142 PolarHBondContact O-NE2 2.92Å; R25-E294 WeakPolarHBondContact CD-OE2 3.48Å; R25-E294 IonicContact CZ-OE2 3.93Å; R25-E294 IonicContact NE-OE2 2.72Å; R25-E294 IonicContact NH1-OE1 3.1Å; R25-E294 PolarHBondContact NH1-OE1 3.13Å; R25-E294 IonicContact NH1-OE2 3.49Å; R25-E294 PolarHBondContact NH1-OE2 2.91Å
26	D	90.9	Very high	71.8	Confident	61 Å²	61	68.5 Å²	68.5	33%	0.326	41%	0.406	S	S	.	.			trans	-58.3	149.1	172.6	-77.3	2.6	0	0	0	110.5	R139 Y295	D26-R139 WeakPolarHBondContact CA-O 3.34Å; D26-R139 HydrophobicContact CB-CB 4.18Å; D26-Y295 HydrophobicContact CB-CD1 4.43Å; D26-Y295 HydrophobicContact CB-CG 4.39Å; D26-Y295 WeakPolarHBondContact O-CB 3.35Å; D26-Y295 PolarHBondContact O-N 3.37Å
27	Y	94.8	Very high	74.1	Confident	33 Å²	33	63.4 Å²	63.4	13%	0.129	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	158.6	175.6	-74.4	8.8	0	0	0	112	R139 H142 V205 L207 V292	Y27-R139 PolarHBondContact N-O 2.86Å; Y27-R139 VanDerWaalsContact O-CG 3.3Å; Y27-R139 WeakPolarHBondContact O-CG 3.4Å; Y27-R139 PolarHBondContact O-NH1 3.23Å; Y27-H142 AromaticContact CD1-CD2 3.93Å; Y27-H142 AromaticContact CD1-NE2 3.88Å; Y27-H142 HydrophobicContact CD2-CB 3.92Å; Y27-H142 AromaticContact CD2-CG 3.97Å; Y27-H142 AromaticContact CE1-CE1 3.92Å; Y27-H142 AromaticContact CE1-ND1 3.98Å; Y27-H142 HydrophobicContact CE2-CB 3.96Å; Y27-H142 HydrophobicContact CG-CB 4.47Å; Y27-H142 AromaticContact CG-CD2 3.81Å; Y27-H142 AromaticContact CZ-ND1 3.95Å; Y27-V205 HydrophobicContact CD2-CG2 3.98Å; Y27-V205 HydrophobicContact CE2-CG2 4.36Å; Y27-L207 HydrophobicContact CD1-CD2 3.96Å; Y27-L207 HydrophobicContact CE1-CD1 4.41Å; Y27-L207 HydrophobicContact CE1-CD2 3.74Å; Y27-L207 HydrophobicContact CE1-CG 3.87Å; Y27-L207 HydrophobicContact CE2-CD2 4.42Å; Y27-L207 HydrophobicContact CE2-CG 4.4Å; Y27-L207 HydrophobicContact CG-CD2 4.41Å; Y27-V292 HydrophobicContact CD2-CG1 3.46Å; Y27-V292 VanDerWaalsContact CD2-CG1 3.46Å; Y27-V292 HydrophobicContact CE2-CG1 4.04Å; Y27-V292 HydrophobicContact CG-CG1 4.04Å
28	S	95.4	Very high	76.4	Confident	4 Å²	4	63.6 Å²	63.6	3%	0.028	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	163.6	174.4	81.5	0	0	0	0	112.8	D65 R139 V292 A293 E294	S28-D65 VanDerWaalsContact CA-OD2 3.24Å; S28-D65 WeakPolarHBondContact CA-OD2 3.44Å; S28-R139 VanDerWaalsContact CA-NH1 3.32Å; S28-V292 WeakPolarHBondContact O-CA 3.27Å; S28-A293 PolarHBondContact N-O 2.81Å; S28-A293 PolarHBondContact O-N 3.04Å; S28-E294 PolarHBondContact OG-O 3.28Å
29	L	96.9	Very high	78.3	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	131.8	173.1	-60.9	-178.1	0	0	0	111	T31 R60 D65 L67 L137 I211 I291 V292	L29-T31 WeakPolarHBondContact CB-OG1 3.29Å; L29-R60 PolarHBondContact O-NH1 3.37Å; L29-R60 PolarHBondContact O-NH2 2.87Å; L29-D65 HydrophobicContact CB-CB 4.03Å; L29-D65 HydrophobicContact CD1-CB 3.87Å; L29-D65 HydrophobicContact CG-CB 3.86Å; L29-D65 PolarHBondContact N-OD2 3.13Å; L29-L67 HydrophobicContact CD1-CD1 3.87Å; L29-L67 HydrophobicContact CD1-CG 4.18Å; L29-L137 HydrophobicContact CD1-CB 4.03Å; L29-L137 HydrophobicContact CD2-CB 4.37Å; L29-L137 HydrophobicContact CD2-CD2 3.64Å; L29-L137 HydrophobicContact CG-CB 4.05Å; L29-L137 HydrophobicContact CG-CD2 3.65Å; L29-L137 HydrophobicContact CG-CG 4.49Å; L29-I211 HydrophobicContact CD2-CD1 3.84Å; L29-I291 WeakPolarHBondContact CA-O 3.41Å; L29-V292 HydrophobicContact CD2-CG2 3.96Å
30	I	97	Very high	78.8	Confident	42 Å²	42	64 Å²	64	22%	0.215	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	101.5	161	-59.5	173.5	0	0	0	106.2	S237 V242 S290 I291 A293	I30-S237 WeakPolarHBondContact CD1-O 3.37Å; I30-V242 HydrophobicContact CG2-CG2 4.24Å; I30-S290 VanDerWaalsContact O-CA 3.31Å; I30-S290 WeakPolarHBondContact O-CA 3.15Å; I30-I291 PolarHBondContact N-O 3.27Å; I30-I291 PolarHBondContact O-N 2.98Å; I30-A293 HydrophobicContact CD1-CB 3.77Å; I30-A293 HydrophobicContact CG1-CB 4.06Å
31	T	97	Very high	78.8	Confident	13 Å²	13	69.1 Å²	69.1	8%	0.08	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	136.8	-172.2	-52.5	0	0	0	0	111.6	L29 I58 L67 Y239 L288 L289 S290	L29-T31 WeakPolarHBondContact CB-OG1 3.29Å; T31-I58 HydrophobicContact CG2-CD1 3.57Å; T31-I58 HydrophobicContact CG2-CG1 3.96Å; T31-I58 HydrophobicContact CG2-CG2 4.49Å; T31-L67 HydrophobicContact CG2-CD1 4.19Å; T31-L67 HydrophobicContact CG2-CD2 3.8Å; T31-Y239 VanDerWaalsContact O-CE2 3.3Å; T31-Y239 WeakPolarHBondContact O-CE2 3.37Å; T31-L288 HydrophobicContact CG2-CB 4.49Å; T31-L289 CarbonylContact C-O 3.47Å; T31-L289 VanDerWaalsContact CA-O 3.28Å; T31-L289 WeakPolarHBondContact CA-O 3.44Å; T31-S290 WeakPolarHBondContact CB-OG 3.29Å; T31-S290 WeakPolarHBondContact CG2-OG 3.37Å; T31-S290 WeakPolarHBondContact OG1-CB 3.16Å; T31-S290 PolarHBondContact OG1-OG 3.25Å
32	A	96.6	Very high	78.8	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	154.2	165.9	0	0	0	0	0	110.7	Y239 V242 L243 L288 L289	A32-Y239 HydrophobicContact CB-CD2 4.31Å; A32-Y239 HydrophobicContact CB-CE2 3.81Å; A32-V242 HydrophobicContact CB-CB 4.35Å; A32-V242 HydrophobicContact CB-CG1 3.8Å; A32-L243 HydrophobicContact CB-CB 3.73Å; A32-L243 HydrophobicContact CB-CD1 4.05Å; A32-L243 HydrophobicContact CB-CG 4.49Å; A32-L288 WeakPolarHBondContact O-CA 3.28Å; A32-L289 PolarHBondContact N-O 3.35Å; A32-L289 PolarHBondContact O-N 3.03Å
33	S	96.2	Very high	78.2	Confident	19 Å²	19	67.9 Å²	67.9	13%	0.133	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.7	176.8	72.9	0	0	0	0	112.1	M49 Y51 V287	S33-M49 VanDerWaalsContact CB-CE 3.43Å; S33-M49 VanDerWaalsContact OG-CE 3.22Å; S33-M49 WeakPolarHBondContact OG-CE 3.18Å; S33-Y51 PolarHBondContact OG-OH 3.28Å; S33-V287 CarbonylContact C-O 3.6Å; S33-V287 VanDerWaalsContact CA-O 3.23Å; S33-V287 WeakPolarHBondContact CA-O 3.24Å
34	Y	96.1	Very high	77.6	Confident	64 Å²	64	68.8 Å²	68.8	25%	0.251	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	155.5	169.3	-159.9	-103.2	0	0	0	110.9	F36 Q247 A250 V287	Y34-F36 HydrophobicContact CD1-CE2 4.16Å; Y34-F36 HydrophobicContact CD1-CZ 4.37Å; Y34-F36 HydrophobicContact CE1-CE1 4.24Å; Y34-F36 AromaticContact CE1-CE2 3.79Å; Y34-F36 HydrophobicContact CE1-CE2 3.79Å; Y34-F36 AromaticContact CE1-CZ 3.55Å; Y34-F36 HydrophobicContact CE1-CZ 3.55Å; Y34-Q247 HydrophobicContact CD1-CB 4.2Å; Y34-Q247 HydrophobicContact CD1-CG 3.78Å; Y34-Q247 HydrophobicContact CD2-CG 3.41Å; Y34-Q247 VanDerWaalsContact CD2-CG 3.41Å; Y34-Q247 HydrophobicContact CE1-CB 4.36Å; Y34-Q247 HydrophobicContact CE1-CG 3.96Å; Y34-Q247 HydrophobicContact CE2-CG 3.63Å; Y34-Q247 HydrophobicContact CG-CB 4.29Å; Y34-Q247 HydrophobicContact CG-CG 3.47Å; Y34-Q247 VanDerWaalsContact CG-CG 3.47Å; Y34-A250 HydrophobicContact CD1-CB 3.93Å; Y34-V287 PolarHBondContact N-O 2.83Å; Y34-V287 PolarHBondContact O-N 3.18Å
35	G	93.9	Very high	76.7	Confident	10 Å²	10	73.6 Å²	73.6	10%	0.103	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	173.7	-178.4	0	0	0	0	0	114.6	Y51 I285	G35-Y51 VanDerWaalsContact C-CD1 3.42Å; G35-Y51 WeakPolarHBondContact O-CD1 3.21Å; G35-I285 CarbonylContact C-O 3.57Å; G35-I285 WeakPolarHBondContact CA-O 3.5Å
36	F	88.4	Confident	75.2	Confident	27 Å²	27	70.5 Å²	70.5	12%	0.118	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	144	-179.6	-62.9	-83.6	0	0	0	109.8	Y34 F40 A250 K251 H254 I285	Y34-F36 HydrophobicContact CD1-CE2 4.16Å; Y34-F36 HydrophobicContact CD1-CZ 4.37Å; Y34-F36 HydrophobicContact CE1-CE1 4.24Å; Y34-F36 AromaticContact CE1-CE2 3.79Å; Y34-F36 HydrophobicContact CE1-CE2 3.79Å; Y34-F36 AromaticContact CE1-CZ 3.55Å; Y34-F36 HydrophobicContact CE1-CZ 3.55Å; F36-F40 HydrophobicContact CD1-CE2 4.33Å; F36-A250 HydrophobicContact CD2-CB 4.12Å; F36-A250 HydrophobicContact CE2-CB 3.76Å; F36-A250 WeakPolarHBondContact CE2-O 3.37Å; F36-K251 HydrophobicContact CE2-CG 4.05Å; F36-K251 HydrophobicContact CZ-CG 3.59Å; F36-H254 HydrophobicContact CD2-CB 4.01Å; F36-H254 HydrophobicContact CE2-CB 4.2Å; F36-H254 HydrophobicContact CG-CB 4.43Å; F36-H254 AromaticContact CG-CD2 3.89Å; F36-I285 PolarHBondContact N-O 3.19Å; F36-I285 PolarHBondContact O-N 3.36Å
37	G	88.1	Confident	73.2	Confident	20 Å²	20	77.2 Å²	77.2	21%	0.206	38%	0.377	C	S	.	.			trans	-92.2	139.7	162.1	0	0	0	0	0	110.2	D39 D284	G37-D39 VanDerWaalsContact C-N 3.33Å; G37-D39 PolarHBondContact O-N 2.8Å; G37-D284 WeakPolarHBondContact CA-OD1 3.31Å
38	K	82.1	Confident	71.5	Confident	68 Å²	68	78.5 Å²	78.5	30%	0.296	40%	0.4	S	S	.	.	S	Bend	trans	-53.3	-45.8	175.9	172.9	168.6	57.5	-145.3	0	112.5	F40 Y258 P282 D283 D284	K38-F40 PolarHBondContact O-N 3.01Å; K38-Y258 PolarHBondContact O-OH 3.25Å; K38-P282 HydrophobicContact CD-CB 4.47Å; K38-P282 WeakPolarHBondContact CD-O 3.34Å; K38-D283 IonicContact NZ-OD1 2.66Å; K38-D283 PolarHBondContact NZ-OD1 3.23Å; K38-D284 WeakPolarHBondContact CB-OD1 3.46Å; K38-D284 PolarHBondContact N-OD1 2.83Å
39	D	73.1	Confident	70.9	Confident	68 Å²	68	80.8 Å²	80.8	36%	0.364	41%	0.411	S	S	.	.			trans	-87.9	96.1	177.7	-84.4	-67.5	0	0	0	109.7	G37 R41 R77	G37-D39 VanDerWaalsContact C-N 3.33Å; G37-D39 PolarHBondContact O-N 2.8Å; D39-R41 PolarHBondContact O-N 3.02Å; D39-R41 IonicContact OD1-CZ 3.82Å; D39-R41 IonicContact OD1-NE 3.56Å; D39-R41 IonicContact OD1-NH2 3.1Å; D39-R41 PolarHBondContact OD1-NH2 3.13Å; D39-R41 VanDerWaalsContact OD1-NH2 3.13Å; D39-R77 IonicContact OD2-NH1 2.8Å; D39-R77 PolarHBondContact OD2-NH1 2.81Å
40	F	53.3	Low	70.6	Confident	161 Å²	161	81.9 Å²	81.9	71%	0.706	42%	0.419	S	S	*	.			trans	-65.5	17.5	172.6	-116.7	-84.4	0	0	0	114.3	F36 K38 K42	F36-F40 HydrophobicContact CD1-CE2 4.33Å; K38-F40 PolarHBondContact O-N 3.01Å; F40-K42 PolarHBondContact O-N 2.82Å
41	R	41.8	Very low	70.3	Confident	197 Å²	197	82.1 Å²	82.1	74%	0.743	42%	0.417	S	S	*	.			trans	-69.9	117.8	-178.5	-85.4	-172.8	-94.5	-159	-5.4	109.7	D39 G43	D39-R41 PolarHBondContact O-N 3.02Å; D39-R41 IonicContact OD1-CZ 3.82Å; D39-R41 IonicContact OD1-NE 3.56Å; D39-R41 IonicContact OD1-NH2 3.1Å; D39-R41 PolarHBondContact OD1-NH2 3.13Å; D39-R41 VanDerWaalsContact OD1-NH2 3.13Å; R41-G43 PolarHBondContact O-N 2.7Å
42	K	39.7	Very low	70.2	Confident	217 Å²	217	82.7 Å²	82.7	94%	0.943	43%	0.425	S	S	*	.	S	Bend	trans	-32.7	101.9	164.3	-72.8	177	175.4	176.4	0	111	F40	F40-K42 PolarHBondContact O-N 2.82Å
43	G	34.2	Very low	70.1	Confident	62 Å²	62	83 Å²	83	64%	0.639	43%	0.427	S	S	*	.			trans	174.4	95.5	179.2	0	0	0	0	0	114	R41	R41-G43 PolarHBondContact O-N 2.7Å
44	I	36.4	Very low	70.2	Confident	153 Å²	153	82.1 Å²	82.1	79%	0.785	42%	0.421	S	S	*	.			trans	69.3	105.9	166.5	-47.8	174.2	0	0	0	113.3	K46	I44-K46 VanDerWaalsContact C-N 3.28Å; I44-K46 PolarHBondContact O-N 2.9Å
45	L	38.2	Very low	70.3	Confident	177 Å²	177	79.1 Å²	79.1	93%	0.927	41%	0.409	S	S	*	.			trans	-51.8	98	154.5	-81.1	153.2	0	0	0	107.3	K47	L45-K47 PolarHBondContact O-N 3.34Å
46	K	49.1	Very low	70.5	Confident	84 Å²	84	79 Å²	79	37%	0.365	41%	0.407	S	S	.	.			trans	-61	123.2	172.3	-73.6	-173.9	-174	175.8	0	106.3	I44 G48 C50 G52 S84	I44-K46 VanDerWaalsContact C-N 3.28Å; I44-K46 PolarHBondContact O-N 2.9Å; K46-G48 PolarHBondContact O-N 3.31Å; K46-C50 HydrophobicContact CB-CB 4.27Å; K46-C50 HydrophobicContact CD-CB 4.45Å; K46-G52 PolarHBondContact NZ-O 3.39Å; K46-S84 PolarHBondContact NZ-OG 3.36Å
47	K	48.1	Very low	70.9	Confident	203 Å²	203	77.8 Å²	77.8	88%	0.883	40%	0.401	S	S	*	.	S	Bend	trans	-71.9	113.3	-176.8	-163.5	179.6	-176	-178.1	0	108	L45	L45-K47 PolarHBondContact O-N 3.34Å
48	G	60.2	Low	71.4	Confident	60 Å²	60	78.9 Å²	78.9	62%	0.619	40%	0.402	S	S	*	.	S	Bend	trans	123.4	-170.5	179.7	0	0	0	0	0	112.7	K46 C50	K46-G48 PolarHBondContact O-N 3.31Å; G48-C50 VanDerWaalsContact C-N 3.29Å; G48-C50 PolarHBondContact O-N 3.49Å; G48-C50 VanDerWaalsContact O-N 3.17Å
49	M	83.3	Confident	72.1	Confident	51 Å²	51	75.7 Å²	75.7	25%	0.251	39%	0.389	S	S	.	.	S	Bend	trans	-87.7	63.8	-179.9	-66.8	178.7	62.7	0	0	110.8	S33 C56 I58 L288	S33-M49 VanDerWaalsContact CB-CE 3.43Å; S33-M49 VanDerWaalsContact OG-CE 3.22Å; S33-M49 WeakPolarHBondContact OG-CE 3.18Å; M49-C56 WeakPolarHBondContact CB-O 3.49Å; M49-C56 HydrophobicContact CE-CB 4.48Å; M49-C56 WeakPolarHBondContact CE-SG 3.42Å; M49-C56 PolarHBondContact O-N 3.02Å; M49-C56 PolarHBondContact O-SG 3.38Å; M49-I58 HydrophobicContact CE-CD1 3.66Å; M49-I58 HydrophobicContact CE-CG1 3.67Å; M49-I58 HydrophobicContact SD-CD1 4.4Å; M49-I58 HydrophobicContact SD-CG1 4.29Å; M49-L288 HydrophobicContact CE-CD2 3.85Å
50	C	90	Very high	73.2	Confident	24 Å²	24	78.5 Å²	78.5	16%	0.162	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.6	179.2	-58.3	0	0	0	0	110.8	K46 G48 D54	K46-C50 HydrophobicContact CB-CB 4.27Å; K46-C50 HydrophobicContact CD-CB 4.45Å; G48-C50 VanDerWaalsContact C-N 3.29Å; G48-C50 PolarHBondContact O-N 3.49Å; G48-C50 VanDerWaalsContact O-N 3.17Å; C50-D54 VanDerWaalsContact CA-O 3.32Å; C50-D54 WeakPolarHBondContact CA-O 3.33Å
51	Y	91.4	Very high	75.2	Confident	46 Å²	46	72.4 Å²	72.4	18%	0.18	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	92.1	-176.4	-53.9	-78.3	0	0	0	108.9	S33 G35 D53 D54 D284 T286	S33-Y51 PolarHBondContact OG-OH 3.28Å; G35-Y51 VanDerWaalsContact C-CD1 3.42Å; G35-Y51 WeakPolarHBondContact O-CD1 3.21Å; Y51-D53 PolarHBondContact O-N 3.25Å; Y51-D54 PolarHBondContact N-O 3.23Å; Y51-D54 WeakPolarHBondContact O-CB 3.1Å; Y51-D54 PolarHBondContact O-N 3.11Å; Y51-D284 WeakPolarHBondContact O-CB 3.28Å; Y51-T286 HydrophobicContact CD2-CG2 3.78Å; Y51-T286 VanDerWaalsContact CD2-OG1 3.29Å; Y51-T286 WeakPolarHBondContact CD2-OG1 3.44Å; Y51-T286 HydrophobicContact CE2-CG2 3.97Å
52	G	93.1	Very high	77.6	Confident	25 Å²	25	73.1 Å²	73.1	26%	0.258	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	-121.7	-170.3	0	0	0	0	0	111.9	K46 S84 D284	K46-G52 PolarHBondContact NZ-O 3.39Å; G52-S84 WeakPolarHBondContact O-CB 3.4Å; G52-D284 WeakPolarHBondContact CA-OD1 3.5Å
53	D	95.6	Very high	80.2	Confident	7 Å²	7	64.9 Å²	64.9	4%	0.037	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-9.9	172.8	-62.8	-23.7	0	0	0	113.1	Y51 G72 R77 P83 S84 S87 D284	Y51-D53 PolarHBondContact O-N 3.25Å; D53-G72 PolarHBondContact O-N 2.82Å; D53-R77 IonicContact OD1-NH2 3.13Å; D53-R77 PolarHBondContact OD1-NH2 2.93Å; D53-R77 IonicContact OD2-CZ 3.45Å; D53-R77 IonicContact OD2-NH2 2.98Å; D53-R77 PolarHBondContact OD2-NH2 3.12Å; D53-P83 HydrophobicContact CB-CB 4.03Å; D53-P83 WeakPolarHBondContact OD2-CG 3.17Å; D53-S84 PolarHBondContact OD1-N 3.4Å; D53-S87 WeakPolarHBondContact O-CB 3.41Å; D53-S87 PolarHBondContact O-OG 2.93Å; D53-D284 WeakPolarHBondContact CA-OD2 3.19Å; D53-D284 VanDerWaalsContact CB-OD2 3.28Å; D53-D284 WeakPolarHBondContact CB-OD2 3.3Å; D53-D284 PolarHBondContact N-OD2 2.6Å
54	D	97.6	Very high	83.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	151.5	169.5	-71.3	-12.7	0	0	0	113.1	C50 Y51 A70 D71 T215 D284 I285 T286	C50-D54 VanDerWaalsContact CA-O 3.32Å; C50-D54 WeakPolarHBondContact CA-O 3.33Å; Y51-D54 PolarHBondContact N-O 3.23Å; Y51-D54 WeakPolarHBondContact O-CB 3.1Å; Y51-D54 PolarHBondContact O-N 3.11Å; D54-A70 WeakPolarHBondContact CA-O 3.28Å; D54-D71 WeakPolarHBondContact OD1-CA 3.38Å; D54-D71 WeakPolarHBondContact OD1-CB 3.48Å; D54-T215 HydrophobicContact CB-CG2 4.36Å; D54-T215 WeakPolarHBondContact OD2-CB 3.45Å; D54-T215 WeakPolarHBondContact OD2-CG2 3.19Å; D54-T215 PolarHBondContact OD2-OG1 3.44Å; D54-D284 HydrophobicContact CB-CB 4.34Å; D54-I285 PolarHBondContact OD2-N 2.74Å; D54-T286 WeakPolarHBondContact CB-OG1 3.47Å; D54-T286 VanDerWaalsContact CG-OG1 3.29Å; D54-T286 VanDerWaalsContact OD2-CB 3.3Å; D54-T286 WeakPolarHBondContact OD2-CB 3.47Å; D54-T286 PolarHBondContact OD2-N 2.83Å; D54-T286 PolarHBondContact OD2-OG1 3.23Å
55	A	97.7	Very high	86.1	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.008	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	155.3	166.1	0	0	0	0	0	112.1	V69 A70 A88 M91	A55-V69 CarbonylContact O-C 3.34Å; A55-V69 WeakPolarHBondContact O-CA 3.28Å; A55-A70 PolarHBondContact N-O 3.34Å; A55-A70 PolarHBondContact O-N 3.45Å; A55-A88 VanDerWaalsContact CB-CA 3.46Å; A55-A88 HydrophobicContact CB-CB 4.12Å; A55-M91 HydrophobicContact CB-CB 4.16Å; A55-M91 HydrophobicContact CB-CG 3.88Å
56	C	98.3	Very high	89	Confident	8 Å²	8	46.4 Å²	46.4	5%	0.054	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	170.6	171.5	61.1	0	0	0	0	112.3	M49 G68 V69 T286 L288	M49-C56 WeakPolarHBondContact CB-O 3.49Å; M49-C56 HydrophobicContact CE-CB 4.48Å; M49-C56 WeakPolarHBondContact CE-SG 3.42Å; M49-C56 PolarHBondContact O-N 3.02Å; M49-C56 PolarHBondContact O-SG 3.38Å; C56-G68 CarbonylContact C-O 3.57Å; C56-G68 WeakPolarHBondContact CA-O 3.4Å; C56-G68 WeakPolarHBondContact CB-O 3.08Å; C56-V69 HydrophobicContact CB-CB 4.42Å; C56-V69 HydrophobicContact CB-CG1 3.84Å; C56-T286 HydrophobicContact CB-CG2 3.81Å; C56-L288 HydrophobicContact CB-CD1 4.19Å; C56-L288 HydrophobicContact CB-CD2 4.2Å; C56-L288 HydrophobicContact CB-CG 4.35Å
57	F	98	Very high	91.4	Very high	1 Å²	1	42.4 Å²	42.4	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.1	169.9	75.3	-89.6	0	0	0	111.8	A59 V66 L67 G68 M91 C94 E95 V98	F57-A59 HydrophobicContact CD2-CB 3.9Å; F57-A59 HydrophobicContact CE2-CB 3.99Å; F57-V66 HydrophobicContact CE2-CB 4.25Å; F57-V66 HydrophobicContact CE2-CG1 3.85Å; F57-V66 HydrophobicContact CZ-CG1 3.9Å; F57-L67 WeakPolarHBondContact O-CA 3.35Å; F57-G68 PolarHBondContact N-O 3.02Å; F57-G68 PolarHBondContact O-N 2.73Å; F57-G68 VanDerWaalsContact O-N 3.13Å; F57-M91 HydrophobicContact CD1-CB 4Å; F57-M91 HydrophobicContact CD1-CG 4.39Å; F57-M91 WeakPolarHBondContact CD1-O 3.26Å; F57-M91 HydrophobicContact CD1-SD 3.63Å; F57-M91 HydrophobicContact CE1-CE 4.47Å; F57-M91 HydrophobicContact CE1-SD 3.85Å; F57-C94 HydrophobicContact CD1-CB 4.27Å; F57-C94 HydrophobicContact CE1-CB 3.53Å; F57-C94 HydrophobicContact CZ-CB 3.84Å; F57-E95 HydrophobicContact CB-CB 3.81Å; F57-E95 HydrophobicContact CB-CG 3.99Å; F57-E95 HydrophobicContact CD2-CB 3.76Å; F57-E95 HydrophobicContact CD2-CG 3.94Å; F57-E95 HydrophobicContact CE2-CB 4.48Å; F57-E95 HydrophobicContact CG-CB 3.78Å; F57-E95 HydrophobicContact CG-CG 4.22Å; F57-V98 HydrophobicContact CE2-CG2 4.5Å
58	I	97.7	Very high	93.8	Very high	44 Å²	44	32.8 Å²	32.8	23%	0.226	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.4	169.8	-58.2	168	0	0	0	106.8	T31 M49 L67 L288	T31-I58 HydrophobicContact CG2-CD1 3.57Å; T31-I58 HydrophobicContact CG2-CG1 3.96Å; T31-I58 HydrophobicContact CG2-CG2 4.49Å; M49-I58 HydrophobicContact CE-CD1 3.66Å; M49-I58 HydrophobicContact CE-CG1 3.67Å; M49-I58 HydrophobicContact SD-CD1 4.4Å; M49-I58 HydrophobicContact SD-CG1 4.29Å; I58-L67 HydrophobicContact CB-CD2 4.12Å; I58-L67 HydrophobicContact CG1-CD2 3.92Å; I58-L67 HydrophobicContact CG2-CD2 3.76Å; I58-L288 HydrophobicContact CD1-CD2 4.19Å; I58-L288 HydrophobicContact CG1-CD2 4.12Å
59	A	97.3	Very high	95.6	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.008	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.3	-179.9	0	0	0	0	0	110.7	F57 V66 E95 V98 K99	F57-A59 HydrophobicContact CD2-CB 3.9Å; F57-A59 HydrophobicContact CE2-CB 3.99Å; A59-V66 PolarHBondContact N-O 2.97Å; A59-V66 PolarHBondContact O-N 2.85Å; A59-E95 HydrophobicContact CB-CG 4.1Å; A59-V98 HydrophobicContact CB-CB 3.92Å; A59-V98 HydrophobicContact CB-CG1 3.6Å; A59-K99 HydrophobicContact CB-CG 4.45Å
60	R	95.3	Very high	96.3	Very high	126 Å²	126	27.5 Å²	27.5	48%	0.475	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.9	170.6	-52.1	-174.9	82.9	101.4	-6.7	108.9	L29 D65	L29-R60 PolarHBondContact O-NH1 3.37Å; L29-R60 PolarHBondContact O-NH2 2.87Å; R60-D65 VanDerWaalsContact CG-OD1 3.28Å; R60-D65 WeakPolarHBondContact CG-OD1 3.22Å; R60-D65 IonicContact CZ-OD1 3.95Å; R60-D65 IonicContact NE-OD1 2.58Å; R60-D65 PolarHBondContact NE-OD1 3.32Å; R60-D65 IonicContact NH2-OD1 3.74Å; R60-D65 IonicContact NH2-OD2 2.91Å
61	H	95.4	Very high	96.7	Very high	33 Å²	33	27 Å²	27	15%	0.153	12%	0.122	C	C	.	.			trans	-119.9	166.2	167.8	-173.6	-103	0	0	0	109.7	T63 A64 V98 F103 R139	H61-T63 PolarHBondContact ND1-N 2.66Å; H61-T63 PolarHBondContact ND1-OG1 3.19Å; H61-T63 PolarHBondContact O-N 3.22Å; H61-T63 VanDerWaalsContact O-N 3.13Å; H61-A64 CarbonylContact C-O 3.56Å; H61-A64 WeakPolarHBondContact CA-O 3.31Å; H61-A64 PolarHBondContact N-O 2.92Å; H61-A64 PolarHBondContact O-N 2.9Å; H61-V98 HydrophobicContact CB-CG1 4.15Å; H61-V98 PolarHBondContact CD2-O 2.86Å; H61-F103 HydrophobicContact CB-CE1 3.87Å; H61-F103 HydrophobicContact CB-CZ 3.82Å; H61-F103 AromaticContact CG-CE1 3.69Å; H61-F103 AromaticContact CG-CZ 3.96Å; H61-F103 AromaticContact ND1-CE1 3.75Å; H61-F103 AromaticContact ND1-CZ 3.87Å; H61-R139 PolarHBondContact O-NE 2.85Å; H61-R139 PolarHBondContact O-NH2 2.88Å
62	R	92.9	Very high	97	Very high	213 Å²	213	24.8 Å²	24.8	80%	0.804	11%	0.114	S	C	*	.	S	Bend	trans	-56.3	-30.4	-178.8	-40.2	179	-164.1	-174.3	2.2	112.6
63	T	94.4	Very high	97.2	Very high	43 Å²	43	25.1 Å²	25.1	26%	0.264	11%	0.111	S	C	.	.	S	Bend	trans	-110	-13.9	-173	54.7	0	0	0	0	113.4	H61 R139	H61-T63 PolarHBondContact ND1-N 2.66Å; H61-T63 PolarHBondContact ND1-OG1 3.19Å; H61-T63 PolarHBondContact O-N 3.22Å; H61-T63 VanDerWaalsContact O-N 3.13Å; T63-R139 WeakPolarHBondContact O-CB 3.46Å; T63-R139 WeakPolarHBondContact O-CG 3.41Å; T63-R139 PolarHBondContact O-N 3.35Å
64	A	97.4	Very high	97.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	153	-174.4	0	0	0	0	0	112.7	H61 V66 F103 P105 V136 L137	H61-A64 CarbonylContact C-O 3.56Å; H61-A64 WeakPolarHBondContact CA-O 3.31Å; H61-A64 PolarHBondContact N-O 2.92Å; H61-A64 PolarHBondContact O-N 2.9Å; A64-V66 HydrophobicContact CB-CG2 4.2Å; A64-F103 HydrophobicContact CB-CE2 3.87Å; A64-F103 HydrophobicContact CB-CZ 3.96Å; A64-P105 HydrophobicContact CB-CB 4.18Å; A64-P105 HydrophobicContact CB-CG 4.18Å; A64-V136 HydrophobicContact CB-CG1 3.86Å; A64-L137 CarbonylContact C-O 3.58Å; A64-L137 WeakPolarHBondContact CA-O 3.23Å; A64-L137 VanDerWaalsContact CB-O 3.27Å; A64-L137 WeakPolarHBondContact CB-O 3.28Å
65	D	98.1	Very high	96.8	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	129.9	158.4	-73.2	-46.1	0	0	0	108.2	S28 L29 R60 L137 R139	S28-D65 VanDerWaalsContact CA-OD2 3.24Å; S28-D65 WeakPolarHBondContact CA-OD2 3.44Å; L29-D65 HydrophobicContact CB-CB 4.03Å; L29-D65 HydrophobicContact CD1-CB 3.87Å; L29-D65 HydrophobicContact CG-CB 3.86Å; L29-D65 PolarHBondContact N-OD2 3.13Å; R60-D65 VanDerWaalsContact CG-OD1 3.28Å; R60-D65 WeakPolarHBondContact CG-OD1 3.22Å; R60-D65 IonicContact CZ-OD1 3.95Å; R60-D65 IonicContact NE-OD1 2.58Å; R60-D65 PolarHBondContact NE-OD1 3.32Å; R60-D65 IonicContact NH2-OD1 3.74Å; R60-D65 IonicContact NH2-OD2 2.91Å; D65-L137 HydrophobicContact CB-CB 4.39Å; D65-L137 PolarHBondContact N-O 3.16Å; D65-L137 PolarHBondContact O-N 3.07Å; D65-R139 IonicContact OD1-CZ 3.49Å; D65-R139 IonicContact OD1-NH1 2.66Å; D65-R139 IonicContact OD1-NH2 3.65Å; D65-R139 PolarHBondContact OD1-NH2 2.77Å; D65-R139 IonicContact OD2-CZ 3.77Å; D65-R139 VanDerWaalsContact OD2-CZ 3.27Å; D65-R139 IonicContact OD2-NH1 3.1Å; D65-R139 PolarHBondContact OD2-NH1 3.14Å; D65-R139 IonicContact OD2-NH2 3.11Å; D65-R139 PolarHBondContact OD2-NH2 3.45Å; D65-R139 VanDerWaalsContact OD2-NH2 3.14Å
66	V	98.7	Very high	96.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	132.2	-176	-171	0	0	0	0	110.5	F57 A59 A64 V98 F103 I111 I134 V135 V136	F57-V66 HydrophobicContact CE2-CB 4.25Å; F57-V66 HydrophobicContact CE2-CG1 3.85Å; F57-V66 HydrophobicContact CZ-CG1 3.9Å; A59-V66 PolarHBondContact N-O 2.97Å; A59-V66 PolarHBondContact O-N 2.85Å; A64-V66 HydrophobicContact CB-CG2 4.2Å; V66-V98 HydrophobicContact CB-CG1 3.95Å; V66-V98 HydrophobicContact CB-CG2 3.94Å; V66-V98 HydrophobicContact CG1-CG2 3.89Å; V66-V98 HydrophobicContact CG2-CB 4.45Å; V66-V98 HydrophobicContact CG2-CG1 3.61Å; V66-V98 HydrophobicContact CG2-CG2 3.92Å; V66-F103 HydrophobicContact CG2-CE2 3.93Å; V66-F103 HydrophobicContact CG2-CZ 4.25Å; V66-I111 HydrophobicContact CG1-CD1 4.09Å; V66-I134 HydrophobicContact CG1-CG2 3.92Å; V66-V135 CarbonylContact C-O 3.55Å; V66-V135 WeakPolarHBondContact CA-O 3.19Å; V66-V136 HydrophobicContact CB-CG2 4.45Å; V66-V136 HydrophobicContact CG1-CG2 3.8Å; V66-V136 HydrophobicContact CG2-CB 4.48Å; V66-V136 HydrophobicContact CG2-CG1 4.07Å; V66-V136 HydrophobicContact CG2-CG2 4.05Å
67	L	98.3	Very high	96.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	149.2	179.9	-49.3	178.9	0	0	0	108.6	L29 T31 F57 I58 I134 V135 L288 S290	L29-L67 HydrophobicContact CD1-CD1 3.87Å; L29-L67 HydrophobicContact CD1-CG 4.18Å; T31-L67 HydrophobicContact CG2-CD1 4.19Å; T31-L67 HydrophobicContact CG2-CD2 3.8Å; F57-L67 WeakPolarHBondContact O-CA 3.35Å; I58-L67 HydrophobicContact CB-CD2 4.12Å; I58-L67 HydrophobicContact CG1-CD2 3.92Å; I58-L67 HydrophobicContact CG2-CD2 3.76Å; L67-I134 WeakPolarHBondContact O-CA 3.46Å; L67-V135 HydrophobicContact CB-CB 4.4Å; L67-V135 PolarHBondContact N-O 3.23Å; L67-V135 PolarHBondContact O-N 2.8Å; L67-L288 HydrophobicContact CB-CD1 3.94Å; L67-S290 WeakPolarHBondContact CD1-OG 3.26Å
68	G	98.6	Very high	96.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	148.4	168.6	0	0	0	0	0	112.5	C56 F57 M91 C133	C56-G68 CarbonylContact C-O 3.57Å; C56-G68 WeakPolarHBondContact CA-O 3.4Å; C56-G68 WeakPolarHBondContact CB-O 3.08Å; F57-G68 PolarHBondContact N-O 3.02Å; F57-G68 PolarHBondContact O-N 2.73Å; F57-G68 VanDerWaalsContact O-N 3.13Å; G68-M91 VanDerWaalsContact C-SD 3.57Å; G68-C133 CarbonylContact C-O 3.43Å; G68-C133 WeakPolarHBondContact CA-O 3.46Å
69	V	98.8	Very high	95.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	150.7	170	-59	0	0	0	0	108.9	A55 C56 A132 C133 T213 T215 T286 L288	A55-V69 CarbonylContact O-C 3.34Å; A55-V69 WeakPolarHBondContact O-CA 3.28Å; C56-V69 HydrophobicContact CB-CB 4.42Å; C56-V69 HydrophobicContact CB-CG1 3.84Å; V69-A132 WeakPolarHBondContact O-CA 3.4Å; V69-C133 HydrophobicContact CG2-CB 3.82Å; V69-C133 PolarHBondContact N-O 2.86Å; V69-C133 PolarHBondContact O-N 2.79Å; V69-T213 HydrophobicContact CG1-CG2 4.01Å; V69-T213 HydrophobicContact CG2-CG2 3.81Å; V69-T215 HydrophobicContact CB-CG2 4.13Å; V69-T215 HydrophobicContact CG2-CG2 4.34Å; V69-T286 HydrophobicContact CG1-CG2 4.15Å; V69-L288 HydrophobicContact CG1-CD1 3.69Å; V69-L288 HydrophobicContact CG1-CG 3.87Å
70	A	98.6	Very high	95.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	134	172.7	0	0	0	0	0	109.2	D54 A55 M91 T131	D54-A70 WeakPolarHBondContact CA-O 3.28Å; A55-A70 PolarHBondContact N-O 3.34Å; A55-A70 PolarHBondContact O-N 3.45Å; A70-M91 HydrophobicContact CB-CE 3.77Å; A70-M91 HydrophobicContact CB-CG 3.85Å; A70-M91 HydrophobicContact CB-SD 4Å; A70-T131 WeakPolarHBondContact CA-O 3.4Å; A70-T131 WeakPolarHBondContact CB-O 3.25Å
71	D	98.4	Very high	95.5	Very high	13 Å²	13	46.5 Å²	46.5	7%	0.07	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123	171.1	166.2	30.3	0	0	0	109.7	D54 S130 T131 T215	D54-D71 WeakPolarHBondContact OD1-CA 3.38Å; D54-D71 WeakPolarHBondContact OD1-CB 3.48Å; D71-S130 CarbonylContact O-C 3.45Å; D71-S130 WeakPolarHBondContact O-CA 3.41Å; D71-S130 WeakPolarHBondContact O-CB 3.24Å; D71-T131 WeakPolarHBondContact CB-OG1 3.32Å; D71-T131 PolarHBondContact N-OG1 2.91Å; D71-T131 PolarHBondContact O-N 2.92Å; D71-T215 HydrophobicContact CB-CG2 4.02Å
72	G	97.9	Very high	95.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-80.5	121.9	177.4	0	0	0	0	0	111.6	D53 G74 S129	D53-G72 PolarHBondContact O-N 2.82Å; G72-G74 PolarHBondContact O-N 3.14Å; G72-S129 WeakPolarHBondContact CA-O 3.27Å
73	V	96.4	Very high	95.5	Very high	32 Å²	32	37.8 Å²	37.8	19%	0.194	22%	0.219	C	C	.	.			trans	-63	113.5	-172.3	178.3	0	0	0	0	111.6	G75 W76 P83 S129 Q178	V73-G75 PolarHBondContact O-N 3.17Å; V73-W76 VanDerWaalsContact O-CD1 3.3Å; V73-W76 PolarHBondContact O-N 2.81Å; V73-P83 WeakPolarHBondContact O-CB 3.47Å; V73-S129 VanDerWaalsContact CB-OG 3.29Å; V73-S129 WeakPolarHBondContact CB-OG 3.35Å; V73-S129 VanDerWaalsContact CG2-OG 3.26Å; V73-S129 WeakPolarHBondContact CG2-OG 3.15Å; V73-S129 PolarHBondContact N-O 3.37Å; V73-Q178 HydrophobicContact CG2-CB 4.41Å
74	G	93.3	Very high	95.6	Very high	39 Å²	39	36 Å²	36	40%	0.402	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-58.2	-25.6	-172.8	0	0	0	0	0	115.8	G72 W76 R77	G72-G74 PolarHBondContact O-N 3.14Å; G74-W76 PolarHBondContact O-N 3.38Å; G74-W76 VanDerWaalsContact O-N 3.12Å; G74-R77 VanDerWaalsContact O-CB 3.24Å; G74-R77 WeakPolarHBondContact O-CB 3.1Å; G74-R77 PolarHBondContact O-N 3.04Å; G74-R77 VanDerWaalsContact O-N 3.07Å
75	G	92.3	Very high	95.5	Very high	40 Å²	40	41 Å²	41	41%	0.412	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-60.5	-21.5	-177.9	0	0	0	0	0	114.8	V73 R77 D78	V73-G75 PolarHBondContact O-N 3.17Å; G75-R77 PolarHBondContact O-N 2.96Å; G75-D78 PolarHBondContact O-N 2.79Å
76	W	94.1	Very high	95.4	Very high	19 Å²	19	40.8 Å²	40.8	7%	0.072	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-61.7	-24.1	174.5	-77.9	102.4	0	0	0	113.9	V73 G74 D78 Y79 G80 V81 P83 G128 S129 P183 V190	V73-W76 VanDerWaalsContact O-CD1 3.3Å; V73-W76 PolarHBondContact O-N 2.81Å; G74-W76 PolarHBondContact O-N 3.38Å; G74-W76 VanDerWaalsContact O-N 3.12Å; W76-D78 PolarHBondContact O-N 3.49Å; W76-Y79 WeakPolarHBondContact O-CA 3.24Å; W76-Y79 PolarHBondContact O-N 3.38Å; W76-G80 PolarHBondContact O-N 2.84Å; W76-V81 CarbonylContact C-O 3.25Å; W76-V81 VanDerWaalsContact C-O 3.25Å; W76-V81 HydrophobicContact CB-CB 3.98Å; W76-V81 HydrophobicContact CB-CG1 4.03Å; W76-V81 HydrophobicContact CD2-CG1 4.37Å; W76-V81 HydrophobicContact CE3-CB 3.99Å; W76-V81 HydrophobicContact CE3-CG1 4.06Å; W76-V81 HydrophobicContact CE3-CG2 4.04Å; W76-V81 HydrophobicContact CG-CG1 4.38Å; W76-V81 PolarHBondContact O-N 3.4Å; W76-V81 VanDerWaalsContact O-N 3.14Å; W76-P83 HydrophobicContact CB-CG 4.22Å; W76-G128 VanDerWaalsContact NE1-C 3.32Å; W76-S129 PolarHBondContact NE1-OG 2.88Å; W76-P183 HydrophobicContact CZ3-CG 4.25Å; W76-V190 HydrophobicContact CH2-CG1 3.98Å; W76-V190 HydrophobicContact CH2-CG2 4.12Å; W76-V190 HydrophobicContact CZ2-CG1 3.61Å
77	R	93.4	Very high	95.4	Very high	110 Å²	110	40.8 Å²	40.8	42%	0.415	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-61.3	-32.2	179.5	-163.2	176.2	-65.7	-176.3	-2	112.4	D39 D53 G74 G75 Y79 G80 V81 P83	D39-R77 IonicContact OD2-NH1 2.8Å; D39-R77 PolarHBondContact OD2-NH1 2.81Å; D53-R77 IonicContact OD1-NH2 3.13Å; D53-R77 PolarHBondContact OD1-NH2 2.93Å; D53-R77 IonicContact OD2-CZ 3.45Å; D53-R77 IonicContact OD2-NH2 2.98Å; D53-R77 PolarHBondContact OD2-NH2 3.12Å; G74-R77 VanDerWaalsContact O-CB 3.24Å; G74-R77 WeakPolarHBondContact O-CB 3.1Å; G74-R77 PolarHBondContact O-N 3.04Å; G74-R77 VanDerWaalsContact O-N 3.07Å; G75-R77 PolarHBondContact O-N 2.96Å; R77-Y79 PolarHBondContact O-N 2.95Å; R77-G80 PolarHBondContact O-N 2.83Å; R77-V81 WeakPolarHBondContact CA-O 3.3Å; R77-V81 PolarHBondContact N-O 3.06Å; R77-P83 HydrophobicContact CB-CG 4.49Å
78	D	91.8	Very high	95.3	Very high	146 Å²	146	41.3 Å²	41.3	78%	0.781	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-66.6	-20.1	176.6	-67.8	-21.4	0	0	0	112.6	G75 W76	G75-D78 PolarHBondContact O-N 2.79Å; W76-D78 PolarHBondContact O-N 3.49Å
79	Y	90.1	Very high	95.3	Very high	185 Å²	185	42.7 Å²	42.7	73%	0.725	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-99.5	9.1	176.1	-58.5	-86.4	0	0	0	112.7	W76 R77 V81	W76-Y79 WeakPolarHBondContact O-CA 3.24Å; W76-Y79 PolarHBondContact O-N 3.38Å; R77-Y79 PolarHBondContact O-N 2.95Å; Y79-V81 PolarHBondContact O-N 3.37Å
80	G	92.1	Very high	95.2	Very high	74 Å²	74	42.7 Å²	42.7	76%	0.763	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.5	16.3	-178.1	0	0	0	0	0	114.1	W76 R77	W76-G80 PolarHBondContact O-N 2.84Å; R77-G80 PolarHBondContact O-N 2.83Å
81	V	93.8	Very high	95.2	Very high	24 Å²	24	42.8 Å²	42.8	15%	0.145	25%	0.245	C	C	.	.			trans	-98.5	129.6	176	174.1	0	0	0	0	108.6	W76 R77 Y79 P83 L127	W76-V81 CarbonylContact C-O 3.25Å; W76-V81 VanDerWaalsContact C-O 3.25Å; W76-V81 HydrophobicContact CB-CB 3.98Å; W76-V81 HydrophobicContact CB-CG1 4.03Å; W76-V81 HydrophobicContact CD2-CG1 4.37Å; W76-V81 HydrophobicContact CE3-CB 3.99Å; W76-V81 HydrophobicContact CE3-CG1 4.06Å; W76-V81 HydrophobicContact CE3-CG2 4.04Å; W76-V81 HydrophobicContact CG-CG1 4.38Å; W76-V81 PolarHBondContact O-N 3.4Å; W76-V81 VanDerWaalsContact O-N 3.14Å; R77-V81 WeakPolarHBondContact CA-O 3.3Å; R77-V81 PolarHBondContact N-O 3.06Å; Y79-V81 PolarHBondContact O-N 3.37Å; V81-P83 VanDerWaalsContact O-CD 3.29Å; V81-P83 WeakPolarHBondContact O-CD 3.37Å; V81-L127 HydrophobicContact CG1-CB 4.1Å; V81-L127 WeakPolarHBondContact CG1-O 3.45Å; V81-L127 HydrophobicContact CG2-CB 4.07Å; V81-L127 HydrophobicContact CG2-CD1 4.36Å
82	D	94.4	Very high	95.2	Very high	63 Å²	63	48.6 Å²	48.6	34%	0.337	27%	0.266	S	S	.	.			trans	-81.1	109.5	178.4	175.9	-3.1	0	0	0	109.9	S84 Q85	D82-S84 VanDerWaalsContact CG-OG 3.28Å; D82-S84 PolarHBondContact O-N 3.11Å; D82-S84 WeakPolarHBondContact OD1-CB 3.49Å; D82-S84 PolarHBondContact OD1-N 2.82Å; D82-S84 PolarHBondContact OD1-OG 3.13Å; D82-S84 PolarHBondContact OD2-OG 3.17Å; D82-Q85 HydrophobicContact CB-CG 3.98Å; D82-Q85 PolarHBondContact O-N 3.5Å; D82-Q85 VanDerWaalsContact O-N 3.16Å
83	P	95.5	Very high	95.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-33.2	-172.9	-19.3	31.3	0	0	0	112.8	D53 V73 W76 R77 V81 Q85 F86	D53-P83 HydrophobicContact CB-CB 4.03Å; D53-P83 WeakPolarHBondContact OD2-CG 3.17Å; V73-P83 WeakPolarHBondContact O-CB 3.47Å; W76-P83 HydrophobicContact CB-CG 4.22Å; R77-P83 HydrophobicContact CB-CG 4.49Å; V81-P83 VanDerWaalsContact O-CD 3.29Å; V81-P83 WeakPolarHBondContact O-CD 3.37Å; P83-Q85 PolarHBondContact O-N 2.65Å; P83-Q85 VanDerWaalsContact O-N 3.12Å; P83-F86 PolarHBondContact O-N 3.22Å
84	S	95.4	Very high	95.3	Very high	7 Å²	7	48 Å²	48	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-23.1	179.9	75.9	0	0	0	0	114.5	K46 G52 D53 D82 F86 S87 A88	K46-S84 PolarHBondContact NZ-OG 3.36Å; G52-S84 WeakPolarHBondContact O-CB 3.4Å; D53-S84 PolarHBondContact OD1-N 3.4Å; D82-S84 VanDerWaalsContact CG-OG 3.28Å; D82-S84 PolarHBondContact O-N 3.11Å; D82-S84 WeakPolarHBondContact OD1-CB 3.49Å; D82-S84 PolarHBondContact OD1-N 2.82Å; D82-S84 PolarHBondContact OD1-OG 3.13Å; D82-S84 PolarHBondContact OD2-OG 3.17Å; S84-F86 VanDerWaalsContact C-N 3.32Å; S84-S87 PolarHBondContact O-OG 3.24Å; S84-A88 WeakPolarHBondContact O-CB 3.32Å; S84-A88 PolarHBondContact O-N 3.2Å
85	Q	95.4	Very high	95.5	Very high	103 Å²	103	48.4 Å²	48.4	48%	0.481	25%	0.253	S	S	.	.	H	α-helix	trans	-69.4	-35.9	-179.2	-62.6	-171	40.3	0	0	111.1	D82 P83 T89 L126	D82-Q85 HydrophobicContact CB-CG 3.98Å; D82-Q85 PolarHBondContact O-N 3.5Å; D82-Q85 VanDerWaalsContact O-N 3.16Å; P83-Q85 PolarHBondContact O-N 2.65Å; P83-Q85 VanDerWaalsContact O-N 3.12Å; Q85-T89 VanDerWaalsContact O-CB 3.24Å; Q85-T89 WeakPolarHBondContact O-CB 3.18Å; Q85-T89 PolarHBondContact O-N 3.27Å; Q85-T89 VanDerWaalsContact O-N 3.11Å; Q85-T89 PolarHBondContact O-OG1 2.94Å; Q85-L126 HydrophobicContact CB-CD1 3.75Å
86	F	97	Very high	95.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.7	-59.1	179.5	-167.3	-79	0	0	0	110.8	P83 S84 A88 T89 L90 Y116 L119 L126 G128 S130 L179 I181	P83-F86 PolarHBondContact O-N 3.22Å; S84-F86 VanDerWaalsContact C-N 3.32Å; F86-A88 PolarHBondContact O-N 2.98Å; F86-T89 PolarHBondContact O-N 2.81Å; F86-L90 HydrophobicContact CE1-CD2 4.42Å; F86-L90 WeakPolarHBondContact O-CB 3.22Å; F86-L90 PolarHBondContact O-N 2.94Å; F86-Y116 HydrophobicContact CZ-CD2 4.26Å; F86-Y116 HydrophobicContact CZ-CE2 4.06Å; F86-L119 HydrophobicContact CZ-CD2 4.42Å; F86-L126 HydrophobicContact CD2-CG 4.46Å; F86-G128 VanDerWaalsContact CD2-C 3.4Å; F86-G128 WeakPolarHBondContact CD2-O 3.27Å; F86-G128 WeakPolarHBondContact CE2-O 3.45Å; F86-S130 VanDerWaalsContact CD1-OG 3.31Å; F86-S130 WeakPolarHBondContact CD1-OG 3.19Å; F86-S130 WeakPolarHBondContact CE1-OG 3.43Å; F86-L179 HydrophobicContact CE1-CB 4.12Å; F86-L179 HydrophobicContact CZ-CB 4.07Å; F86-L179 WeakPolarHBondContact CZ-O 3.44Å; F86-I181 HydrophobicContact CE2-CB 4.12Å; F86-I181 HydrophobicContact CE2-CD1 3.92Å; F86-I181 HydrophobicContact CE2-CG1 3.77Å
87	S	97.7	Very high	96	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.6	-46.9	179.8	58.5	0	0	0	0	111.7	D53 S84 T89 L90 M91	D53-S87 WeakPolarHBondContact O-CB 3.41Å; D53-S87 PolarHBondContact O-OG 2.93Å; S84-S87 PolarHBondContact O-OG 3.24Å; S87-T89 PolarHBondContact O-N 2.97Å; S87-L90 PolarHBondContact O-N 3.45Å; S87-M91 WeakPolarHBondContact O-CG 3.32Å; S87-M91 PolarHBondContact O-N 3.47Å
88	A	97	Very high	96.3	Very high	12 Å²	12	44.2 Å²	44.2	10%	0.099	23%	0.225	C	C	.	.	H	α-helix	trans	-65.5	-37	-179.5	0	0	0	0	0	113.2	A55 S84 F86 R92	A55-A88 VanDerWaalsContact CB-CA 3.46Å; A55-A88 HydrophobicContact CB-CB 4.12Å; S84-A88 WeakPolarHBondContact O-CB 3.32Å; S84-A88 PolarHBondContact O-N 3.2Å; F86-A88 PolarHBondContact O-N 2.98Å; A88-R92 VanDerWaalsContact O-CB 3.25Å; A88-R92 WeakPolarHBondContact O-CB 3.31Å; A88-R92 PolarHBondContact O-N 2.89Å; A88-R92 VanDerWaalsContact O-N 3.12Å
89	T	96.9	Very high	96.5	Very high	30 Å²	30	42.9 Å²	42.9	18%	0.184	21%	0.213	C	C	.	.	H	α-helix	trans	-74.1	-40.2	177.9	-54.5	0	0	0	0	110.7	Q85 F86 S87 R92 T93 L119 L126	Q85-T89 VanDerWaalsContact O-CB 3.24Å; Q85-T89 WeakPolarHBondContact O-CB 3.18Å; Q85-T89 PolarHBondContact O-N 3.27Å; Q85-T89 VanDerWaalsContact O-N 3.11Å; Q85-T89 PolarHBondContact O-OG1 2.94Å; F86-T89 PolarHBondContact O-N 2.81Å; S87-T89 PolarHBondContact O-N 2.97Å; T89-R92 PolarHBondContact O-N 2.82Å; T89-T93 WeakPolarHBondContact O-CB 3.28Å; T89-T93 PolarHBondContact O-N 2.95Å; T89-T93 PolarHBondContact O-OG1 2.88Å; T89-L119 HydrophobicContact CG2-CD1 4.08Å; T89-L119 HydrophobicContact CG2-CG 4.13Å; T89-L126 VanDerWaalsContact CB-CD2 3.43Å; T89-L126 HydrophobicContact CG2-CD2 3.76Å
90	L	98.3	Very high	96.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-51.2	175.6	-178.7	63.7	0	0	0	111.4	F86 S87 R92 T93 C94 L112 L119 A132 L179	F86-L90 HydrophobicContact CE1-CD2 4.42Å; F86-L90 WeakPolarHBondContact O-CB 3.22Å; F86-L90 PolarHBondContact O-N 2.94Å; S87-L90 PolarHBondContact O-N 3.45Å; L90-R92 PolarHBondContact O-N 2.83Å; L90-T93 PolarHBondContact O-N 2.85Å; L90-C94 PolarHBondContact O-N 3.29Å; L90-C94 PolarHBondContact O-SG 2.8Å; L90-L112 HydrophobicContact CD1-CD1 4.39Å; L90-L112 HydrophobicContact CD2-CD1 4.16Å; L90-L119 HydrophobicContact CB-CD2 3.95Å; L90-L119 HydrophobicContact CD1-CD2 4.3Å; L90-A132 HydrophobicContact CD2-CB 4.15Å; L90-L179 HydrophobicContact CD1-CD1 4.49Å; L90-L179 HydrophobicContact CD2-CD1 4.02Å
91	M	98.4	Very high	97.2	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-41.5	179.7	-68.9	-60.6	96.7	0	0	112.4	A55 F57 G68 A70 S87 T93 C94 E95 A132	A55-M91 HydrophobicContact CB-CB 4.16Å; A55-M91 HydrophobicContact CB-CG 3.88Å; F57-M91 HydrophobicContact CD1-CB 4Å; F57-M91 HydrophobicContact CD1-CG 4.39Å; F57-M91 WeakPolarHBondContact CD1-O 3.26Å; F57-M91 HydrophobicContact CD1-SD 3.63Å; F57-M91 HydrophobicContact CE1-CE 4.47Å; F57-M91 HydrophobicContact CE1-SD 3.85Å; G68-M91 VanDerWaalsContact C-SD 3.57Å; A70-M91 HydrophobicContact CB-CE 3.77Å; A70-M91 HydrophobicContact CB-CG 3.85Å; A70-M91 HydrophobicContact CB-SD 4Å; S87-M91 WeakPolarHBondContact O-CG 3.32Å; S87-M91 PolarHBondContact O-N 3.47Å; M91-T93 VanDerWaalsContact C-N 3.33Å; M91-T93 PolarHBondContact O-N 2.88Å; M91-C94 PolarHBondContact O-N 3.09Å; M91-E95 WeakPolarHBondContact O-CB 3.41Å; M91-E95 PolarHBondContact O-N 2.85Å; M91-A132 HydrophobicContact CE-CB 4.47Å
92	R	97.8	Very high	97.3	Very high	135 Å²	135	42.5 Å²	42.5	51%	0.509	20%	0.198	S	C	.	.	H	α-helix	trans	-63.5	-38.9	175.8	-170.9	-174.9	-56.8	117.4	5.7	112.2	A88 T89 L90 R96	A88-R92 VanDerWaalsContact O-CB 3.25Å; A88-R92 WeakPolarHBondContact O-CB 3.31Å; A88-R92 PolarHBondContact O-N 2.89Å; A88-R92 VanDerWaalsContact O-N 3.12Å; T89-R92 PolarHBondContact O-N 2.82Å; L90-R92 PolarHBondContact O-N 2.83Å; R92-R96 WeakPolarHBondContact O-CB 3.42Å; R92-R96 PolarHBondContact O-N 2.98Å
93	T	97.9	Very high	97.5	Very high	18 Å²	18	40.8 Å²	40.8	11%	0.11	19%	0.188	C	C	.	.	H	α-helix	trans	-66.9	-45.7	176.7	-61.7	0	0	0	0	110.9	T89 L90 M91 E95 R96 L97 E118 L119	T89-T93 WeakPolarHBondContact O-CB 3.28Å; T89-T93 PolarHBondContact O-N 2.95Å; T89-T93 PolarHBondContact O-OG1 2.88Å; L90-T93 PolarHBondContact O-N 2.85Å; M91-T93 VanDerWaalsContact C-N 3.33Å; M91-T93 PolarHBondContact O-N 2.88Å; T93-E95 PolarHBondContact O-N 2.95Å; T93-R96 WeakPolarHBondContact O-CB 3.33Å; T93-R96 PolarHBondContact O-N 3.04Å; T93-L97 HydrophobicContact CG2-CD1 4.31Å; T93-L97 WeakPolarHBondContact O-CG 3.2Å; T93-L97 PolarHBondContact O-N 2.71Å; T93-E118 HydrophobicContact CG2-CB 4.1Å; T93-E118 VanDerWaalsContact CG2-OE2 3.24Å; T93-E118 WeakPolarHBondContact CG2-OE2 3.4Å; T93-L119 HydrophobicContact CG2-CD1 4.3Å
94	C	98.6	Very high	97.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-46.6	175.3	-65.6	0	0	0	0	111.7	F57 L90 M91 R96 L97 V98 I111	F57-C94 HydrophobicContact CD1-CB 4.27Å; F57-C94 HydrophobicContact CE1-CB 3.53Å; F57-C94 HydrophobicContact CZ-CB 3.84Å; L90-C94 PolarHBondContact O-N 3.29Å; L90-C94 PolarHBondContact O-SG 2.8Å; M91-C94 PolarHBondContact O-N 3.09Å; C94-R96 VanDerWaalsContact C-N 3.3Å; C94-R96 PolarHBondContact O-N 3.35Å; C94-L97 PolarHBondContact O-N 2.82Å; C94-V98 WeakPolarHBondContact O-CG2 3.26Å; C94-V98 PolarHBondContact O-N 3.14Å; C94-I111 HydrophobicContact CB-CG2 3.82Å
95	E	98.4	Very high	97.7	Very high	49 Å²	49	45.2 Å²	45.2	23%	0.229	22%	0.215	C	C	.	.	H	α-helix	trans	-55.8	-45.5	175.9	-169.5	-166.6	-174.2	0	0	111.6	F57 A59 M91 T93 V98 K99	F57-E95 HydrophobicContact CB-CB 3.81Å; F57-E95 HydrophobicContact CB-CG 3.99Å; F57-E95 HydrophobicContact CD2-CB 3.76Å; F57-E95 HydrophobicContact CD2-CG 3.94Å; F57-E95 HydrophobicContact CE2-CB 4.48Å; F57-E95 HydrophobicContact CG-CB 3.78Å; F57-E95 HydrophobicContact CG-CG 4.22Å; A59-E95 HydrophobicContact CB-CG 4.1Å; M91-E95 WeakPolarHBondContact O-CB 3.41Å; M91-E95 PolarHBondContact O-N 2.85Å; T93-E95 PolarHBondContact O-N 2.95Å; E95-V98 PolarHBondContact O-N 3.26Å; E95-K99 HydrophobicContact CG-CD 4.17Å; E95-K99 WeakPolarHBondContact O-CB 3.23Å; E95-K99 WeakPolarHBondContact O-CG 3.38Å; E95-K99 PolarHBondContact O-N 3.25Å; E95-K99 WeakPolarHBondContact OE1-CE 3.11Å; E95-K99 IonicContact OE1-NZ 3.69Å; E95-K99 PolarHBondContact OE1-NZ 2.88Å
96	R	98	Very high	97.8	Very high	77 Å²	77	43.7 Å²	43.7	29%	0.291	22%	0.216	S	C	.	.	H	α-helix	trans	-63.9	-45.4	178.6	-173.6	-171.5	61.5	67.1	8.2	111.6	R92 T93 C94 V98 K99 E100 E118	R92-R96 WeakPolarHBondContact O-CB 3.42Å; R92-R96 PolarHBondContact O-N 2.98Å; T93-R96 WeakPolarHBondContact O-CB 3.33Å; T93-R96 PolarHBondContact O-N 3.04Å; C94-R96 VanDerWaalsContact C-N 3.3Å; C94-R96 PolarHBondContact O-N 3.35Å; R96-V98 VanDerWaalsContact C-N 3.29Å; R96-V98 PolarHBondContact O-N 3.35Å; R96-K99 PolarHBondContact O-N 2.84Å; R96-E100 WeakPolarHBondContact CD-OE1 3.44Å; R96-E100 HydrophobicContact CG-CG 4.41Å; R96-E100 WeakPolarHBondContact CG-OE1 3.15Å; R96-E100 IonicContact CZ-OE1 2.75Å; R96-E100 IonicContact NH1-OE1 2.77Å; R96-E100 PolarHBondContact NH1-OE1 2.82Å; R96-E100 IonicContact NH1-OE2 3.97Å; R96-E100 PolarHBondContact NH1-OE2 3.14Å; R96-E100 VanDerWaalsContact NH1-OE2 3.1Å; R96-E100 WeakPolarHBondContact O-CB 3.44Å; R96-E100 WeakPolarHBondContact O-CG 3.24Å; R96-E100 PolarHBondContact O-N 2.53Å; R96-E118 IonicContact CZ-OE1 2.66Å; R96-E118 IonicContact CZ-OE2 2.61Å; R96-E118 IonicContact NH2-OE1 3.51Å; R96-E118 PolarHBondContact NH2-OE1 3.09Å; R96-E118 IonicContact NH2-OE2 2.72Å; R96-E118 PolarHBondContact NH2-OE2 3.16Å
97	L	98.5	Very high	97.9	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-57.4	-43.3	176.8	-71.4	170.4	0	0	0	111.5	T93 C94 G101 R102	T93-L97 HydrophobicContact CG2-CD1 4.31Å; T93-L97 WeakPolarHBondContact O-CG 3.2Å; T93-L97 PolarHBondContact O-N 2.71Å; C94-L97 PolarHBondContact O-N 2.82Å; L97-G101 PolarHBondContact O-N 2.82Å; L97-R102 HydrophobicContact CD2-CB 3.93Å; L97-R102 PolarHBondContact O-N 3.48Å
98	V	98.4	Very high	97.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.3	-49.5	176.4	174.3	0	0	0	0	111.5	F57 A59 H61 V66 C94 E95 R96 E100 G101 F103 I111	F57-V98 HydrophobicContact CE2-CG2 4.5Å; A59-V98 HydrophobicContact CB-CB 3.92Å; A59-V98 HydrophobicContact CB-CG1 3.6Å; H61-V98 HydrophobicContact CB-CG1 4.15Å; H61-V98 PolarHBondContact CD2-O 2.86Å; V66-V98 HydrophobicContact CB-CG1 3.95Å; V66-V98 HydrophobicContact CB-CG2 3.94Å; V66-V98 HydrophobicContact CG1-CG2 3.89Å; V66-V98 HydrophobicContact CG2-CB 4.45Å; V66-V98 HydrophobicContact CG2-CG1 3.61Å; V66-V98 HydrophobicContact CG2-CG2 3.92Å; C94-V98 WeakPolarHBondContact O-CG2 3.26Å; C94-V98 PolarHBondContact O-N 3.14Å; E95-V98 PolarHBondContact O-N 3.26Å; R96-V98 VanDerWaalsContact C-N 3.29Å; R96-V98 PolarHBondContact O-N 3.35Å; V98-E100 VanDerWaalsContact C-N 3.27Å; V98-E100 PolarHBondContact O-N 3.19Å; V98-G101 PolarHBondContact O-N 2.95Å; V98-F103 HydrophobicContact CB-CD1 4.3Å; V98-F103 HydrophobicContact CB-CE1 4.29Å; V98-F103 HydrophobicContact CG1-CD1 4.31Å; V98-F103 HydrophobicContact CG1-CE1 3.82Å; V98-F103 HydrophobicContact CG1-CZ 3.99Å; V98-F103 HydrophobicContact CG2-CD1 4.35Å; V98-F103 HydrophobicContact CG2-CG 4.37Å; V98-F103 WeakPolarHBondContact O-CE1 3.47Å; V98-I111 HydrophobicContact CG2-CD1 4.01Å; V98-I111 HydrophobicContact CG2-CG2 4.34Å
99	K	97.8	Very high	98	Very high	118 Å²	118	48.2 Å²	48.2	51%	0.513	24%	0.239	S	C	.	.	H	α-helix	trans	-61.4	-34.8	-179.5	-76.6	176.1	171.3	173.9	0	112.8	A59 E95 R96 G101	A59-K99 HydrophobicContact CB-CG 4.45Å; E95-K99 HydrophobicContact CG-CD 4.17Å; E95-K99 WeakPolarHBondContact O-CB 3.23Å; E95-K99 WeakPolarHBondContact O-CG 3.38Å; E95-K99 PolarHBondContact O-N 3.25Å; E95-K99 WeakPolarHBondContact OE1-CE 3.11Å; E95-K99 IonicContact OE1-NZ 3.69Å; E95-K99 PolarHBondContact OE1-NZ 2.88Å; R96-K99 PolarHBondContact O-N 2.84Å; K99-G101 VanDerWaalsContact C-N 3.26Å; K99-G101 PolarHBondContact O-N 2.81Å
100	E	97.8	Very high	98	Very high	89 Å²	89	47.7 Å²	47.7	42%	0.416	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-3.9	175.5	-70.1	-179.3	-156.2	0	0	113.6	R96 V98 R102	R96-E100 WeakPolarHBondContact CD-OE1 3.44Å; R96-E100 HydrophobicContact CG-CG 4.41Å; R96-E100 WeakPolarHBondContact CG-OE1 3.15Å; R96-E100 IonicContact CZ-OE1 2.75Å; R96-E100 IonicContact NH1-OE1 2.77Å; R96-E100 PolarHBondContact NH1-OE1 2.82Å; R96-E100 IonicContact NH1-OE2 3.97Å; R96-E100 PolarHBondContact NH1-OE2 3.14Å; R96-E100 VanDerWaalsContact NH1-OE2 3.1Å; R96-E100 WeakPolarHBondContact O-CB 3.44Å; R96-E100 WeakPolarHBondContact O-CG 3.24Å; R96-E100 PolarHBondContact O-N 2.53Å; V98-E100 VanDerWaalsContact C-N 3.27Å; V98-E100 PolarHBondContact O-N 3.19Å; E100-R102 VanDerWaalsContact C-N 3.27Å; E100-R102 HydrophobicContact CB-CG 4.05Å; E100-R102 PolarHBondContact O-N 2.73Å; E100-R102 IonicContact OE2-CZ 3.9Å; E100-R102 IonicContact OE2-NE 3.53Å; E100-R102 PolarHBondContact OE2-NE 3.47Å; E100-R102 IonicContact OE2-NH2 2.78Å; E100-R102 PolarHBondContact OE2-NH2 2.75Å; E100-R102 VanDerWaalsContact OE2-NH2 3.1Å
101	G	97.3	Very high	98.1	Very high	33 Å²	33	47.7 Å²	47.7	34%	0.34	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	20.1	-177.9	0	0	0	0	0	113.8	L97 V98 K99 F103	L97-G101 PolarHBondContact O-N 2.82Å; V98-G101 PolarHBondContact O-N 2.95Å; K99-G101 VanDerWaalsContact C-N 3.26Å; K99-G101 PolarHBondContact O-N 2.81Å; G101-F103 PolarHBondContact O-N 3.07Å
102	R	97.6	Very high	98.1	Very high	152 Å²	152	47.6 Å²	47.6	57%	0.574	24%	0.239	S	C	*	.			trans	-88.4	50.1	177.9	-60.2	-172.5	-169.7	-159.8	2.6	111.5	L97 E100	L97-R102 HydrophobicContact CD2-CB 3.93Å; L97-R102 PolarHBondContact O-N 3.48Å; E100-R102 VanDerWaalsContact C-N 3.27Å; E100-R102 HydrophobicContact CB-CG 4.05Å; E100-R102 PolarHBondContact O-N 2.73Å; E100-R102 IonicContact OE2-CZ 3.9Å; E100-R102 IonicContact OE2-NE 3.53Å; E100-R102 PolarHBondContact OE2-NE 3.47Å; E100-R102 IonicContact OE2-NH2 2.78Å; E100-R102 PolarHBondContact OE2-NH2 2.75Å; E100-R102 VanDerWaalsContact OE2-NH2 3.1Å
103	F	98.1	Very high	98.1	Very high	28 Å²	28	42 Å²	42	12%	0.123	22%	0.22	C	C	.	.	S	Bend	trans	-152.5	164.3	178.6	75.8	-71.4	0	0	0	111	H61 A64 V66 V98 G101 P105 I111	H61-F103 HydrophobicContact CB-CE1 3.87Å; H61-F103 HydrophobicContact CB-CZ 3.82Å; H61-F103 AromaticContact CG-CE1 3.69Å; H61-F103 AromaticContact CG-CZ 3.96Å; H61-F103 AromaticContact ND1-CE1 3.75Å; H61-F103 AromaticContact ND1-CZ 3.87Å; A64-F103 HydrophobicContact CB-CE2 3.87Å; A64-F103 HydrophobicContact CB-CZ 3.96Å; V66-F103 HydrophobicContact CG2-CE2 3.93Å; V66-F103 HydrophobicContact CG2-CZ 4.25Å; V98-F103 HydrophobicContact CB-CD1 4.3Å; V98-F103 HydrophobicContact CB-CE1 4.29Å; V98-F103 HydrophobicContact CG1-CD1 4.31Å; V98-F103 HydrophobicContact CG1-CE1 3.82Å; V98-F103 HydrophobicContact CG1-CZ 3.99Å; V98-F103 HydrophobicContact CG2-CD1 4.35Å; V98-F103 HydrophobicContact CG2-CG 4.37Å; V98-F103 WeakPolarHBondContact O-CE1 3.47Å; G101-F103 PolarHBondContact O-N 3.07Å; F103-P105 HydrophobicContact CE2-CB 4.4Å; F103-P105 HydrophobicContact CE2-CG 3.93Å; F103-I111 HydrophobicContact CB-CD1 4.03Å; F103-I111 HydrophobicContact CB-CG1 3.65Å; F103-I111 HydrophobicContact CD2-CD1 3.87Å; F103-I111 HydrophobicContact CD2-CG1 4.41Å; F103-I111 HydrophobicContact CG-CD1 4.22Å; F103-I111 HydrophobicContact CG-CG1 4.39Å
104	T	97.7	Very high	98.1	Very high	80 Å²	80	43.6 Å²	43.6	49%	0.491	23%	0.232	S	C	.	.			trans	-114.4	124.3	169.7	-59.4	0	0	0	0	107.8	S106 N107	T104-S106 VanDerWaalsContact C-N 3.25Å; T104-S106 PolarHBondContact O-N 2.93Å; T104-N107 CarbonylContact O-C 3.44Å; T104-N107 PolarHBondContact O-N 3.37Å
105	P	97.3	Very high	98.1	Very high	20 Å²	20	43.6 Å²	43.6	13%	0.13	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-38.6	-175.5	-30	35.8	0	0	0	114.7	A64 F103 N107 V136 D138 H145	A64-P105 HydrophobicContact CB-CB 4.18Å; A64-P105 HydrophobicContact CB-CG 4.18Å; F103-P105 HydrophobicContact CE2-CB 4.4Å; F103-P105 HydrophobicContact CE2-CG 3.93Å; P105-N107 PolarHBondContact O-N 3.43Å; P105-V136 HydrophobicContact CB-CG1 4.07Å; P105-V136 VanDerWaalsContact O-CG1 3.24Å; P105-V136 WeakPolarHBondContact O-CG1 3.05Å; P105-D138 HydrophobicContact CB-CB 3.92Å; P105-H145 PolarHBondContact O-CD2 3.13Å
106	S	97.7	Very high	98.1	Very high	71 Å²	71	41.9 Å²	41.9	50%	0.497	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	2.2	178.2	59.4	0	0	0	0	115.2	T104	T104-S106 VanDerWaalsContact C-N 3.25Å; T104-S106 PolarHBondContact O-N 2.93Å
107	N	98.1	Very high	98.1	Very high	77 Å²	77	43.2 Å²	43.2	41%	0.412	23%	0.23	S	C	.	.			trans	-133.2	72.7	-177.7	-174.1	12.7	0	0	0	112	T104 P105 V109 G110	T104-N107 CarbonylContact O-C 3.44Å; T104-N107 PolarHBondContact O-N 3.37Å; P105-N107 PolarHBondContact O-N 3.43Å; N107-V109 VanDerWaalsContact C-N 3.28Å; N107-V109 PolarHBondContact O-N 2.84Å; N107-G110 PolarHBondContact O-N 2.96Å; N107-G110 VanDerWaalsContact O-N 3.11Å; N107-G110 PolarHBondContact OD1-N 3.48Å
108	P	98.3	Very high	98	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.039	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-32.8	175.8	25.5	-34.7	0	0	0	112.8	G110 I111 L112 I134 V136 H145 T146 C147	P108-G110 PolarHBondContact O-N 2.89Å; P108-I111 WeakPolarHBondContact O-CA 3.41Å; P108-I111 VanDerWaalsContact O-CB 3.31Å; P108-I111 WeakPolarHBondContact O-CB 3.36Å; P108-I111 PolarHBondContact O-N 2.74Å; P108-L112 PolarHBondContact O-N 3.38Å; P108-I134 HydrophobicContact CB-CB 4.4Å; P108-I134 HydrophobicContact CB-CG2 4.1Å; P108-V136 HydrophobicContact CB-CG2 3.95Å; P108-H145 HydrophobicContact CG-CB 4.07Å; P108-T146 VanDerWaalsContact CG-C 3.43Å; P108-C147 VanDerWaalsContact C-SG 3.55Å; P108-C147 HydrophobicContact CB-CB 4.23Å; P108-C147 HydrophobicContact CG-CB 4.13Å
109	V	98.6	Very high	97.8	Very high	23 Å²	23	46 Å²	46	14%	0.139	24%	0.242	C	C	.	.	H	α-helix	trans	-57	-37.2	173.2	178.3	0	0	0	0	111	N107 I111 L112 T113 C147 S200	N107-V109 VanDerWaalsContact C-N 3.28Å; N107-V109 PolarHBondContact O-N 2.84Å; V109-I111 VanDerWaalsContact C-N 3.28Å; V109-I111 PolarHBondContact O-N 3.45Å; V109-L112 PolarHBondContact O-N 3.39Å; V109-T113 VanDerWaalsContact O-CB 3.32Å; V109-T113 WeakPolarHBondContact O-CB 3.32Å; V109-T113 PolarHBondContact O-N 3.39Å; V109-T113 PolarHBondContact O-OG1 3.23Å; V109-C147 HydrophobicContact CG2-CB 3.58Å; V109-S200 WeakPolarHBondContact CG2-OG 3.24Å
110	G	98.5	Very high	97.6	Very high	19 Å²	19	44.4 Å²	44.4	20%	0.196	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-32.3	175.4	0	0	0	0	0	113.8	N107 P108 S114	N107-G110 PolarHBondContact O-N 2.96Å; N107-G110 VanDerWaalsContact O-N 3.11Å; N107-G110 PolarHBondContact OD1-N 3.48Å; P108-G110 PolarHBondContact O-N 2.89Å; G110-S114 VanDerWaalsContact O-CB 3.25Å; G110-S114 WeakPolarHBondContact O-CB 3.31Å; G110-S114 PolarHBondContact O-N 3.09Å; G110-S114 PolarHBondContact O-OG 3.27Å
111	I	98.7	Very high	97.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-68.3	-50.6	174.1	-56.6	173	0	0	0	109.4	V66 C94 V98 F103 P108 V109 T113 S114 G115 I134 V136	V66-I111 HydrophobicContact CG1-CD1 4.09Å; C94-I111 HydrophobicContact CB-CG2 3.82Å; V98-I111 HydrophobicContact CG2-CD1 4.01Å; V98-I111 HydrophobicContact CG2-CG2 4.34Å; F103-I111 HydrophobicContact CB-CD1 4.03Å; F103-I111 HydrophobicContact CB-CG1 3.65Å; F103-I111 HydrophobicContact CD2-CD1 3.87Å; F103-I111 HydrophobicContact CD2-CG1 4.41Å; F103-I111 HydrophobicContact CG-CD1 4.22Å; F103-I111 HydrophobicContact CG-CG1 4.39Å; P108-I111 WeakPolarHBondContact O-CA 3.41Å; P108-I111 VanDerWaalsContact O-CB 3.31Å; P108-I111 WeakPolarHBondContact O-CB 3.36Å; P108-I111 PolarHBondContact O-N 2.74Å; V109-I111 VanDerWaalsContact C-N 3.28Å; V109-I111 PolarHBondContact O-N 3.45Å; I111-T113 PolarHBondContact O-N 2.8Å; I111-S114 PolarHBondContact O-N 3.17Å; I111-G115 PolarHBondContact O-N 2.97Å; I111-I134 HydrophobicContact CB-CD1 4.03Å; I111-I134 HydrophobicContact CD1-CG2 4.33Å; I111-I134 HydrophobicContact CG2-CD1 3.91Å; I111-V136 HydrophobicContact CD1-CG2 3.93Å
112	L	98.7	Very high	97	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.1	-47.6	179	-176.2	60.1	0	0	0	111.6	L90 P108 V109 G115 Y116 A132 I134 L149 L179 P195 A198	L90-L112 HydrophobicContact CD1-CD1 4.39Å; L90-L112 HydrophobicContact CD2-CD1 4.16Å; P108-L112 PolarHBondContact O-N 3.38Å; V109-L112 PolarHBondContact O-N 3.39Å; L112-G115 PolarHBondContact O-N 3.32Å; L112-Y116 WeakPolarHBondContact O-CB 3.38Å; L112-Y116 PolarHBondContact O-N 2.84Å; L112-A132 HydrophobicContact CD1-CB 3.51Å; L112-A132 HydrophobicContact CD2-CB 4.31Å; L112-I134 HydrophobicContact CB-CD1 3.85Å; L112-I134 HydrophobicContact CD1-CD1 4.38Å; L112-L149 HydrophobicContact CD2-CB 4.29Å; L112-L179 HydrophobicContact CD1-CD1 3.66Å; L112-L179 HydrophobicContact CG-CD1 4.08Å; L112-P195 HydrophobicContact CD2-CB 4.42Å; L112-P195 HydrophobicContact CG-CB 4.3Å; L112-A198 HydrophobicContact CD2-CB 4.32Å
113	T	98.6	Very high	96.4	Very high	17 Å²	17	52.4 Å²	52.4	10%	0.104	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-50.4	-179.2	-53.9	0	0	0	0	111.1	V109 I111 G115 Y116 Y117 P195 E196	V109-T113 VanDerWaalsContact O-CB 3.32Å; V109-T113 WeakPolarHBondContact O-CB 3.32Å; V109-T113 PolarHBondContact O-N 3.39Å; V109-T113 PolarHBondContact O-OG1 3.23Å; I111-T113 PolarHBondContact O-N 2.8Å; T113-G115 VanDerWaalsContact C-N 3.31Å; T113-G115 PolarHBondContact O-N 3.1Å; T113-Y116 PolarHBondContact O-N 3.1Å; T113-Y117 HydrophobicContact CG2-CD2 4.09Å; T113-Y117 HydrophobicContact CG2-CE1 4.38Å; T113-Y117 HydrophobicContact CG2-CE2 3.81Å; T113-Y117 WeakPolarHBondContact O-CB 3.49Å; T113-Y117 PolarHBondContact O-N 3.48Å; T113-P195 HydrophobicContact CG2-CB 4.43Å; T113-P195 HydrophobicContact CG2-CG 4.48Å; T113-P195 WeakPolarHBondContact OG1-CB 3.25Å; T113-E196 WeakPolarHBondContact CG2-OE1 3.43Å
114	S	98.4	Very high	95.9	Very high	52 Å²	52	56.7 Å²	56.7	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-40.8	179	-57.9	0	0	0	0	111.2	G110 I111 E118	G110-S114 VanDerWaalsContact O-CB 3.25Å; G110-S114 WeakPolarHBondContact O-CB 3.31Å; G110-S114 PolarHBondContact O-N 3.09Å; G110-S114 PolarHBondContact O-OG 3.27Å; I111-S114 PolarHBondContact O-N 3.17Å; S114-E118 WeakPolarHBondContact O-CG 3.25Å; S114-E118 PolarHBondContact O-N 2.91Å; S114-E118 VanDerWaalsContact O-N 3.11Å
115	G	98	Very high	95.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-51.7	175.9	0	0	0	0	0	112	I111 L112 T113 Y117 E118 L119	I111-G115 PolarHBondContact O-N 2.97Å; L112-G115 PolarHBondContact O-N 3.32Å; T113-G115 VanDerWaalsContact C-N 3.31Å; T113-G115 PolarHBondContact O-N 3.1Å; G115-Y117 PolarHBondContact O-N 3.12Å; G115-E118 PolarHBondContact O-N 2.72Å; G115-L119 WeakPolarHBondContact O-CD1 3.41Å; G115-L119 PolarHBondContact O-N 3.15Å
116	Y	98.2	Very high	95.2	Very high	14 Å²	14	56.5 Å²	56.5	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-61.9	-43.3	179.7	179.4	-128.2	0	0	0	113	F86 L112 T113 E118 L119 L120 L179 S180 I181 S192 P195	F86-Y116 HydrophobicContact CZ-CD2 4.26Å; F86-Y116 HydrophobicContact CZ-CE2 4.06Å; L112-Y116 WeakPolarHBondContact O-CB 3.38Å; L112-Y116 PolarHBondContact O-N 2.84Å; T113-Y116 PolarHBondContact O-N 3.1Å; Y116-E118 VanDerWaalsContact C-N 3.32Å; Y116-E118 PolarHBondContact O-N 3.33Å; Y116-L119 WeakPolarHBondContact O-CB 3.46Å; Y116-L119 PolarHBondContact O-N 3.09Å; Y116-L119 VanDerWaalsContact O-N 3.09Å; Y116-L120 HydrophobicContact CD1-CD1 4.21Å; Y116-L120 HydrophobicContact CE1-CD1 3.87Å; Y116-L120 HydrophobicContact CE2-CD1 4.5Å; Y116-L120 HydrophobicContact CE2-CD2 4.46Å; Y116-L120 HydrophobicContact CE2-CG 4.27Å; Y116-L120 PolarHBondContact O-N 3.41Å; Y116-L179 HydrophobicContact CD1-CD2 3.98Å; Y116-L179 HydrophobicContact CD2-CB 3.92Å; Y116-L179 HydrophobicContact CD2-CD1 3.96Å; Y116-L179 HydrophobicContact CD2-CD2 4.43Å; Y116-L179 HydrophobicContact CD2-CG 4.33Å; Y116-L179 HydrophobicContact CE1-CD2 4.07Å; Y116-L179 HydrophobicContact CE2-CB 3.85Å; Y116-L179 HydrophobicContact CG-CB 4.44Å; Y116-L179 HydrophobicContact CG-CD1 3.87Å; Y116-L179 HydrophobicContact CG-CD2 4.14Å; Y116-L179 HydrophobicContact CG-CG 4.38Å; Y116-S180 PolarHBondContact OH-O 3.14Å; Y116-I181 HydrophobicContact CE2-CG1 4.21Å; Y116-S192 PolarHBondContact OH-OG 2.94Å; Y116-P195 HydrophobicContact CD1-CG 3.5Å; Y116-P195 HydrophobicContact CE1-CG 4.25Å; Y116-P195 HydrophobicContact CG-CG 4.23Å
117	Y	97.4	Very high	95.1	Very high	104 Å²	104	55.4 Å²	55.4	41%	0.408	29%	0.289	S	S	.	.	H	α-helix	trans	-67.9	-30.9	179.8	-74.3	3.4	0	0	0	113	T113 G115 L120 Q121	T113-Y117 HydrophobicContact CG2-CD2 4.09Å; T113-Y117 HydrophobicContact CG2-CE1 4.38Å; T113-Y117 HydrophobicContact CG2-CE2 3.81Å; T113-Y117 WeakPolarHBondContact O-CB 3.49Å; T113-Y117 PolarHBondContact O-N 3.48Å; G115-Y117 PolarHBondContact O-N 3.12Å; Y117-L120 HydrophobicContact CD1-CD1 3.84Å; Y117-L120 HydrophobicContact CE1-CD1 4.36Å; Y117-L120 PolarHBondContact O-N 3.26Å; Y117-Q121 WeakPolarHBondContact O-CG 3.4Å; Y117-Q121 PolarHBondContact O-N 3.46Å
118	E	96.6	Very high	95.1	Very high	60 Å²	60	51.8 Å²	51.8	28%	0.28	27%	0.269	S	S	.	.	H	α-helix	trans	-65.8	-39.3	169.4	-76.7	-169.1	-168.7	0	0	112.1	T93 R96 S114 G115 Y116 L120 Q121 N122	T93-E118 HydrophobicContact CG2-CB 4.1Å; T93-E118 VanDerWaalsContact CG2-OE2 3.24Å; T93-E118 WeakPolarHBondContact CG2-OE2 3.4Å; R96-E118 IonicContact CZ-OE1 2.66Å; R96-E118 IonicContact CZ-OE2 2.61Å; R96-E118 IonicContact NH2-OE1 3.51Å; R96-E118 PolarHBondContact NH2-OE1 3.09Å; R96-E118 IonicContact NH2-OE2 2.72Å; R96-E118 PolarHBondContact NH2-OE2 3.16Å; S114-E118 WeakPolarHBondContact O-CG 3.25Å; S114-E118 PolarHBondContact O-N 2.91Å; S114-E118 VanDerWaalsContact O-N 3.11Å; G115-E118 PolarHBondContact O-N 2.72Å; Y116-E118 VanDerWaalsContact C-N 3.32Å; Y116-E118 PolarHBondContact O-N 3.33Å; E118-L120 VanDerWaalsContact C-N 3.32Å; E118-L120 PolarHBondContact O-N 3.27Å; E118-Q121 PolarHBondContact O-N 2.96Å; E118-Q121 VanDerWaalsContact O-N 3.13Å; E118-N122 PolarHBondContact O-N 2.86Å
119	L	95.4	Very high	95	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-41.5	175.5	-90.5	66.2	0	0	0	111.6	F86 T89 L90 T93 G115 Y116 Q121 N122 L126 I181	F86-L119 HydrophobicContact CZ-CD2 4.42Å; T89-L119 HydrophobicContact CG2-CD1 4.08Å; T89-L119 HydrophobicContact CG2-CG 4.13Å; L90-L119 HydrophobicContact CB-CD2 3.95Å; L90-L119 HydrophobicContact CD1-CD2 4.3Å; T93-L119 HydrophobicContact CG2-CD1 4.3Å; G115-L119 WeakPolarHBondContact O-CD1 3.41Å; G115-L119 PolarHBondContact O-N 3.15Å; Y116-L119 WeakPolarHBondContact O-CB 3.46Å; Y116-L119 PolarHBondContact O-N 3.09Å; Y116-L119 VanDerWaalsContact O-N 3.09Å; L119-Q121 PolarHBondContact O-N 3.11Å; L119-N122 WeakPolarHBondContact O-CB 3.28Å; L119-N122 PolarHBondContact O-N 3.18Å; L119-L126 HydrophobicContact CD2-CD2 3.86Å; L119-L126 HydrophobicContact CG-CD2 4.12Å; L119-I181 HydrophobicContact CB-CD1 3.95Å
120	L	93.9	Very high	95	Very high	85 Å²	85	50.4 Å²	50.4	45%	0.445	26%	0.261	S	S	.	.	H	α-helix	trans	-60.9	-26.9	176.1	-73.5	170.5	0	0	0	113.3	Y116 Y117 E118 I181	Y116-L120 HydrophobicContact CD1-CD1 4.21Å; Y116-L120 HydrophobicContact CE1-CD1 3.87Å; Y116-L120 HydrophobicContact CE2-CD1 4.5Å; Y116-L120 HydrophobicContact CE2-CD2 4.46Å; Y116-L120 HydrophobicContact CE2-CG 4.27Å; Y116-L120 PolarHBondContact O-N 3.41Å; Y117-L120 HydrophobicContact CD1-CD1 3.84Å; Y117-L120 HydrophobicContact CE1-CD1 4.36Å; Y117-L120 PolarHBondContact O-N 3.26Å; E118-L120 VanDerWaalsContact C-N 3.32Å; E118-L120 PolarHBondContact O-N 3.27Å; L120-I181 HydrophobicContact CD2-CD1 4.11Å; L120-I181 HydrophobicContact CD2-CG1 3.69Å; L120-I181 HydrophobicContact CG-CD1 4.46Å; L120-I181 HydrophobicContact CG-CG1 4.44Å
121	Q	92.8	Very high	95	Very high	158 Å²	158	49.5 Å²	49.5	74%	0.738	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	2	-177.7	-66.5	174.2	16.5	0	0	113.3	Y117 E118 L119 K123	Y117-Q121 WeakPolarHBondContact O-CG 3.4Å; Y117-Q121 PolarHBondContact O-N 3.46Å; E118-Q121 PolarHBondContact O-N 2.96Å; E118-Q121 VanDerWaalsContact O-N 3.13Å; L119-Q121 PolarHBondContact O-N 3.11Å; Q121-K123 PolarHBondContact O-N 2.98Å
122	N	89.2	Confident	95	Very high	73 Å²	73	49.5 Å²	49.5	39%	0.39	25%	0.252	S	S	.	.			trans	-62.1	136	177.8	-80	-23.7	0	0	0	111.5	E118 L119 V124	E118-N122 PolarHBondContact O-N 2.86Å; L119-N122 WeakPolarHBondContact O-CB 3.28Å; L119-N122 PolarHBondContact O-N 3.18Å; N122-V124 WeakPolarHBondContact CB-O 3.35Å; N122-V124 PolarHBondContact O-N 2.91Å
123	K	85.1	Confident	95	Very high	212 Å²	212	49.5 Å²	49.5	92%	0.922	25%	0.252	S	S	*	.	S	Bend	trans	-58.7	-34.3	179	-67.9	-175.3	178.9	-179.6	0	113	Q121	Q121-K123 PolarHBondContact O-N 2.98Å
124	V	86.9	Confident	95	Very high	118 Å²	118	48.7 Å²	48.7	72%	0.715	25%	0.247	S	C	*	.	S	Bend	trans	-105.5	115.3	171.8	-179.7	0	0	0	0	106.1	N122 L126	N122-V124 WeakPolarHBondContact CB-O 3.35Å; N122-V124 PolarHBondContact O-N 2.91Å; V124-L126 PolarHBondContact O-N 3.1Å
125	P	87.3	Confident	95.1	Very high	78 Å²	78	46.2 Å²	46.2	51%	0.506	23%	0.229	S	C	.	.			trans	-57.5	123.9	179.8	-26.3	34.8	0	0	0	111	L127	P125-L127 VanDerWaalsContact C-N 3.34Å; P125-L127 HydrophobicContact CB-CD2 4.06Å; P125-L127 PolarHBondContact O-N 3.28Å
126	L	93.3	Very high	95.1	Very high	18 Å²	18	46.2 Å²	46.2	9%	0.094	23%	0.229	C	C	.	.			trans	-87	80.3	175.1	-176.7	67.3	0	0	0	108.6	Q85 F86 T89 L119 V124 I181	Q85-L126 HydrophobicContact CB-CD1 3.75Å; F86-L126 HydrophobicContact CD2-CG 4.46Å; T89-L126 VanDerWaalsContact CB-CD2 3.43Å; T89-L126 HydrophobicContact CG2-CD2 3.76Å; L119-L126 HydrophobicContact CD2-CD2 3.86Å; L119-L126 HydrophobicContact CG-CD2 4.12Å; V124-L126 PolarHBondContact O-N 3.1Å; L126-I181 WeakPolarHBondContact O-CB 3.39Å
127	L	95.6	Very high	95.1	Very high	48 Å²	48	45.5 Å²	45.5	25%	0.251	23%	0.227	S	C	.	.			trans	-61.1	143	179	-53.8	-179.1	0	0	0	110.2	V81 P125 I181 P183	V81-L127 HydrophobicContact CG1-CB 4.1Å; V81-L127 WeakPolarHBondContact CG1-O 3.45Å; V81-L127 HydrophobicContact CG2-CB 4.07Å; V81-L127 HydrophobicContact CG2-CD1 4.36Å; P125-L127 VanDerWaalsContact C-N 3.34Å; P125-L127 HydrophobicContact CB-CD2 4.06Å; P125-L127 PolarHBondContact O-N 3.28Å; L127-I181 WeakPolarHBondContact CA-O 3.33Å; L127-I181 HydrophobicContact CD2-CG2 4.26Å; L127-P183 HydrophobicContact CD1-CB 4.43Å; L127-P183 HydrophobicContact CD1-CG 4.22Å; L127-P183 HydrophobicContact CD2-CG 4.46Å
128	G	96.8	Very high	95.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	141.4	-178.8	-177.4	0	0	0	0	0	112.1	W76 F86 S180 I181	W76-G128 VanDerWaalsContact NE1-C 3.32Å; F86-G128 VanDerWaalsContact CD2-C 3.4Å; F86-G128 WeakPolarHBondContact CD2-O 3.27Å; F86-G128 WeakPolarHBondContact CE2-O 3.45Å; G128-S180 WeakPolarHBondContact O-CA 3.46Å; G128-I181 PolarHBondContact N-O 3.03Å; G128-I181 PolarHBondContact O-N 2.96Å
129	S	97.8	Very high	95	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	159.5	170.3	64.8	0	0	0	0	111.4	G72 V73 W76 Q178 L179 S180	G72-S129 WeakPolarHBondContact CA-O 3.27Å; V73-S129 VanDerWaalsContact CB-OG 3.29Å; V73-S129 WeakPolarHBondContact CB-OG 3.35Å; V73-S129 VanDerWaalsContact CG2-OG 3.26Å; V73-S129 WeakPolarHBondContact CG2-OG 3.15Å; V73-S129 PolarHBondContact N-O 3.37Å; W76-S129 PolarHBondContact NE1-OG 2.88Å; S129-Q178 PolarHBondContact OG-OE1 3.41Å; S129-L179 CarbonylContact C-O 3.6Å; S129-L179 WeakPolarHBondContact CA-O 3.37Å; S129-L179 WeakPolarHBondContact CB-O 3.36Å; S129-S180 WeakPolarHBondContact CB-OG 3.33Å
130	S	98.3	Very high	94.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	156.9	172	74.5	0	0	0	0	112.1	D71 F86 Q178 L179	D71-S130 CarbonylContact O-C 3.45Å; D71-S130 WeakPolarHBondContact O-CA 3.41Å; D71-S130 WeakPolarHBondContact O-CB 3.24Å; F86-S130 VanDerWaalsContact CD1-OG 3.31Å; F86-S130 WeakPolarHBondContact CD1-OG 3.19Å; F86-S130 WeakPolarHBondContact CE1-OG 3.43Å; S130-Q178 WeakPolarHBondContact O-CA 3.22Å; S130-L179 PolarHBondContact N-O 3.27Å; S130-L179 PolarHBondContact O-N 2.9Å
131	T	98.6	Very high	94.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.23	C	C	.	.			trans	-72.5	171.5	157.4	66.1	0	0	0	0	109.7	A70 D71 L149 S152 P176	A70-T131 WeakPolarHBondContact CA-O 3.4Å; A70-T131 WeakPolarHBondContact CB-O 3.25Å; D71-T131 WeakPolarHBondContact CB-OG1 3.32Å; D71-T131 PolarHBondContact N-OG1 2.91Å; D71-T131 PolarHBondContact O-N 2.92Å; T131-L149 CarbonylContact C-O 3.55Å; T131-L149 WeakPolarHBondContact CA-O 3.1Å; T131-L149 VanDerWaalsContact CB-O 3.3Å; T131-L149 WeakPolarHBondContact CB-O 3.28Å; T131-S152 PolarHBondContact OG1-OG 3.33Å; T131-S152 VanDerWaalsContact OG1-OG 3.09Å; T131-P176 HydrophobicContact CG2-CB 3.79Å; T131-P176 HydrophobicContact CG2-CG 3.79Å
132	A	98.7	Very high	94.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	131.8	171.3	0	0	0	0	0	112.4	V69 L90 M91 L112 L149	V69-A132 WeakPolarHBondContact O-CA 3.4Å; L90-A132 HydrophobicContact CD2-CB 4.15Å; M91-A132 HydrophobicContact CE-CB 4.47Å; L112-A132 HydrophobicContact CD1-CB 3.51Å; L112-A132 HydrophobicContact CD2-CB 4.31Å; A132-L149 PolarHBondContact N-O 3.42Å; A132-L149 PolarHBondContact O-N 3.09Å
133	C	98.8	Very high	95.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.3	168.4	179.6	0	0	0	0	109.6	G68 V69 C147 N148	G68-C133 CarbonylContact C-O 3.43Å; G68-C133 WeakPolarHBondContact CA-O 3.46Å; V69-C133 HydrophobicContact CG2-CB 3.82Å; V69-C133 PolarHBondContact N-O 2.86Å; V69-C133 PolarHBondContact O-N 2.79Å; C133-C147 CarbonylContact C-O 3.54Å; C133-C147 WeakPolarHBondContact CA-O 3.4Å; C133-N148 WeakPolarHBondContact CB-OD1 3.31Å
134	I	98.9	Very high	95.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134	176.4	-57.5	-177.8	0	0	0	109.4	V66 L67 P108 I111 L112 V136 T146 C147	V66-I134 HydrophobicContact CG1-CG2 3.92Å; L67-I134 WeakPolarHBondContact O-CA 3.46Å; P108-I134 HydrophobicContact CB-CB 4.4Å; P108-I134 HydrophobicContact CB-CG2 4.1Å; I111-I134 HydrophobicContact CB-CD1 4.03Å; I111-I134 HydrophobicContact CD1-CG2 4.33Å; I111-I134 HydrophobicContact CG2-CD1 3.91Å; L112-I134 HydrophobicContact CB-CD1 3.85Å; L112-I134 HydrophobicContact CD1-CD1 4.38Å; I134-V136 HydrophobicContact CG2-CG2 4.17Å; I134-T146 CarbonylContact O-C 3.56Å; I134-T146 VanDerWaalsContact O-CA 3.28Å; I134-T146 WeakPolarHBondContact O-CA 3.17Å; I134-C147 PolarHBondContact N-O 3.48Å; I134-C147 PolarHBondContact O-N 2.81Å
135	V	98.8	Very high	96.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128.2	177.7	176.7	0	0	0	0	109.2	V66 L67 L144 T146 F154 I211 T213	V66-V135 CarbonylContact C-O 3.55Å; V66-V135 WeakPolarHBondContact CA-O 3.19Å; L67-V135 HydrophobicContact CB-CB 4.4Å; L67-V135 PolarHBondContact N-O 3.23Å; L67-V135 PolarHBondContact O-N 2.8Å; V135-L144 HydrophobicContact CG1-CD1 3.57Å; V135-L144 HydrophobicContact CG1-CD2 3.74Å; V135-L144 HydrophobicContact CG1-CG 3.69Å; V135-T146 HydrophobicContact CB-CG2 4.48Å; V135-T146 HydrophobicContact CG1-CG2 4.27Å; V135-T146 HydrophobicContact CG2-CG2 4.03Å; V135-F154 HydrophobicContact CG2-CB 4.18Å; V135-F154 HydrophobicContact CG2-CD1 4.36Å; V135-F154 HydrophobicContact CG2-CG 4.24Å; V135-I211 HydrophobicContact CG1-CG2 4.37Å; V135-T213 HydrophobicContact CG2-CG2 4.22Å
136	V	98.8	Very high	96.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	116.4	-178.8	-179.4	0	0	0	0	109.4	A64 V66 P105 P108 I111 I134 L144 H145	A64-V136 HydrophobicContact CB-CG1 3.86Å; V66-V136 HydrophobicContact CB-CG2 4.45Å; V66-V136 HydrophobicContact CG1-CG2 3.8Å; V66-V136 HydrophobicContact CG2-CB 4.48Å; V66-V136 HydrophobicContact CG2-CG1 4.07Å; V66-V136 HydrophobicContact CG2-CG2 4.05Å; P105-V136 HydrophobicContact CB-CG1 4.07Å; P105-V136 VanDerWaalsContact O-CG1 3.24Å; P105-V136 WeakPolarHBondContact O-CG1 3.05Å; P108-V136 HydrophobicContact CB-CG2 3.95Å; I111-V136 HydrophobicContact CD1-CG2 3.93Å; I134-V136 HydrophobicContact CG2-CG2 4.17Å; V136-L144 CarbonylContact O-C 3.58Å; V136-L144 WeakPolarHBondContact O-CA 3.17Å; V136-H145 HydrophobicContact CB-CB 4.39Å; V136-H145 PolarHBondContact N-O 2.9Å; V136-H145 PolarHBondContact O-N 3.4Å
137	L	98.6	Very high	97.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	109.6	164.3	176.4	68.1	0	0	0	108.7	L29 A64 D65 R139 L144 V205	L29-L137 HydrophobicContact CD1-CB 4.03Å; L29-L137 HydrophobicContact CD2-CB 4.37Å; L29-L137 HydrophobicContact CD2-CD2 3.64Å; L29-L137 HydrophobicContact CG-CB 4.05Å; L29-L137 HydrophobicContact CG-CD2 3.65Å; L29-L137 HydrophobicContact CG-CG 4.49Å; A64-L137 CarbonylContact C-O 3.58Å; A64-L137 WeakPolarHBondContact CA-O 3.23Å; A64-L137 VanDerWaalsContact CB-O 3.27Å; A64-L137 WeakPolarHBondContact CB-O 3.28Å; D65-L137 HydrophobicContact CB-CB 4.39Å; D65-L137 PolarHBondContact N-O 3.16Å; D65-L137 PolarHBondContact O-N 3.07Å; L137-R139 PolarHBondContact O-N 3.02Å; L137-L144 HydrophobicContact CB-CD1 4.02Å; L137-L144 HydrophobicContact CD1-CD1 4.35Å; L137-V205 HydrophobicContact CD1-CG2 3.51Å
138	D	97.5	Very high	97.3	Very high	27 Å²	27	18 Å²	18	14%	0.144	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	115.8	168.1	-178.2	-26.7	0	0	0	109	P105 R140 S141 H142 Q143	P105-D138 HydrophobicContact CB-CB 3.92Å; D138-R140 PolarHBondContact O-N 3.37Å; D138-R140 PolarHBondContact OD1-N 2.94Å; D138-S141 WeakPolarHBondContact CB-OG 3.3Å; D138-S141 PolarHBondContact OD1-N 2.88Å; D138-S141 PolarHBondContact OD2-OG 2.94Å; D138-H142 PolarHBondContact O-N 2.74Å; D138-H142 VanDerWaalsContact O-N 3.11Å; D138-Q143 PolarHBondContact N-O 3.42Å
139	R	94.1	Very high	97.4	Very high	4 Å²	4	18 Å²	18	2%	0.015	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.6	-174	-66.4	-168.3	-174.6	-68	0.5	113.4	D26 Y27 S28 H61 T63 D65 L137 H142	D26-R139 WeakPolarHBondContact CA-O 3.34Å; D26-R139 HydrophobicContact CB-CB 4.18Å; Y27-R139 PolarHBondContact N-O 2.86Å; Y27-R139 VanDerWaalsContact O-CG 3.3Å; Y27-R139 WeakPolarHBondContact O-CG 3.4Å; Y27-R139 PolarHBondContact O-NH1 3.23Å; S28-R139 VanDerWaalsContact CA-NH1 3.32Å; H61-R139 PolarHBondContact O-NE 2.85Å; H61-R139 PolarHBondContact O-NH2 2.88Å; T63-R139 WeakPolarHBondContact O-CB 3.46Å; T63-R139 WeakPolarHBondContact O-CG 3.41Å; T63-R139 PolarHBondContact O-N 3.35Å; D65-R139 IonicContact OD1-CZ 3.49Å; D65-R139 IonicContact OD1-NH1 2.66Å; D65-R139 IonicContact OD1-NH2 3.65Å; D65-R139 PolarHBondContact OD1-NH2 2.77Å; D65-R139 IonicContact OD2-CZ 3.77Å; D65-R139 VanDerWaalsContact OD2-CZ 3.27Å; D65-R139 IonicContact OD2-NH1 3.1Å; D65-R139 PolarHBondContact OD2-NH1 3.14Å; D65-R139 IonicContact OD2-NH2 3.11Å; D65-R139 PolarHBondContact OD2-NH2 3.45Å; D65-R139 VanDerWaalsContact OD2-NH2 3.14Å; L137-R139 PolarHBondContact O-N 3.02Å; R139-H142 PolarHBondContact O-CD2 2.93Å; R139-H142 PolarHBondContact O-NE2 3.31Å
140	R	88.4	Confident	97.5	Very high	189 Å²	189	18 Å²	18	71%	0.713	8%	0.082	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-40	-171.3	-69	-175.9	176.4	-163.3	-1.2	112.7	D138 H142	D138-R140 PolarHBondContact O-N 3.37Å; D138-R140 PolarHBondContact OD1-N 2.94Å; R140-H142 VanDerWaalsContact C-N 3.27Å
141	S	94.2	Very high	97.4	Very high	50 Å²	50	18.2 Å²	18.2	35%	0.35	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-15.5	177.4	66.6	0	0	0	0	112	D138 Q143	D138-S141 WeakPolarHBondContact CB-OG 3.3Å; D138-S141 PolarHBondContact OD1-N 2.88Å; D138-S141 PolarHBondContact OD2-OG 2.94Å; S141-Q143 PolarHBondContact O-N 3.32Å; S141-Q143 WeakPolarHBondContact OG-CB 3.42Å; S141-Q143 PolarHBondContact OG-N 2.89Å
142	H	95.4	Very high	97.4	Very high	36 Å²	36	18.2 Å²	18.2	17%	0.167	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	30.2	-172.1	-51.2	162.7	0	0	0	112	R25 Y27 D138 R139 R140 V205	R25-H142 PolarHBondContact O-NE2 2.92Å; Y27-H142 AromaticContact CD1-CD2 3.93Å; Y27-H142 AromaticContact CD1-NE2 3.88Å; Y27-H142 HydrophobicContact CD2-CB 3.92Å; Y27-H142 AromaticContact CD2-CG 3.97Å; Y27-H142 AromaticContact CE1-CE1 3.92Å; Y27-H142 AromaticContact CE1-ND1 3.98Å; Y27-H142 HydrophobicContact CE2-CB 3.96Å; Y27-H142 HydrophobicContact CG-CB 4.47Å; Y27-H142 AromaticContact CG-CD2 3.81Å; Y27-H142 AromaticContact CZ-ND1 3.95Å; D138-H142 PolarHBondContact O-N 2.74Å; D138-H142 VanDerWaalsContact O-N 3.11Å; R139-H142 PolarHBondContact O-CD2 2.93Å; R139-H142 PolarHBondContact O-NE2 3.31Å; R140-H142 VanDerWaalsContact C-N 3.27Å; H142-V205 WeakPolarHBondContact O-CG2 3.39Å; H142-V205 PolarHBondContact O-N 2.91Å
143	Q	97.7	Very high	97.4	Very high	62 Å²	62	18.2 Å²	18.2	29%	0.29	8%	0.083	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	142.8	177	-63.8	-165.2	-27.9	0	0	110.9	D138 S141 H145 F203 D204	D138-Q143 PolarHBondContact N-O 3.42Å; S141-Q143 PolarHBondContact O-N 3.32Å; S141-Q143 WeakPolarHBondContact OG-CB 3.42Å; S141-Q143 PolarHBondContact OG-N 2.89Å; Q143-H145 PolarHBondContact OE1-CE1 2.87Å; Q143-F203 WeakPolarHBondContact CA-O 3.42Å; Q143-D204 WeakPolarHBondContact CG-OD1 3.25Å; Q143-D204 PolarHBondContact NE2-OD1 2.9Å
144	L	98.3	Very high	97.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.7	164.4	-154.9	76.8	0	0	0	108.2	V135 V136 L137 T146 V156 S202 F203 V205 I211	V135-L144 HydrophobicContact CG1-CD1 3.57Å; V135-L144 HydrophobicContact CG1-CD2 3.74Å; V135-L144 HydrophobicContact CG1-CG 3.69Å; V136-L144 CarbonylContact O-C 3.58Å; V136-L144 WeakPolarHBondContact O-CA 3.17Å; L137-L144 HydrophobicContact CB-CD1 4.02Å; L137-L144 HydrophobicContact CD1-CD1 4.35Å; L144-T146 HydrophobicContact CD2-CG2 4.13Å; L144-T146 HydrophobicContact CG-CG2 4.29Å; L144-V156 HydrophobicContact CD2-CG2 3.96Å; L144-S202 VanDerWaalsContact O-CA 3.29Å; L144-S202 WeakPolarHBondContact O-CA 3.13Å; L144-F203 HydrophobicContact CB-CD2 4.36Å; L144-F203 HydrophobicContact CB-CE2 3.9Å; L144-F203 HydrophobicContact CB-CZ 4.03Å; L144-F203 HydrophobicContact CD2-CE1 4.41Å; L144-F203 HydrophobicContact CD2-CE2 3.88Å; L144-F203 HydrophobicContact CD2-CZ 3.52Å; L144-F203 HydrophobicContact CG-CZ 4.36Å; L144-F203 PolarHBondContact N-O 3.26Å; L144-F203 PolarHBondContact O-N 3.38Å; L144-F203 VanDerWaalsContact O-N 3.13Å; L144-V205 HydrophobicContact CB-CG1 3.74Å; L144-I211 HydrophobicContact CD2-CG1 4.03Å; L144-I211 HydrophobicContact CD2-CG2 4.39Å
145	H	98.7	Very high	97.3	Very high	9 Å²	9	18.4 Å²	18.4	4%	0.042	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.6	172.5	-55	-78.3	0	0	0	108.8	P105 P108 V136 Q143 S202	P105-H145 PolarHBondContact O-CD2 3.13Å; P108-H145 HydrophobicContact CG-CB 4.07Å; V136-H145 HydrophobicContact CB-CB 4.39Å; V136-H145 PolarHBondContact N-O 2.9Å; V136-H145 PolarHBondContact O-N 3.4Å; Q143-H145 PolarHBondContact OE1-CE1 2.87Å; H145-S202 WeakPolarHBondContact ND1-CB 3.49Å; H145-S202 PolarHBondContact ND1-OG 3.36Å
146	T	98.6	Very high	97.3	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.006	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.1	-176.5	70.2	0	0	0	0	111.5	P108 I134 V135 L144 F154 S200 S201	P108-T146 VanDerWaalsContact CG-C 3.43Å; I134-T146 CarbonylContact O-C 3.56Å; I134-T146 VanDerWaalsContact O-CA 3.28Å; I134-T146 WeakPolarHBondContact O-CA 3.17Å; V135-T146 HydrophobicContact CB-CG2 4.48Å; V135-T146 HydrophobicContact CG1-CG2 4.27Å; V135-T146 HydrophobicContact CG2-CG2 4.03Å; L144-T146 HydrophobicContact CD2-CG2 4.13Å; L144-T146 HydrophobicContact CG-CG2 4.29Å; T146-F154 VanDerWaalsContact CB-CE1 3.44Å; T146-F154 HydrophobicContact CG2-CD1 4.12Å; T146-F154 HydrophobicContact CG2-CD2 4.35Å; T146-F154 HydrophobicContact CG2-CE1 3.64Å; T146-F154 HydrophobicContact CG2-CE2 3.9Å; T146-F154 HydrophobicContact CG2-CG 4.46Å; T146-F154 HydrophobicContact CG2-CZ 3.53Å; T146-F154 VanDerWaalsContact OG1-CE1 3.22Å; T146-F154 WeakPolarHBondContact OG1-CE1 3.3Å; T146-F154 VanDerWaalsContact OG1-CZ 3.28Å; T146-F154 WeakPolarHBondContact OG1-CZ 3.35Å; T146-S200 VanDerWaalsContact O-CA 3.28Å; T146-S200 WeakPolarHBondContact O-CA 3.44Å; T146-S201 PolarHBondContact N-O 2.75Å; T146-S201 PolarHBondContact O-N 2.9Å; T146-S201 VanDerWaalsContact O-N 3.17Å; T146-S201 PolarHBondContact OG1-OG 3.09Å
147	C	98.4	Very high	97.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	132.8	159.2	68.3	0	0	0	0	110	P108 V109 C133 I134 A198 D199	P108-C147 VanDerWaalsContact C-SG 3.55Å; P108-C147 HydrophobicContact CB-CB 4.23Å; P108-C147 HydrophobicContact CG-CB 4.13Å; V109-C147 HydrophobicContact CG2-CB 3.58Å; C133-C147 CarbonylContact C-O 3.54Å; C133-C147 WeakPolarHBondContact CA-O 3.4Å; I134-C147 PolarHBondContact N-O 3.48Å; I134-C147 PolarHBondContact O-N 2.81Å; C147-A198 HydrophobicContact CB-CB 4.06Å; C147-D199 CarbonylContact C-O 3.52Å; C147-D199 VanDerWaalsContact CA-O 3.23Å; C147-D199 WeakPolarHBondContact CA-O 3.32Å
148	N	98.7	Very high	97.2	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.8	177.3	-171.6	43.3	0	0	0	109.8	C133 G150 S152 D167 Q169 A198 D199	C133-N148 WeakPolarHBondContact CB-OD1 3.31Å; N148-G150 PolarHBondContact ND2-O 3.06Å; N148-S152 VanDerWaalsContact CG-O 3.32Å; N148-S152 PolarHBondContact ND2-O 2.85Å; N148-S152 PolarHBondContact OD1-O 3.2Å; N148-D167 PolarHBondContact ND2-O 3.09Å; N148-Q169 PolarHBondContact O-OE1 2.94Å; N148-A198 CarbonylContact O-C 3.51Å; N148-A198 VanDerWaalsContact O-CA 3.26Å; N148-A198 WeakPolarHBondContact O-CA 3.29Å; N148-D199 PolarHBondContact N-O 3.35Å; N148-D199 PolarHBondContact O-N 3.19Å
149	L	98.7	Very high	97.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	109.5	171.6	-170.7	83.1	0	0	0	108.7	L112 T131 A132 F177 L179 D193 A197 A198	L112-L149 HydrophobicContact CD2-CB 4.29Å; T131-L149 CarbonylContact C-O 3.55Å; T131-L149 WeakPolarHBondContact CA-O 3.1Å; T131-L149 VanDerWaalsContact CB-O 3.3Å; T131-L149 WeakPolarHBondContact CB-O 3.28Å; A132-L149 PolarHBondContact N-O 3.42Å; A132-L149 PolarHBondContact O-N 3.09Å; L149-F177 HydrophobicContact CD1-CB 4.1Å; L149-F177 HydrophobicContact CD1-CD1 4.3Å; L149-F177 HydrophobicContact CG-CB 4.15Å; L149-L179 HydrophobicContact CD2-CD1 4.44Å; L149-L179 HydrophobicContact CD2-CD2 3.55Å; L149-L179 HydrophobicContact CD2-CG 3.52Å; L149-D193 HydrophobicContact CD1-CB 4.41Å; L149-A197 HydrophobicContact CD1-CB 4.17Å; L149-A198 HydrophobicContact CB-CB 4.02Å; L149-A198 HydrophobicContact CD1-CB 4.21Å
150	G	98.4	Very high	97.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	104.2	-149.3	-177.4	0	0	0	0	0	113.2	N148 Q169 F177	N148-G150 PolarHBondContact ND2-O 3.06Å; G150-Q169 CarbonylContact C-O 3.45Å; G150-Q169 WeakPolarHBondContact CA-O 3.48Å; G150-Q169 PolarHBondContact O-N 3.35Å; G150-F177 VanDerWaalsContact CA-O 3.25Å; G150-F177 WeakPolarHBondContact CA-O 3.32Å
151	D	97.8	Very high	97.6	Very high	3 Å²	3	23 Å²	23	2%	0.016	14%	0.142	C	C	.	.	S	Bend	trans	-115.8	10.5	-173.8	51.9	6.3	0	0	0	114.1	E168 Q170 P176	D151-E168 HydrophobicContact CB-CB 4.3Å; D151-E168 HydrophobicContact CB-CG 4.21Å; D151-Q170 PolarHBondContact OD2-NE2 3.29Å; D151-P176 HydrophobicContact CB-CB 4.34Å; D151-P176 VanDerWaalsContact CG-CB 3.49Å; D151-P176 VanDerWaalsContact OD1-CB 3.32Å; D151-P176 WeakPolarHBondContact OD1-CB 3.46Å; D151-P176 WeakPolarHBondContact OD2-CB 3.44Å
152	S	98.1	Very high	97.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.138	C	C	.	.			trans	-61.8	175.3	148.1	-71.1	0	0	0	0	110.1	T131 N148	T131-S152 PolarHBondContact OG1-OG 3.33Å; T131-S152 VanDerWaalsContact OG1-OG 3.09Å; N148-S152 VanDerWaalsContact CG-O 3.32Å; N148-S152 PolarHBondContact ND2-O 2.85Å; N148-S152 PolarHBondContact OD1-O 3.2Å
153	G	98.3	Very high	97.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.7	-168.6	176.7	0	0	0	0	0	116.3	S166 T213 A214	G153-S166 WeakPolarHBondContact CA-OG 3.38Å; G153-T213 WeakPolarHBondContact O-CA 3.05Å; G153-A214 PolarHBondContact N-O 3.32Å; G153-A214 PolarHBondContact O-N 3.21Å
154	F	98.7	Very high	97.9	Very high	3 Å²	3	24 Å²	24	1%	0.013	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	159.8	176.1	72.3	-85	0	0	0	112.1	V135 T146 V156 S166 F203 L212 T213	V135-F154 HydrophobicContact CG2-CB 4.18Å; V135-F154 HydrophobicContact CG2-CD1 4.36Å; V135-F154 HydrophobicContact CG2-CG 4.24Å; T146-F154 VanDerWaalsContact CB-CE1 3.44Å; T146-F154 HydrophobicContact CG2-CD1 4.12Å; T146-F154 HydrophobicContact CG2-CD2 4.35Å; T146-F154 HydrophobicContact CG2-CE1 3.64Å; T146-F154 HydrophobicContact CG2-CE2 3.9Å; T146-F154 HydrophobicContact CG2-CG 4.46Å; T146-F154 HydrophobicContact CG2-CZ 3.53Å; T146-F154 VanDerWaalsContact OG1-CE1 3.22Å; T146-F154 WeakPolarHBondContact OG1-CE1 3.3Å; T146-F154 VanDerWaalsContact OG1-CZ 3.28Å; T146-F154 WeakPolarHBondContact OG1-CZ 3.35Å; F154-V156 HydrophobicContact CD2-CG2 4.17Å; F154-V156 HydrophobicContact CE2-CG2 4.34Å; F154-S166 PolarHBondContact N-OG 2.83Å; F154-S166 PolarHBondContact O-N 2.78Å; F154-S166 PolarHBondContact O-OG 2.89Å; F154-F203 AromaticContact CE2-CE1 4Å; F154-F203 HydrophobicContact CE2-CE1 4Å; F154-F203 AromaticContact CE2-CZ 3.99Å; F154-F203 HydrophobicContact CE2-CZ 3.99Å; F154-F203 HydrophobicContact CZ-CE1 4.31Å; F154-L212 CarbonylContact C-O 3.4Å; F154-L212 WeakPolarHBondContact CA-O 3.11Å; F154-L212 WeakPolarHBondContact CB-O 3.48Å; F154-T213 HydrophobicContact CB-CG2 4.43Å
155	L	97.9	Very high	97.9	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	151.4	165.3	71.2	114.2	0	0	0	110.6	V157 V162 H164 I211 L212 F219 I227 L231	L155-V157 HydrophobicContact CD1-CG2 3.21Å; L155-V162 HydrophobicContact CB-CG1 4.47Å; L155-V162 HydrophobicContact CD1-CG2 4.29Å; L155-H164 CarbonylContact C-O 3.59Å; L155-H164 WeakPolarHBondContact CA-O 3.5Å; L155-I211 WeakPolarHBondContact O-CA 3.35Å; L155-L212 HydrophobicContact CD1-CB 4.36Å; L155-L212 HydrophobicContact CD2-CB 3.71Å; L155-L212 HydrophobicContact CD2-CD2 3.42Å; L155-L212 VanDerWaalsContact CD2-CD2 3.42Å; L155-L212 HydrophobicContact CD2-CG 4.08Å; L155-L212 HydrophobicContact CG-CB 3.77Å; L155-L212 HydrophobicContact CG-CD2 4.37Å; L155-L212 PolarHBondContact N-O 3.47Å; L155-L212 PolarHBondContact O-N 3.23Å; L155-F219 HydrophobicContact CD2-CE1 3.93Å; L155-F219 HydrophobicContact CD2-CZ 4.43Å; L155-I227 HydrophobicContact CD1-CG2 4.46Å; L155-I227 HydrophobicContact CD2-CD1 4.13Å; L155-I227 HydrophobicContact CD2-CG2 4.07Å; L155-L231 HydrophobicContact CD1-CD1 4.48Å
156	V	98.5	Very high	97.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.2	173.2	-176.6	0	0	0	0	109	L144 F154 V162 V163 H164 F203 D209 I210 I211	L144-V156 HydrophobicContact CD2-CG2 3.96Å; F154-V156 HydrophobicContact CD2-CG2 4.17Å; F154-V156 HydrophobicContact CE2-CG2 4.34Å; V156-V162 WeakPolarHBondContact O-CA 3.39Å; V156-V163 HydrophobicContact CB-CG2 4.06Å; V156-V163 HydrophobicContact CG1-CG2 3.8Å; V156-V163 VanDerWaalsContact O-CG2 3.31Å; V156-V163 WeakPolarHBondContact O-CG2 3.36Å; V156-V163 PolarHBondContact O-N 2.92Å; V156-H164 HydrophobicContact CB-CB 4.18Å; V156-H164 HydrophobicContact CG2-CB 4.36Å; V156-H164 PolarHBondContact N-O 3.04Å; V156-H164 PolarHBondContact O-N 3.22Å; V156-F203 HydrophobicContact CB-CE2 4.26Å; V156-F203 HydrophobicContact CB-CZ 4.38Å; V156-F203 HydrophobicContact CG1-CE2 4.32Å; V156-F203 HydrophobicContact CG2-CE2 3.72Å; V156-F203 HydrophobicContact CG2-CZ 3.51Å; V156-D209 HydrophobicContact CG1-CB 4.29Å; V156-I210 CarbonylContact C-O 3.4Å; V156-I210 VanDerWaalsContact CA-O 3.31Å; V156-I210 WeakPolarHBondContact CA-O 3.14Å; V156-I211 HydrophobicContact CG2-CG1 4.02Å; V156-I211 HydrophobicContact CG2-CG2 4.42Å
157	V	98.4	Very high	97.7	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.03	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.1	178.3	-173.6	0	0	0	0	109.7	L155 E161 I210 L228 L231	L155-V157 HydrophobicContact CD1-CG2 3.21Å; V157-E161 CarbonylContact C-O 3.59Å; V157-E161 VanDerWaalsContact CA-O 3.26Å; V157-E161 WeakPolarHBondContact CA-O 3.45Å; V157-E161 WeakPolarHBondContact CG1-O 3.24Å; V157-I210 HydrophobicContact CB-CB 4.26Å; V157-I210 PolarHBondContact N-O 3.35Å; V157-I210 PolarHBondContact O-N 3.03Å; V157-L228 HydrophobicContact CB-CD2 4.38Å; V157-L228 HydrophobicContact CG1-CD2 3.72Å; V157-L228 HydrophobicContact CG2-CD2 3.67Å; V157-L231 HydrophobicContact CB-CD1 4.38Å; V157-L231 HydrophobicContact CG2-CD1 3.57Å
158	R	97.6	Very high	97.5	Very high	63 Å²	63	37.2 Å²	37.2	24%	0.238	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.7	174.2	-176.7	179.1	-63.8	156.6	-0.2	108.9	G160 E161 V163 D204 D209	R158-G160 PolarHBondContact O-N 3.36Å; R158-G160 VanDerWaalsContact O-N 3.14Å; R158-E161 PolarHBondContact N-O 2.58Å; R158-E161 PolarHBondContact O-N 3.11Å; R158-E161 VanDerWaalsContact O-N 3.13Å; R158-V163 HydrophobicContact CB-CB 4.48Å; R158-V163 HydrophobicContact CB-CG1 3.71Å; R158-V163 HydrophobicContact CB-CG2 3.91Å; R158-D204 PolarHBondContact NH2-O 3.07Å; R158-D209 WeakPolarHBondContact CB-OD1 3.41Å; R158-D209 VanDerWaalsContact CG-OD1 3.22Å; R158-D209 WeakPolarHBondContact CG-OD1 3.34Å; R158-D209 IonicContact CZ-OD1 3.75Å; R158-D209 IonicContact CZ-OD2 3.41Å; R158-D209 IonicContact NE-OD1 2.83Å; R158-D209 PolarHBondContact NE-OD1 2.94Å; R158-D209 IonicContact NE-OD2 3.28Å; R158-D209 PolarHBondContact NE-OD2 3.38Å; R158-D209 IonicContact NH2-OD1 3.8Å; R158-D209 IonicContact NH2-OD2 2.7Å; R158-D209 PolarHBondContact NH2-OD2 3.47Å
159	G	95.1	Very high	97.5	Very high	86 Å²	86	38.7 Å²	38.7	89%	0.887	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	23.4	179.7	0	0	0	0	0	114.5
160	G	95.4	Very high	97.3	Very high	31 Å²	31	40.9 Å²	40.9	32%	0.32	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	2.6	-178.9	0	0	0	0	0	115.4	R158	R158-G160 PolarHBondContact O-N 3.36Å; R158-G160 VanDerWaalsContact O-N 3.14Å
161	E	97.3	Very high	97.2	Very high	131 Å²	131	44.4 Å²	44.4	61%	0.612	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	147	178.2	-61.2	-61	143.7	0	0	110.8	V157 R158 V163	V157-E161 CarbonylContact C-O 3.59Å; V157-E161 VanDerWaalsContact CA-O 3.26Å; V157-E161 WeakPolarHBondContact CA-O 3.45Å; V157-E161 WeakPolarHBondContact CG1-O 3.24Å; R158-E161 PolarHBondContact N-O 2.58Å; R158-E161 PolarHBondContact O-N 3.11Å; R158-E161 VanDerWaalsContact O-N 3.13Å; E161-V163 PolarHBondContact O-N 2.94Å
162	V	98.1	Very high	96.9	Very high	44 Å²	44	51 Å²	51	27%	0.267	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	115.8	172.7	-179.5	0	0	0	0	108.5	L155 V156 H164 R165 L228	L155-V162 HydrophobicContact CB-CG1 4.47Å; L155-V162 HydrophobicContact CD1-CG2 4.29Å; V156-V162 WeakPolarHBondContact O-CA 3.39Å; V162-H164 WeakPolarHBondContact CG1-O 3.41Å; V162-R165 HydrophobicContact CG1-CB 4.13Å; V162-L228 HydrophobicContact CG2-CD1 4.2Å; V162-L228 HydrophobicContact CG2-CD2 4Å; V162-L228 HydrophobicContact CG2-CG 4.3Å
163	V	97.8	Very high	96.7	Very high	56 Å²	56	53 Å²	53	34%	0.339	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-25.6	177.4	-69.1	0	0	0	0	112.8	V156 R158 E161	V156-V163 HydrophobicContact CB-CG2 4.06Å; V156-V163 HydrophobicContact CG1-CG2 3.8Å; V156-V163 VanDerWaalsContact O-CG2 3.31Å; V156-V163 WeakPolarHBondContact O-CG2 3.36Å; V156-V163 PolarHBondContact O-N 2.92Å; R158-V163 HydrophobicContact CB-CB 4.48Å; R158-V163 HydrophobicContact CB-CG1 3.71Å; R158-V163 HydrophobicContact CB-CG2 3.91Å; E161-V163 PolarHBondContact O-N 2.94Å
164	H	97.6	Very high	96.4	Very high	71 Å²	71	56 Å²	56	33%	0.329	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	142.9	173.3	-68.3	-80.3	0	0	0	109.9	L155 V156 V162 F203	L155-H164 CarbonylContact C-O 3.59Å; L155-H164 WeakPolarHBondContact CA-O 3.5Å; V156-H164 HydrophobicContact CB-CB 4.18Å; V156-H164 HydrophobicContact CG2-CB 4.36Å; V156-H164 PolarHBondContact N-O 3.04Å; V156-H164 PolarHBondContact O-N 3.22Å; V162-H164 WeakPolarHBondContact CG1-O 3.41Å; H164-F203 HydrophobicContact CB-CE1 4.02Å; H164-F203 HydrophobicContact CB-CE2 4.3Å; H164-F203 HydrophobicContact CB-CZ 3.87Å; H164-F203 AromaticContact CD2-CD2 3.41Å; H164-F203 VanDerWaalsContact CD2-CD2 3.41Å; H164-F203 WeakPolarHBondContact CD2-CD2 3.41Å; H164-F203 AromaticContact CD2-CE2 3.59Å; H164-F203 AromaticContact CD2-CG 3.65Å; H164-F203 AromaticContact CD2-CZ 3.98Å; H164-F203 AromaticContact CE1-CD1 4Å; H164-F203 AromaticContact CE1-CG 3.77Å; H164-F203 AromaticContact CG-CD1 3.92Å; H164-F203 AromaticContact CG-CE1 3.87Å; H164-F203 AromaticContact CG-CE2 4Å; H164-F203 AromaticContact CG-CG 4Å; H164-F203 AromaticContact CG-CZ 3.9Å; H164-F203 AromaticContact ND1-CD1 3.87Å; H164-F203 AromaticContact NE2-CD2 3.62Å; H164-F203 AromaticContact NE2-CG 3.52Å
165	R	97.4	Very high	96.2	Very high	81 Å²	81	57 Å²	57	31%	0.306	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	138.4	173.7	-179.9	172.4	176.7	79.3	16.6	107.8	V162 E168 D224	V162-R165 HydrophobicContact CG1-CB 4.13Å; R165-E168 IonicContact NH2-OE1 2.58Å; R165-D224 IonicContact CZ-OD1 3.82Å; R165-D224 IonicContact NE-OD1 2.65Å; R165-D224 IonicContact NH1-OD1 2.83Å; R165-D224 PolarHBondContact NH1-OD1 2.92Å; R165-D224 IonicContact NH1-OD2 3.79Å
166	S	97.7	Very high	96.2	Very high	6 Å²	6	57.6 Å²	57.6	4%	0.042	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-68.9	144.6	171.9	52.5	0	0	0	0	111.2	G153 F154	G153-S166 WeakPolarHBondContact CA-OG 3.38Å; F154-S166 PolarHBondContact N-OG 2.83Å; F154-S166 PolarHBondContact O-N 2.78Å; F154-S166 PolarHBondContact O-OG 2.89Å
167	D	95.6	Very high	96.2	Very high	116 Å²	116	59.8 Å²	59.8	62%	0.62	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-81.4	139.6	166.9	-66.6	-41	0	0	0	110.2	N148	N148-D167 PolarHBondContact ND2-O 3.09Å
168	E	95.4	Very high	96.2	Very high	83 Å²	83	60.2 Å²	60.2	39%	0.388	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-77.8	139.5	174.2	-69.1	167	-157.2	0	0	110.1	D151 R165	D151-E168 HydrophobicContact CB-CB 4.3Å; D151-E168 HydrophobicContact CB-CG 4.21Å; R165-E168 IonicContact NH2-OE1 2.58Å
169	Q	97.3	Very high	96.2	Very high	32 Å²	32	57.2 Å²	57.2	15%	0.15	31%	0.305	C	S	.	.			trans	-113	114.1	178.7	-60.7	-175	-51	0	0	110.8	N148 G150 P176 F177 A197 D199	N148-Q169 PolarHBondContact O-OE1 2.94Å; G150-Q169 CarbonylContact C-O 3.45Å; G150-Q169 WeakPolarHBondContact CA-O 3.48Å; G150-Q169 PolarHBondContact O-N 3.35Å; Q169-P176 WeakPolarHBondContact O-CA 3.42Å; Q169-F177 HydrophobicContact CB-CB 4.02Å; Q169-F177 HydrophobicContact CB-CD2 3.78Å; Q169-F177 HydrophobicContact CB-CE2 4.39Å; Q169-F177 HydrophobicContact CB-CG 3.86Å; Q169-F177 PolarHBondContact O-N 2.94Å; Q169-A197 PolarHBondContact NE2-O 2.96Å; Q169-D199 HydrophobicContact CG-CB 4.48Å
170	Q	95.9	Very high	96.3	Very high	47 Å²	47	53.3 Å²	53.3	22%	0.22	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.2	178.9	-63.9	-174.4	-16.9	0	0	111.4	D151 T175	D151-Q170 PolarHBondContact OD2-NE2 3.29Å; Q170-T175 CarbonylContact C-O 3.54Å; Q170-T175 WeakPolarHBondContact CA-O 3.21Å
171	H	94.9	Very high	96.3	Very high	73 Å²	73	52.5 Å²	52.5	34%	0.338	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-36.9	172.4	-68.6	-72.6	0	0	0	111.4	T175 F177 D193	H171-T175 PolarHBondContact N-O 3.22Å; H171-F177 AromaticContact CD2-CD2 3.89Å; H171-F177 AromaticContact CE1-CD2 3.91Å; H171-F177 AromaticContact CE1-CE2 3.65Å; H171-F177 AromaticContact CE1-CZ 3.72Å; H171-F177 AromaticContact ND1-CE2 3.76Å; H171-F177 AromaticContact NE2-CD2 3.69Å; H171-F177 AromaticContact NE2-CE2 3.91Å; H171-F177 AromaticContact NE2-CG 3.86Å; H171-D193 IonicContact CD2-OD2 3.79Å; H171-D193 IonicContact CE1-OD1 3.93Å; H171-D193 PolarHBondContact CE1-OD1 3.17Å; H171-D193 IonicContact CE1-OD2 3.78Å; H171-D193 IonicContact NE2-OD1 3.14Å; H171-D193 PolarHBondContact NE2-OD1 3.05Å; H171-D193 VanDerWaalsContact NE2-OD1 3.1Å; H171-D193 IonicContact NE2-OD2 3.27Å; H171-D193 PolarHBondContact NE2-OD2 2.82Å
172	Y	92.2	Very high	96	Very high	141 Å²	141	47.6 Å²	47.6	55%	0.553	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-159.9	170.2	173.8	39.2	-90.3	0	0	0	108	N174 T175	Y172-N174 PolarHBondContact O-N 3.41Å; Y172-T175 VanDerWaalsContact CD2-CB 3.5Å; Y172-T175 HydrophobicContact CD2-CG2 4.24Å; Y172-T175 VanDerWaalsContact CD2-OG1 3.25Å; Y172-T175 WeakPolarHBondContact CD2-OG1 3.48Å; Y172-T175 HydrophobicContact CE1-CG2 4.18Å; Y172-T175 HydrophobicContact CE2-CG2 3.64Å; Y172-T175 WeakPolarHBondContact CE2-OG1 3.31Å; Y172-T175 PolarHBondContact O-N 2.8Å
173	F	92.9	Very high	95.5	Very high	43 Å²	43	47.5 Å²	47.5	19%	0.189	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.5	124.3	-176.6	173.7	-101.1	0	0	0	112.3	T175 F266 F269 A270 N273 L275	F173-T175 PolarHBondContact O-N 3.15Å; F173-F266 HydrophobicContact CE1-CE2 4.19Å; F173-F266 HydrophobicContact CE1-CZ 4.15Å; F173-F266 HydrophobicContact CE2-CE2 4.26Å; F173-F266 HydrophobicContact CZ-CD2 4.17Å; F173-F266 HydrophobicContact CZ-CE1 4.49Å; F173-F266 AromaticContact CZ-CE2 3.51Å; F173-F266 HydrophobicContact CZ-CE2 3.51Å; F173-F266 AromaticContact CZ-CZ 3.7Å; F173-F266 HydrophobicContact CZ-CZ 3.7Å; F173-F269 AromaticContact CD2-CD1 3.49Å; F173-F269 HydrophobicContact CD2-CD1 3.49Å; F173-F269 VanDerWaalsContact CD2-CD1 3.49Å; F173-F269 AromaticContact CD2-CE1 3.68Å; F173-F269 HydrophobicContact CD2-CE1 3.68Å; F173-F269 HydrophobicContact CD2-CG 4.2Å; F173-F269 HydrophobicContact CE2-CB 4.24Å; F173-F269 AromaticContact CE2-CD1 3.53Å; F173-F269 HydrophobicContact CE2-CD1 3.53Å; F173-F269 HydrophobicContact CE2-CE1 4.19Å; F173-F269 HydrophobicContact CE2-CG 4.09Å; F173-A270 HydrophobicContact CE1-CB 4.16Å; F173-A270 HydrophobicContact CE2-CB 4.02Å; F173-A270 HydrophobicContact CZ-CB 3.47Å; F173-A270 VanDerWaalsContact CZ-CB 3.47Å; F173-N273 HydrophobicContact CB-CB 4.31Å; F173-N273 HydrophobicContact CD2-CB 4.26Å; F173-N273 HydrophobicContact CG-CB 4.23Å; F173-L275 HydrophobicContact CD1-CD1 3.73Å; F173-L275 HydrophobicContact CE1-CD1 3.48Å; F173-L275 VanDerWaalsContact CE1-CD1 3.48Å; F173-L275 HydrophobicContact CZ-CD1 4.35Å
174	N	92.8	Very high	94.9	Very high	63 Å²	63	50.3 Å²	50.3	34%	0.337	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	34.3	178	-167.3	66.1	0	0	0	113.2	Y172 F266 K281	Y172-N174 PolarHBondContact O-N 3.41Å; N174-F266 HydrophobicContact CB-CE2 4.07Å; N174-F266 WeakPolarHBondContact OD1-CE2 2.98Å; N174-K281 PolarHBondContact OD1-NZ 3.43Å
175	T	95.3	Very high	94.2	Very high	25 Å²	25	50.5 Å²	50.5	15%	0.153	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	91.1	169.9	-61.3	0	0	0	0	109.4	Q170 H171 Y172 F173 L191	Q170-T175 CarbonylContact C-O 3.54Å; Q170-T175 WeakPolarHBondContact CA-O 3.21Å; H171-T175 PolarHBondContact N-O 3.22Å; Y172-T175 VanDerWaalsContact CD2-CB 3.5Å; Y172-T175 HydrophobicContact CD2-CG2 4.24Å; Y172-T175 VanDerWaalsContact CD2-OG1 3.25Å; Y172-T175 WeakPolarHBondContact CD2-OG1 3.48Å; Y172-T175 HydrophobicContact CE1-CG2 4.18Å; Y172-T175 HydrophobicContact CE2-CG2 3.64Å; Y172-T175 WeakPolarHBondContact CE2-OG1 3.31Å; Y172-T175 PolarHBondContact O-N 2.8Å; F173-T175 PolarHBondContact O-N 3.15Å; T175-L191 HydrophobicContact CG2-CD1 3.45Å; T175-L191 VanDerWaalsContact CG2-CD1 3.45Å
176	P	97.3	Very high	93.6	Very high	13 Å²	13	47.9 Å²	47.9	8%	0.084	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	158.3	-176.6	26	-32.6	0	0	0	113	T131 D151 Q169 Q178	T131-P176 HydrophobicContact CG2-CB 3.79Å; T131-P176 HydrophobicContact CG2-CG 3.79Å; D151-P176 HydrophobicContact CB-CB 4.34Å; D151-P176 VanDerWaalsContact CG-CB 3.49Å; D151-P176 VanDerWaalsContact OD1-CB 3.32Å; D151-P176 WeakPolarHBondContact OD1-CB 3.46Å; D151-P176 WeakPolarHBondContact OD2-CB 3.44Å; Q169-P176 WeakPolarHBondContact O-CA 3.42Å; P176-Q178 PolarHBondContact O-NE2 3.2Å
177	F	98.4	Very high	92.7	Very high	46 Å²	46	55.2 Å²	55.2	20%	0.202	30%	0.304	C	S	.	.			trans	-58.1	138.1	158.9	-81	-125.6	0	0	0	109.2	L149 G150 Q169 H171 D193 A197	L149-F177 HydrophobicContact CD1-CB 4.1Å; L149-F177 HydrophobicContact CD1-CD1 4.3Å; L149-F177 HydrophobicContact CG-CB 4.15Å; G150-F177 VanDerWaalsContact CA-O 3.25Å; G150-F177 WeakPolarHBondContact CA-O 3.32Å; Q169-F177 HydrophobicContact CB-CB 4.02Å; Q169-F177 HydrophobicContact CB-CD2 3.78Å; Q169-F177 HydrophobicContact CB-CE2 4.39Å; Q169-F177 HydrophobicContact CB-CG 3.86Å; Q169-F177 PolarHBondContact O-N 2.94Å; H171-F177 AromaticContact CD2-CD2 3.89Å; H171-F177 AromaticContact CE1-CD2 3.91Å; H171-F177 AromaticContact CE1-CE2 3.65Å; H171-F177 AromaticContact CE1-CZ 3.72Å; H171-F177 AromaticContact ND1-CE2 3.76Å; H171-F177 AromaticContact NE2-CD2 3.69Å; H171-F177 AromaticContact NE2-CE2 3.91Å; H171-F177 AromaticContact NE2-CG 3.86Å; F177-D193 WeakPolarHBondContact CA-OD2 3.46Å; F177-D193 HydrophobicContact CD1-CB 4.08Å; F177-A197 HydrophobicContact CD1-CB 4.35Å; F177-A197 HydrophobicContact CE1-CB 4.38Å
178	Q	98.1	Very high	91.8	Very high	13 Å²	13	53.7 Å²	53.7	6%	0.061	32%	0.316	C	S	.	.			trans	-153.1	142.2	-171.3	60.4	-167.2	-95.5	0	0	112.5	V73 S129 S130 P176 L191 D193	V73-Q178 HydrophobicContact CG2-CB 4.41Å; S129-Q178 PolarHBondContact OG-OE1 3.41Å; S130-Q178 WeakPolarHBondContact O-CA 3.22Å; P176-Q178 PolarHBondContact O-NE2 3.2Å; Q178-L191 HydrophobicContact CG-CB 4.35Å; Q178-D193 PolarHBondContact N-OD2 3.4Å; Q178-D193 PolarHBondContact O-N 3Å
179	L	98.1	Very high	91.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	136.4	166.7	-61.8	178.6	0	0	0	108.9	F86 L90 L112 Y116 S129 S130 L149 D193 P195	F86-L179 HydrophobicContact CE1-CB 4.12Å; F86-L179 HydrophobicContact CZ-CB 4.07Å; F86-L179 WeakPolarHBondContact CZ-O 3.44Å; L90-L179 HydrophobicContact CD1-CD1 4.49Å; L90-L179 HydrophobicContact CD2-CD1 4.02Å; L112-L179 HydrophobicContact CD1-CD1 3.66Å; L112-L179 HydrophobicContact CG-CD1 4.08Å; Y116-L179 HydrophobicContact CD1-CD2 3.98Å; Y116-L179 HydrophobicContact CD2-CB 3.92Å; Y116-L179 HydrophobicContact CD2-CD1 3.96Å; Y116-L179 HydrophobicContact CD2-CD2 4.43Å; Y116-L179 HydrophobicContact CD2-CG 4.33Å; Y116-L179 HydrophobicContact CE1-CD2 4.07Å; Y116-L179 HydrophobicContact CE2-CB 3.85Å; Y116-L179 HydrophobicContact CG-CB 4.44Å; Y116-L179 HydrophobicContact CG-CD1 3.87Å; Y116-L179 HydrophobicContact CG-CD2 4.14Å; Y116-L179 HydrophobicContact CG-CG 4.38Å; S129-L179 CarbonylContact C-O 3.6Å; S129-L179 WeakPolarHBondContact CA-O 3.37Å; S129-L179 WeakPolarHBondContact CB-O 3.36Å; S130-L179 PolarHBondContact N-O 3.27Å; S130-L179 PolarHBondContact O-N 2.9Å; L149-L179 HydrophobicContact CD2-CD1 4.44Å; L149-L179 HydrophobicContact CD2-CD2 3.55Å; L149-L179 HydrophobicContact CD2-CG 3.52Å; L179-D193 WeakPolarHBondContact CD2-O 2.88Å; L179-P195 HydrophobicContact CD2-CB 4.37Å; L179-P195 HydrophobicContact CD2-CG 3.71Å
180	S	96.8	Very high	90.8	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.028	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	136.4	-173.9	-53	0	0	0	0	113.6	Y116 G128 S129 L191 S192	Y116-S180 PolarHBondContact OH-O 3.14Å; G128-S180 WeakPolarHBondContact O-CA 3.46Å; S129-S180 WeakPolarHBondContact CB-OG 3.33Å; S180-L191 WeakPolarHBondContact CB-O 3.46Å; S180-L191 PolarHBondContact OG-O 3.28Å; S180-S192 PolarHBondContact O-OG 3.19Å; S180-S192 VanDerWaalsContact O-OG 3.1Å
181	I	95.4	Very high	90.7	Very high	14 Å²	14	56.6 Å²	56.6	7%	0.072	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	105.1	167.5	-63.4	174	0	0	0	107.7	F86 Y116 L119 L120 L126 L127 G128	F86-I181 HydrophobicContact CE2-CB 4.12Å; F86-I181 HydrophobicContact CE2-CD1 3.92Å; F86-I181 HydrophobicContact CE2-CG1 3.77Å; Y116-I181 HydrophobicContact CE2-CG1 4.21Å; L119-I181 HydrophobicContact CB-CD1 3.95Å; L120-I181 HydrophobicContact CD2-CD1 4.11Å; L120-I181 HydrophobicContact CD2-CG1 3.69Å; L120-I181 HydrophobicContact CG-CD1 4.46Å; L120-I181 HydrophobicContact CG-CG1 4.44Å; L126-I181 WeakPolarHBondContact O-CB 3.39Å; L127-I181 WeakPolarHBondContact CA-O 3.33Å; L127-I181 HydrophobicContact CD2-CG2 4.26Å; G128-I181 PolarHBondContact N-O 3.03Å; G128-I181 PolarHBondContact O-N 2.96Å
182	A	91.6	Very high	90.6	Very high	28 Å²	28	56.2 Å²	56.2	23%	0.231	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-76.2	152	-179.9	0	0	0	0	0	111.9	V190	A182-V190 HydrophobicContact CB-CB 3.98Å; A182-V190 HydrophobicContact CB-CG2 3.87Å
183	P	88	Confident	90.8	Very high	42 Å²	42	50.8 Å²	50.8	27%	0.273	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-56.9	149.5	165.1	-19.9	28.8	0	0	0	111.1	W76 L127 G185 A186	W76-P183 HydrophobicContact CZ3-CG 4.25Å; L127-P183 HydrophobicContact CD1-CB 4.43Å; L127-P183 HydrophobicContact CD1-CG 4.22Å; L127-P183 HydrophobicContact CD2-CG 4.46Å; P183-G185 PolarHBondContact O-N 3.3Å; P183-A186 HydrophobicContact CB-CB 4.35Å; P183-A186 HydrophobicContact CG-CB 4.45Å; P183-A186 WeakPolarHBondContact O-CB 3.41Å; P183-A186 PolarHBondContact O-N 3.18Å
184	P	85.2	Confident	91	Very high	115 Å²	115	51.7 Å²	51.7	75%	0.747	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	128	174.9	-26.1	34.3	0	0	0	111.8	A186	P184-A186 VanDerWaalsContact C-N 3.33Å
185	G	82.4	Confident	91.3	Very high	76 Å²	76	48.7 Å²	48.7	78%	0.784	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	1	-179.3	0	0	0	0	0	115.8	P183	P183-G185 PolarHBondContact O-N 3.3Å
186	A	83.9	Confident	91.4	Very high	25 Å²	25	52.3 Å²	52.3	21%	0.207	34%	0.339	C	S	.	.			trans	-102.2	14.7	170.6	0	0	0	0	0	112.7	P183 P184 G188 V189 V190	P183-A186 HydrophobicContact CB-CB 4.35Å; P183-A186 HydrophobicContact CG-CB 4.45Å; P183-A186 WeakPolarHBondContact O-CB 3.41Å; P183-A186 PolarHBondContact O-N 3.18Å; P184-A186 VanDerWaalsContact C-N 3.33Å; A186-G188 PolarHBondContact O-N 2.85Å; A186-V189 PolarHBondContact O-N 3.09Å; A186-V189 VanDerWaalsContact O-N 3.12Å; A186-V190 HydrophobicContact CB-CG2 4.44Å; A186-V190 PolarHBondContact O-N 2.96Å
187	E	79.4	Confident	91.4	Very high	160 Å²	160	53.5 Å²	53.5	75%	0.748	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	128.6	176.4	-68	153.6	-160.1	0	0	110.2	V189	E187-V189 VanDerWaalsContact C-N 3.27Å; E187-V189 PolarHBondContact O-N 2.58Å
188	G	77.2	Confident	91.4	Very high	85 Å²	85	51.7 Å²	51.7	88%	0.876	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-5.3	-177.7	0	0	0	0	0	115.5	A186	A186-G188 PolarHBondContact O-N 2.85Å
189	V	83	Confident	91.4	Very high	124 Å²	124	53.9 Å²	53.9	75%	0.752	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-37.1	170.3	-176.7	0	0	0	0	110.9	A186 E187	A186-V189 PolarHBondContact O-N 3.09Å; A186-V189 VanDerWaalsContact O-N 3.12Å; E187-V189 VanDerWaalsContact C-N 3.27Å; E187-V189 PolarHBondContact O-N 2.58Å
190	V	88.4	Confident	91.3	Very high	36 Å²	36	56.8 Å²	56.8	22%	0.218	38%	0.376	C	S	.	.	S	Bend	trans	-83.8	128.8	174.8	-179.2	0	0	0	0	108.9	W76 A182 A186 S192	W76-V190 HydrophobicContact CH2-CG1 3.98Å; W76-V190 HydrophobicContact CH2-CG2 4.12Å; W76-V190 HydrophobicContact CZ2-CG1 3.61Å; A182-V190 HydrophobicContact CB-CB 3.98Å; A182-V190 HydrophobicContact CB-CG2 3.87Å; A186-V190 HydrophobicContact CB-CG2 4.44Å; A186-V190 PolarHBondContact O-N 2.96Å; V190-S192 PolarHBondContact O-N 2.94Å
191	L	92.5	Very high	91.3	Very high	63 Å²	63	58.3 Å²	58.3	33%	0.33	39%	0.386	S	S	.	.			trans	-57.5	127.7	170.7	-68.4	173.8	0	0	0	109.2	T175 Q178 S180	T175-L191 HydrophobicContact CG2-CD1 3.45Å; T175-L191 VanDerWaalsContact CG2-CD1 3.45Å; Q178-L191 HydrophobicContact CG-CB 4.35Å; S180-L191 WeakPolarHBondContact CB-O 3.46Å; S180-L191 PolarHBondContact OG-O 3.28Å
192	S	93.8	Very high	91.4	Very high	65 Å²	65	61 Å²	61	46%	0.455	41%	0.407	S	S	.	.			trans	-149.2	111.8	178.5	-168.6	0	0	0	0	108.3	Y116 S180 V190	Y116-S192 PolarHBondContact OH-OG 2.94Å; S180-S192 PolarHBondContact O-OG 3.19Å; S180-S192 VanDerWaalsContact O-OG 3.1Å; V190-S192 PolarHBondContact O-N 2.94Å
193	D	97.2	Very high	91.6	Very high	26 Å²	26	60.6 Å²	60.6	14%	0.139	40%	0.4	C	S	.	.			trans	-93.9	155	-180	-63.3	-69.5	0	0	0	111	L149 H171 F177 Q178 L179	L149-D193 HydrophobicContact CD1-CB 4.41Å; H171-D193 IonicContact CD2-OD2 3.79Å; H171-D193 IonicContact CE1-OD1 3.93Å; H171-D193 PolarHBondContact CE1-OD1 3.17Å; H171-D193 IonicContact CE1-OD2 3.78Å; H171-D193 IonicContact NE2-OD1 3.14Å; H171-D193 PolarHBondContact NE2-OD1 3.05Å; H171-D193 VanDerWaalsContact NE2-OD1 3.1Å; H171-D193 IonicContact NE2-OD2 3.27Å; H171-D193 PolarHBondContact NE2-OD2 2.82Å; F177-D193 WeakPolarHBondContact CA-OD2 3.46Å; F177-D193 HydrophobicContact CD1-CB 4.08Å; Q178-D193 PolarHBondContact N-OD2 3.4Å; Q178-D193 PolarHBondContact O-N 3Å; L179-D193 WeakPolarHBondContact CD2-O 2.88Å
194	S	96.9	Very high	92	Very high	62 Å²	62	63.4 Å²	63.4	43%	0.434	41%	0.412	S	S	.	.			trans	-74.6	139.3	173.3	-144.5	0	0	0	0	109.5	E196 A197	S194-E196 WeakPolarHBondContact CB-OE2 3.31Å; S194-E196 PolarHBondContact O-N 2.79Å; S194-E196 VanDerWaalsContact O-N 3.09Å; S194-E196 PolarHBondContact OG-OE2 2.88Å; S194-A197 VanDerWaalsContact O-CB 3.24Å; S194-A197 WeakPolarHBondContact O-CB 3.4Å; S194-A197 PolarHBondContact O-N 2.96Å
195	P	97.4	Very high	92.6	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-51.2	-31.5	168.2	-26.5	33	0	0	0	113.5	L112 T113 Y116 L179 A197 A198	L112-P195 HydrophobicContact CD2-CB 4.42Å; L112-P195 HydrophobicContact CG-CB 4.3Å; T113-P195 HydrophobicContact CG2-CB 4.43Å; T113-P195 HydrophobicContact CG2-CG 4.48Å; T113-P195 WeakPolarHBondContact OG1-CB 3.25Å; Y116-P195 HydrophobicContact CD1-CG 3.5Å; Y116-P195 HydrophobicContact CE1-CG 4.25Å; Y116-P195 HydrophobicContact CG-CG 4.23Å; L179-P195 HydrophobicContact CD2-CB 4.37Å; L179-P195 HydrophobicContact CD2-CG 3.71Å; P195-A197 PolarHBondContact O-N 2.53Å; P195-A198 WeakPolarHBondContact O-CB 3.24Å; P195-A198 PolarHBondContact O-N 3.07Å; P195-A198 VanDerWaalsContact O-N 3.14Å
196	E	97.4	Very high	93.3	Very high	100 Å²	100	59.5 Å²	59.5	47%	0.467	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-69.3	-12.4	177.8	-62.9	76.5	-171.7	0	0	113.6	T113 S194 A198	T113-E196 WeakPolarHBondContact CG2-OE1 3.43Å; S194-E196 WeakPolarHBondContact CB-OE2 3.31Å; S194-E196 PolarHBondContact O-N 2.79Å; S194-E196 VanDerWaalsContact O-N 3.09Å; S194-E196 PolarHBondContact OG-OE2 2.88Å; E196-A198 VanDerWaalsContact C-N 3.26Å
197	A	97.9	Very high	93.8	Very high	39 Å²	39	61.9 Å²	61.9	32%	0.322	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-79.7	-8.3	172	0	0	0	0	0	112.8	L149 Q169 F177 S194 P195 D199	L149-A197 HydrophobicContact CD1-CB 4.17Å; Q169-A197 PolarHBondContact NE2-O 2.96Å; F177-A197 HydrophobicContact CD1-CB 4.35Å; F177-A197 HydrophobicContact CE1-CB 4.38Å; S194-A197 VanDerWaalsContact O-CB 3.24Å; S194-A197 WeakPolarHBondContact O-CB 3.4Å; S194-A197 PolarHBondContact O-N 2.96Å; P195-A197 PolarHBondContact O-N 2.53Å; A197-D199 PolarHBondContact O-N 2.85Å
198	A	98.3	Very high	94.6	Very high	8 Å²	8	56.3 Å²	56.3	7%	0.066	36%	0.359	C	S	.	.	S	Bend	trans	-60.2	128.1	179.2	0	0	0	0	0	111.3	L112 C147 N148 L149 P195 E196 S200	L112-A198 HydrophobicContact CD2-CB 4.32Å; C147-A198 HydrophobicContact CB-CB 4.06Å; N148-A198 CarbonylContact O-C 3.51Å; N148-A198 VanDerWaalsContact O-CA 3.26Å; N148-A198 WeakPolarHBondContact O-CA 3.29Å; L149-A198 HydrophobicContact CB-CB 4.02Å; L149-A198 HydrophobicContact CD1-CB 4.21Å; P195-A198 WeakPolarHBondContact O-CB 3.24Å; P195-A198 PolarHBondContact O-N 3.07Å; P195-A198 VanDerWaalsContact O-N 3.14Å; E196-A198 VanDerWaalsContact C-N 3.26Å; A198-S200 PolarHBondContact O-N 3.09Å; A198-S200 PolarHBondContact O-OG 3.26Å; A198-S200 VanDerWaalsContact O-OG 3.14Å
199	D	98.1	Very high	95.6	Very high	59 Å²	59	52.4 Å²	52.4	32%	0.316	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	129.2	172.6	-179.3	52.6	0	0	0	109.7	C147 N148 Q169 A197	C147-D199 CarbonylContact C-O 3.52Å; C147-D199 VanDerWaalsContact CA-O 3.23Å; C147-D199 WeakPolarHBondContact CA-O 3.32Å; N148-D199 PolarHBondContact N-O 3.35Å; N148-D199 PolarHBondContact O-N 3.19Å; Q169-D199 HydrophobicContact CG-CB 4.48Å; A197-D199 PolarHBondContact O-N 2.85Å
200	S	96.8	Very high	96.4	Very high	61 Å²	61	47.5 Å²	47.5	43%	0.427	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.8	-169.2	-62.5	0	0	0	0	111.2	V109 T146 A198	V109-S200 WeakPolarHBondContact CG2-OG 3.24Å; T146-S200 VanDerWaalsContact O-CA 3.28Å; T146-S200 WeakPolarHBondContact O-CA 3.44Å; A198-S200 PolarHBondContact O-N 3.09Å; A198-S200 PolarHBondContact O-OG 3.26Å; A198-S200 VanDerWaalsContact O-OG 3.14Å
201	S	96.4	Very high	96.9	Very high	35 Å²	35	45.8 Å²	45.8	25%	0.245	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	157.9	-178.1	86.3	0	0	0	0	111.6	T146	T146-S201 PolarHBondContact N-O 2.75Å; T146-S201 PolarHBondContact O-N 2.9Å; T146-S201 VanDerWaalsContact O-N 3.17Å; T146-S201 PolarHBondContact OG1-OG 3.09Å
202	S	97.6	Very high	97.2	Very high	72 Å²	72	42.8 Å²	42.8	50%	0.503	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	131.8	174.4	-62.1	0	0	0	0	110.3	L144 H145	L144-S202 VanDerWaalsContact O-CA 3.29Å; L144-S202 WeakPolarHBondContact O-CA 3.13Å; H145-S202 WeakPolarHBondContact ND1-CB 3.49Å; H145-S202 PolarHBondContact ND1-OG 3.36Å
203	F	96.4	Very high	97.4	Very high	18 Å²	18	39.7 Å²	39.7	8%	0.079	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	158.2	-178.1	53.3	-91.4	0	0	0	111.9	Q143 L144 F154 V156 H164 V205	Q143-F203 WeakPolarHBondContact CA-O 3.42Å; L144-F203 HydrophobicContact CB-CD2 4.36Å; L144-F203 HydrophobicContact CB-CE2 3.9Å; L144-F203 HydrophobicContact CB-CZ 4.03Å; L144-F203 HydrophobicContact CD2-CE1 4.41Å; L144-F203 HydrophobicContact CD2-CE2 3.88Å; L144-F203 HydrophobicContact CD2-CZ 3.52Å; L144-F203 HydrophobicContact CG-CZ 4.36Å; L144-F203 PolarHBondContact N-O 3.26Å; L144-F203 PolarHBondContact O-N 3.38Å; L144-F203 VanDerWaalsContact O-N 3.13Å; F154-F203 AromaticContact CE2-CE1 4Å; F154-F203 HydrophobicContact CE2-CE1 4Å; F154-F203 AromaticContact CE2-CZ 3.99Å; F154-F203 HydrophobicContact CE2-CZ 3.99Å; F154-F203 HydrophobicContact CZ-CE1 4.31Å; V156-F203 HydrophobicContact CB-CE2 4.26Å; V156-F203 HydrophobicContact CB-CZ 4.38Å; V156-F203 HydrophobicContact CG1-CE2 4.32Å; V156-F203 HydrophobicContact CG2-CE2 3.72Å; V156-F203 HydrophobicContact CG2-CZ 3.51Å; H164-F203 HydrophobicContact CB-CE1 4.02Å; H164-F203 HydrophobicContact CB-CE2 4.3Å; H164-F203 HydrophobicContact CB-CZ 3.87Å; H164-F203 AromaticContact CD2-CD2 3.41Å; H164-F203 VanDerWaalsContact CD2-CD2 3.41Å; H164-F203 WeakPolarHBondContact CD2-CD2 3.41Å; H164-F203 AromaticContact CD2-CE2 3.59Å; H164-F203 AromaticContact CD2-CG 3.65Å; H164-F203 AromaticContact CD2-CZ 3.98Å; H164-F203 AromaticContact CE1-CD1 4Å; H164-F203 AromaticContact CE1-CG 3.77Å; H164-F203 AromaticContact CG-CD1 3.92Å; H164-F203 AromaticContact CG-CE1 3.87Å; H164-F203 AromaticContact CG-CE2 4Å; H164-F203 AromaticContact CG-CG 4Å; H164-F203 AromaticContact CG-CZ 3.9Å; H164-F203 AromaticContact ND1-CD1 3.87Å; H164-F203 AromaticContact NE2-CD2 3.62Å; H164-F203 AromaticContact NE2-CG 3.52Å; F203-V205 HydrophobicContact CD2-CG1 4.38Å; F203-V205 HydrophobicContact CE2-CG1 4.15Å
204	D	96.7	Very high	97.5	Very high	101 Å²	101	38.5 Å²	38.5	54%	0.54	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.6	180	-55.9	-43.2	0	0	0	111.1	Q143 R158	Q143-D204 WeakPolarHBondContact CG-OD1 3.25Å; Q143-D204 PolarHBondContact NE2-OD1 2.9Å; R158-D204 PolarHBondContact NH2-O 3.07Å
205	V	97	Very high	97.6	Very high	7 Å²	7	35.5 Å²	35.5	4%	0.042	21%	0.212	C	C	.	.			trans	-101.9	159.7	174	-68.3	0	0	0	0	111.9	Y27 L137 H142 L144 F203 D209 V292	Y27-V205 HydrophobicContact CD2-CG2 3.98Å; Y27-V205 HydrophobicContact CE2-CG2 4.36Å; L137-V205 HydrophobicContact CD1-CG2 3.51Å; H142-V205 WeakPolarHBondContact O-CG2 3.39Å; H142-V205 PolarHBondContact O-N 2.91Å; L144-V205 HydrophobicContact CB-CG1 3.74Å; F203-V205 HydrophobicContact CD2-CG1 4.38Å; F203-V205 HydrophobicContact CE2-CG1 4.15Å; V205-D209 WeakPolarHBondContact CA-OD2 3.41Å; V205-V292 HydrophobicContact CB-CG2 4.19Å; V205-V292 HydrophobicContact CG2-CG1 4.25Å; V205-V292 HydrophobicContact CG2-CG2 4.31Å
206	Q	96.3	Very high	97.6	Very high	103 Å²	103	35.7 Å²	35.7	48%	0.481	21%	0.213	S	C	.	.			trans	-120.6	153.2	176.1	-62.3	179.1	21.5	0	0	109.9	G208 D209 V292	Q206-G208 PolarHBondContact O-N 3.39Å; Q206-D209 PolarHBondContact N-OD2 3.12Å; Q206-D209 VanDerWaalsContact O-CB 3.26Å; Q206-D209 WeakPolarHBondContact O-CB 3.47Å; Q206-D209 VanDerWaalsContact O-CG 3.29Å; Q206-D209 PolarHBondContact O-N 2.67Å; Q206-V292 WeakPolarHBondContact O-CB 3.15Å
207	L	95.8	Very high	97.6	Very high	75 Å²	75	31 Å²	31	39%	0.393	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	132.8	170.3	-68.6	174.5	0	0	0	110.3	Y27 D209 V292 A293 E294	Y27-L207 HydrophobicContact CD1-CD2 3.96Å; Y27-L207 HydrophobicContact CE1-CD1 4.41Å; Y27-L207 HydrophobicContact CE1-CD2 3.74Å; Y27-L207 HydrophobicContact CE1-CG 3.87Å; Y27-L207 HydrophobicContact CE2-CD2 4.42Å; Y27-L207 HydrophobicContact CE2-CG 4.4Å; Y27-L207 HydrophobicContact CG-CD2 4.41Å; L207-D209 VanDerWaalsContact C-N 3.32Å; L207-V292 HydrophobicContact CD2-CG1 4.46Å; L207-A293 VanDerWaalsContact CD2-C 3.44Å; L207-E294 HydrophobicContact CD1-CG 3.8Å; L207-E294 HydrophobicContact CD2-CG 3.85Å
208	G	96.3	Very high	97.7	Very high	43 Å²	43	29.1 Å²	29.1	44%	0.443	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-5	-176.6	0	0	0	0	0	114.9	Q206 I210 V292	Q206-G208 PolarHBondContact O-N 3.39Å; G208-I210 PolarHBondContact O-N 2.57Å; G208-V292 PolarHBondContact N-O 3.33Å
209	D	98.2	Very high	97.7	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.016	17%	0.174	C	C	.	.			trans	-57.7	137.5	168.7	-77.5	-8.2	0	0	0	109.7	V156 R158 V205 Q206 L207 I291 V292	V156-D209 HydrophobicContact CG1-CB 4.29Å; R158-D209 WeakPolarHBondContact CB-OD1 3.41Å; R158-D209 VanDerWaalsContact CG-OD1 3.22Å; R158-D209 WeakPolarHBondContact CG-OD1 3.34Å; R158-D209 IonicContact CZ-OD1 3.75Å; R158-D209 IonicContact CZ-OD2 3.41Å; R158-D209 IonicContact NE-OD1 2.83Å; R158-D209 PolarHBondContact NE-OD1 2.94Å; R158-D209 IonicContact NE-OD2 3.28Å; R158-D209 PolarHBondContact NE-OD2 3.38Å; R158-D209 IonicContact NH2-OD1 3.8Å; R158-D209 IonicContact NH2-OD2 2.7Å; R158-D209 PolarHBondContact NH2-OD2 3.47Å; V205-D209 WeakPolarHBondContact CA-OD2 3.41Å; Q206-D209 PolarHBondContact N-OD2 3.12Å; Q206-D209 VanDerWaalsContact O-CB 3.26Å; Q206-D209 WeakPolarHBondContact O-CB 3.47Å; Q206-D209 VanDerWaalsContact O-CG 3.29Å; Q206-D209 PolarHBondContact O-N 2.67Å; L207-D209 VanDerWaalsContact C-N 3.32Å; D209-I291 WeakPolarHBondContact O-CA 3.06Å; D209-V292 HydrophobicContact CB-CB 4.33Å; D209-V292 HydrophobicContact CB-CG2 3.87Å; D209-V292 PolarHBondContact O-N 2.98Å
210	I	98.5	Very high	97.7	Very high	21 Å²	21	27 Å²	27	11%	0.108	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.4	178.1	-57.4	171.8	0	0	0	107.8	V156 V157 G208 L231 L234 L289 S290 I291	V156-I210 CarbonylContact C-O 3.4Å; V156-I210 VanDerWaalsContact CA-O 3.31Å; V156-I210 WeakPolarHBondContact CA-O 3.14Å; V157-I210 HydrophobicContact CB-CB 4.26Å; V157-I210 PolarHBondContact N-O 3.35Å; V157-I210 PolarHBondContact O-N 3.03Å; G208-I210 PolarHBondContact O-N 2.57Å; I210-L231 HydrophobicContact CG2-CD1 4.37Å; I210-L231 HydrophobicContact CG2-CD2 3.99Å; I210-L234 HydrophobicContact CD1-CD2 3.59Å; I210-L234 HydrophobicContact CG1-CD2 4.15Å; I210-L289 HydrophobicContact CG2-CD1 3.45Å; I210-L289 VanDerWaalsContact CG2-CD1 3.45Å; I210-L289 HydrophobicContact CG2-CG 4.43Å; I210-S290 CarbonylContact C-O 3.58Å; I210-S290 WeakPolarHBondContact CA-O 3.49Å; I210-I291 HydrophobicContact CG1-CG1 4.45Å
211	I	98.7	Very high	97.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.4	172.7	-54.4	96.8	0	0	0	108.5	L29 V135 L144 L155 V156 S290 V292	L29-I211 HydrophobicContact CD2-CD1 3.84Å; V135-I211 HydrophobicContact CG1-CG2 4.37Å; L144-I211 HydrophobicContact CD2-CG1 4.03Å; L144-I211 HydrophobicContact CD2-CG2 4.39Å; L155-I211 WeakPolarHBondContact O-CA 3.35Å; V156-I211 HydrophobicContact CG2-CG1 4.02Å; V156-I211 HydrophobicContact CG2-CG2 4.42Å; I211-S290 PolarHBondContact N-O 3.4Å; I211-S290 PolarHBondContact O-N 2.95Å; I211-V292 HydrophobicContact CD1-CG2 3.48Å; I211-V292 VanDerWaalsContact CD1-CG2 3.48Å
212	L	98.8	Very high	97.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.1	166.9	-173	78.1	0	0	0	107.8	F154 L155 L218 I227 I249 V287 L288 L289	F154-L212 CarbonylContact C-O 3.4Å; F154-L212 WeakPolarHBondContact CA-O 3.11Å; F154-L212 WeakPolarHBondContact CB-O 3.48Å; L155-L212 HydrophobicContact CD1-CB 4.36Å; L155-L212 HydrophobicContact CD2-CB 3.71Å; L155-L212 HydrophobicContact CD2-CD2 3.42Å; L155-L212 VanDerWaalsContact CD2-CD2 3.42Å; L155-L212 HydrophobicContact CD2-CG 4.08Å; L155-L212 HydrophobicContact CG-CB 3.77Å; L155-L212 HydrophobicContact CG-CD2 4.37Å; L155-L212 PolarHBondContact N-O 3.47Å; L155-L212 PolarHBondContact O-N 3.23Å; L212-L218 HydrophobicContact CD2-CD2 3.52Å; L212-L218 HydrophobicContact CG-CD2 4.33Å; L212-I227 HydrophobicContact CD2-CD1 4.38Å; L212-I227 HydrophobicContact CD2-CG2 3.64Å; L212-I249 HydrophobicContact CD1-CD1 3.98Å; L212-V287 HydrophobicContact CD1-CG1 3.44Å; L212-V287 VanDerWaalsContact CD1-CG1 3.44Å; L212-L288 WeakPolarHBondContact CA-O 3.49Å; L212-L289 HydrophobicContact CB-CD1 4.34Å; L212-L289 HydrophobicContact CD1-CB 4.33Å; L212-L289 HydrophobicContact CD1-CD1 3.78Å
213	T	98.8	Very high	97.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.9	172.5	-53.6	0	0	0	0	107.6	V69 V135 G153 F154 L288	V69-T213 HydrophobicContact CG1-CG2 4.01Å; V69-T213 HydrophobicContact CG2-CG2 3.81Å; V135-T213 HydrophobicContact CG2-CG2 4.22Å; G153-T213 WeakPolarHBondContact O-CA 3.05Å; F154-T213 HydrophobicContact CB-CG2 4.43Å; T213-L288 PolarHBondContact N-O 3.18Å; T213-L288 PolarHBondContact O-N 2.87Å
214	A	98.8	Very high	97.9	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	163.1	-171.7	0	0	0	0	0	112.7	G153 L218 F219 T286 V287	G153-A214 PolarHBondContact N-O 3.32Å; G153-A214 PolarHBondContact O-N 3.21Å; A214-L218 HydrophobicContact CB-CB 3.91Å; A214-L218 HydrophobicContact CB-CD2 3.46Å; A214-L218 VanDerWaalsContact CB-CD2 3.46Å; A214-L218 HydrophobicContact CB-CG 4.3Å; A214-F219 HydrophobicContact CB-CE2 3.9Å; A214-F219 HydrophobicContact CB-CZ 4.03Å; A214-T286 WeakPolarHBondContact CA-O 3.47Å; A214-T286 VanDerWaalsContact CB-O 3.24Å; A214-T286 WeakPolarHBondContact CB-O 3.48Å; A214-V287 HydrophobicContact CB-CG2 4.38Å
215	T	98.8	Very high	98	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.124	C	C	.	.			trans	-82.4	167.6	169.5	50.1	0	0	0	0	111.3	D54 V69 D71 G217 L218 T286	D54-T215 HydrophobicContact CB-CG2 4.36Å; D54-T215 WeakPolarHBondContact OD2-CB 3.45Å; D54-T215 WeakPolarHBondContact OD2-CG2 3.19Å; D54-T215 PolarHBondContact OD2-OG1 3.44Å; V69-T215 HydrophobicContact CB-CG2 4.13Å; V69-T215 HydrophobicContact CG2-CG2 4.34Å; D71-T215 HydrophobicContact CB-CG2 4.02Å; T215-G217 PolarHBondContact O-N 2.91Å; T215-L218 PolarHBondContact O-N 3.41Å; T215-L218 VanDerWaalsContact O-N 3.12Å; T215-T286 PolarHBondContact N-O 2.84Å; T215-T286 PolarHBondContact OG1-N 2.82Å
216	D	98.1	Very high	98.1	Very high	5 Å²	5	24.5 Å²	24.5	3%	0.027	13%	0.129	C	C	.	.	H	α-helix	trans	-56.8	-33.9	-177.8	70.6	-33.1	0	0	0	112.1	L218 F219 D220 K281	D216-L218 CarbonylContact O-C 3.51Å; D216-L218 PolarHBondContact O-N 3.45Å; D216-F219 PolarHBondContact O-N 3.1Å; D216-D220 VanDerWaalsContact O-CB 3.31Å; D216-D220 WeakPolarHBondContact O-CB 3.39Å; D216-D220 PolarHBondContact O-N 3.02Å; D216-K281 IonicContact OD2-NZ 3.15Å; D216-K281 PolarHBondContact OD2-NZ 3.14Å
217	G	98.1	Very high	98.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-54.6	-24.6	177.1	0	0	0	0	0	114.4	T215 N221 D284	T215-G217 PolarHBondContact O-N 2.91Å; G217-N221 PolarHBondContact O-ND2 3.35Å; G217-D284 WeakPolarHBondContact CA-O 3.47Å
218	L	98.6	Very high	98.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-75.9	-58.6	165.7	176.1	65.9	0	0	0	111.8	L212 A214 T215 D216 D220 N221 M222 I227 I249 A253 V287	L212-L218 HydrophobicContact CD2-CD2 3.52Å; L212-L218 HydrophobicContact CG-CD2 4.33Å; A214-L218 HydrophobicContact CB-CB 3.91Å; A214-L218 HydrophobicContact CB-CD2 3.46Å; A214-L218 VanDerWaalsContact CB-CD2 3.46Å; A214-L218 HydrophobicContact CB-CG 4.3Å; T215-L218 PolarHBondContact O-N 3.41Å; T215-L218 VanDerWaalsContact O-N 3.12Å; D216-L218 CarbonylContact O-C 3.51Å; D216-L218 PolarHBondContact O-N 3.45Å; L218-D220 VanDerWaalsContact C-N 3.32Å; L218-D220 PolarHBondContact O-N 3.41Å; L218-N221 PolarHBondContact O-N 2.98Å; L218-N221 VanDerWaalsContact O-N 3.1Å; L218-M222 HydrophobicContact CD1-CB 4Å; L218-M222 HydrophobicContact CD1-CE 4.07Å; L218-M222 HydrophobicContact CD1-SD 4.42Å; L218-M222 PolarHBondContact O-N 3.25Å; L218-I227 HydrophobicContact CD2-CD1 4.41Å; L218-I249 HydrophobicContact CD1-CG2 3.67Å; L218-I249 HydrophobicContact CD2-CG2 4.15Å; L218-A253 HydrophobicContact CD1-CB 3.5Å; L218-A253 VanDerWaalsContact CD1-CB 3.5Å; L218-V287 HydrophobicContact CD2-CG2 4.17Å
219	F	98.4	Very high	98.4	Very high	9 Å²	9	20 Å²	20	4%	0.039	10%	0.095	C	C	.	.	H	α-helix	trans	-67.4	-31.7	-168.1	-64.2	-57	0	0	0	113.1	L155 A214 D216 N221 I227 P265	L155-F219 HydrophobicContact CD2-CE1 3.93Å; L155-F219 HydrophobicContact CD2-CZ 4.43Å; A214-F219 HydrophobicContact CB-CE2 3.9Å; A214-F219 HydrophobicContact CB-CZ 4.03Å; D216-F219 PolarHBondContact O-N 3.1Å; F219-N221 PolarHBondContact O-N 2.93Å; F219-I227 HydrophobicContact CD1-CD1 4.2Å; F219-I227 HydrophobicContact CE1-CD1 4.16Å; F219-P265 WeakPolarHBondContact O-CB 3.08Å; F219-P265 WeakPolarHBondContact O-CG 3.33Å
220	D	98.3	Very high	98.4	Very high	15 Å²	15	20.4 Å²	20.4	8%	0.08	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.7	174.3	-85.4	-26.8	0	0	0	113.3	D216 L218 S264 P265 F266 K281	D216-D220 VanDerWaalsContact O-CB 3.31Å; D216-D220 WeakPolarHBondContact O-CB 3.39Å; D216-D220 PolarHBondContact O-N 3.02Å; L218-D220 VanDerWaalsContact C-N 3.32Å; L218-D220 PolarHBondContact O-N 3.41Å; D220-S264 WeakPolarHBondContact O-CB 3.05Å; D220-P265 VanDerWaalsContact O-CD 3.22Å; D220-P265 WeakPolarHBondContact O-CD 3.42Å; D220-F266 HydrophobicContact CB-CB 3.81Å; D220-F266 WeakPolarHBondContact O-CB 3.46Å; D220-F266 PolarHBondContact O-N 2.94Å; D220-K281 HydrophobicContact CB-CB 4.37Å; D220-K281 HydrophobicContact CB-CD 3.92Å; D220-K281 WeakPolarHBondContact OD2-CD 3.45Å; D220-K281 WeakPolarHBondContact OD2-CE 3.29Å; D220-K281 IonicContact OD2-NZ 3.98Å; D220-K281 PolarHBondContact OD2-NZ 3.49Å
221	N	98.5	Very high	98.3	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-23.8	-174.6	-68.7	-61.9	0	0	0	113.3	G217 L218 F219 L256 A257 Y262 G280 K281	G217-N221 PolarHBondContact O-ND2 3.35Å; L218-N221 PolarHBondContact O-N 2.98Å; L218-N221 VanDerWaalsContact O-N 3.1Å; F219-N221 PolarHBondContact O-N 2.93Å; N221-L256 HydrophobicContact CB-CB 4.48Å; N221-A257 VanDerWaalsContact OD1-CA 3.31Å; N221-A257 WeakPolarHBondContact OD1-CA 3.38Å; N221-Y262 WeakPolarHBondContact O-CE1 3.29Å; N221-Y262 PolarHBondContact O-OH 3.22Å; N221-G280 WeakPolarHBondContact OD1-CA 3.49Å; N221-K281 PolarHBondContact ND2-O 2.87Å; N221-K281 PolarHBondContact OD1-N 3.47Å; N221-K281 PolarHBondContact OD1-O 3.21Å
222	M	98.3	Very high	98.2	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.127	C	C	.	.			trans	-129.8	109.8	-171.8	-134.9	170.8	74.6	0	0	112.1	L218 M226 I227 E230 I249 Q252 A253 L256	L218-M222 HydrophobicContact CD1-CB 4Å; L218-M222 HydrophobicContact CD1-CE 4.07Å; L218-M222 HydrophobicContact CD1-SD 4.42Å; L218-M222 PolarHBondContact O-N 3.25Å; M222-M226 HydrophobicContact CG-CB 3.73Å; M222-M226 HydrophobicContact CG-SD 4.16Å; M222-M226 HydrophobicContact SD-CB 4.47Å; M222-I227 HydrophobicContact CB-CG1 4.34Å; M222-I227 HydrophobicContact CE-CB 4.04Å; M222-I227 HydrophobicContact CE-CG1 3.36Å; M222-E230 HydrophobicContact CE-CG 4.36Å; M222-I249 HydrophobicContact CE-CB 4.5Å; M222-I249 HydrophobicContact CE-CG2 3.85Å; M222-Q252 HydrophobicContact SD-CB 3.88Å; M222-Q252 HydrophobicContact SD-CG 3.83Å; M222-A253 HydrophobicContact CB-CB 4.48Å; M222-A253 HydrophobicContact SD-CB 4.22Å; M222-L256 HydrophobicContact CG-CD1 3.96Å
223	P	97.8	Very high	97.9	Very high	29 Å²	29	32.5 Å²	32.5	19%	0.188	15%	0.149	C	C	.	.			trans	-70.2	158	176.3	29.5	-35.8	0	0	0	111.5	Y225 M226 I227 Y262 P265	P223-Y225 VanDerWaalsContact C-N 3.25Å; P223-Y225 HydrophobicContact CB-CD1 3.83Å; P223-Y225 HydrophobicContact CB-CE1 3.66Å; P223-Y225 HydrophobicContact CG-CD1 3.72Å; P223-Y225 HydrophobicContact CG-CE1 3.18Å; P223-Y225 PolarHBondContact O-N 3.41Å; P223-Y225 VanDerWaalsContact O-N 3.09Å; P223-M226 HydrophobicContact CG-CB 4.34Å; P223-M226 HydrophobicContact CG-CG 3.96Å; P223-M226 HydrophobicContact CG-SD 4.09Å; P223-M226 WeakPolarHBondContact O-CB 3.23Å; P223-M226 PolarHBondContact O-N 3.45Å; P223-I227 PolarHBondContact O-N 3.47Å; P223-Y262 VanDerWaalsContact CD-OH 3.29Å; P223-Y262 WeakPolarHBondContact CD-OH 2.98Å; P223-P265 HydrophobicContact CB-CG 4.21Å
224	D	98	Very high	97.6	Very high	51 Å²	51	34.1 Å²	34.1	27%	0.273	16%	0.157	S	C	.	.	H	α-helix	trans	-49.7	-42.2	-176.2	-74.5	-1.2	0	0	0	113.5	R165 M226 I227 L228	R165-D224 IonicContact CZ-OD1 3.82Å; R165-D224 IonicContact NE-OD1 2.65Å; R165-D224 IonicContact NH1-OD1 2.83Å; R165-D224 PolarHBondContact NH1-OD1 2.92Å; R165-D224 IonicContact NH1-OD2 3.79Å; D224-M226 VanDerWaalsContact C-N 3.27Å; D224-M226 PolarHBondContact O-N 2.61Å; D224-I227 WeakPolarHBondContact O-CB 3.38Å; D224-I227 PolarHBondContact O-N 2.91Å; D224-I227 VanDerWaalsContact O-N 3.15Å; D224-L228 VanDerWaalsContact O-CG 3.32Å; D224-L228 WeakPolarHBondContact O-CG 3.41Å; D224-L228 PolarHBondContact O-N 2.95Å
225	Y	97.9	Very high	96.9	Very high	132 Å²	132	43.2 Å²	43.2	52%	0.518	20%	0.197	S	C	.	.	H	α-helix	trans	-63.5	-31.3	-179.3	75.5	-95.6	0	0	0	113.2	P223 Q229	P223-Y225 VanDerWaalsContact C-N 3.25Å; P223-Y225 HydrophobicContact CB-CD1 3.83Å; P223-Y225 HydrophobicContact CB-CE1 3.66Å; P223-Y225 HydrophobicContact CG-CD1 3.72Å; P223-Y225 HydrophobicContact CG-CE1 3.18Å; P223-Y225 PolarHBondContact O-N 3.41Å; P223-Y225 VanDerWaalsContact O-N 3.09Å; Y225-Q229 VanDerWaalsContact O-CG 3.27Å; Y225-Q229 WeakPolarHBondContact O-CG 3.37Å; Y225-Q229 PolarHBondContact O-N 3.12Å; Y225-Q229 VanDerWaalsContact O-N 3.17Å
226	M	98.5	Very high	96.5	Very high	28 Å²	28	46.4 Å²	46.4	14%	0.138	22%	0.217	C	C	.	.	H	α-helix	trans	-75	-41	174.6	-72.2	-172.1	179.4	0	0	110.5	M222 P223 D224 L228 Q229 E230 L256 Y262	M222-M226 HydrophobicContact CG-CB 3.73Å; M222-M226 HydrophobicContact CG-SD 4.16Å; M222-M226 HydrophobicContact SD-CB 4.47Å; P223-M226 HydrophobicContact CG-CB 4.34Å; P223-M226 HydrophobicContact CG-CG 3.96Å; P223-M226 HydrophobicContact CG-SD 4.09Å; P223-M226 WeakPolarHBondContact O-CB 3.23Å; P223-M226 PolarHBondContact O-N 3.45Å; D224-M226 VanDerWaalsContact C-N 3.27Å; D224-M226 PolarHBondContact O-N 2.61Å; M226-L228 VanDerWaalsContact C-N 3.32Å; M226-L228 PolarHBondContact O-N 3.21Å; M226-Q229 WeakPolarHBondContact O-CB 3Å; M226-Q229 PolarHBondContact O-N 3.47Å; M226-Q229 VanDerWaalsContact O-N 3.09Å; M226-E230 PolarHBondContact O-N 3.26Å; M226-E230 VanDerWaalsContact O-N 3.09Å; M226-L256 HydrophobicContact SD-CD1 3.77Å; M226-Y262 HydrophobicContact CE-CE2 4.35Å
227	I	98.6	Very high	96	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-56.4	-48.5	173	-64.6	167.6	0	0	0	110.1	L155 L212 L218 F219 M222 P223 D224 Q229 E230 L231	L155-I227 HydrophobicContact CD1-CG2 4.46Å; L155-I227 HydrophobicContact CD2-CD1 4.13Å; L155-I227 HydrophobicContact CD2-CG2 4.07Å; L212-I227 HydrophobicContact CD2-CD1 4.38Å; L212-I227 HydrophobicContact CD2-CG2 3.64Å; L218-I227 HydrophobicContact CD2-CD1 4.41Å; F219-I227 HydrophobicContact CD1-CD1 4.2Å; F219-I227 HydrophobicContact CE1-CD1 4.16Å; M222-I227 HydrophobicContact CB-CG1 4.34Å; M222-I227 HydrophobicContact CE-CB 4.04Å; M222-I227 HydrophobicContact CE-CG1 3.36Å; P223-I227 PolarHBondContact O-N 3.47Å; D224-I227 WeakPolarHBondContact O-CB 3.38Å; D224-I227 PolarHBondContact O-N 2.91Å; D224-I227 VanDerWaalsContact O-N 3.15Å; I227-Q229 VanDerWaalsContact C-N 3.28Å; I227-Q229 PolarHBondContact O-N 3.03Å; I227-E230 PolarHBondContact O-N 3.13Å; I227-E230 VanDerWaalsContact O-N 3.14Å; I227-L231 HydrophobicContact CG2-CD1 3.98Å; I227-L231 HydrophobicContact CG2-CG 4.32Å; I227-L231 WeakPolarHBondContact O-CG 3.39Å; I227-L231 PolarHBondContact O-N 3.44Å
228	L	98.5	Very high	95.8	Very high	26 Å²	26	53.2 Å²	53.2	14%	0.136	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-33.7	177.4	-67.9	178.7	0	0	0	112.6	V157 V162 D224 M226 L231 K232	V157-L228 HydrophobicContact CB-CD2 4.38Å; V157-L228 HydrophobicContact CG1-CD2 3.72Å; V157-L228 HydrophobicContact CG2-CD2 3.67Å; V162-L228 HydrophobicContact CG2-CD1 4.2Å; V162-L228 HydrophobicContact CG2-CD2 4Å; V162-L228 HydrophobicContact CG2-CG 4.3Å; D224-L228 VanDerWaalsContact O-CG 3.32Å; D224-L228 WeakPolarHBondContact O-CG 3.41Å; D224-L228 PolarHBondContact O-N 2.95Å; M226-L228 VanDerWaalsContact C-N 3.32Å; M226-L228 PolarHBondContact O-N 3.21Å; L228-L231 HydrophobicContact CD2-CD1 4.46Å; L228-L231 PolarHBondContact O-N 3.46Å; L228-K232 WeakPolarHBondContact O-CG 3.33Å; L228-K232 PolarHBondContact O-N 3.39Å; L228-K232 VanDerWaalsContact O-N 3.12Å
229	Q	98.2	Very high	95.6	Very high	100 Å²	100	58.9 Å²	58.9	47%	0.467	28%	0.281	S	S	.	.	H	α-helix	trans	-65.3	-40	174.5	-76	171.8	16	0	0	112.2	Y225 M226 I227	Y225-Q229 VanDerWaalsContact O-CG 3.27Å; Y225-Q229 WeakPolarHBondContact O-CG 3.37Å; Y225-Q229 PolarHBondContact O-N 3.12Å; Y225-Q229 VanDerWaalsContact O-N 3.17Å; M226-Q229 WeakPolarHBondContact O-CB 3Å; M226-Q229 PolarHBondContact O-N 3.47Å; M226-Q229 VanDerWaalsContact O-N 3.09Å; I227-Q229 VanDerWaalsContact C-N 3.28Å; I227-Q229 PolarHBondContact O-N 3.03Å
230	E	98	Very high	95.4	Very high	11 Å²	11	63.4 Å²	63.4	5%	0.051	31%	0.306	C	S	.	.	H	α-helix	trans	-68.4	-41.7	174.7	-67.6	-57.7	123	0	0	111.8	M222 M226 I227 K232 K233 S248 I249 Q252	M222-E230 HydrophobicContact CE-CG 4.36Å; M226-E230 PolarHBondContact O-N 3.26Å; M226-E230 VanDerWaalsContact O-N 3.09Å; I227-E230 PolarHBondContact O-N 3.13Å; I227-E230 VanDerWaalsContact O-N 3.14Å; E230-K232 PolarHBondContact O-N 2.85Å; E230-K233 VanDerWaalsContact O-CB 3.24Å; E230-K233 WeakPolarHBondContact O-CB 3.31Å; E230-K233 WeakPolarHBondContact O-CG 3.22Å; E230-K233 PolarHBondContact O-N 3.09Å; E230-K233 WeakPolarHBondContact OE1-CE 3.36Å; E230-K233 IonicContact OE1-NZ 2.79Å; E230-K233 PolarHBondContact OE1-NZ 3.35Å; E230-K233 WeakPolarHBondContact OE2-CE 3.44Å; E230-K233 IonicContact OE2-NZ 3.57Å; E230-K233 PolarHBondContact OE2-NZ 2.98Å; E230-S248 VanDerWaalsContact OE2-CB 3.29Å; E230-S248 WeakPolarHBondContact OE2-CB 3.4Å; E230-S248 PolarHBondContact OE2-OG 3.19Å; E230-I249 HydrophobicContact CB-CD1 4.29Å; E230-I249 HydrophobicContact CB-CG1 3.47Å; E230-I249 VanDerWaalsContact CB-CG1 3.47Å; E230-I249 HydrophobicContact CG-CG1 4.07Å; E230-Q252 PolarHBondContact OE1-OE1 3.41Å
231	L	97.6	Very high	95.3	Very high	9 Å²	9	63.1 Å²	63.1	5%	0.047	31%	0.305	C	S	.	.	H	α-helix	trans	-62.8	-28.6	178	-68.9	178	0	0	0	113.1	L155 V157 I210 I227 L228 K233 L234 T245 I249 L289	L155-L231 HydrophobicContact CD1-CD1 4.48Å; V157-L231 HydrophobicContact CB-CD1 4.38Å; V157-L231 HydrophobicContact CG2-CD1 3.57Å; I210-L231 HydrophobicContact CG2-CD1 4.37Å; I210-L231 HydrophobicContact CG2-CD2 3.99Å; I227-L231 HydrophobicContact CG2-CD1 3.98Å; I227-L231 HydrophobicContact CG2-CG 4.32Å; I227-L231 WeakPolarHBondContact O-CG 3.39Å; I227-L231 PolarHBondContact O-N 3.44Å; L228-L231 HydrophobicContact CD2-CD1 4.46Å; L228-L231 PolarHBondContact O-N 3.46Å; L231-K233 PolarHBondContact O-N 2.88Å; L231-K233 VanDerWaalsContact O-N 3.16Å; L231-L234 WeakPolarHBondContact O-CB 3.4Å; L231-L234 PolarHBondContact O-N 2.98Å; L231-L234 VanDerWaalsContact O-N 3.09Å; L231-T245 HydrophobicContact CD2-CG2 4.1Å; L231-I249 HydrophobicContact CD2-CD1 3.74Å; L231-I249 HydrophobicContact CG-CD1 4.26Å; L231-L289 HydrophobicContact CD2-CD1 3.59Å; L231-L289 HydrophobicContact CD2-CD2 4.14Å
232	K	95.4	Very high	95.3	Very high	158 Å²	158	63.1 Å²	63.1	69%	0.687	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.3	172.1	-74.7	169.9	-174.2	177.8	0	113.6	L228 E230 L234	L228-K232 WeakPolarHBondContact O-CG 3.33Å; L228-K232 PolarHBondContact O-N 3.39Å; L228-K232 VanDerWaalsContact O-N 3.12Å; E230-K232 PolarHBondContact O-N 2.85Å; K232-L234 VanDerWaalsContact C-N 3.28Å
233	K	92.1	Very high	95.2	Very high	108 Å²	108	64.8 Å²	64.8	47%	0.47	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-12.9	177.1	-56.5	176.7	-173.1	170.3	0	112.7	E230 L231 K235	E230-K233 VanDerWaalsContact O-CB 3.24Å; E230-K233 WeakPolarHBondContact O-CB 3.31Å; E230-K233 WeakPolarHBondContact O-CG 3.22Å; E230-K233 PolarHBondContact O-N 3.09Å; E230-K233 WeakPolarHBondContact OE1-CE 3.36Å; E230-K233 IonicContact OE1-NZ 2.79Å; E230-K233 PolarHBondContact OE1-NZ 3.35Å; E230-K233 WeakPolarHBondContact OE2-CE 3.44Å; E230-K233 IonicContact OE2-NZ 3.57Å; E230-K233 PolarHBondContact OE2-NZ 2.98Å; L231-K233 PolarHBondContact O-N 2.88Å; L231-K233 VanDerWaalsContact O-N 3.16Å; K233-K235 WeakPolarHBondContact O-CG 3.35Å; K233-K235 PolarHBondContact O-N 3.27Å
234	L	92.7	Very high	95.2	Very high	33 Å²	33	69.6 Å²	69.6	17%	0.173	33%	0.334	C	S	.	.			trans	-65.8	110.7	176.6	-175.8	75.6	0	0	0	109.8	I210 L231 K232 S241 V242 T245 I291	I210-L234 HydrophobicContact CD1-CD2 3.59Å; I210-L234 HydrophobicContact CG1-CD2 4.15Å; L231-L234 WeakPolarHBondContact O-CB 3.4Å; L231-L234 PolarHBondContact O-N 2.98Å; L231-L234 VanDerWaalsContact O-N 3.09Å; K232-L234 VanDerWaalsContact C-N 3.28Å; L234-S241 WeakPolarHBondContact CD1-OG 3.48Å; L234-V242 HydrophobicContact CD1-CG2 4.18Å; L234-T245 HydrophobicContact CB-CG2 4.38Å; L234-T245 WeakPolarHBondContact CD1-OG1 3.41Å; L234-I291 HydrophobicContact CD1-CD1 4.06Å; L234-I291 HydrophobicContact CD2-CD1 3.54Å; L234-I291 HydrophobicContact CD2-CG1 4.07Å; L234-I291 HydrophobicContact CG-CD1 4.21Å
235	K	85.7	Confident	95.2	Very high	192 Å²	192	67.5 Å²	67.5	84%	0.835	32%	0.322	S	S	*	.			trans	-91.6	-35	-172.6	-62.3	-175.9	-178.4	175.1	0	113.5	K233 S241	K233-K235 WeakPolarHBondContact O-CG 3.35Å; K233-K235 PolarHBondContact O-N 3.27Å; K235-S241 PolarHBondContact N-OG 2.69Å
236	T	89.2	Confident	95.2	Very high	67 Å²	67	61.2 Å²	61.2	41%	0.411	30%	0.298	S	S	.	.	S	Bend	trans	-144.4	148.1	-170.5	53	0	0	0	0	110.3	N238 S241	T236-N238 PolarHBondContact O-N 2.76Å; T236-N238 VanDerWaalsContact OG1-CG 3.31Å; T236-N238 PolarHBondContact OG1-ND2 2.84Å; T236-N238 PolarHBondContact OG1-OD1 3.49Å; T236-S241 PolarHBondContact N-OG 3.22Å; T236-S241 WeakPolarHBondContact O-CB 3.18Å; T236-S241 PolarHBondContact O-OG 2.66Å; T236-S241 VanDerWaalsContact OG1-CB 3.28Å; T236-S241 WeakPolarHBondContact OG1-CB 3.4Å
237	S	87.9	Confident	95.1	Very high	74 Å²	74	62.3 Å²	62.3	52%	0.517	30%	0.303	S	S	.	.	S	Bend	trans	-80.1	45	176.8	-47.4	0	0	0	0	113	I30	I30-S237 WeakPolarHBondContact CD1-O 3.37Å
238	N	93.1	Very high	95.1	Very high	74 Å²	74	64 Å²	64	40%	0.396	31%	0.314	S	S	.	.	S	Bend	trans	-112.8	160.8	174.5	68.3	32.7	0	0	0	110.9	T236 D240 S241 V242	T236-N238 PolarHBondContact O-N 2.76Å; T236-N238 VanDerWaalsContact OG1-CG 3.31Å; T236-N238 PolarHBondContact OG1-ND2 2.84Å; T236-N238 PolarHBondContact OG1-OD1 3.49Å; N238-D240 VanDerWaalsContact C-N 3.33Å; N238-D240 PolarHBondContact O-N 3.1Å; N238-D240 PolarHBondContact OD1-N 3.33Å; N238-S241 PolarHBondContact O-N 2.99Å; N238-S241 VanDerWaalsContact OD1-CB 3.23Å; N238-S241 WeakPolarHBondContact OD1-CB 3.37Å; N238-S241 PolarHBondContact OD1-N 3.49Å; N238-V242 WeakPolarHBondContact O-CG2 3.36Å; N238-V242 PolarHBondContact O-N 2.77Å; N238-V242 VanDerWaalsContact O-N 3.07Å
239	Y	94.4	Very high	95.1	Very high	118 Å²	118	62.7 Å²	62.7	46%	0.463	31%	0.308	S	S	.	.	H	α-helix	trans	-56.2	-43.7	-176	179.5	-93.3	0	0	0	113.2	T31 A32 S241 V242 L243	T31-Y239 VanDerWaalsContact O-CE2 3.3Å; T31-Y239 WeakPolarHBondContact O-CE2 3.37Å; A32-Y239 HydrophobicContact CB-CD2 4.31Å; A32-Y239 HydrophobicContact CB-CE2 3.81Å; Y239-S241 PolarHBondContact O-N 2.72Å; Y239-V242 PolarHBondContact O-N 2.86Å; Y239-L243 HydrophobicContact CE1-CB 4.34Å; Y239-L243 HydrophobicContact CE1-CD2 3.93Å; Y239-L243 WeakPolarHBondContact O-CB 3.48Å; Y239-L243 PolarHBondContact O-N 2.86Å
240	D	95.6	Very high	95.1	Very high	104 Å²	104	58 Å²	58	56%	0.556	29%	0.286	S	S	*	.	H	α-helix	trans	-64.2	-41.5	-177.3	-69	-27	0	0	0	112.4	N238 L243 Q244	N238-D240 VanDerWaalsContact C-N 3.33Å; N238-D240 PolarHBondContact O-N 3.1Å; N238-D240 PolarHBondContact OD1-N 3.33Å; D240-L243 PolarHBondContact O-N 3.12Å; D240-Q244 WeakPolarHBondContact O-CB 3.36Å; D240-Q244 VanDerWaalsContact O-CG 3.23Å; D240-Q244 WeakPolarHBondContact O-CG 3.1Å; D240-Q244 PolarHBondContact O-N 3.28Å
241	S	96.4	Very high	95	Very high	9 Å²	9	62 Å²	62	6%	0.063	30%	0.303	C	S	.	.	H	α-helix	trans	-67	-39.2	175.9	-178.6	0	0	0	0	111.5	L234 K235 T236 N238 Y239 T245	L234-S241 WeakPolarHBondContact CD1-OG 3.48Å; K235-S241 PolarHBondContact N-OG 2.69Å; T236-S241 PolarHBondContact N-OG 3.22Å; T236-S241 WeakPolarHBondContact O-CB 3.18Å; T236-S241 PolarHBondContact O-OG 2.66Å; T236-S241 VanDerWaalsContact OG1-CB 3.28Å; T236-S241 WeakPolarHBondContact OG1-CB 3.4Å; N238-S241 PolarHBondContact O-N 2.99Å; N238-S241 VanDerWaalsContact OD1-CB 3.23Å; N238-S241 WeakPolarHBondContact OD1-CB 3.37Å; N238-S241 PolarHBondContact OD1-N 3.49Å; Y239-S241 PolarHBondContact O-N 2.72Å; S241-T245 WeakPolarHBondContact O-CB 3.29Å; S241-T245 PolarHBondContact O-N 2.99Å; S241-T245 VanDerWaalsContact O-N 3.07Å; S241-T245 PolarHBondContact O-OG1 3.02Å
242	V	97.3	Very high	95.1	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-47.4	174.4	177.2	0	0	0	0	110.4	I30 A32 L234 N238 Y239 T245 A246 L289 I291	I30-V242 HydrophobicContact CG2-CG2 4.24Å; A32-V242 HydrophobicContact CB-CB 4.35Å; A32-V242 HydrophobicContact CB-CG1 3.8Å; L234-V242 HydrophobicContact CD1-CG2 4.18Å; N238-V242 WeakPolarHBondContact O-CG2 3.36Å; N238-V242 PolarHBondContact O-N 2.77Å; N238-V242 VanDerWaalsContact O-N 3.07Å; Y239-V242 PolarHBondContact O-N 2.86Å; V242-T245 PolarHBondContact O-N 3.34Å; V242-A246 WeakPolarHBondContact O-CB 3.43Å; V242-A246 PolarHBondContact O-N 3.5Å; V242-L289 HydrophobicContact CG1-CB 3.99Å; V242-L289 HydrophobicContact CG1-CD2 4.11Å; V242-L289 HydrophobicContact CG1-CG 3.98Å; V242-L289 WeakPolarHBondContact CG1-O 3.48Å; V242-I291 HydrophobicContact CG2-CD1 3.34Å; V242-I291 HydrophobicContact CG2-CG1 3.85Å
243	L	96.6	Very high	95.2	Very high	37 Å²	37	56.5 Å²	56.5	19%	0.194	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-45.9	178.7	177.8	60.7	0	0	0	112.2	A32 Y239 D240 T245 A246 Q247	A32-L243 HydrophobicContact CB-CB 3.73Å; A32-L243 HydrophobicContact CB-CD1 4.05Å; A32-L243 HydrophobicContact CB-CG 4.49Å; Y239-L243 HydrophobicContact CE1-CB 4.34Å; Y239-L243 HydrophobicContact CE1-CD2 3.93Å; Y239-L243 WeakPolarHBondContact O-CB 3.48Å; Y239-L243 PolarHBondContact O-N 2.86Å; D240-L243 PolarHBondContact O-N 3.12Å; L243-T245 VanDerWaalsContact C-N 3.27Å; L243-T245 PolarHBondContact O-N 3.38Å; L243-A246 PolarHBondContact O-N 2.96Å; L243-Q247 HydrophobicContact CD1-CG 4.34Å; L243-Q247 WeakPolarHBondContact O-CB 3.28Å; L243-Q247 VanDerWaalsContact O-CG 3.25Å; L243-Q247 WeakPolarHBondContact O-CG 3.38Å; L243-Q247 PolarHBondContact O-N 2.99Å
244	Q	96.7	Very high	95.5	Very high	130 Å²	130	52.9 Å²	52.9	61%	0.607	26%	0.264	S	S	*	.	H	α-helix	trans	-60.9	-38	177.2	-75.4	174.5	7.3	0	0	111.9	D240 Q247 S248	D240-Q244 WeakPolarHBondContact O-CB 3.36Å; D240-Q244 VanDerWaalsContact O-CG 3.23Å; D240-Q244 WeakPolarHBondContact O-CG 3.1Å; D240-Q244 PolarHBondContact O-N 3.28Å; Q244-Q247 WeakPolarHBondContact O-CB 3.44Å; Q244-S248 WeakPolarHBondContact O-CB 3.4Å; Q244-S248 PolarHBondContact O-N 3.49Å
245	T	98	Very high	95.7	Very high	6 Å²	6	56.6 Å²	56.6	4%	0.037	28%	0.284	C	S	.	.	H	α-helix	trans	-70.6	-45.3	178	-52.7	0	0	0	0	111	L231 L234 S241 V242 L243 Q247 S248 I249 L289	L231-T245 HydrophobicContact CD2-CG2 4.1Å; L234-T245 HydrophobicContact CB-CG2 4.38Å; L234-T245 WeakPolarHBondContact CD1-OG1 3.41Å; S241-T245 WeakPolarHBondContact O-CB 3.29Å; S241-T245 PolarHBondContact O-N 2.99Å; S241-T245 VanDerWaalsContact O-N 3.07Å; S241-T245 PolarHBondContact O-OG1 3.02Å; V242-T245 PolarHBondContact O-N 3.34Å; L243-T245 VanDerWaalsContact C-N 3.27Å; L243-T245 PolarHBondContact O-N 3.38Å; T245-Q247 VanDerWaalsContact C-N 3.29Å; T245-Q247 PolarHBondContact O-N 2.99Å; T245-S248 WeakPolarHBondContact O-CB 3.31Å; T245-S248 PolarHBondContact O-N 2.93Å; T245-S248 VanDerWaalsContact O-N 3.09Å; T245-I249 HydrophobicContact CG2-CD1 4.2Å; T245-I249 WeakPolarHBondContact O-CG1 3.3Å; T245-I249 PolarHBondContact O-N 2.91Å; T245-L289 HydrophobicContact CG2-CD2 3.71Å
246	A	97.8	Very high	96.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.3	-41.9	173.8	0	0	0	0	0	112	V242 L243 I249 A250 V287 L289	V242-A246 WeakPolarHBondContact O-CB 3.43Å; V242-A246 PolarHBondContact O-N 3.5Å; L243-A246 PolarHBondContact O-N 2.96Å; A246-I249 PolarHBondContact O-N 2.66Å; A246-A250 WeakPolarHBondContact O-CB 3.46Å; A246-A250 PolarHBondContact O-N 3.01Å; A246-V287 HydrophobicContact CB-CG1 4.15Å; A246-L289 HydrophobicContact CB-CB 3.9Å; A246-L289 HydrophobicContact CB-CD2 4.47Å
247	Q	97.2	Very high	96.7	Very high	51 Å²	51	45.6 Å²	45.6	24%	0.238	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-43	173.8	-77	175.2	-1.6	0	0	112.7	Y34 L243 Q244 T245 K251	Y34-Q247 HydrophobicContact CD1-CB 4.2Å; Y34-Q247 HydrophobicContact CD1-CG 3.78Å; Y34-Q247 HydrophobicContact CD2-CG 3.41Å; Y34-Q247 VanDerWaalsContact CD2-CG 3.41Å; Y34-Q247 HydrophobicContact CE1-CB 4.36Å; Y34-Q247 HydrophobicContact CE1-CG 3.96Å; Y34-Q247 HydrophobicContact CE2-CG 3.63Å; Y34-Q247 HydrophobicContact CG-CB 4.29Å; Y34-Q247 HydrophobicContact CG-CG 3.47Å; Y34-Q247 VanDerWaalsContact CG-CG 3.47Å; L243-Q247 HydrophobicContact CD1-CG 4.34Å; L243-Q247 WeakPolarHBondContact O-CB 3.28Å; L243-Q247 VanDerWaalsContact O-CG 3.25Å; L243-Q247 WeakPolarHBondContact O-CG 3.38Å; L243-Q247 PolarHBondContact O-N 2.99Å; Q244-Q247 WeakPolarHBondContact O-CB 3.44Å; T245-Q247 VanDerWaalsContact C-N 3.29Å; T245-Q247 PolarHBondContact O-N 2.99Å; Q247-K251 VanDerWaalsContact O-CB 3.3Å; Q247-K251 WeakPolarHBondContact O-CB 2.98Å; Q247-K251 WeakPolarHBondContact O-CD 3.4Å; Q247-K251 WeakPolarHBondContact O-CG 3.41Å; Q247-K251 PolarHBondContact O-N 2.84Å
248	S	98.1	Very high	97.1	Very high	36 Å²	36	47 Å²	47	25%	0.252	23%	0.227	S	C	.	.	H	α-helix	trans	-64.7	-46	179.9	-163.3	0	0	0	0	111.2	E230 Q244 T245 K251 Q252	E230-S248 VanDerWaalsContact OE2-CB 3.29Å; E230-S248 WeakPolarHBondContact OE2-CB 3.4Å; E230-S248 PolarHBondContact OE2-OG 3.19Å; Q244-S248 WeakPolarHBondContact O-CB 3.4Å; Q244-S248 PolarHBondContact O-N 3.49Å; T245-S248 WeakPolarHBondContact O-CB 3.31Å; T245-S248 PolarHBondContact O-N 2.93Å; T245-S248 VanDerWaalsContact O-N 3.09Å; S248-K251 PolarHBondContact O-N 3Å; S248-Q252 PolarHBondContact O-N 2.8Å
249	I	98.6	Very high	97.3	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.1	-55.2	175.4	-69.8	170.3	0	0	0	110.8	L212 L218 M222 E230 L231 T245 A246 K251 Q252 A253 V287	L212-I249 HydrophobicContact CD1-CD1 3.98Å; L218-I249 HydrophobicContact CD1-CG2 3.67Å; L218-I249 HydrophobicContact CD2-CG2 4.15Å; M222-I249 HydrophobicContact CE-CB 4.5Å; M222-I249 HydrophobicContact CE-CG2 3.85Å; E230-I249 HydrophobicContact CB-CD1 4.29Å; E230-I249 HydrophobicContact CB-CG1 3.47Å; E230-I249 VanDerWaalsContact CB-CG1 3.47Å; E230-I249 HydrophobicContact CG-CG1 4.07Å; L231-I249 HydrophobicContact CD2-CD1 3.74Å; L231-I249 HydrophobicContact CG-CD1 4.26Å; T245-I249 HydrophobicContact CG2-CD1 4.2Å; T245-I249 WeakPolarHBondContact O-CG1 3.3Å; T245-I249 PolarHBondContact O-N 2.91Å; A246-I249 PolarHBondContact O-N 2.66Å; I249-K251 VanDerWaalsContact C-N 3.3Å; I249-K251 PolarHBondContact O-N 3.47Å; I249-Q252 PolarHBondContact O-N 3Å; I249-A253 WeakPolarHBondContact O-CB 3.48Å; I249-A253 PolarHBondContact O-N 2.71Å; I249-V287 HydrophobicContact CG2-CG1 4.46Å; I249-V287 HydrophobicContact CG2-CG2 4.18Å
250	A	97.9	Very high	97.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-37.7	-177.3	0	0	0	0	0	112.1	Y34 F36 A246 H254 I285 V287	Y34-A250 HydrophobicContact CD1-CB 3.93Å; F36-A250 HydrophobicContact CD2-CB 4.12Å; F36-A250 HydrophobicContact CE2-CB 3.76Å; F36-A250 WeakPolarHBondContact CE2-O 3.37Å; A246-A250 WeakPolarHBondContact O-CB 3.46Å; A246-A250 PolarHBondContact O-N 3.01Å; A250-H254 VanDerWaalsContact O-CB 3.32Å; A250-H254 WeakPolarHBondContact O-CB 3.27Å; A250-H254 PolarHBondContact O-N 3.18Å; A250-I285 HydrophobicContact CB-CG2 4.24Å; A250-V287 HydrophobicContact CB-CG2 4.06Å
251	K	97.7	Very high	97.4	Very high	97 Å²	97	45 Å²	45	42%	0.422	23%	0.229	S	C	.	.	H	α-helix	trans	-65.6	-44.9	177.3	-79.9	172.1	-178.7	175.2	0	111.9	F36 Q247 S248 I249 A253 H254 D255	F36-K251 HydrophobicContact CE2-CG 4.05Å; F36-K251 HydrophobicContact CZ-CG 3.59Å; Q247-K251 VanDerWaalsContact O-CB 3.3Å; Q247-K251 WeakPolarHBondContact O-CB 2.98Å; Q247-K251 WeakPolarHBondContact O-CD 3.4Å; Q247-K251 WeakPolarHBondContact O-CG 3.41Å; Q247-K251 PolarHBondContact O-N 2.84Å; S248-K251 PolarHBondContact O-N 3Å; I249-K251 VanDerWaalsContact C-N 3.3Å; I249-K251 PolarHBondContact O-N 3.47Å; K251-A253 VanDerWaalsContact C-N 3.34Å; K251-H254 WeakPolarHBondContact O-CB 3.32Å; K251-H254 PolarHBondContact O-N 3.22Å; K251-D255 VanDerWaalsContact O-CG 3.31Å; K251-D255 PolarHBondContact O-N 3.01Å
252	Q	98.3	Very high	97.5	Very high	51 Å²	51	46 Å²	46	24%	0.238	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-42.9	178.5	-173.6	176.6	23	0	0	111.2	M222 E230 S248 I249 H254 D255 L256	M222-Q252 HydrophobicContact SD-CB 3.88Å; M222-Q252 HydrophobicContact SD-CG 3.83Å; E230-Q252 PolarHBondContact OE1-OE1 3.41Å; S248-Q252 PolarHBondContact O-N 2.8Å; I249-Q252 PolarHBondContact O-N 3Å; Q252-H254 VanDerWaalsContact C-N 3.34Å; Q252-H254 PolarHBondContact O-N 3.04Å; Q252-D255 PolarHBondContact O-N 3.27Å; Q252-L256 HydrophobicContact CG-CD1 4.11Å; Q252-L256 WeakPolarHBondContact O-CB 3.45Å; Q252-L256 VanDerWaalsContact O-CG 3.3Å; Q252-L256 WeakPolarHBondContact O-CG 2.86Å; Q252-L256 PolarHBondContact O-N 2.61Å
253	A	98.3	Very high	97.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-44.7	174.7	0	0	0	0	0	111.7	L218 M222 I249 K251 L256 A257 I285	L218-A253 HydrophobicContact CD1-CB 3.5Å; L218-A253 VanDerWaalsContact CD1-CB 3.5Å; M222-A253 HydrophobicContact CB-CB 4.48Å; M222-A253 HydrophobicContact SD-CB 4.22Å; I249-A253 WeakPolarHBondContact O-CB 3.48Å; I249-A253 PolarHBondContact O-N 2.71Å; K251-A253 VanDerWaalsContact C-N 3.34Å; A253-L256 PolarHBondContact O-N 3.32Å; A253-A257 WeakPolarHBondContact O-CB 3.46Å; A253-A257 PolarHBondContact O-N 3.24Å; A253-I285 HydrophobicContact CB-CD1 4.04Å
254	H	97.3	Very high	97.5	Very high	31 Å²	31	48.1 Å²	48.1	14%	0.144	24%	0.241	C	C	.	.	H	α-helix	trans	-59.2	-49	174.8	176.2	-80.2	0	0	0	111.9	F36 A250 K251 Q252 L256 A257 Y258 I285	F36-H254 HydrophobicContact CD2-CB 4.01Å; F36-H254 HydrophobicContact CE2-CB 4.2Å; F36-H254 HydrophobicContact CG-CB 4.43Å; F36-H254 AromaticContact CG-CD2 3.89Å; A250-H254 VanDerWaalsContact O-CB 3.32Å; A250-H254 WeakPolarHBondContact O-CB 3.27Å; A250-H254 PolarHBondContact O-N 3.18Å; K251-H254 WeakPolarHBondContact O-CB 3.32Å; K251-H254 PolarHBondContact O-N 3.22Å; Q252-H254 VanDerWaalsContact C-N 3.34Å; Q252-H254 PolarHBondContact O-N 3.04Å; H254-L256 VanDerWaalsContact C-N 3.31Å; H254-L256 PolarHBondContact O-N 3.06Å; H254-A257 VanDerWaalsContact O-CB 3.28Å; H254-A257 WeakPolarHBondContact O-CB 3.42Å; H254-A257 PolarHBondContact O-N 3.12Å; H254-A257 VanDerWaalsContact O-N 3.16Å; H254-Y258 AromaticContact CD2-CE2 3.87Å; H254-Y258 AromaticContact CE1-CD2 3.9Å; H254-Y258 AromaticContact CE1-CE2 3.81Å; H254-Y258 AromaticContact NE2-CE2 3.48Å; H254-Y258 WeakPolarHBondContact NE2-CE2 3.23Å; H254-Y258 VanDerWaalsContact O-CD2 3.31Å; H254-Y258 WeakPolarHBondContact O-CD2 3.46Å; H254-Y258 PolarHBondContact O-N 3.18Å; H254-I285 HydrophobicContact CB-CD1 3.91Å
255	D	97.5	Very high	97.6	Very high	112 Å²	112	43.8 Å²	43.8	60%	0.599	23%	0.225	S	C	*	.	H	α-helix	trans	-61.9	-39.8	-179.8	-69.2	-16.1	0	0	0	111.8	K251 Q252 Y258 D259	K251-D255 VanDerWaalsContact O-CG 3.31Å; K251-D255 PolarHBondContact O-N 3.01Å; Q252-D255 PolarHBondContact O-N 3.27Å; D255-Y258 PolarHBondContact O-N 2.97Å; D255-D259 PolarHBondContact O-N 3.18Å
256	L	98.3	Very high	97.6	Very high	25 Å²	25	45 Å²	45	13%	0.131	23%	0.229	C	C	.	.	H	α-helix	trans	-67.6	-35.5	175	-71	170.3	0	0	0	112.6	N221 M222 M226 Q252 A253 H254 Y258 D259 Y262 G280	N221-L256 HydrophobicContact CB-CB 4.48Å; M222-L256 HydrophobicContact CG-CD1 3.96Å; M226-L256 HydrophobicContact SD-CD1 3.77Å; Q252-L256 HydrophobicContact CG-CD1 4.11Å; Q252-L256 WeakPolarHBondContact O-CB 3.45Å; Q252-L256 VanDerWaalsContact O-CG 3.3Å; Q252-L256 WeakPolarHBondContact O-CG 2.86Å; Q252-L256 PolarHBondContact O-N 2.61Å; A253-L256 PolarHBondContact O-N 3.32Å; H254-L256 VanDerWaalsContact C-N 3.31Å; H254-L256 PolarHBondContact O-N 3.06Å; L256-Y258 PolarHBondContact O-N 3.17Å; L256-D259 PolarHBondContact O-N 3.38Å; L256-D259 VanDerWaalsContact O-N 3.13Å; L256-Y262 HydrophobicContact CB-CD1 3.98Å; L256-Y262 HydrophobicContact CB-CE1 3.84Å; L256-Y262 HydrophobicContact CD1-CE1 4.27Å; L256-Y262 HydrophobicContact CD2-CD1 3.98Å; L256-Y262 HydrophobicContact CD2-CD2 4.14Å; L256-Y262 HydrophobicContact CD2-CE1 3.98Å; L256-Y262 HydrophobicContact CD2-CE2 4.18Å; L256-Y262 HydrophobicContact CD2-CG 4.05Å; L256-Y262 HydrophobicContact CG-CE1 4.25Å; L256-G280 WeakPolarHBondContact O-CA 3.09Å
257	A	97.6	Very high	97.6	Very high	2 Å²	2	45 Å²	45	2%	0.017	23%	0.229	C	C	.	.	H	α-helix	trans	-56.1	-33.5	176.6	0	0	0	0	0	112.9	N221 A253 H254 G280 P282	N221-A257 VanDerWaalsContact OD1-CA 3.31Å; N221-A257 WeakPolarHBondContact OD1-CA 3.38Å; A253-A257 WeakPolarHBondContact O-CB 3.46Å; A253-A257 PolarHBondContact O-N 3.24Å; H254-A257 VanDerWaalsContact O-CB 3.28Å; H254-A257 WeakPolarHBondContact O-CB 3.42Å; H254-A257 PolarHBondContact O-N 3.12Å; H254-A257 VanDerWaalsContact O-N 3.16Å; A257-G280 CarbonylContact O-C 3.25Å; A257-G280 VanDerWaalsContact O-C 3.25Å; A257-G280 WeakPolarHBondContact O-CA 3.16Å; A257-P282 VanDerWaalsContact O-CD 3.29Å; A257-P282 WeakPolarHBondContact O-CD 3.38Å; A257-P282 WeakPolarHBondContact O-CG 3.5Å
258	Y	96.9	Very high	97.6	Very high	104 Å²	104	46.8 Å²	46.8	41%	0.408	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	5.2	-179.5	-67.7	-86.1	0	0	0	114.1	K38 H254 D255 L256 P260 P282	K38-Y258 PolarHBondContact O-OH 3.25Å; H254-Y258 AromaticContact CD2-CE2 3.87Å; H254-Y258 AromaticContact CE1-CD2 3.9Å; H254-Y258 AromaticContact CE1-CE2 3.81Å; H254-Y258 AromaticContact NE2-CE2 3.48Å; H254-Y258 WeakPolarHBondContact NE2-CE2 3.23Å; H254-Y258 VanDerWaalsContact O-CD2 3.31Å; H254-Y258 WeakPolarHBondContact O-CD2 3.46Å; H254-Y258 PolarHBondContact O-N 3.18Å; D255-Y258 PolarHBondContact O-N 2.97Å; L256-Y258 PolarHBondContact O-N 3.17Å; Y258-P260 VanDerWaalsContact O-CD 3.27Å; Y258-P260 WeakPolarHBondContact O-CD 3.26Å; Y258-P282 HydrophobicContact CD1-CB 4.26Å; Y258-P282 HydrophobicContact CD1-CG 4.06Å; Y258-P282 HydrophobicContact CE1-CB 3.76Å; Y258-P282 HydrophobicContact CE1-CG 4.03Å; Y258-P282 HydrophobicContact CE2-CB 4.46Å
259	D	97.4	Very high	97.5	Very high	61 Å²	61	49.1 Å²	49.1	33%	0.326	24%	0.244	S	C	.	.			trans	-82.2	111.6	173.8	-176.2	-8.9	0	0	0	110.5	D255 L256 N261 Y262 G279 G280	D255-D259 PolarHBondContact O-N 3.18Å; L256-D259 PolarHBondContact O-N 3.38Å; L256-D259 VanDerWaalsContact O-N 3.13Å; D259-N261 PolarHBondContact O-N 2.69Å; D259-N261 PolarHBondContact OD1-N 3.22Å; D259-Y262 PolarHBondContact O-N 3.11Å; D259-Y262 PolarHBondContact OD1-N 3.23Å; D259-G279 CarbonylContact O-C 3.48Å; D259-G279 WeakPolarHBondContact O-CA 3.25Å; D259-G280 PolarHBondContact O-N 3.41Å
260	P	96.7	Very high	97.3	Very high	90 Å²	90	49.1 Å²	49.1	58%	0.584	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-14.6	-178.9	32	-37.1	0	0	0	113.6	Y258	Y258-P260 VanDerWaalsContact O-CD 3.27Å; Y258-P260 WeakPolarHBondContact O-CD 3.26Å
261	N	95.9	Very high	97.3	Very high	103 Å²	103	51.1 Å²	51.1	55%	0.551	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-10.6	-177.8	-62.6	-60.9	0	0	0	112.9	D259 R278	D259-N261 PolarHBondContact O-N 2.69Å; D259-N261 PolarHBondContact OD1-N 3.22Å; N261-R278 VanDerWaalsContact O-CZ 3.24Å; N261-R278 PolarHBondContact O-NE 2.66Å; N261-R278 PolarHBondContact O-NH2 3.45Å
262	Y	97.2	Very high	97.1	Very high	29 Å²	29	52 Å²	52	11%	0.114	27%	0.266	C	S	.	.			trans	-69.2	142.2	178	176.3	-132.4	0	0	0	111.2	N221 P223 M226 L256 D259 S264 G279	N221-Y262 WeakPolarHBondContact O-CE1 3.29Å; N221-Y262 PolarHBondContact O-OH 3.22Å; P223-Y262 VanDerWaalsContact CD-OH 3.29Å; P223-Y262 WeakPolarHBondContact CD-OH 2.98Å; M226-Y262 HydrophobicContact CE-CE2 4.35Å; L256-Y262 HydrophobicContact CB-CD1 3.98Å; L256-Y262 HydrophobicContact CB-CE1 3.84Å; L256-Y262 HydrophobicContact CD1-CE1 4.27Å; L256-Y262 HydrophobicContact CD2-CD1 3.98Å; L256-Y262 HydrophobicContact CD2-CD2 4.14Å; L256-Y262 HydrophobicContact CD2-CE1 3.98Å; L256-Y262 HydrophobicContact CD2-CE2 4.18Å; L256-Y262 HydrophobicContact CD2-CG 4.05Å; L256-Y262 HydrophobicContact CG-CE1 4.25Å; D259-Y262 PolarHBondContact O-N 3.11Å; D259-Y262 PolarHBondContact OD1-N 3.23Å; Y262-S264 VanDerWaalsContact CE1-CB 3.4Å; Y262-G279 CarbonylContact O-C 3.38Å; Y262-G279 WeakPolarHBondContact O-CA 3.44Å; Y262-G279 PolarHBondContact O-N 3.49Å
263	M	97.3	Very high	96.9	Very high	82 Å²	82	53.4 Å²	53.4	40%	0.404	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-98.6	87	168.4	-168.4	61.8	74.7	0	0	107.4	A267 Q268 R278	M263-A267 HydrophobicContact SD-CB 3.78Å; M263-Q268 HydrophobicContact CG-CB 4.48Å; M263-R278 HydrophobicContact CE-CG 4.2Å
264	S	98.1	Very high	96.8	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.31	C	S	.	.			trans	-69	158	-179.3	62.8	0	0	0	0	112	D220 Y262 F266 A267 Q268 G279	D220-S264 WeakPolarHBondContact O-CB 3.05Å; Y262-S264 VanDerWaalsContact CE1-CB 3.4Å; S264-F266 PolarHBondContact O-N 2.8Å; S264-A267 PolarHBondContact O-N 3.49Å; S264-A267 VanDerWaalsContact O-N 3.09Å; S264-A267 VanDerWaalsContact OG-CB 3.28Å; S264-A267 WeakPolarHBondContact OG-CB 3.29Å; S264-A267 PolarHBondContact OG-N 3.4Å; S264-Q268 WeakPolarHBondContact O-CB 3.38Å; S264-Q268 PolarHBondContact O-N 3.3Å; S264-G279 WeakPolarHBondContact CB-O 3.49Å; S264-G279 PolarHBondContact OG-O 2.89Å
265	P	97.9	Very high	96.6	Very high	40 Å²	40	59.1 Å²	59.1	26%	0.26	32%	0.323	S	S	.	.	H	α-helix	trans	-46.4	-45.4	167.6	-29.6	34.2	0	0	0	112.6	F219 D220 P223 Q268 F269	F219-P265 WeakPolarHBondContact O-CB 3.08Å; F219-P265 WeakPolarHBondContact O-CG 3.33Å; D220-P265 VanDerWaalsContact O-CD 3.22Å; D220-P265 WeakPolarHBondContact O-CD 3.42Å; P223-P265 HydrophobicContact CB-CG 4.21Å; P265-Q268 PolarHBondContact O-N 2.81Å; P265-F269 WeakPolarHBondContact O-CB 3.44Å; P265-F269 PolarHBondContact O-N 3.44Å
266	F	97.9	Very high	96.4	Very high	30 Å²	30	61.9 Å²	61.9	13%	0.132	34%	0.338	C	S	.	.	H	α-helix	trans	-59.1	-51.9	174.5	175.2	-96.7	0	0	0	112.7	F173 N174 D220 S264 Q268 F269 A270 V277 K281	F173-F266 HydrophobicContact CE1-CE2 4.19Å; F173-F266 HydrophobicContact CE1-CZ 4.15Å; F173-F266 HydrophobicContact CE2-CE2 4.26Å; F173-F266 HydrophobicContact CZ-CD2 4.17Å; F173-F266 HydrophobicContact CZ-CE1 4.49Å; F173-F266 AromaticContact CZ-CE2 3.51Å; F173-F266 HydrophobicContact CZ-CE2 3.51Å; F173-F266 AromaticContact CZ-CZ 3.7Å; F173-F266 HydrophobicContact CZ-CZ 3.7Å; N174-F266 HydrophobicContact CB-CE2 4.07Å; N174-F266 WeakPolarHBondContact OD1-CE2 2.98Å; D220-F266 HydrophobicContact CB-CB 3.81Å; D220-F266 WeakPolarHBondContact O-CB 3.46Å; D220-F266 PolarHBondContact O-N 2.94Å; S264-F266 PolarHBondContact O-N 2.8Å; F266-Q268 VanDerWaalsContact C-N 3.3Å; F266-Q268 PolarHBondContact O-N 3.22Å; F266-F269 PolarHBondContact O-N 3.13Å; F266-A270 WeakPolarHBondContact O-CB 3.47Å; F266-A270 PolarHBondContact O-N 3.43Å; F266-V277 HydrophobicContact CE1-CG1 4.46Å; F266-K281 HydrophobicContact CB-CB 4.15Å; F266-K281 HydrophobicContact CB-CD 4.5Å; F266-K281 HydrophobicContact CD1-CB 3.91Å; F266-K281 HydrophobicContact CD1-CD 4.45Å; F266-K281 HydrophobicContact CD1-CG 4.24Å; F266-K281 HydrophobicContact CD2-CD 3.75Å; F266-K281 HydrophobicContact CD2-CG 4.41Å; F266-K281 HydrophobicContact CE1-CG 4.42Å; F266-K281 HydrophobicContact CE2-CD 4.04Å; F266-K281 HydrophobicContact CG-CB 3.95Å; F266-K281 HydrophobicContact CG-CD 3.97Å; F266-K281 HydrophobicContact CG-CG 4.24Å
267	A	97.6	Very high	96.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.8	-36.8	-178.4	0	0	0	0	0	112.1	M263 S264 A270 C271 V277 G279	M263-A267 HydrophobicContact SD-CB 3.78Å; S264-A267 PolarHBondContact O-N 3.49Å; S264-A267 VanDerWaalsContact O-N 3.09Å; S264-A267 VanDerWaalsContact OG-CB 3.28Å; S264-A267 WeakPolarHBondContact OG-CB 3.29Å; S264-A267 PolarHBondContact OG-N 3.4Å; A267-A270 WeakPolarHBondContact O-CB 3.37Å; A267-A270 PolarHBondContact O-N 3.16Å; A267-C271 PolarHBondContact O-N 3.38Å; A267-C271 PolarHBondContact O-SG 2.89Å; A267-V277 HydrophobicContact CB-CG1 4.48Å; A267-G279 WeakPolarHBondContact CB-O 3.3Å
268	Q	97.1	Very high	96.1	Very high	90 Å²	90	70.5 Å²	70.5	42%	0.421	37%	0.374	S	S	.	.	H	α-helix	trans	-62.6	-48.3	173.3	-175.5	60.5	64.2	0	0	110.6	M263 S264 P265 F266 A270 C271 D272	M263-Q268 HydrophobicContact CG-CB 4.48Å; S264-Q268 WeakPolarHBondContact O-CB 3.38Å; S264-Q268 PolarHBondContact O-N 3.3Å; P265-Q268 PolarHBondContact O-N 2.81Å; F266-Q268 VanDerWaalsContact C-N 3.3Å; F266-Q268 PolarHBondContact O-N 3.22Å; Q268-A270 VanDerWaalsContact C-N 3.31Å; Q268-A270 PolarHBondContact O-N 2.87Å; Q268-C271 WeakPolarHBondContact O-CB 3.41Å; Q268-C271 PolarHBondContact O-N 3.44Å; Q268-C271 VanDerWaalsContact O-N 3.15Å; Q268-D272 PolarHBondContact NE2-OD1 3.12Å; Q268-D272 VanDerWaalsContact NE2-OD1 3.09Å; Q268-D272 VanDerWaalsContact O-CG 3.26Å; Q268-D272 PolarHBondContact O-N 2.79Å
269	F	95.3	Very high	96.1	Very high	85 Å²	85	65.7 Å²	65.7	37%	0.373	36%	0.356	S	S	.	.	H	α-helix	trans	-65.4	-34.7	178.5	-169.1	-135.2	0	0	0	112.3	F173 P265 F266 D272 N273	F173-F269 AromaticContact CD2-CD1 3.49Å; F173-F269 HydrophobicContact CD2-CD1 3.49Å; F173-F269 VanDerWaalsContact CD2-CD1 3.49Å; F173-F269 AromaticContact CD2-CE1 3.68Å; F173-F269 HydrophobicContact CD2-CE1 3.68Å; F173-F269 HydrophobicContact CD2-CG 4.2Å; F173-F269 HydrophobicContact CE2-CB 4.24Å; F173-F269 AromaticContact CE2-CD1 3.53Å; F173-F269 HydrophobicContact CE2-CD1 3.53Å; F173-F269 HydrophobicContact CE2-CE1 4.19Å; F173-F269 HydrophobicContact CE2-CG 4.09Å; P265-F269 WeakPolarHBondContact O-CB 3.44Å; P265-F269 PolarHBondContact O-N 3.44Å; F266-F269 PolarHBondContact O-N 3.13Å; F269-D272 PolarHBondContact O-N 2.67Å; F269-N273 WeakPolarHBondContact CD2-ND2 3.03Å; F269-N273 VanDerWaalsContact CE2-ND2 3.31Å; F269-N273 WeakPolarHBondContact CE2-ND2 3.32Å; F269-N273 PolarHBondContact O-N 3.33Å; F269-N273 PolarHBondContact O-ND2 3.2Å
270	A	96.1	Very high	96.1	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-45.4	172	0	0	0	0	0	111.3	F173 F266 A267 Q268 N273 G274 L275 V277	F173-A270 HydrophobicContact CE1-CB 4.16Å; F173-A270 HydrophobicContact CE2-CB 4.02Å; F173-A270 HydrophobicContact CZ-CB 3.47Å; F173-A270 VanDerWaalsContact CZ-CB 3.47Å; F266-A270 WeakPolarHBondContact O-CB 3.47Å; F266-A270 PolarHBondContact O-N 3.43Å; A267-A270 WeakPolarHBondContact O-CB 3.37Å; A267-A270 PolarHBondContact O-N 3.16Å; Q268-A270 VanDerWaalsContact C-N 3.31Å; Q268-A270 PolarHBondContact O-N 2.87Å; A270-N273 CarbonylContact O-C 3.54Å; A270-N273 PolarHBondContact O-N 3.29Å; A270-N273 VanDerWaalsContact O-N 3.17Å; A270-G274 PolarHBondContact O-N 3.07Å; A270-L275 CarbonylContact C-O 3.54Å; A270-L275 HydrophobicContact CB-CB 4.15Å; A270-L275 HydrophobicContact CB-CD1 4.37Å; A270-L275 WeakPolarHBondContact O-CB 3.46Å; A270-L275 PolarHBondContact O-N 3.33Å; A270-V277 HydrophobicContact CB-CB 4.07Å; A270-V277 HydrophobicContact CB-CG2 4.25Å
271	C	96.3	Very high	96.1	Very high	42 Å²	42	60.5 Å²	60.5	28%	0.284	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-43	175.9	-70.1	0	0	0	0	112.2	A267 Q268 N273 G274 L275 V277	A267-C271 PolarHBondContact O-N 3.38Å; A267-C271 PolarHBondContact O-SG 2.89Å; Q268-C271 WeakPolarHBondContact O-CB 3.41Å; Q268-C271 PolarHBondContact O-N 3.44Å; Q268-C271 VanDerWaalsContact O-N 3.15Å; C271-N273 PolarHBondContact O-N 3.36Å; C271-G274 PolarHBondContact O-N 3.13Å; C271-L275 WeakPolarHBondContact CA-O 3.24Å; C271-L275 PolarHBondContact N-O 3.05Å; C271-V277 PolarHBondContact SG-O 3.31Å; C271-V277 VanDerWaalsContact SG-O 3.41Å
272	D	94.9	Very high	96.1	Very high	114 Å²	114	58.2 Å²	58.2	61%	0.61	32%	0.317	S	S	*	.	H	α-helix	trans	-65.2	-26	177.9	-63	-17.7	0	0	0	111.8	Q268 F269 G274	Q268-D272 PolarHBondContact NE2-OD1 3.12Å; Q268-D272 VanDerWaalsContact NE2-OD1 3.09Å; Q268-D272 VanDerWaalsContact O-CG 3.26Å; Q268-D272 PolarHBondContact O-N 2.79Å; F269-D272 PolarHBondContact O-N 2.67Å; D272-G274 VanDerWaalsContact C-N 3.35Å
273	N	94	Very high	96.1	Very high	82 Å²	82	57.9 Å²	57.9	44%	0.439	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	12.2	171.9	-74.9	-85.5	0	0	0	113.8	F173 F269 A270 C271	F173-N273 HydrophobicContact CB-CB 4.31Å; F173-N273 HydrophobicContact CD2-CB 4.26Å; F173-N273 HydrophobicContact CG-CB 4.23Å; F269-N273 WeakPolarHBondContact CD2-ND2 3.03Å; F269-N273 VanDerWaalsContact CE2-ND2 3.31Å; F269-N273 WeakPolarHBondContact CE2-ND2 3.32Å; F269-N273 PolarHBondContact O-N 3.33Å; F269-N273 PolarHBondContact O-ND2 3.2Å; A270-N273 CarbonylContact O-C 3.54Å; A270-N273 PolarHBondContact O-N 3.29Å; A270-N273 VanDerWaalsContact O-N 3.17Å; C271-N273 PolarHBondContact O-N 3.36Å
274	G	95.2	Very high	96	Very high	69 Å²	69	54.2 Å²	54.2	71%	0.711	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	9.3	172.9	0	0	0	0	0	115.7	A270 C271 D272	A270-G274 PolarHBondContact O-N 3.07Å; C271-G274 PolarHBondContact O-N 3.13Å; D272-G274 VanDerWaalsContact C-N 3.35Å
275	L	94.1	Very high	96	Very high	82 Å²	82	54.2 Å²	54.2	43%	0.429	30%	0.299	S	S	.	.			trans	-94.3	127.1	175	-56.1	176	0	0	0	110.2	F173 A270 C271 V277	F173-L275 HydrophobicContact CD1-CD1 3.73Å; F173-L275 HydrophobicContact CE1-CD1 3.48Å; F173-L275 VanDerWaalsContact CE1-CD1 3.48Å; F173-L275 HydrophobicContact CZ-CD1 4.35Å; A270-L275 CarbonylContact C-O 3.54Å; A270-L275 HydrophobicContact CB-CB 4.15Å; A270-L275 HydrophobicContact CB-CD1 4.37Å; A270-L275 WeakPolarHBondContact O-CB 3.46Å; A270-L275 PolarHBondContact O-N 3.33Å; C271-L275 WeakPolarHBondContact CA-O 3.24Å; C271-L275 PolarHBondContact N-O 3.05Å; L275-V277 HydrophobicContact CB-CG2 3.98Å; L275-V277 PolarHBondContact O-N 2.74Å
276	N	93.5	Very high	96	Very high	169 Å²	169	52.3 Å²	52.3	90%	0.904	29%	0.287	S	S	*	.			trans	-85.1	79.2	176.7	-170.8	15.7	0	0	0	110.7
277	V	93.3	Very high	96.1	Very high	54 Å²	54	50.9 Å²	50.9	33%	0.327	28%	0.281	S	S	.	.			trans	-114.8	145.1	-178.2	-179.5	0	0	0	0	109.9	F266 A267 A270 C271 L275	F266-V277 HydrophobicContact CE1-CG1 4.46Å; A267-V277 HydrophobicContact CB-CG1 4.48Å; A270-V277 HydrophobicContact CB-CB 4.07Å; A270-V277 HydrophobicContact CB-CG2 4.25Å; C271-V277 PolarHBondContact SG-O 3.31Å; C271-V277 VanDerWaalsContact SG-O 3.41Å; L275-V277 HydrophobicContact CB-CG2 3.98Å; L275-V277 PolarHBondContact O-N 2.74Å
278	R	95.5	Very high	96.1	Very high	155 Å²	155	50.9 Å²	50.9	59%	0.585	28%	0.281	S	S	*	.			trans	-142.2	152.1	172.3	-173	176.9	-179.1	-175.8	-0.9	109	N261 M263	N261-R278 VanDerWaalsContact O-CZ 3.24Å; N261-R278 PolarHBondContact O-NE 2.66Å; N261-R278 PolarHBondContact O-NH2 3.45Å; M263-R278 HydrophobicContact CE-CG 4.2Å
279	G	97.3	Very high	96.2	Very high	3 Å²	3	46.6 Å²	46.6	3%	0.031	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	113.7	174	-179.3	0	0	0	0	0	111.9	D259 Y262 S264 A267	D259-G279 CarbonylContact O-C 3.48Å; D259-G279 WeakPolarHBondContact O-CA 3.25Å; Y262-G279 CarbonylContact O-C 3.38Å; Y262-G279 WeakPolarHBondContact O-CA 3.44Å; Y262-G279 PolarHBondContact O-N 3.49Å; S264-G279 WeakPolarHBondContact CB-O 3.49Å; S264-G279 PolarHBondContact OG-O 2.89Å; A267-G279 WeakPolarHBondContact CB-O 3.3Å
280	G	97.6	Very high	96.3	Very high	17 Å²	17	42.5 Å²	42.5	18%	0.175	24%	0.243	C	C	.	.			trans	-67.1	169	161.6	0	0	0	0	0	112.9	N221 L256 A257 D259 P282	N221-G280 WeakPolarHBondContact OD1-CA 3.49Å; L256-G280 WeakPolarHBondContact O-CA 3.09Å; A257-G280 CarbonylContact O-C 3.25Å; A257-G280 VanDerWaalsContact O-C 3.25Å; A257-G280 WeakPolarHBondContact O-CA 3.16Å; D259-G280 PolarHBondContact O-N 3.41Å; G280-P282 WeakPolarHBondContact O-CD 3.33Å
281	K	96.8	Very high	96.4	Very high	25 Å²	25	42.6 Å²	42.6	11%	0.109	24%	0.243	C	C	.	.			trans	-106.2	100.7	169.8	-175	-161.9	-177.8	-169.9	0	107.9	N174 D216 D220 N221 F266 D283	N174-K281 PolarHBondContact OD1-NZ 3.43Å; D216-K281 IonicContact OD2-NZ 3.15Å; D216-K281 PolarHBondContact OD2-NZ 3.14Å; D220-K281 HydrophobicContact CB-CB 4.37Å; D220-K281 HydrophobicContact CB-CD 3.92Å; D220-K281 WeakPolarHBondContact OD2-CD 3.45Å; D220-K281 WeakPolarHBondContact OD2-CE 3.29Å; D220-K281 IonicContact OD2-NZ 3.98Å; D220-K281 PolarHBondContact OD2-NZ 3.49Å; N221-K281 PolarHBondContact ND2-O 2.87Å; N221-K281 PolarHBondContact OD1-N 3.47Å; N221-K281 PolarHBondContact OD1-O 3.21Å; F266-K281 HydrophobicContact CB-CB 4.15Å; F266-K281 HydrophobicContact CB-CD 4.5Å; F266-K281 HydrophobicContact CD1-CB 3.91Å; F266-K281 HydrophobicContact CD1-CD 4.45Å; F266-K281 HydrophobicContact CD1-CG 4.24Å; F266-K281 HydrophobicContact CD2-CD 3.75Å; F266-K281 HydrophobicContact CD2-CG 4.41Å; F266-K281 HydrophobicContact CE1-CG 4.42Å; F266-K281 HydrophobicContact CE2-CD 4.04Å; F266-K281 HydrophobicContact CG-CB 3.95Å; F266-K281 HydrophobicContact CG-CD 3.97Å; F266-K281 HydrophobicContact CG-CG 4.24Å; K281-D283 VanDerWaalsContact CE-OD2 3.27Å; K281-D283 WeakPolarHBondContact CE-OD2 3.35Å; K281-D283 IonicContact NZ-OD2 3.38Å; K281-D283 PolarHBondContact O-N 3.16Å; K281-D283 VanDerWaalsContact O-N 3.13Å
282	P	96.1	Very high	96.5	Very high	54 Å²	54	40.7 Å²	40.7	35%	0.351	23%	0.23	S	C	.	.			trans	-59.2	117.7	172.6	-24.2	33.9	0	0	0	110.4	K38 A257 Y258 G280	K38-P282 HydrophobicContact CD-CB 4.47Å; K38-P282 WeakPolarHBondContact CD-O 3.34Å; A257-P282 VanDerWaalsContact O-CD 3.29Å; A257-P282 WeakPolarHBondContact O-CD 3.38Å; A257-P282 WeakPolarHBondContact O-CG 3.5Å; Y258-P282 HydrophobicContact CD1-CB 4.26Å; Y258-P282 HydrophobicContact CD1-CG 4.06Å; Y258-P282 HydrophobicContact CE1-CB 3.76Å; Y258-P282 HydrophobicContact CE1-CG 4.03Å; Y258-P282 HydrophobicContact CE2-CB 4.46Å; G280-P282 WeakPolarHBondContact O-CD 3.33Å
283	D	95.8	Very high	96.5	Very high	22 Å²	22	36.1 Å²	36.1	12%	0.118	21%	0.208	C	C	.	.			trans	-148.1	172.5	175.7	-124.2	-20.7	0	0	0	113.6	K38 K281	K38-D283 IonicContact NZ-OD1 2.66Å; K38-D283 PolarHBondContact NZ-OD1 3.23Å; K281-D283 VanDerWaalsContact CE-OD2 3.27Å; K281-D283 WeakPolarHBondContact CE-OD2 3.35Å; K281-D283 IonicContact NZ-OD2 3.38Å; K281-D283 PolarHBondContact O-N 3.16Å; K281-D283 VanDerWaalsContact O-N 3.13Å
284	D	96.8	Very high	96.4	Very high	5 Å²	5	36 Å²	36	3%	0.027	21%	0.205	C	C	.	.			trans	-64.1	139.5	165.9	-64.3	-38.8	0	0	0	109	G37 K38 Y51 G52 D53 D54 G217	G37-D284 WeakPolarHBondContact CA-OD1 3.31Å; K38-D284 WeakPolarHBondContact CB-OD1 3.46Å; K38-D284 PolarHBondContact N-OD1 2.83Å; Y51-D284 WeakPolarHBondContact O-CB 3.28Å; G52-D284 WeakPolarHBondContact CA-OD1 3.5Å; D53-D284 WeakPolarHBondContact CA-OD2 3.19Å; D53-D284 VanDerWaalsContact CB-OD2 3.28Å; D53-D284 WeakPolarHBondContact CB-OD2 3.3Å; D53-D284 PolarHBondContact N-OD2 2.6Å; D54-D284 HydrophobicContact CB-CB 4.34Å; G217-D284 WeakPolarHBondContact CA-O 3.47Å
285	I	97.8	Very high	95.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.9	-175.4	-61	176	0	0	0	108.1	G35 F36 D54 A250 A253 H254 V287	G35-I285 CarbonylContact C-O 3.57Å; G35-I285 WeakPolarHBondContact CA-O 3.5Å; F36-I285 PolarHBondContact N-O 3.19Å; F36-I285 PolarHBondContact O-N 3.36Å; D54-I285 PolarHBondContact OD2-N 2.74Å; A250-I285 HydrophobicContact CB-CG2 4.24Å; A253-I285 HydrophobicContact CB-CD1 4.04Å; H254-I285 HydrophobicContact CB-CD1 3.91Å; I285-V287 HydrophobicContact CG2-CG2 4.3Å
286	T	98.3	Very high	95	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.1	174.8	-62.5	0	0	0	0	110.5	Y51 D54 C56 V69 A214 T215	Y51-T286 HydrophobicContact CD2-CG2 3.78Å; Y51-T286 VanDerWaalsContact CD2-OG1 3.29Å; Y51-T286 WeakPolarHBondContact CD2-OG1 3.44Å; Y51-T286 HydrophobicContact CE2-CG2 3.97Å; D54-T286 WeakPolarHBondContact CB-OG1 3.47Å; D54-T286 VanDerWaalsContact CG-OG1 3.29Å; D54-T286 VanDerWaalsContact OD2-CB 3.3Å; D54-T286 WeakPolarHBondContact OD2-CB 3.47Å; D54-T286 PolarHBondContact OD2-N 2.83Å; D54-T286 PolarHBondContact OD2-OG1 3.23Å; C56-T286 HydrophobicContact CB-CG2 3.81Å; V69-T286 HydrophobicContact CG1-CG2 4.15Å; A214-T286 WeakPolarHBondContact CA-O 3.47Å; A214-T286 VanDerWaalsContact CB-O 3.24Å; A214-T286 WeakPolarHBondContact CB-O 3.48Å; T215-T286 PolarHBondContact N-O 2.84Å; T215-T286 PolarHBondContact OG1-N 2.82Å
287	V	98.5	Very high	93.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123.8	-179.6	173.5	0	0	0	0	110	S33 Y34 L212 A214 L218 A246 I249 A250 I285	S33-V287 CarbonylContact C-O 3.6Å; S33-V287 VanDerWaalsContact CA-O 3.23Å; S33-V287 WeakPolarHBondContact CA-O 3.24Å; Y34-V287 PolarHBondContact N-O 2.83Å; Y34-V287 PolarHBondContact O-N 3.18Å; L212-V287 HydrophobicContact CD1-CG1 3.44Å; L212-V287 VanDerWaalsContact CD1-CG1 3.44Å; A214-V287 HydrophobicContact CB-CG2 4.38Å; L218-V287 HydrophobicContact CD2-CG2 4.17Å; A246-V287 HydrophobicContact CB-CG1 4.15Å; I249-V287 HydrophobicContact CG2-CG1 4.46Å; I249-V287 HydrophobicContact CG2-CG2 4.18Å; A250-V287 HydrophobicContact CB-CG2 4.06Å; I285-V287 HydrophobicContact CG2-CG2 4.3Å
288	L	98.6	Very high	93.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119	162.8	-58.1	-179.5	0	0	0	108.3	T31 A32 M49 C56 I58 L67 V69 L212 T213	T31-L288 HydrophobicContact CG2-CB 4.49Å; A32-L288 WeakPolarHBondContact O-CA 3.28Å; M49-L288 HydrophobicContact CE-CD2 3.85Å; C56-L288 HydrophobicContact CB-CD1 4.19Å; C56-L288 HydrophobicContact CB-CD2 4.2Å; C56-L288 HydrophobicContact CB-CG 4.35Å; I58-L288 HydrophobicContact CD1-CD2 4.19Å; I58-L288 HydrophobicContact CG1-CD2 4.12Å; L67-L288 HydrophobicContact CB-CD1 3.94Å; V69-L288 HydrophobicContact CG1-CD1 3.69Å; V69-L288 HydrophobicContact CG1-CG 3.87Å; L212-L288 WeakPolarHBondContact CA-O 3.49Å; T213-L288 PolarHBondContact N-O 3.18Å; T213-L288 PolarHBondContact O-N 2.87Å
289	L	98.6	Very high	93.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	129	174.3	-174.7	66.2	0	0	0	109.2	T31 A32 I210 L212 L231 V242 T245 A246	T31-L289 CarbonylContact C-O 3.47Å; T31-L289 VanDerWaalsContact CA-O 3.28Å; T31-L289 WeakPolarHBondContact CA-O 3.44Å; A32-L289 PolarHBondContact N-O 3.35Å; A32-L289 PolarHBondContact O-N 3.03Å; I210-L289 HydrophobicContact CG2-CD1 3.45Å; I210-L289 VanDerWaalsContact CG2-CD1 3.45Å; I210-L289 HydrophobicContact CG2-CG 4.43Å; L212-L289 HydrophobicContact CB-CD1 4.34Å; L212-L289 HydrophobicContact CD1-CB 4.33Å; L212-L289 HydrophobicContact CD1-CD1 3.78Å; L231-L289 HydrophobicContact CD2-CD1 3.59Å; L231-L289 HydrophobicContact CD2-CD2 4.14Å; V242-L289 HydrophobicContact CG1-CB 3.99Å; V242-L289 HydrophobicContact CG1-CD2 4.11Å; V242-L289 HydrophobicContact CG1-CG 3.98Å; V242-L289 WeakPolarHBondContact CG1-O 3.48Å; T245-L289 HydrophobicContact CG2-CD2 3.71Å; A246-L289 HydrophobicContact CB-CB 3.9Å; A246-L289 HydrophobicContact CB-CD2 4.47Å
290	S	98.3	Very high	93	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.6	-178.9	-52.8	0	0	0	0	111.8	I30 T31 L67 I210 I211	I30-S290 VanDerWaalsContact O-CA 3.31Å; I30-S290 WeakPolarHBondContact O-CA 3.15Å; T31-S290 WeakPolarHBondContact CB-OG 3.29Å; T31-S290 WeakPolarHBondContact CG2-OG 3.37Å; T31-S290 WeakPolarHBondContact OG1-CB 3.16Å; T31-S290 PolarHBondContact OG1-OG 3.25Å; L67-S290 WeakPolarHBondContact CD1-OG 3.26Å; I210-S290 CarbonylContact C-O 3.58Å; I210-S290 WeakPolarHBondContact CA-O 3.49Å; I211-S290 PolarHBondContact N-O 3.4Å; I211-S290 PolarHBondContact O-N 2.95Å
291	I	97.9	Very high	92.7	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133	168.1	-58.3	170	0	0	0	108.5	L29 I30 D209 I210 L234 V242 A293	L29-I291 WeakPolarHBondContact CA-O 3.41Å; I30-I291 PolarHBondContact N-O 3.27Å; I30-I291 PolarHBondContact O-N 2.98Å; D209-I291 WeakPolarHBondContact O-CA 3.06Å; I210-I291 HydrophobicContact CG1-CG1 4.45Å; L234-I291 HydrophobicContact CD1-CD1 4.06Å; L234-I291 HydrophobicContact CD2-CD1 3.54Å; L234-I291 HydrophobicContact CD2-CG1 4.07Å; L234-I291 HydrophobicContact CG-CD1 4.21Å; V242-I291 HydrophobicContact CG2-CD1 3.34Å; V242-I291 HydrophobicContact CG2-CG1 3.85Å; I291-A293 PolarHBondContact O-N 2.98Å
292	V	97.3	Very high	92.5	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	118.4	169.5	-175.3	0	0	0	0	108.9	Y27 S28 L29 V205 Q206 L207 G208 D209 I211	Y27-V292 HydrophobicContact CD2-CG1 3.46Å; Y27-V292 VanDerWaalsContact CD2-CG1 3.46Å; Y27-V292 HydrophobicContact CE2-CG1 4.04Å; Y27-V292 HydrophobicContact CG-CG1 4.04Å; S28-V292 WeakPolarHBondContact O-CA 3.27Å; L29-V292 HydrophobicContact CD2-CG2 3.96Å; V205-V292 HydrophobicContact CB-CG2 4.19Å; V205-V292 HydrophobicContact CG2-CG1 4.25Å; V205-V292 HydrophobicContact CG2-CG2 4.31Å; Q206-V292 WeakPolarHBondContact O-CB 3.15Å; L207-V292 HydrophobicContact CD2-CG1 4.46Å; G208-V292 PolarHBondContact N-O 3.33Å; D209-V292 HydrophobicContact CB-CB 4.33Å; D209-V292 HydrophobicContact CB-CG2 3.87Å; D209-V292 PolarHBondContact O-N 2.98Å; I211-V292 HydrophobicContact CD1-CG2 3.48Å; I211-V292 VanDerWaalsContact CD1-CG2 3.48Å
293	A	95.2	Very high	92.2	Very high	17 Å²	17	34.9 Å²	34.9	14%	0.14	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	164.2	179.9	0	0	0	0	0	110.2	S28 I30 L207 I291 Y295	S28-A293 PolarHBondContact N-O 2.81Å; S28-A293 PolarHBondContact O-N 3.04Å; I30-A293 HydrophobicContact CD1-CB 3.77Å; I30-A293 HydrophobicContact CG1-CB 4.06Å; L207-A293 VanDerWaalsContact CD2-C 3.44Å; I291-A293 PolarHBondContact O-N 2.98Å; A293-Y295 PolarHBondContact O-N 3.41Å
294	E	91.8	Very high	92	Very high	79 Å²	79	35.8 Å²	35.8	37%	0.369	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	139.3	169.2	-65.2	-174.8	-173.7	0	0	109.6	R25 S28 L207 T296	R25-E294 WeakPolarHBondContact CD-OE2 3.48Å; R25-E294 IonicContact CZ-OE2 3.93Å; R25-E294 IonicContact NE-OE2 2.72Å; R25-E294 IonicContact NH1-OE1 3.1Å; R25-E294 PolarHBondContact NH1-OE1 3.13Å; R25-E294 IonicContact NH1-OE2 3.49Å; R25-E294 PolarHBondContact NH1-OE2 2.91Å; S28-E294 PolarHBondContact OG-O 3.28Å; L207-E294 HydrophobicContact CD1-CG 3.8Å; L207-E294 HydrophobicContact CD2-CG 3.85Å; E294-T296 PolarHBondContact O-N 2.81Å
295	Y	83.3	Confident	91.6	Very high	81 Å²	81	38.2 Å²	38.2	32%	0.318	20%	0.202	S	C	.	.			trans	-70.8	122.6	173	-179.1	-102.9	0	0	0	109.7	D26 A293 D297	D26-Y295 HydrophobicContact CB-CD1 4.43Å; D26-Y295 HydrophobicContact CB-CG 4.39Å; D26-Y295 WeakPolarHBondContact O-CB 3.35Å; D26-Y295 PolarHBondContact O-N 3.37Å; A293-Y295 PolarHBondContact O-N 3.41Å; Y295-D297 WeakPolarHBondContact CE1-OD1 3.37Å; Y295-D297 PolarHBondContact OH-OD1 3.19Å
296	T	76.4	Confident	91.1	Very high	113 Å²	113	41.3 Å²	41.3	69%	0.693	22%	0.219	S	C	*	.			trans	-115.3	123.4	171.1	58.5	0	0	0	0	108.2	E294	E294-T296 PolarHBondContact O-N 2.81Å
297	D	58.8	Low	90.4	Very high	202 Å²	202	45.1 Å²	45.1	100%	1.08	24%	0.238	S	C	*	.			trans	-55.9	0	175.1	-82.5	-36.9	0	0	0	113.5	Y295	Y295-D297 WeakPolarHBondContact CE1-OD1 3.37Å; Y295-D297 PolarHBondContact OH-OD1 3.19Å

Retrieved 297 of 297 residues in 133.2 ms (Link to these results)

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