A0A674H9Y6_TAEGU Loading...

Metallophosphoesterase MPPED2

Displays low metallophosphoesterase activity (in vitro). May play a role in the development of the nervous system.

AlphaFold DB , UniProt , Accession A0A674H9Y6, Species TAEGU (Taeniopygia guttata, Zebra finch), Gene MPPED2, Length 294 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.1	Very low	51.7	Low	231 Å²	231	133.9 Å²	133.9	100%	1.138	78%	0.784	S	S	*	*				0	116.6	0	-72.1	-159	-95.2	0	0	107.3	H3	M1-H3 PolarHBondContact O-N 2.67Å
2	A	36.6	Very low	55.4	Low	105 Å²	105	132.3 Å²	132.3	87%	0.868	78%	0.777	S	S	*	*			trans	-72.3	113.5	179.5	0	0	0	0	0	108.6	G4	A2-G4 PolarHBondContact O-N 3.43Å; A2-G4 VanDerWaalsContact O-N 3.11Å
3	H	39.9	Very low	58.7	Low	185 Å²	185	122.9 Å²	122.9	86%	0.856	72%	0.721	S	S	*	*			trans	-73.9	98.6	167.7	-80.1	-71	0	0	0	107.7	M1 I5	M1-H3 PolarHBondContact O-N 2.67Å; H3-I5 PolarHBondContact O-N 3.45Å
4	G	35.6	Very low	61.6	Low	68 Å²	68	121.6 Å²	121.6	70%	0.701	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-58.6	122.1	168.2	0	0	0	0	0	109.3	A2	A2-G4 PolarHBondContact O-N 3.43Å; A2-G4 VanDerWaalsContact O-N 3.11Å
5	I	42.3	Very low	64	Low	162 Å²	162	117.1 Å²	117.1	83%	0.831	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-62.3	127.4	167.8	-60.7	170.9	0	0	0	106.1	H3 S7	H3-I5 PolarHBondContact O-N 3.45Å; I5-S7 PolarHBondContact O-N 2.98Å
6	P	39.8	Very low	66.2	Low	110 Å²	110	110.9 Å²	110.9	71%	0.714	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-62.4	128	177.8	-9.9	22.9	0	0	0	108.3	Q8	P6-Q8 PolarHBondContact O-N 3.25Å
7	S	46.9	Very low	68.1	Low	115 Å²	115	114.1 Å²	114.1	80%	0.804	66%	0.659	S	S	*	*			trans	-57.4	109	167.4	58.1	0	0	0	0	107.7	I5 G9	I5-S7 PolarHBondContact O-N 2.98Å; S7-G9 PolarHBondContact O-N 3.13Å; S7-G9 VanDerWaalsContact O-N 3.08Å
8	Q	55.5	Low	69.8	Low	190 Å²	190	110.9 Å²	110.9	89%	0.888	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-57.2	119	169.4	-75.8	-177.2	-8.2	0	0	106.7	P6	P6-Q8 PolarHBondContact O-N 3.25Å
9	G	61	Low	71.3	Confident	62 Å²	62	105.4 Å²	105.4	64%	0.639	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-57	144.5	178.3	0	0	0	0	0	110.2	S7 V11	S7-G9 PolarHBondContact O-N 3.13Å; S7-G9 VanDerWaalsContact O-N 3.08Å; G9-V11 PolarHBondContact O-N 2.88Å; G9-V11 VanDerWaalsContact O-N 3.12Å
10	K	80.7	Confident	72.6	Confident	177 Å²	177	104.2 Å²	104.2	77%	0.77	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-55.8	116.8	179.8	-163.1	175.6	-176.2	-179.7	0	109.7	T12	K10-T12 PolarHBondContact O-N 2.84Å
11	V	93.6	Very high	73.8	Confident	68 Å²	68	102.5 Å²	102.5	41%	0.412	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-67.9	119.7	-179.7	177.6	0	0	0	0	108.6	G9 I13 R241 R242	G9-V11 PolarHBondContact O-N 2.88Å; G9-V11 VanDerWaalsContact O-N 3.12Å; V11-I13 HydrophobicContact CG1-CD1 4.13Å; V11-R241 HydrophobicContact CG1-CB 4.38Å; V11-R242 HydrophobicContact CB-CB 4.36Å; V11-R242 HydrophobicContact CB-CG 4.29Å; V11-R242 HydrophobicContact CG1-CB 4.22Å; V11-R242 WeakPolarHBondContact O-CD 3.37Å
12	T	96.1	Very high	76.7	Confident	114 Å²	114	92.1 Å²	92.1	70%	0.699	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-101.4	128.6	176	-57.2	0	0	0	0	109.1	K10	K10-T12 PolarHBondContact O-N 2.84Å
13	I	98.3	Very high	79.7	Confident	11 Å²	11	89.4 Å²	89.4	6%	0.056	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-94.8	135.2	173.2	-54.2	-59.1	0	0	0	108.2	V11 L197 N237 R241 R242	V11-I13 HydrophobicContact CG1-CD1 4.13Å; I13-L197 HydrophobicContact CB-CD1 4.02Å; I13-L197 HydrophobicContact CG2-CD1 3.67Å; I13-N237 HydrophobicContact CG2-CB 4.02Å; I13-R241 HydrophobicContact CD1-CB 3.92Å; I13-R242 HydrophobicContact CD1-CB 4.16Å; I13-R242 HydrophobicContact CG1-CB 4.09Å
14	T	98.4	Very high	82.5	Confident	105 Å²	105	85.7 Å²	85.7	64%	0.644	50%	0.497	S	S	*	.			trans	-113.8	162.4	171	59.1	0	0	0	0	109.4	D16	T14-D16 PolarHBondContact O-N 3.39Å
15	V	98.8	Very high	85.5	Confident	54 Å²	54	82.5 Å²	82.5	33%	0.327	46%	0.463	S	S	.	.			trans	-57.3	133.6	173	177.3	0	0	0	0	109.4	Q194 L197	V15-Q194 HydrophobicContact CG2-CB 4.02Å; V15-Q194 VanDerWaalsContact CG2-OE1 3.31Å; V15-L197 HydrophobicContact CG2-CB 4.49Å; V15-L197 HydrophobicContact CG2-CD2 3.76Å
16	D	98.7	Very high	88.2	Confident	17 Å²	17	76.5 Å²	76.5	9%	0.091	43%	0.431	C	S	.	.			trans	-74.6	142.2	179.3	-158.6	-72.7	0	0	0	110.7	T14 Y18 S19 Y29 V233 E234 N237	T14-D16 PolarHBondContact O-N 3.39Å; D16-Y18 PolarHBondContact O-N 3.25Å; D16-Y18 VanDerWaalsContact O-N 3.16Å; D16-Y18 PolarHBondContact OD1-N 3.09Å; D16-S19 WeakPolarHBondContact O-CB 3.2Å; D16-S19 PolarHBondContact O-N 2.83Å; D16-Y29 WeakPolarHBondContact OD2-CE2 3.47Å; D16-Y29 VanDerWaalsContact OD2-CZ 3.26Å; D16-Y29 PolarHBondContact OD2-OH 3.1Å; D16-V233 HydrophobicContact CB-CB 4.32Å; D16-V233 HydrophobicContact CB-CG1 3.5Å; D16-V233 VanDerWaalsContact CG-CG1 3.48Å; D16-V233 WeakPolarHBondContact OD2-CG1 3.41Å; D16-E234 WeakPolarHBondContact CB-OE1 3.44Å; D16-E234 PolarHBondContact N-OE1 3.38Å; D16-N237 PolarHBondContact OD2-ND2 2.92Å
17	E	98.5	Very high	91	Very high	165 Å²	165	74.4 Å²	74.4	77%	0.771	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.9	173.9	-174.1	-177.9	-176.3	0	0	111.7
18	Y	98.3	Very high	93.5	Very high	58 Å²	58	71.6 Å²	71.6	23%	0.227	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	13.3	179	-60.1	-91.4	0	0	0	113.3	D16 S20 N21 Q24 A25 H28	D16-Y18 PolarHBondContact O-N 3.25Å; D16-Y18 VanDerWaalsContact O-N 3.16Å; D16-Y18 PolarHBondContact OD1-N 3.09Å; Y18-S20 PolarHBondContact O-N 2.87Å; Y18-S20 VanDerWaalsContact O-N 3.14Å; Y18-N21 CarbonylContact O-C 3.36Å; Y18-N21 PolarHBondContact O-N 2.87Å; Y18-Q24 HydrophobicContact CD1-CB 4.04Å; Y18-A25 VanDerWaalsContact CB-CB 3.46Å; Y18-A25 HydrophobicContact CG-CB 4.41Å; Y18-H28 HydrophobicContact CD2-CB 4.41Å; Y18-H28 HydrophobicContact CE1-CB 4.31Å; Y18-H28 HydrophobicContact CE2-CB 4.16Å; Y18-H28 AromaticContact CE2-CD2 3.9Å; Y18-H28 AromaticContact CE2-CE1 3.68Å; Y18-H28 AromaticContact CE2-CG 3.56Å; Y18-H28 AromaticContact CE2-ND1 3.41Å; Y18-H28 WeakPolarHBondContact CE2-ND1 3.37Å; Y18-H28 AromaticContact CZ-CE1 3.94Å; Y18-H28 AromaticContact CZ-CG 3.74Å; Y18-H28 AromaticContact CZ-ND1 3.33Å; Y18-H28 VanDerWaalsContact CZ-ND1 3.33Å; Y18-H28 PolarHBondContact OH-ND1 3.06Å; Y18-H28 VanDerWaalsContact OH-ND1 3.07Å
19	S	98.3	Very high	95.5	Very high	6 Å²	6	63.3 Å²	63.3	4%	0.042	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-43.2	-175.4	176.6	0	0	0	0	113.2	D16 N21 R192 G193 E234	D16-S19 WeakPolarHBondContact O-CB 3.2Å; D16-S19 PolarHBondContact O-N 2.83Å; S19-N21 VanDerWaalsContact C-N 3.31Å; S19-N21 PolarHBondContact O-N 3.24Å; S19-R192 WeakPolarHBondContact O-CD 3.49Å; S19-G193 WeakPolarHBondContact OG-CA 3.13Å; S19-G193 PolarHBondContact OG-N 2.88Å; S19-E234 WeakPolarHBondContact CB-OE1 3.29Å; S19-E234 PolarHBondContact OG-OE1 2.89Å; S19-E234 VanDerWaalsContact OG-OE1 3.13Å; S19-E234 PolarHBondContact OG-OE2 3.44Å
20	S	97.8	Very high	97.3	Very high	80 Å²	80	61.8 Å²	61.8	56%	0.559	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-10.7	-179.2	55.1	0	0	0	0	114.4	Y18	Y18-S20 PolarHBondContact O-N 2.87Å; Y18-S20 VanDerWaalsContact O-N 3.14Å
21	N	98.3	Very high	98.1	Very high	70 Å²	70	59.4 Å²	59.4	37%	0.374	32%	0.323	S	S	.	.			trans	-128.7	70.3	-175	-68.7	-82.3	0	0	0	111	Y18 S19 T23 Q24 A25	Y18-N21 CarbonylContact O-C 3.36Å; Y18-N21 PolarHBondContact O-N 2.87Å; S19-N21 VanDerWaalsContact C-N 3.31Å; S19-N21 PolarHBondContact O-N 3.24Å; N21-T23 VanDerWaalsContact C-N 3.33Å; N21-T23 PolarHBondContact O-N 2.96Å; N21-Q24 HydrophobicContact CB-CB 3.97Å; N21-Q24 HydrophobicContact CB-CG 4.14Å; N21-Q24 WeakPolarHBondContact O-CA 3.32Å; N21-Q24 WeakPolarHBondContact O-CB 3.33Å; N21-Q24 PolarHBondContact O-N 2.71Å; N21-A25 PolarHBondContact O-N 3.21Å
22	P	98.4	Very high	98.4	Very high	13 Å²	13	61 Å²	61	8%	0.084	33%	0.329	C	S	.	.	H	α-helix	trans	-53.9	-40.5	-173.5	20.8	-35.1	0	0	0	114.2	Q24 A25 F26 L217 R229	P22-Q24 VanDerWaalsContact C-N 3.32Å; P22-Q24 PolarHBondContact O-N 2.85Å; P22-A25 WeakPolarHBondContact O-CB 3.42Å; P22-A25 PolarHBondContact O-N 2.78Å; P22-F26 PolarHBondContact O-N 3.49Å; P22-L217 HydrophobicContact CB-CD1 3.79Å; P22-L217 WeakPolarHBondContact O-CD1 3.38Å; P22-R229 HydrophobicContact CB-CB 4.21Å; P22-R229 WeakPolarHBondContact CB-O 3.41Å; P22-R229 WeakPolarHBondContact CG-O 3.08Å
23	T	98.6	Very high	98.4	Very high	48 Å²	48	60.5 Å²	60.5	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-37.5	177.1	-52.6	0	0	0	0	112.6	N21 T27 Q228 R229	N21-T23 VanDerWaalsContact C-N 3.33Å; N21-T23 PolarHBondContact O-N 2.96Å; T23-T27 PolarHBondContact O-N 2.89Å; T23-T27 VanDerWaalsContact O-N 3.13Å; T23-T27 PolarHBondContact O-OG1 3.03Å; T23-Q228 WeakPolarHBondContact OG1-CA 3.37Å; T23-Q228 WeakPolarHBondContact OG1-CB 3.18Å; T23-R229 PolarHBondContact OG1-N 3.35Å
24	Q	98.7	Very high	98.4	Very high	107 Å²	107	63.5 Å²	63.5	50%	0.5	34%	0.341	S	S	.	.	H	α-helix	trans	-73.1	-40.3	175.5	-63.4	178.5	8.4	0	0	110.9	Y18 N21 P22 F26 T27 H28	Y18-Q24 HydrophobicContact CD1-CB 4.04Å; N21-Q24 HydrophobicContact CB-CB 3.97Å; N21-Q24 HydrophobicContact CB-CG 4.14Å; N21-Q24 WeakPolarHBondContact O-CA 3.32Å; N21-Q24 WeakPolarHBondContact O-CB 3.33Å; N21-Q24 PolarHBondContact O-N 2.71Å; P22-Q24 VanDerWaalsContact C-N 3.32Å; P22-Q24 PolarHBondContact O-N 2.85Å; Q24-F26 VanDerWaalsContact C-N 3.31Å; Q24-F26 PolarHBondContact O-N 3.29Å; Q24-T27 PolarHBondContact O-N 2.9Å; Q24-T27 VanDerWaalsContact O-N 3.17Å; Q24-H28 VanDerWaalsContact O-CB 3.3Å; Q24-H28 WeakPolarHBondContact O-CB 3.25Å; Q24-H28 PolarHBondContact O-N 2.67Å
25	A	98.8	Very high	98.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-55.7	-47.3	172.4	0	0	0	0	0	111	Y18 N21 P22 T27 H28 Y29 L217 V233	Y18-A25 VanDerWaalsContact CB-CB 3.46Å; Y18-A25 HydrophobicContact CG-CB 4.41Å; N21-A25 PolarHBondContact O-N 3.21Å; P22-A25 WeakPolarHBondContact O-CB 3.42Å; P22-A25 PolarHBondContact O-N 2.78Å; A25-T27 VanDerWaalsContact C-N 3.34Å; A25-T27 PolarHBondContact O-N 3.23Å; A25-H28 PolarHBondContact O-N 2.75Å; A25-Y29 WeakPolarHBondContact O-CB 3.49Å; A25-Y29 WeakPolarHBondContact O-CD2 3.24Å; A25-Y29 PolarHBondContact O-N 2.82Å; A25-L217 HydrophobicContact CB-CD2 3.58Å; A25-V233 HydrophobicContact CB-CG1 4.27Å; A25-V233 HydrophobicContact CB-CG2 3.94Å
26	F	98.8	Very high	98.4	Very high	36 Å²	36	58.1 Å²	58.1	16%	0.158	30%	0.303	C	S	.	.	H	α-helix	trans	-55.2	-51.4	175.9	-179.2	-89.9	0	0	0	110.6	P22 Q24 Y29 N30 F36 L217 R229	P22-F26 PolarHBondContact O-N 3.49Å; Q24-F26 VanDerWaalsContact C-N 3.31Å; Q24-F26 PolarHBondContact O-N 3.29Å; F26-Y29 PolarHBondContact O-N 3.32Å; F26-N30 VanDerWaalsContact O-CB 3.24Å; F26-N30 WeakPolarHBondContact O-CB 3.36Å; F26-N30 PolarHBondContact O-N 3.27Å; F26-F36 HydrophobicContact CB-CE2 4.36Å; F26-F36 HydrophobicContact CD2-CD1 4.14Å; F26-F36 AromaticContact CD2-CD2 3.48Å; F26-F36 HydrophobicContact CD2-CD2 3.48Å; F26-F36 VanDerWaalsContact CD2-CD2 3.48Å; F26-F36 HydrophobicContact CD2-CE1 4.16Å; F26-F36 AromaticContact CD2-CE2 3.5Å; F26-F36 HydrophobicContact CD2-CE2 3.5Å; F26-F36 AromaticContact CD2-CG 3.8Å; F26-F36 HydrophobicContact CD2-CG 3.8Å; F26-F36 AromaticContact CD2-CZ 3.85Å; F26-F36 HydrophobicContact CD2-CZ 3.85Å; F26-F36 HydrophobicContact CE1-CD2 4.48Å; F26-F36 HydrophobicContact CE2-CB 3.64Å; F26-F36 AromaticContact CE2-CD1 3.78Å; F26-F36 HydrophobicContact CE2-CD1 3.78Å; F26-F36 AromaticContact CE2-CD2 3.41Å; F26-F36 HydrophobicContact CE2-CD2 3.41Å; F26-F36 VanDerWaalsContact CE2-CD2 3.41Å; F26-F36 HydrophobicContact CE2-CE1 4.26Å; F26-F36 AromaticContact CE2-CE2 3.93Å; F26-F36 HydrophobicContact CE2-CE2 3.93Å; F26-F36 AromaticContact CE2-CG 3.31Å; F26-F36 HydrophobicContact CE2-CG 3.31Å; F26-F36 HydrophobicContact CE2-CZ 4.32Å; F26-F36 HydrophobicContact CG-CD2 4.08Å; F26-F36 HydrophobicContact CG-CE2 4.02Å; F26-F36 HydrophobicContact CZ-CB 3.78Å; F26-F36 AromaticContact CZ-CD2 3.94Å; F26-F36 HydrophobicContact CZ-CD2 3.94Å; F26-F36 AromaticContact CZ-CG 3.92Å; F26-F36 HydrophobicContact CZ-CG 3.92Å; F26-F36 WeakPolarHBondContact O-CE2 3.44Å; F26-L217 HydrophobicContact CB-CD1 4.19Å; F26-R229 HydrophobicContact CB-CG 4.06Å; F26-R229 HydrophobicContact CD2-CG 4.45Å; F26-R229 HydrophobicContact CG-CG 4.21Å
27	T	98.6	Very high	98.4	Very high	67 Å²	67	61.2 Å²	61.2	41%	0.411	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-47.2	-178	-58	0	0	0	0	111.9	T23 Q24 A25 Y29 N30 I31	T23-T27 PolarHBondContact O-N 2.89Å; T23-T27 VanDerWaalsContact O-N 3.13Å; T23-T27 PolarHBondContact O-OG1 3.03Å; Q24-T27 PolarHBondContact O-N 2.9Å; Q24-T27 VanDerWaalsContact O-N 3.17Å; A25-T27 VanDerWaalsContact C-N 3.34Å; A25-T27 PolarHBondContact O-N 3.23Å; T27-Y29 PolarHBondContact O-N 3.11Å; T27-N30 PolarHBondContact O-N 3.49Å; T27-I31 HydrophobicContact CG2-CD1 3.69Å; T27-I31 HydrophobicContact CG2-CG1 4.37Å; T27-I31 WeakPolarHBondContact O-CG1 3.45Å; T27-I31 PolarHBondContact O-N 2.7Å
28	H	98.7	Very high	98.3	Very high	56 Å²	56	57.8 Å²	57.8	26%	0.259	31%	0.309	S	S	.	.	H	α-helix	trans	-56.8	-52.2	178	176.3	94.7	0	0	0	111.1	Y18 Q24 A25 N30 I31 N32	Y18-H28 HydrophobicContact CD2-CB 4.41Å; Y18-H28 HydrophobicContact CE1-CB 4.31Å; Y18-H28 HydrophobicContact CE2-CB 4.16Å; Y18-H28 AromaticContact CE2-CD2 3.9Å; Y18-H28 AromaticContact CE2-CE1 3.68Å; Y18-H28 AromaticContact CE2-CG 3.56Å; Y18-H28 AromaticContact CE2-ND1 3.41Å; Y18-H28 WeakPolarHBondContact CE2-ND1 3.37Å; Y18-H28 AromaticContact CZ-CE1 3.94Å; Y18-H28 AromaticContact CZ-CG 3.74Å; Y18-H28 AromaticContact CZ-ND1 3.33Å; Y18-H28 VanDerWaalsContact CZ-ND1 3.33Å; Y18-H28 PolarHBondContact OH-ND1 3.06Å; Y18-H28 VanDerWaalsContact OH-ND1 3.07Å; Q24-H28 VanDerWaalsContact O-CB 3.3Å; Q24-H28 WeakPolarHBondContact O-CB 3.25Å; Q24-H28 PolarHBondContact O-N 2.67Å; A25-H28 PolarHBondContact O-N 2.75Å; H28-N30 VanDerWaalsContact C-N 3.3Å; H28-N30 PolarHBondContact O-N 3.37Å; H28-I31 PolarHBondContact O-N 3.02Å; H28-N32 PolarHBondContact CE1-ND2 2.89Å; H28-N32 PolarHBondContact ND1-ND2 3.31Å; H28-N32 PolarHBondContact NE2-ND2 2.95Å; H28-N32 WeakPolarHBondContact O-CB 3.44Å; H28-N32 PolarHBondContact O-N 3.41Å; H28-N32 PolarHBondContact O-ND2 2.89Å
29	Y	98.6	Very high	98.2	Very high	15 Å²	15	59.7 Å²	59.7	6%	0.059	33%	0.329	C	S	.	.	H	α-helix	trans	-64.9	-35	179	-80.6	-53.2	0	0	0	112.7	D16 A25 F26 T27 Q33 S34 R35 L217 V233 R241	D16-Y29 WeakPolarHBondContact OD2-CE2 3.47Å; D16-Y29 VanDerWaalsContact OD2-CZ 3.26Å; D16-Y29 PolarHBondContact OD2-OH 3.1Å; A25-Y29 WeakPolarHBondContact O-CB 3.49Å; A25-Y29 WeakPolarHBondContact O-CD2 3.24Å; A25-Y29 PolarHBondContact O-N 2.82Å; F26-Y29 PolarHBondContact O-N 3.32Å; T27-Y29 PolarHBondContact O-N 3.11Å; Y29-Q33 WeakPolarHBondContact O-CA 3.17Å; Y29-Q33 WeakPolarHBondContact O-CB 3.39Å; Y29-Q33 PolarHBondContact O-N 3.26Å; Y29-S34 PolarHBondContact O-N 3.04Å; Y29-R35 VanDerWaalsContact CZ-NH1 3.3Å; Y29-R35 PolarHBondContact O-N 3Å; Y29-L217 HydrophobicContact CD2-CD2 4.38Å; Y29-V233 HydrophobicContact CE2-CG1 4.36Å; Y29-R241 PolarHBondContact OH-NH2 2.95Å; Y29-R241 VanDerWaalsContact OH-NH2 3.14Å
30	N	98	Very high	98.1	Very high	30 Å²	30	65.4 Å²	65.4	16%	0.16	36%	0.355	C	S	.	.	H	α-helix	trans	-71.1	-42.1	179.4	-149.5	31.2	0	0	0	112.3	F26 T27 H28 S34 F36 Q37	F26-N30 VanDerWaalsContact O-CB 3.24Å; F26-N30 WeakPolarHBondContact O-CB 3.36Å; F26-N30 PolarHBondContact O-N 3.27Å; T27-N30 PolarHBondContact O-N 3.49Å; H28-N30 VanDerWaalsContact C-N 3.3Å; H28-N30 PolarHBondContact O-N 3.37Å; N30-S34 WeakPolarHBondContact O-CA 3.41Å; N30-S34 PolarHBondContact O-N 3.3Å; N30-F36 HydrophobicContact CB-CD2 4.03Å; N30-F36 PolarHBondContact OD1-N 2.84Å; N30-Q37 PolarHBondContact ND2-NE2 3.15Å; N30-Q37 WeakPolarHBondContact OD1-CG 3.42Å; N30-Q37 PolarHBondContact OD1-NE2 2.65Å
31	I	98.3	Very high	98.2	Very high	127 Å²	127	62.2 Å²	62.2	65%	0.651	33%	0.332	S	S	*	.	H	α-helix	trans	-67.9	-46.4	178.7	-69.8	173.2	0	0	0	110.8	T27 H28	T27-I31 HydrophobicContact CG2-CD1 3.69Å; T27-I31 HydrophobicContact CG2-CG1 4.37Å; T27-I31 WeakPolarHBondContact O-CG1 3.45Å; T27-I31 PolarHBondContact O-N 2.7Å; H28-I31 PolarHBondContact O-N 3.02Å
32	N	98.5	Very high	98.2	Very high	101 Å²	101	63.3 Å²	63.3	54%	0.54	33%	0.334	S	S	.	.	H	α-helix	trans	-87.3	-24.8	-169.6	-65.4	-38.6	0	0	0	113.8	H28	H28-N32 PolarHBondContact CE1-ND2 2.89Å; H28-N32 PolarHBondContact ND1-ND2 3.31Å; H28-N32 PolarHBondContact NE2-ND2 2.95Å; H28-N32 WeakPolarHBondContact O-CB 3.44Å; H28-N32 PolarHBondContact O-N 3.41Å; H28-N32 PolarHBondContact O-ND2 2.89Å
33	Q	97.8	Very high	98.2	Very high	104 Å²	104	67.1 Å²	67.1	49%	0.486	35%	0.352	S	S	.	.	H	α-helix	trans	-129.7	-3.2	-172.6	-56.7	173.7	13	0	0	112.8	Y29 R35	Y29-Q33 WeakPolarHBondContact O-CA 3.17Å; Y29-Q33 WeakPolarHBondContact O-CB 3.39Å; Y29-Q33 PolarHBondContact O-N 3.26Å; Q33-R35 HydrophobicContact CB-CB 4.26Å; Q33-R35 PolarHBondContact O-N 3.32Å; Q33-R35 VanDerWaalsContact O-N 3.13Å
34	S	97.8	Very high	98.2	Very high	74 Å²	74	67 Å²	67	52%	0.517	35%	0.352	S	S	.	.			trans	52.1	31.5	-170.6	-60.8	0	0	0	0	112.3	Y29 N30 F36 Q37	Y29-S34 PolarHBondContact O-N 3.04Å; N30-S34 WeakPolarHBondContact O-CA 3.41Å; N30-S34 PolarHBondContact O-N 3.3Å; S34-F36 PolarHBondContact O-N 2.92Å; S34-Q37 WeakPolarHBondContact O-CB 3.22Å; S34-Q37 PolarHBondContact O-N 2.79Å
35	R	98.3	Very high	98.2	Very high	26 Å²	26	68.5 Å²	68.5	10%	0.098	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.3	-166.3	-165.7	173.6	-178.1	-178.8	-0.5	114	Y29 Q33 V41 N237 Q240 R241	Y29-R35 VanDerWaalsContact CZ-NH1 3.3Å; Y29-R35 PolarHBondContact O-N 3Å; Q33-R35 HydrophobicContact CB-CB 4.26Å; Q33-R35 PolarHBondContact O-N 3.32Å; Q33-R35 VanDerWaalsContact O-N 3.13Å; R35-V41 WeakPolarHBondContact O-CG2 3.46Å; R35-N237 PolarHBondContact NH1-OD1 2.93Å; R35-N237 PolarHBondContact NH2-OD1 2.94Å; R35-Q240 VanDerWaalsContact CZ-OE1 3.22Å; R35-R241 VanDerWaalsContact NH1-NH2 3.16Å
36	F	98.4	Very high	98.1	Very high	20 Å²	20	72.3 Å²	72.3	9%	0.088	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	21.2	179.9	-48.2	-77.8	0	0	0	112.4	F26 N30 S34 L217 F219 L236	F26-F36 HydrophobicContact CB-CE2 4.36Å; F26-F36 HydrophobicContact CD2-CD1 4.14Å; F26-F36 AromaticContact CD2-CD2 3.48Å; F26-F36 HydrophobicContact CD2-CD2 3.48Å; F26-F36 VanDerWaalsContact CD2-CD2 3.48Å; F26-F36 HydrophobicContact CD2-CE1 4.16Å; F26-F36 AromaticContact CD2-CE2 3.5Å; F26-F36 HydrophobicContact CD2-CE2 3.5Å; F26-F36 AromaticContact CD2-CG 3.8Å; F26-F36 HydrophobicContact CD2-CG 3.8Å; F26-F36 AromaticContact CD2-CZ 3.85Å; F26-F36 HydrophobicContact CD2-CZ 3.85Å; F26-F36 HydrophobicContact CE1-CD2 4.48Å; F26-F36 HydrophobicContact CE2-CB 3.64Å; F26-F36 AromaticContact CE2-CD1 3.78Å; F26-F36 HydrophobicContact CE2-CD1 3.78Å; F26-F36 AromaticContact CE2-CD2 3.41Å; F26-F36 HydrophobicContact CE2-CD2 3.41Å; F26-F36 VanDerWaalsContact CE2-CD2 3.41Å; F26-F36 HydrophobicContact CE2-CE1 4.26Å; F26-F36 AromaticContact CE2-CE2 3.93Å; F26-F36 HydrophobicContact CE2-CE2 3.93Å; F26-F36 AromaticContact CE2-CG 3.31Å; F26-F36 HydrophobicContact CE2-CG 3.31Å; F26-F36 HydrophobicContact CE2-CZ 4.32Å; F26-F36 HydrophobicContact CG-CD2 4.08Å; F26-F36 HydrophobicContact CG-CE2 4.02Å; F26-F36 HydrophobicContact CZ-CB 3.78Å; F26-F36 AromaticContact CZ-CD2 3.94Å; F26-F36 HydrophobicContact CZ-CD2 3.94Å; F26-F36 AromaticContact CZ-CG 3.92Å; F26-F36 HydrophobicContact CZ-CG 3.92Å; F26-F36 WeakPolarHBondContact O-CE2 3.44Å; N30-F36 HydrophobicContact CB-CD2 4.03Å; N30-F36 PolarHBondContact OD1-N 2.84Å; S34-F36 PolarHBondContact O-N 2.92Å; F36-L217 HydrophobicContact CZ-CD2 4.21Å; F36-L217 HydrophobicContact CZ-CG 4.28Å; F36-F219 HydrophobicContact CD1-CE2 4.1Å; F36-F219 HydrophobicContact CD1-CZ 4.48Å; F36-F219 HydrophobicContact CE1-CD2 4.48Å; F36-F219 AromaticContact CE1-CE2 3.99Å; F36-F219 HydrophobicContact CE1-CE2 3.99Å; F36-L236 HydrophobicContact CE1-CD2 3.77Å; F36-L236 HydrophobicContact CZ-CD2 3.66Å
37	Q	97.9	Very high	98.1	Very high	83 Å²	83	73.7 Å²	73.7	39%	0.388	40%	0.396	S	S	.	.			trans	-99.1	155	-178.6	-64.5	-64.1	-13.4	0	0	112.8	N30 S34 V41	N30-Q37 PolarHBondContact ND2-NE2 3.15Å; N30-Q37 WeakPolarHBondContact OD1-CG 3.42Å; N30-Q37 PolarHBondContact OD1-NE2 2.65Å; S34-Q37 WeakPolarHBondContact O-CB 3.22Å; S34-Q37 PolarHBondContact O-N 2.79Å; Q37-V41 PolarHBondContact O-N 3.02Å
38	P	96.7	Very high	98.1	Very high	92 Å²	92	74.3 Å²	74.3	60%	0.597	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	159.8	166	28.8	-35.3	0	0	0	111.7
39	P	97.2	Very high	98.1	Very high	99 Å²	99	75.7 Å²	75.7	64%	0.643	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	cis	-83.9	-18.8	5.1	33.3	-35.7	0	0	0	113.9	H42	P39-H42 PolarHBondContact O-ND1 3.03Å
40	H	96.4	Very high	98	Very high	126 Å²	126	81.5 Å²	81.5	58%	0.583	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-40.5	-171.5	-53.8	100.6	0	0	0	112.3	H42 D262 G263	H40-H42 PolarHBondContact O-ND1 3.48Å; H40-D262 CarbonylContact O-C 3.59Å; H40-G263 PolarHBondContact O-N 2.65Å; H40-G263 VanDerWaalsContact O-N 3.16Å
41	V	98.6	Very high	98	Very high	12 Å²	12	82 Å²	82	7%	0.073	44%	0.441	C	S	.	.	S	Bend	trans	-95.5	117.8	176.6	-178.2	0	0	0	0	110.6	R35 Q37 F219 M260 T261 D262	R35-V41 WeakPolarHBondContact O-CG2 3.46Å; Q37-V41 PolarHBondContact O-N 3.02Å; V41-F219 HydrophobicContact CG1-CE1 4.02Å; V41-F219 HydrophobicContact CG1-CZ 4.31Å; V41-F219 HydrophobicContact CG2-CZ 4.26Å; V41-M260 HydrophobicContact CG1-CE 3.64Å; V41-T261 VanDerWaalsContact CA-O 3.3Å; V41-T261 WeakPolarHBondContact CA-O 3.1Å; V41-D262 HydrophobicContact CG2-CB 4.18Å
42	H	98.7	Very high	98	Very high	93 Å²	93	81.3 Å²	81.3	43%	0.431	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	164	177.7	56.8	-82	0	0	0	112.1	P39 H40 M260 T261	P39-H42 PolarHBondContact O-ND1 3.03Å; H40-H42 PolarHBondContact O-ND1 3.48Å; H42-M260 WeakPolarHBondContact O-CA 3.29Å; H42-T261 WeakPolarHBondContact CE1-CG2 3.16Å; H42-T261 PolarHBondContact N-O 2.99Å; H42-T261 WeakPolarHBondContact NE2-CG2 3.47Å; H42-T261 PolarHBondContact O-N 3.32Å
43	M	98.7	Very high	98	Very high	94 Å²	94	79.5 Å²	79.5	46%	0.463	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	144.7	170.1	-67.1	-59.3	-60.5	0	0	110.3	R220 I259 M260	M43-R220 PolarHBondContact SD-NH1 2.83Å; M43-I259 VanDerWaalsContact CE-O 3.23Å; M43-I259 WeakPolarHBondContact CE-O 3.45Å; M43-M260 HydrophobicContact CE-CG 4.37Å; M43-M260 HydrophobicContact SD-CG 3.33Å; M43-M260 WeakPolarHBondContact SD-CG 3.32Å; M43-M260 HydrophobicContact SD-SD 3.91Å
44	V	98.6	Very high	98.1	Very high	46 Å²	46	77.4 Å²	77.4	28%	0.279	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.2	171	-178.3	0	0	0	0	107.9	I259 T261	V44-I259 HydrophobicContact CB-CB 4.05Å; V44-I259 HydrophobicContact CB-CG2 3.76Å; V44-I259 HydrophobicContact CG1-CG2 4.37Å; V44-I259 HydrophobicContact CG2-CG2 4.31Å; V44-I259 PolarHBondContact N-O 3.13Å; V44-T261 HydrophobicContact CG2-CG2 3.79Å
45	D	98.3	Very high	98.1	Very high	138 Å²	138	78.5 Å²	78.5	74%	0.738	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-72.9	138.1	177.7	-68.2	-34.2	0	0	0	110.4
46	P	97.7	Very high	98	Very high	79 Å²	79	80.1 Å²	80.1	51%	0.513	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-66.9	145	174.5	29.4	-34.4	0	0	0	110.5	I259	P46-I259 HydrophobicContact CB-CD1 4.39Å
47	I	98	Very high	98	Very high	66 Å²	66	81.7 Å²	81.7	34%	0.338	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-87.5	143.8	174.9	62.7	174.7	0	0	0	111.1	T51 I285	I47-T51 HydrophobicContact CB-CG2 4.46Å; I47-T51 HydrophobicContact CD1-CG2 4.1Å; I47-I285 HydrophobicContact CD1-CD1 3.94Å; I47-I285 HydrophobicContact CD1-CG1 4.1Å; I47-I285 HydrophobicContact CG1-CD1 3.79Å; I47-I285 HydrophobicContact CG1-CG1 3.69Å
48	P	98.2	Very high	98.1	Very high	80 Å²	80	77.9 Å²	77.9	52%	0.519	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-61.2	152.4	173.2	-26.1	36	0	0	0	113.5	D50 T51	P48-D50 VanDerWaalsContact C-N 3.27Å; P48-D50 VanDerWaalsContact CB-OD1 3.22Å; P48-D50 WeakPolarHBondContact CB-OD1 3.39Å; P48-D50 PolarHBondContact O-N 2.82Å; P48-T51 WeakPolarHBondContact CD-OG1 3.36Å; P48-T51 WeakPolarHBondContact O-CB 3.16Å; P48-T51 PolarHBondContact O-N 3.09Å; P48-T51 PolarHBondContact O-OG1 3.16Å
49	Y	98.6	Very high	98.2	Very high	84 Å²	84	73.6 Å²	73.6	33%	0.329	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-24	-176.1	-61.6	-26.2	0	0	0	115.2	T51 P76 P282 P283 I285	Y49-T51 VanDerWaalsContact C-N 3.27Å; Y49-P76 HydrophobicContact CD1-CB 3.53Å; Y49-P76 HydrophobicContact CD1-CG 4.11Å; Y49-P76 HydrophobicContact CD2-CB 3.77Å; Y49-P76 HydrophobicContact CE1-CB 3.72Å; Y49-P76 HydrophobicContact CE1-CG 3.82Å; Y49-P76 HydrophobicContact CE2-CB 3.93Å; Y49-P76 HydrophobicContact CE2-CG 4.42Å; Y49-P76 HydrophobicContact CG-CB 3.54Å; Y49-P282 VanDerWaalsContact OH-CB 3.29Å; Y49-P282 WeakPolarHBondContact OH-CB 3.47Å; Y49-P283 VanDerWaalsContact CE1-O 3.23Å; Y49-P283 WeakPolarHBondContact CE1-O 3.43Å; Y49-P283 VanDerWaalsContact OH-CD 3.23Å; Y49-P283 WeakPolarHBondContact OH-CD 3.37Å; Y49-P283 PolarHBondContact OH-O 3.18Å; Y49-I285 HydrophobicContact CD1-CD1 4.02Å; Y49-I285 HydrophobicContact CD1-CG1 4.12Å; Y49-I285 HydrophobicContact CD1-CG2 4.16Å; Y49-I285 HydrophobicContact CE1-CG1 4.46Å; Y49-I285 HydrophobicContact CE1-CG2 4.19Å
50	D	97.9	Very high	98.3	Very high	137 Å²	137	68.9 Å²	68.9	73%	0.733	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-2.7	174.8	63.4	-11.5	0	0	0	113.3	P48 P52	P48-D50 VanDerWaalsContact C-N 3.27Å; P48-D50 VanDerWaalsContact CB-OD1 3.22Å; P48-D50 WeakPolarHBondContact CB-OD1 3.39Å; P48-D50 PolarHBondContact O-N 2.82Å; D50-P52 WeakPolarHBondContact O-CD 3.23Å
51	T	98.3	Very high	98.4	Very high	41 Å²	41	62.9 Å²	62.9	25%	0.252	37%	0.369	S	S	.	.	S	Bend	trans	-56.2	121.6	175.1	-58.3	0	0	0	0	109.6	I47 P48 Y49 K53 R59	I47-T51 HydrophobicContact CB-CG2 4.46Å; I47-T51 HydrophobicContact CD1-CG2 4.1Å; P48-T51 WeakPolarHBondContact CD-OG1 3.36Å; P48-T51 WeakPolarHBondContact O-CB 3.16Å; P48-T51 PolarHBondContact O-N 3.09Å; P48-T51 PolarHBondContact O-OG1 3.16Å; Y49-T51 VanDerWaalsContact C-N 3.27Å; T51-K53 PolarHBondContact O-N 2.96Å; T51-R59 VanDerWaalsContact O-CZ 3.3Å; T51-R59 PolarHBondContact O-NH1 3.32Å; T51-R59 PolarHBondContact O-NH2 3.22Å
52	P	98.4	Very high	98.4	Very high	112 Å²	112	62.3 Å²	62.3	73%	0.727	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-58.3	125.6	177.3	-25.5	35	0	0	0	111	D50 P54	D50-P52 WeakPolarHBondContact O-CD 3.23Å; P52-P54 WeakPolarHBondContact O-CD 3.42Å
53	K	98.4	Very high	98.4	Very high	64 Å²	64	57.9 Å²	57.9	28%	0.278	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-64.3	124.1	174.4	-172.5	177.8	73.9	-174.3	0	109	T51 H57 R59 Y77 D79	T51-K53 PolarHBondContact O-N 2.96Å; K53-H57 WeakPolarHBondContact CD-O 3.24Å; K53-H57 VanDerWaalsContact CE-O 3.25Å; K53-H57 WeakPolarHBondContact CE-O 3.26Å; K53-H57 HydrophobicContact CG-CB 4.37Å; K53-R59 HydrophobicContact CD-CB 3.57Å; K53-R59 HydrophobicContact CG-CB 4.23Å; K53-Y77 PolarHBondContact NZ-OH 2.77Å; K53-D79 WeakPolarHBondContact CD-OD2 3.29Å; K53-D79 IonicContact NZ-OD1 3.31Å; K53-D79 PolarHBondContact NZ-OD1 3.36Å; K53-D79 IonicContact NZ-OD2 3.35Å; K53-D79 PolarHBondContact NZ-OD2 3.14Å
54	P	98.3	Very high	98.4	Very high	59 Å²	59	53.4 Å²	53.4	38%	0.383	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-58.4	149.5	-179.7	-24.3	33.6	0	0	0	112.4	P52 G56 H57 D287	P52-P54 WeakPolarHBondContact O-CD 3.42Å; P54-G56 PolarHBondContact O-N 2.83Å; P54-H57 HydrophobicContact CB-CB 4.31Å; P54-H57 WeakPolarHBondContact O-CB 3.26Å; P54-H57 PolarHBondContact O-N 2.81Å; P54-H57 VanDerWaalsContact O-N 3.13Å; P54-D287 WeakPolarHBondContact CD-OD2 3.36Å
55	A	97.8	Very high	98.4	Very high	98 Å²	98	51.2 Å²	51.2	81%	0.81	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	139.6	177.3	0	0	0	0	0	110.9	H57	A55-H57 PolarHBondContact O-N 3.01Å; A55-H57 PolarHBondContact O-ND1 3.02Å
56	G	97.4	Very high	98.4	Very high	59 Å²	59	44.7 Å²	44.7	61%	0.608	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	9.8	-177.9	0	0	0	0	0	115	P54 T290	P54-G56 PolarHBondContact O-N 2.83Å; G56-T290 WeakPolarHBondContact O-CB 3.37Å; G56-T290 PolarHBondContact O-N 2.88Å; G56-T290 PolarHBondContact O-OG1 2.89Å
57	H	98.4	Very high	98.5	Very high	53 Å²	53	41 Å²	41	25%	0.245	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	153.9	176.8	-69.6	55.1	0	0	0	112.6	K53 P54 A55 D287 L288 P289 T290	K53-H57 WeakPolarHBondContact CD-O 3.24Å; K53-H57 VanDerWaalsContact CE-O 3.25Å; K53-H57 WeakPolarHBondContact CE-O 3.26Å; K53-H57 HydrophobicContact CG-CB 4.37Å; P54-H57 HydrophobicContact CB-CB 4.31Å; P54-H57 WeakPolarHBondContact O-CB 3.26Å; P54-H57 PolarHBondContact O-N 2.81Å; P54-H57 VanDerWaalsContact O-N 3.13Å; A55-H57 PolarHBondContact O-N 3.01Å; A55-H57 PolarHBondContact O-ND1 3.02Å; H57-D287 HydrophobicContact CB-CB 4.28Å; H57-L288 CarbonylContact C-O 3.56Å; H57-L288 VanDerWaalsContact CA-O 3.24Å; H57-L288 WeakPolarHBondContact CA-O 3.27Å; H57-L288 WeakPolarHBondContact CB-O 3.46Å; H57-P289 VanDerWaalsContact CD2-N 3.25Å; H57-P289 WeakPolarHBondContact NE2-CG 3.43Å; H57-T290 VanDerWaalsContact C-OG1 3.32Å
58	T	98.8	Very high	98.5	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.3	169.8	-66.2	0	0	0	0	108.5	F60 D79 I80 K170 F172 D287 L288 T290	T58-F60 HydrophobicContact CG2-CD2 4.46Å; T58-F60 HydrophobicContact CG2-CE1 4.43Å; T58-F60 HydrophobicContact CG2-CE2 3.82Å; T58-F60 HydrophobicContact CG2-CZ 3.82Å; T58-D79 WeakPolarHBondContact CA-OD2 3.38Å; T58-D79 HydrophobicContact CG2-CB 3.89Å; T58-I80 HydrophobicContact CG2-CD1 4.02Å; T58-I80 HydrophobicContact CG2-CG1 4.25Å; T58-K170 HydrophobicContact CG2-CD 4.28Å; T58-F172 HydrophobicContact CG2-CE2 4.01Å; T58-D287 WeakPolarHBondContact O-CA 3.3Å; T58-L288 PolarHBondContact N-O 3.07Å; T58-L288 PolarHBondContact O-N 3.35Å; T58-T290 PolarHBondContact N-OG1 2.82Å; T58-T290 PolarHBondContact OG1-OG1 3.13Å
59	R	98.9	Very high	98.5	Very high	3 Å²	3	38.4 Å²	38.4	1%	0.011	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.4	179.2	-179.9	160.5	-69.9	179.4	-1.1	110.3	T51 K53 Y77 D79 I80 I285 D287	T51-R59 VanDerWaalsContact O-CZ 3.3Å; T51-R59 PolarHBondContact O-NH1 3.32Å; T51-R59 PolarHBondContact O-NH2 3.22Å; K53-R59 HydrophobicContact CD-CB 3.57Å; K53-R59 HydrophobicContact CG-CB 4.23Å; R59-Y77 VanDerWaalsContact CD-O 3.24Å; R59-Y77 WeakPolarHBondContact CD-O 3.46Å; R59-D79 PolarHBondContact N-OD2 2.86Å; R59-D79 PolarHBondContact O-N 3.08Å; R59-I80 PolarHBondContact O-N 2.82Å; R59-I285 HydrophobicContact CG-CB 4.21Å; R59-I285 HydrophobicContact CG-CG2 4.46Å; R59-D287 VanDerWaalsContact CA-OD1 3.26Å; R59-D287 WeakPolarHBondContact CA-OD1 3.38Å; R59-D287 WeakPolarHBondContact CB-OD1 3.33Å; R59-D287 VanDerWaalsContact CG-OD1 3.26Å; R59-D287 WeakPolarHBondContact CG-OD1 3.36Å; R59-D287 IonicContact CZ-OD1 3.75Å; R59-D287 IonicContact CZ-OD2 3.6Å; R59-D287 IonicContact NE-OD1 3.91Å; R59-D287 PolarHBondContact NE-OD1 3.16Å; R59-D287 IonicContact NE-OD2 2.78Å; R59-D287 IonicContact NH2-OD1 2.67Å; R59-D287 IonicContact NH2-OD2 3.69Å; R59-D287 PolarHBondContact NH2-OD2 3.31Å
60	F	98.9	Very high	98.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.3	173	-63	-88.7	0	0	0	109.5	T58 I80 L82 F172 I174 I209 I285 F286 L288	T58-F60 HydrophobicContact CG2-CD2 4.46Å; T58-F60 HydrophobicContact CG2-CE1 4.43Å; T58-F60 HydrophobicContact CG2-CE2 3.82Å; T58-F60 HydrophobicContact CG2-CZ 3.82Å; F60-I80 CarbonylContact C-O 3.57Å; F60-I80 WeakPolarHBondContact CA-O 3.36Å; F60-I80 HydrophobicContact CD1-CB 3.88Å; F60-I80 HydrophobicContact CD1-CG2 4.08Å; F60-I80 HydrophobicContact CE1-CB 3.96Å; F60-I80 HydrophobicContact CE1-CD1 3.87Å; F60-I80 HydrophobicContact CE1-CG1 4.41Å; F60-I80 HydrophobicContact CE1-CG2 4.13Å; F60-I80 HydrophobicContact CZ-CD1 4.32Å; F60-L82 HydrophobicContact CB-CD1 4.15Å; F60-L82 HydrophobicContact CD1-CD1 3.8Å; F60-L82 HydrophobicContact CD1-CD2 4.13Å; F60-L82 HydrophobicContact CD1-CG 3.99Å; F60-L82 HydrophobicContact CG-CD1 4.26Å; F60-F172 HydrophobicContact CE2-CE1 4.13Å; F60-F172 HydrophobicContact CE2-CE2 4.18Å; F60-F172 AromaticContact CE2-CZ 3.9Å; F60-F172 HydrophobicContact CE2-CZ 3.9Å; F60-F172 HydrophobicContact CZ-CD1 4.13Å; F60-F172 AromaticContact CZ-CD2 3.83Å; F60-F172 HydrophobicContact CZ-CD2 3.83Å; F60-F172 HydrophobicContact CZ-CE1 4.11Å; F60-F172 AromaticContact CZ-CE2 3.83Å; F60-F172 HydrophobicContact CZ-CE2 3.83Å; F60-F172 AromaticContact CZ-CG 3.96Å; F60-F172 HydrophobicContact CZ-CG 3.96Å; F60-F172 AromaticContact CZ-CZ 3.95Å; F60-F172 HydrophobicContact CZ-CZ 3.95Å; F60-I174 HydrophobicContact CE1-CD1 4.34Å; F60-I209 HydrophobicContact CD1-CD1 3.84Å; F60-I209 HydrophobicContact CD2-CD1 4.34Å; F60-I209 HydrophobicContact CE1-CD1 3.29Å; F60-I209 HydrophobicContact CE2-CD1 3.88Å; F60-I209 HydrophobicContact CG-CD1 4.33Å; F60-I209 HydrophobicContact CZ-CD1 3.32Å; F60-I285 CarbonylContact O-C 3.57Å; F60-I285 VanDerWaalsContact O-CA 3.29Å; F60-I285 WeakPolarHBondContact O-CA 3.45Å; F60-F286 PolarHBondContact N-O 2.89Å; F60-F286 PolarHBondContact O-N 3.26Å; F60-L288 HydrophobicContact CD2-CB 4.49Å; F60-L288 HydrophobicContact CD2-CD1 4.35Å; F60-L288 HydrophobicContact CE2-CB 4Å; F60-L288 HydrophobicContact CE2-CD1 4Å; F60-L288 HydrophobicContact CE2-CG 4.32Å
61	V	98.9	Very high	98.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	117.3	170	-174.7	0	0	0	0	106.9	V63 M75 P76 I80 L81 L82 Y108 P283 I285	V61-V63 HydrophobicContact CG1-CG2 4.37Å; V61-M75 HydrophobicContact CG1-CE 3.96Å; V61-P76 HydrophobicContact CG1-CG 3.76Å; V61-P76 HydrophobicContact CG2-CG 4.23Å; V61-I80 PolarHBondContact N-O 3.28Å; V61-L81 HydrophobicContact CB-CD1 4.21Å; V61-L81 HydrophobicContact CG1-CD1 4.15Å; V61-L81 CarbonylContact O-C 3.19Å; V61-L81 WeakPolarHBondContact O-CA 3.3Å; V61-L81 WeakPolarHBondContact O-CD1 3.45Å; V61-L82 PolarHBondContact O-N 2.63Å; V61-Y108 HydrophobicContact CG2-CD1 4.41Å; V61-Y108 HydrophobicContact CG2-CE1 3.7Å; V61-P283 HydrophobicContact CG1-CB 3.91Å; V61-I285 HydrophobicContact CG2-CG2 4.21Å
62	C	98.9	Very high	98.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.5	-174.5	-54.6	0	0	0	0	109.6	V249 I268 A270 I284	C62-V249 HydrophobicContact CB-CG1 3.88Å; C62-I268 HydrophobicContact CB-CG2 4.11Å; C62-A270 HydrophobicContact CB-CB 3.92Å; C62-I284 HydrophobicContact CB-CB 4.34Å; C62-I284 WeakPolarHBondContact CB-O 3.48Å; C62-I284 PolarHBondContact N-O 2.98Å; C62-I284 PolarHBondContact O-N 3.02Å; C62-I284 VanDerWaalsContact O-N 3.08Å
63	V	98.9	Very high	98.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	154.1	-179.2	177.2	0	0	0	0	108.2	V61 T66 M75 L81 L82 H83 T84 A270 T272 P283	V61-V63 HydrophobicContact CG1-CG2 4.37Å; V63-T66 HydrophobicContact CG1-CG2 3.45Å; V63-T66 VanDerWaalsContact CG1-CG2 3.45Å; V63-M75 HydrophobicContact CG2-CE 3.95Å; V63-M75 HydrophobicContact CG2-SD 4.41Å; V63-L81 HydrophobicContact CB-CD1 4.22Å; V63-L81 HydrophobicContact CG2-CD1 3.93Å; V63-L82 PolarHBondContact N-O 3.21Å; V63-L82 VanDerWaalsContact O-O 3.11Å; V63-H83 CarbonylContact O-C 3.49Å; V63-H83 VanDerWaalsContact O-CA 3.22Å; V63-H83 WeakPolarHBondContact O-CA 3.34Å; V63-T84 PolarHBondContact O-N 2.94Å; V63-A270 CarbonylContact C-O 3.58Å; V63-T272 WeakPolarHBondContact CG1-OG1 3.33Å; V63-P283 HydrophobicContact CG2-CB 3.83Å; V63-P283 HydrophobicContact CG2-CG 4.05Å
64	S	98.9	Very high	98.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-162.8	161.7	178.1	-162.8	0	0	0	0	109.3	T66 T84 G251 A270 T272	S64-T66 VanDerWaalsContact C-N 3.28Å; S64-T66 PolarHBondContact O-N 2.66Å; S64-T84 WeakPolarHBondContact CB-OG1 3.37Å; S64-T84 PolarHBondContact OG-O 3.03Å; S64-T84 PolarHBondContact OG-OG1 2.84Å; S64-G251 WeakPolarHBondContact OG-CA 3.38Å; S64-A270 WeakPolarHBondContact CB-O 3.19Å; S64-A270 PolarHBondContact N-O 2.97Å; S64-T272 PolarHBondContact N-OG1 3.47Å; S64-T272 WeakPolarHBondContact O-CB 3.17Å; S64-T272 PolarHBondContact O-N 3.26Å; S64-T272 PolarHBondContact O-OG1 3.3Å
65	D	98.8	Very high	98.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	21%	0.211	C	C	.	.			trans	55.9	46	167.5	-45.7	-84.4	0	0	0	111.7	H67 G85 D86 H213 G251 G252 H254 S271 C273	D65-H67 PolarHBondContact O-CD2 3.18Å; D65-H67 VanDerWaalsContact O-CD2 3.32Å; D65-G85 PolarHBondContact N-O 3.31Å; D65-D86 CarbonylContact C-O 3.57Å; D65-D86 WeakPolarHBondContact CA-O 3.36Å; D65-D86 HydrophobicContact CB-CB 4.37Å; D65-H213 IonicContact OD1-CE1 2.79Å; D65-H213 PolarHBondContact OD1-CE1 3.04Å; D65-G251 VanDerWaalsContact OD2-CA 3.27Å; D65-G251 WeakPolarHBondContact OD2-CA 3.23Å; D65-G252 VanDerWaalsContact CG-N 3.31Å; D65-G252 VanDerWaalsContact OD1-CA 3.23Å; D65-G252 WeakPolarHBondContact OD1-CA 3.41Å; D65-G252 PolarHBondContact OD1-N 3.18Å; D65-G252 PolarHBondContact OD2-N 3.25Å; D65-H254 WeakPolarHBondContact CB-NE2 3.25Å; D65-H254 IonicContact OD1-NE2 2.82Å; D65-S271 WeakPolarHBondContact OD2-CA 3.38Å; D65-S271 PolarHBondContact OD2-OG 2.66Å; D65-C273 WeakPolarHBondContact O-CB 3.15Å; D65-C273 PolarHBondContact O-N 2.85Å; D65-C273 PolarHBondContact O-SG 3.39Å
66	T	98.8	Very high	98.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.176	C	C	.	.			trans	-81.1	-20.9	178.1	53.8	0	0	0	0	111.7	V63 S64 S68 R69 T70 I73 H83 D86 T272	V63-T66 HydrophobicContact CG1-CG2 3.45Å; V63-T66 VanDerWaalsContact CG1-CG2 3.45Å; S64-T66 VanDerWaalsContact C-N 3.28Å; S64-T66 PolarHBondContact O-N 2.66Å; T66-S68 VanDerWaalsContact C-N 3.34Å; T66-S68 PolarHBondContact O-N 3.36Å; T66-R69 WeakPolarHBondContact O-CA 3.23Å; T66-R69 WeakPolarHBondContact O-CB 3.29Å; T66-R69 PolarHBondContact O-N 3.02Å; T66-T70 HydrophobicContact CG2-CG2 4.41Å; T66-I73 HydrophobicContact CG2-CD1 3.97Å; T66-H83 VanDerWaalsContact CG2-NE2 3.32Å; T66-H83 WeakPolarHBondContact CG2-NE2 3.49Å; T66-H83 PolarHBondContact OG1-NE2 3.19Å; T66-D86 PolarHBondContact N-O 3Å; T66-T272 HydrophobicContact CG2-CG2 4.32Å
67	H	98.6	Very high	98.3	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.009	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.6	52.3	173.5	-61.9	-75.2	0	0	0	113.4	D65 R69 D86 T88 E89 H118 H254	D65-H67 PolarHBondContact O-CD2 3.18Å; D65-H67 VanDerWaalsContact O-CD2 3.32Å; H67-R69 VanDerWaalsContact O-CG 3.25Å; H67-R69 WeakPolarHBondContact O-CG 3.45Å; H67-R69 PolarHBondContact O-N 3.14Å; H67-D86 IonicContact CE1-OD2 3.5Å; H67-D86 PolarHBondContact CE1-OD2 2.85Å; H67-D86 PolarHBondContact N-O 2.97Å; H67-T88 PolarHBondContact ND1-O 2.75Å; H67-E89 HydrophobicContact CB-CG 4.35Å; H67-H118 AromaticContact CE1-CD2 3.47Å; H67-H118 PolarHBondContact CE1-CD2 3.45Å; H67-H118 VanDerWaalsContact CE1-CD2 3.47Å; H67-H118 AromaticContact CE1-CE1 3.9Å; H67-H118 AromaticContact CE1-CG 3.8Å; H67-H118 AromaticContact CE1-NE2 3.58Å; H67-H118 AromaticContact ND1-CD2 3.89Å; H67-H118 AromaticContact ND1-CE1 3.95Å; H67-H118 AromaticContact ND1-CG 3.74Å; H67-H118 AromaticContact ND1-ND1 3.78Å; H67-H254 AromaticContact NE2-CE1 3.58Å; H67-H254 AromaticContact NE2-NE2 3.59Å
68	S	98.5	Very high	98.3	Very high	17 Å²	17	31.3 Å²	31.3	12%	0.119	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	8.9	-176.9	-63.2	0	0	0	0	116	T66 F87 T88 E95 K98	T66-S68 VanDerWaalsContact C-N 3.34Å; T66-S68 PolarHBondContact O-N 3.36Å; S68-F87 PolarHBondContact N-O 2.94Å; S68-T88 WeakPolarHBondContact OG-CA 3.37Å; S68-E95 PolarHBondContact OG-OE1 2.85Å; S68-K98 PolarHBondContact O-NZ 2.98Å
69	R	98.4	Very high	98.3	Very high	74 Å²	74	32.2 Å²	32.2	28%	0.279	17%	0.171	S	C	.	.			trans	-105.9	46.1	-174.4	-56.7	-92.9	-71.4	-69.6	-2.3	112.2	T66 H67 D71 F277 P279	T66-R69 WeakPolarHBondContact O-CA 3.23Å; T66-R69 WeakPolarHBondContact O-CB 3.29Å; T66-R69 PolarHBondContact O-N 3.02Å; H67-R69 VanDerWaalsContact O-CG 3.25Å; H67-R69 WeakPolarHBondContact O-CG 3.45Å; H67-R69 PolarHBondContact O-N 3.14Å; R69-D71 VanDerWaalsContact C-N 3.34Å; R69-F277 PolarHBondContact NH1-O 3.44Å; R69-F277 PolarHBondContact NH2-O 2.97Å; R69-P279 HydrophobicContact CB-CB 4.32Å; R69-P279 HydrophobicContact CB-CG 3.96Å
70	T	98.5	Very high	98.3	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.018	17%	0.17	C	C	.	.			trans	-78.8	-17.8	-179.9	51.5	0	0	0	0	114.1	T66 G72 I73 F99 W102	T66-T70 HydrophobicContact CG2-CG2 4.41Å; T70-G72 PolarHBondContact O-N 3.2Å; T70-I73 PolarHBondContact O-N 2.93Å; T70-F99 HydrophobicContact CG2-CD2 4.1Å; T70-F99 HydrophobicContact CG2-CE2 4.48Å; T70-W102 HydrophobicContact CG2-CD2 3.63Å; T70-W102 HydrophobicContact CG2-CE3 3.75Å; T70-W102 HydrophobicContact CG2-CG 4.02Å; T70-W102 HydrophobicContact CG2-CH2 4.37Å; T70-W102 HydrophobicContact CG2-CZ2 4.26Å; T70-W102 HydrophobicContact CG2-CZ3 4.13Å
71	D	96.8	Very high	98.3	Very high	116 Å²	116	32.1 Å²	32.1	62%	0.62	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	120.7	-179.9	-58.3	-38.7	0	0	0	110.5	R69 K98	R69-D71 VanDerWaalsContact C-N 3.34Å; D71-K98 WeakPolarHBondContact OD2-CE 3.37Å; D71-K98 IonicContact OD2-NZ 3.75Å; D71-K98 PolarHBondContact OD2-NZ 3.41Å
72	G	94.3	Very high	98.3	Very high	65 Å²	65	32.1 Å²	32.1	67%	0.67	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.2	-5.8	176.9	0	0	0	0	0	115.9	T70 Q74	T70-G72 PolarHBondContact O-N 3.2Å; G72-Q74 PolarHBondContact O-N 3.43Å; G72-Q74 PolarHBondContact O-NE2 2.89Å
73	I	97.9	Very high	98.3	Very high	21 Å²	21	32.1 Å²	32.1	11%	0.108	17%	0.17	C	C	.	.			trans	-61.2	120.8	172.6	-57.6	179	0	0	0	108.9	T66 T70 M75 T272 P279 P283	T66-I73 HydrophobicContact CG2-CD1 3.97Å; T70-I73 PolarHBondContact O-N 2.93Å; I73-M75 HydrophobicContact CB-SD 4.42Å; I73-M75 HydrophobicContact CG2-CG 4.24Å; I73-M75 HydrophobicContact CG2-SD 3.52Å; I73-M75 VanDerWaalsContact CG2-SD 3.52Å; I73-M75 PolarHBondContact O-N 3.19Å; I73-T272 HydrophobicContact CD1-CG2 4Å; I73-P279 HydrophobicContact CD1-CB 4.34Å; I73-P279 HydrophobicContact CG1-CB 4.33Å; I73-P283 HydrophobicContact CG2-CG 4.02Å
74	Q	97.9	Very high	98.3	Very high	153 Å²	153	32.1 Å²	32.1	72%	0.715	17%	0.17	S	C	*	.			trans	-80.4	100.8	176.1	-62.1	-56.5	-54.9	0	0	109.4	G72	G72-Q74 PolarHBondContact O-N 3.43Å; G72-Q74 PolarHBondContact O-NE2 2.89Å
75	M	98.6	Very high	98.3	Very high	41 Å²	41	32.1 Å²	32.1	20%	0.202	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-84.9	126	-175.5	-68.5	-57.4	-69.3	0	0	111.3	V61 V63 I73 L81 W102 L106 Y108 P283	V61-M75 HydrophobicContact CG1-CE 3.96Å; V63-M75 HydrophobicContact CG2-CE 3.95Å; V63-M75 HydrophobicContact CG2-SD 4.41Å; I73-M75 HydrophobicContact CB-SD 4.42Å; I73-M75 HydrophobicContact CG2-CG 4.24Å; I73-M75 HydrophobicContact CG2-SD 3.52Å; I73-M75 VanDerWaalsContact CG2-SD 3.52Å; I73-M75 PolarHBondContact O-N 3.19Å; M75-L81 HydrophobicContact CE-CD1 3.82Å; M75-W102 HydrophobicContact CE-CH2 4.02Å; M75-W102 HydrophobicContact CE-CZ2 4.12Å; M75-W102 HydrophobicContact CG-CZ2 3.84Å; M75-W102 HydrophobicContact SD-CH2 4.11Å; M75-W102 HydrophobicContact SD-CZ2 3.71Å; M75-L106 HydrophobicContact CB-CD2 4.07Å; M75-L106 HydrophobicContact CE-CD1 4.36Å; M75-L106 HydrophobicContact CG-CD2 3.78Å; M75-Y108 WeakPolarHBondContact CB-OH 3.45Å; M75-Y108 HydrophobicContact CE-CE2 3.78Å; M75-P283 HydrophobicContact SD-CG 3.77Å
76	P	98.6	Very high	98.3	Very high	10 Å²	10	32.2 Å²	32.2	7%	0.065	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-78.8	168	-175.4	32.7	-37.1	0	0	0	112.8	Y49 V61 Y108 P283 I285	Y49-P76 HydrophobicContact CD1-CB 3.53Å; Y49-P76 HydrophobicContact CD1-CG 4.11Å; Y49-P76 HydrophobicContact CD2-CB 3.77Å; Y49-P76 HydrophobicContact CE1-CB 3.72Å; Y49-P76 HydrophobicContact CE1-CG 3.82Å; Y49-P76 HydrophobicContact CE2-CB 3.93Å; Y49-P76 HydrophobicContact CE2-CG 4.42Å; Y49-P76 HydrophobicContact CG-CB 3.54Å; V61-P76 HydrophobicContact CG1-CG 3.76Å; V61-P76 HydrophobicContact CG2-CG 4.23Å; P76-Y108 VanDerWaalsContact O-CE1 3.32Å; P76-Y108 WeakPolarHBondContact O-CE1 3.45Å; P76-Y108 PolarHBondContact O-OH 3.16Å; P76-P283 HydrophobicContact CG-CB 4.08Å; P76-I285 HydrophobicContact CB-CG2 4.02Å; P76-I285 HydrophobicContact CG-CG2 3.56Å
77	Y	98.4	Very high	98.3	Very high	140 Å²	140	32.2 Å²	32.2	55%	0.549	17%	0.171	S	C	.	.	S	Bend	trans	-61.7	136.7	166.3	171.1	-100.5	0	0	0	110.9	K53 R59	K53-Y77 PolarHBondContact NZ-OH 2.77Å; R59-Y77 VanDerWaalsContact CD-O 3.24Å; R59-Y77 WeakPolarHBondContact CD-O 3.46Å
78	G	98.5	Very high	98.3	Very high	9 Å²	9	32.1 Å²	32.1	9%	0.093	17%	0.17	C	C	.	.			trans	-174.6	178.8	175.1	0	0	0	0	0	110.9	Y108	G78-Y108 WeakPolarHBondContact O-CD1 3.48Å
79	D	98.8	Very high	98.3	Very high	23 Å²	23	34.4 Å²	34.4	12%	0.123	18%	0.179	C	C	.	.	S	Bend	trans	-104.5	-43.2	-176.9	-54.8	-57.7	0	0	0	112	K53 T58 R59 E109	K53-D79 WeakPolarHBondContact CD-OD2 3.29Å; K53-D79 IonicContact NZ-OD1 3.31Å; K53-D79 PolarHBondContact NZ-OD1 3.36Å; K53-D79 IonicContact NZ-OD2 3.35Å; K53-D79 PolarHBondContact NZ-OD2 3.14Å; T58-D79 WeakPolarHBondContact CA-OD2 3.38Å; T58-D79 HydrophobicContact CG2-CB 3.89Å; R59-D79 PolarHBondContact N-OD2 2.86Å; R59-D79 PolarHBondContact O-N 3.08Å; D79-E109 PolarHBondContact O-N 3.09Å
80	I	98.9	Very high	98.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.2	-176	-58.9	179.5	0	0	0	109.9	T58 R59 F60 V61 L82 Y110 I112 V169 K170	T58-I80 HydrophobicContact CG2-CD1 4.02Å; T58-I80 HydrophobicContact CG2-CG1 4.25Å; R59-I80 PolarHBondContact O-N 2.82Å; F60-I80 CarbonylContact C-O 3.57Å; F60-I80 WeakPolarHBondContact CA-O 3.36Å; F60-I80 HydrophobicContact CD1-CB 3.88Å; F60-I80 HydrophobicContact CD1-CG2 4.08Å; F60-I80 HydrophobicContact CE1-CB 3.96Å; F60-I80 HydrophobicContact CE1-CD1 3.87Å; F60-I80 HydrophobicContact CE1-CG1 4.41Å; F60-I80 HydrophobicContact CE1-CG2 4.13Å; F60-I80 HydrophobicContact CZ-CD1 4.32Å; V61-I80 PolarHBondContact N-O 3.28Å; I80-L82 HydrophobicContact CG2-CD2 4Å; I80-Y110 WeakPolarHBondContact CA-O 3.35Å; I80-Y110 HydrophobicContact CD1-CD2 4.19Å; I80-Y110 HydrophobicContact CG1-CD2 4.15Å; I80-I112 HydrophobicContact CG2-CG1 4.02Å; I80-V169 HydrophobicContact CD1-CB 4.46Å; I80-V169 HydrophobicContact CD1-CG2 3.78Å; I80-K170 HydrophobicContact CD1-CD 3.95Å; I80-K170 HydrophobicContact CD1-CG 4.29Å; I80-K170 HydrophobicContact CG1-CD 4.45Å
81	L	98.9	Very high	98.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	133.8	170	176.1	67.5	0	0	0	110	V61 V63 M75 W102 L103 L106 Y108 Y110 K111 I112	V61-L81 HydrophobicContact CB-CD1 4.21Å; V61-L81 HydrophobicContact CG1-CD1 4.15Å; V61-L81 CarbonylContact O-C 3.19Å; V61-L81 WeakPolarHBondContact O-CA 3.3Å; V61-L81 WeakPolarHBondContact O-CD1 3.45Å; V63-L81 HydrophobicContact CB-CD1 4.22Å; V63-L81 HydrophobicContact CG2-CD1 3.93Å; M75-L81 HydrophobicContact CE-CD1 3.82Å; L81-W102 HydrophobicContact CD2-CH2 4.44Å; L81-W102 HydrophobicContact CD2-CZ3 4.29Å; L81-L103 HydrophobicContact CD2-CD2 3.54Å; L81-L106 HydrophobicContact CD2-CD1 3.86Å; L81-Y108 HydrophobicContact CB-CD2 3.65Å; L81-Y108 HydrophobicContact CB-CE2 4.16Å; L81-Y108 HydrophobicContact CB-CG 4.19Å; L81-Y108 HydrophobicContact CD1-CE2 4.42Å; L81-Y108 HydrophobicContact CD2-CD2 4.26Å; L81-Y108 HydrophobicContact CD2-CE2 4.44Å; L81-Y108 HydrophobicContact CG-CD2 4.43Å; L81-Y110 PolarHBondContact N-O 2.88Å; L81-K111 HydrophobicContact CB-CB 4.33Å; L81-K111 HydrophobicContact CB-CG 4.06Å; L81-K111 HydrophobicContact CD2-CB 4.3Å; L81-K111 HydrophobicContact CD2-CG 3.99Å; L81-I112 PolarHBondContact O-N 3.17Å
82	L	98.9	Very high	98.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.2	169	-53	179.5	0	0	0	107.9	F60 V61 V63 I80 I112 I174 I209 M211 L247 V249	F60-L82 HydrophobicContact CB-CD1 4.15Å; F60-L82 HydrophobicContact CD1-CD1 3.8Å; F60-L82 HydrophobicContact CD1-CD2 4.13Å; F60-L82 HydrophobicContact CD1-CG 3.99Å; F60-L82 HydrophobicContact CG-CD1 4.26Å; V61-L82 PolarHBondContact O-N 2.63Å; V63-L82 PolarHBondContact N-O 3.21Å; V63-L82 VanDerWaalsContact O-O 3.11Å; I80-L82 HydrophobicContact CG2-CD2 4Å; L82-I112 HydrophobicContact CD2-CB 3.95Å; L82-I112 HydrophobicContact CD2-CG1 3.93Å; L82-I174 HydrophobicContact CD2-CD1 4.3Å; L82-I209 HydrophobicContact CD1-CG2 3.95Å; L82-M211 HydrophobicContact CB-CE 4.07Å; L82-M211 HydrophobicContact CB-SD 4.28Å; L82-M211 HydrophobicContact CD2-SD 3.89Å; L82-L247 HydrophobicContact CD1-CD2 4.31Å; L82-V249 HydrophobicContact CD1-CG2 3.89Å
83	H	98.9	Very high	98.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114.5	174.4	-162.4	-63.7	0	0	0	110.9	V63 T66 G85 F99 I112 V113 I114 M211	V63-H83 CarbonylContact O-C 3.49Å; V63-H83 VanDerWaalsContact O-CA 3.22Å; V63-H83 WeakPolarHBondContact O-CA 3.34Å; T66-H83 VanDerWaalsContact CG2-NE2 3.32Å; T66-H83 WeakPolarHBondContact CG2-NE2 3.49Å; T66-H83 PolarHBondContact OG1-NE2 3.19Å; H83-G85 PolarHBondContact CE1-O 3.1Å; H83-G85 PolarHBondContact ND1-O 3.22Å; H83-G85 PolarHBondContact O-N 2.92Å; H83-F99 HydrophobicContact CB-CZ 4.34Å; H83-F99 AromaticContact CD2-CE2 3.66Å; H83-F99 AromaticContact CD2-CZ 3.63Å; H83-F99 AromaticContact CG-CZ 3.86Å; H83-F99 AromaticContact NE2-CE2 3.75Å; H83-I112 PolarHBondContact N-O 2.77Å; H83-V113 HydrophobicContact CB-CG2 4.17Å; H83-I114 PolarHBondContact O-N 3.11Å; H83-I114 VanDerWaalsContact O-N 3.11Å; H83-M211 WeakPolarHBondContact O-CE 3.43Å
84	T	98.9	Very high	98.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	45	-171	52.8	0	0	0	0	115.3	V63 S64 I114 M211 H213 V249 F250	V63-T84 PolarHBondContact O-N 2.94Å; S64-T84 WeakPolarHBondContact CB-OG1 3.37Å; S64-T84 PolarHBondContact OG-O 3.03Å; S64-T84 PolarHBondContact OG-OG1 2.84Å; T84-I114 HydrophobicContact CG2-CD1 4.43Å; T84-M211 HydrophobicContact CG2-CB 4.16Å; T84-M211 HydrophobicContact CG2-CE 3.87Å; T84-M211 HydrophobicContact CG2-CG 4.23Å; T84-H213 WeakPolarHBondContact O-CA 3.35Å; T84-H213 PolarHBondContact O-ND1 2.81Å; T84-V249 HydrophobicContact CG2-CB 3.92Å; T84-V249 HydrophobicContact CG2-CG1 3.72Å; T84-F250 VanDerWaalsContact OG1-C 3.23Å; T84-F250 PolarHBondContact OG1-O 3.18Å
85	G	98.8	Very high	98.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	89.7	175.4	175.3	0	0	0	0	0	115.1	D65 H83 F87 I114 A115	D65-G85 PolarHBondContact N-O 3.31Å; H83-G85 PolarHBondContact CE1-O 3.1Å; H83-G85 PolarHBondContact ND1-O 3.22Å; H83-G85 PolarHBondContact O-N 2.92Å; G85-F87 VanDerWaalsContact C-N 3.31Å; G85-F87 PolarHBondContact O-N 3.13Å; G85-I114 WeakPolarHBondContact CA-O 3.35Å; G85-I114 PolarHBondContact N-O 3.09Å; G85-A115 VanDerWaalsContact CA-C 3.47Å
86	D	98.8	Very high	98.5	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.016	12%	0.116	C	C	.	.			trans	53	49	-175.7	-76.6	5.9	0	0	0	111.8	D65 T66 H67 T88 G116 N117 H118 E119 H213	D65-D86 CarbonylContact C-O 3.57Å; D65-D86 WeakPolarHBondContact CA-O 3.36Å; D65-D86 HydrophobicContact CB-CB 4.37Å; T66-D86 PolarHBondContact N-O 3Å; H67-D86 IonicContact CE1-OD2 3.5Å; H67-D86 PolarHBondContact CE1-OD2 2.85Å; H67-D86 PolarHBondContact N-O 2.97Å; D86-T88 VanDerWaalsContact C-N 3.29Å; D86-G116 WeakPolarHBondContact OD1-CA 3.45Å; D86-N117 PolarHBondContact OD1-N 3.25Å; D86-H118 HydrophobicContact CB-CB 4.45Å; D86-H118 WeakPolarHBondContact OD1-CB 3.5Å; D86-H118 IonicContact OD1-CD2 2.8Å; D86-H118 IonicContact OD1-CG 3.39Å; D86-H118 PolarHBondContact OD1-N 2.8Å; D86-H118 IonicContact OD2-CD2 2.75Å; D86-H118 PolarHBondContact OD2-CD2 2.78Å; D86-H118 IonicContact OD2-CG 3.13Å; D86-E119 WeakPolarHBondContact CA-OE2 3.36Å; D86-E119 PolarHBondContact N-OE2 3.29Å; D86-H213 IonicContact OD1-CE1 3.64Å; D86-H213 IonicContact OD1-NE2 2.66Å; D86-H213 IonicContact OD2-CE1 2.95Å; D86-H213 PolarHBondContact OD2-CE1 2.91Å; D86-H213 IonicContact OD2-NE2 3.32Å; D86-H213 PolarHBondContact OD2-NE2 3.03Å
87	F	98.9	Very high	98.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.136	C	C	.	.			trans	-82.8	-11	174.2	53.3	-95.3	0	0	0	112.7	S68 G85 V96 F99 V113 I114 E119 F122 L156	S68-F87 PolarHBondContact N-O 2.94Å; G85-F87 VanDerWaalsContact C-N 3.31Å; G85-F87 PolarHBondContact O-N 3.13Å; F87-V96 HydrophobicContact CE2-CG1 4.45Å; F87-V96 HydrophobicContact CE2-CG2 4.31Å; F87-F99 HydrophobicContact CB-CD1 3.82Å; F87-F99 HydrophobicContact CB-CD2 3.65Å; F87-F99 HydrophobicContact CB-CE1 3.68Å; F87-F99 HydrophobicContact CB-CE2 3.53Å; F87-F99 HydrophobicContact CB-CG 3.79Å; F87-F99 HydrophobicContact CB-CZ 3.54Å; F87-F99 HydrophobicContact CD1-CE1 4.1Å; F87-F99 HydrophobicContact CD1-CZ 4.48Å; F87-F99 HydrophobicContact CD2-CB 4.18Å; F87-F99 AromaticContact CD2-CD1 3.37Å; F87-F99 HydrophobicContact CD2-CD1 3.37Å; F87-F99 AromaticContact CD2-CE1 3.78Å; F87-F99 HydrophobicContact CD2-CE1 3.78Å; F87-F99 AromaticContact CD2-CG 3.78Å; F87-F99 HydrophobicContact CD2-CG 3.78Å; F87-F99 HydrophobicContact CE2-CD1 4.05Å; F87-F99 HydrophobicContact CE2-CE1 4.45Å; F87-F99 AromaticContact CG-CD1 3.67Å; F87-F99 HydrophobicContact CG-CD1 3.67Å; F87-F99 HydrophobicContact CG-CD2 4.42Å; F87-F99 AromaticContact CG-CE1 3.59Å; F87-F99 HydrophobicContact CG-CE1 3.59Å; F87-F99 HydrophobicContact CG-CE2 4.37Å; F87-F99 HydrophobicContact CG-CG 4.08Å; F87-F99 AromaticContact CG-CZ 3.97Å; F87-F99 HydrophobicContact CG-CZ 3.97Å; F87-V113 HydrophobicContact CD1-CG1 3.73Å; F87-V113 HydrophobicContact CE1-CG1 3.56Å; F87-V113 HydrophobicContact CZ-CG1 4.37Å; F87-I114 WeakPolarHBondContact CE1-O 3.42Å; F87-E119 HydrophobicContact CD1-CG 4.26Å; F87-E119 HydrophobicContact CD2-CG 4.41Å; F87-E119 HydrophobicContact CE1-CG 3.65Å; F87-E119 HydrophobicContact CE2-CG 3.8Å; F87-E119 HydrophobicContact CZ-CG 3.38Å; F87-E119 PolarHBondContact N-OE1 2.68Å; F87-F122 HydrophobicContact CE2-CE2 4.43Å; F87-F122 HydrophobicContact CE2-CZ 4.16Å; F87-F122 HydrophobicContact CZ-CE1 4.15Å; F87-F122 HydrophobicContact CZ-CE2 4.19Å; F87-F122 AromaticContact CZ-CZ 3.74Å; F87-F122 HydrophobicContact CZ-CZ 3.74Å; F87-L156 HydrophobicContact CE2-CD1 4.42Å; F87-L156 HydrophobicContact CE2-CD2 4.22Å; F87-L156 HydrophobicContact CZ-CD1 3.97Å
88	T	98.8	Very high	98.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-123.3	172.1	174.3	66	0	0	0	0	112	H67 S68 D86 G91 E95 V96 H118 E119	H67-T88 PolarHBondContact ND1-O 2.75Å; S68-T88 WeakPolarHBondContact OG-CA 3.37Å; D86-T88 VanDerWaalsContact C-N 3.29Å; T88-G91 WeakPolarHBondContact OG1-CA 3.06Å; T88-G91 PolarHBondContact OG1-N 2.95Å; T88-E95 HydrophobicContact CG2-CB 3.56Å; T88-V96 HydrophobicContact CG2-CG2 3.96Å; T88-H118 VanDerWaalsContact O-CB 3.24Å; T88-H118 WeakPolarHBondContact O-CB 3.13Å; T88-E119 WeakPolarHBondContact CB-OE1 3.32Å; T88-E119 PolarHBondContact N-OE1 2.88Å; T88-E119 PolarHBondContact OG1-OE1 2.84Å
89	E	97.7	Very high	98.6	Very high	65 Å²	65	23.5 Å²	23.5	30%	0.304	12%	0.122	S	C	.	.	S	Bend	trans	-89.2	-33.6	170.9	-65.9	-81.3	-166.9	0	0	112	H67 E95 H118	H67-E89 HydrophobicContact CB-CG 4.35Å; E89-E95 VanDerWaalsContact CB-OE1 3.29Å; E89-E95 WeakPolarHBondContact CB-OE1 3.12Å; E89-E95 PolarHBondContact N-OE1 3.39Å; E89-H118 PolarHBondContact O-ND1 2.86Å
90	L	97.6	Very high	98.6	Very high	36 Å²	36	22.8 Å²	22.8	19%	0.188	12%	0.118	C	C	.	.	S	Bend	trans	-142.6	6.5	-175.2	-68	175.7	0	0	0	113.6	L92 E95 H118 L120 F138 V141 W186	L90-L92 VanDerWaalsContact C-N 3.3Å; L90-L92 HydrophobicContact CB-CG 4.16Å; L90-L92 PolarHBondContact O-N 3.41Å; L90-E95 PolarHBondContact N-OE2 2.94Å; L90-H118 CarbonylContact C-O 2.99Å; L90-H118 VanDerWaalsContact CA-O 3.23Å; L90-H118 WeakPolarHBondContact CA-O 3.32Å; L90-L120 HydrophobicContact CD2-CD1 3.99Å; L90-F138 HydrophobicContact CD2-CD1 3.68Å; L90-F138 HydrophobicContact CD2-CE1 3.97Å; L90-V141 HydrophobicContact CB-CG2 3.83Å; L90-V141 HydrophobicContact CD1-CG2 4.35Å; L90-V141 HydrophobicContact CD2-CG2 4.49Å; L90-V141 HydrophobicContact CG-CG2 4.46Å; L90-W186 HydrophobicContact CD2-CH2 4.37Å; L90-W186 HydrophobicContact CD2-CZ3 4.05Å
91	G	98.1	Very high	98.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.136	C	C	.	.			trans	71.6	20.4	-175.1	0	0	0	0	0	113.6	T88 H118 T121	T88-G91 WeakPolarHBondContact OG1-CA 3.06Å; T88-G91 PolarHBondContact OG1-N 2.95Å; G91-H118 PolarHBondContact N-O 2.8Å; G91-T121 WeakPolarHBondContact O-CB 3.32Å; G91-T121 WeakPolarHBondContact O-CG2 3.42Å; G91-T121 PolarHBondContact O-OG1 2.98Å
92	L	98.1	Very high	98.6	Very high	34 Å²	34	27.5 Å²	27.5	18%	0.178	14%	0.141	C	C	.	.			trans	-64.1	139.6	-178.8	-59	177.5	0	0	0	110.1	L90 S94 E95 V96 V141 L144	L90-L92 VanDerWaalsContact C-N 3.3Å; L90-L92 HydrophobicContact CB-CG 4.16Å; L90-L92 PolarHBondContact O-N 3.41Å; L92-S94 PolarHBondContact O-N 2.98Å; L92-E95 HydrophobicContact CB-CG 4.05Å; L92-E95 WeakPolarHBondContact CB-OE2 3.23Å; L92-E95 WeakPolarHBondContact CG-OE2 3.16Å; L92-E95 PolarHBondContact N-OE2 3.05Å; L92-E95 VanDerWaalsContact N-OE2 3.09Å; L92-E95 WeakPolarHBondContact O-CA 3.45Å; L92-E95 WeakPolarHBondContact O-CB 3.49Å; L92-E95 PolarHBondContact O-N 3.01Å; L92-V96 WeakPolarHBondContact O-CG2 3.44Å; L92-V96 PolarHBondContact O-N 2.85Å; L92-V141 HydrophobicContact CD2-CG2 4.07Å; L92-L144 HydrophobicContact CD2-CD1 4.13Å
93	P	98.3	Very high	98.6	Very high	30 Å²	30	27.5 Å²	27.5	20%	0.195	14%	0.141	C	C	.	.	H	α-helix	trans	-52.3	-32.6	-179.6	-30.2	36	0	0	0	114.2	K97 D148 L155	P93-K97 WeakPolarHBondContact O-CB 3.42Å; P93-K97 PolarHBondContact O-N 3.11Å; P93-D148 WeakPolarHBondContact CG-O 3.38Å; P93-L155 HydrophobicContact CB-CD1 3.88Å
94	S	98.2	Very high	98.6	Very high	87 Å²	87	29.3 Å²	29.3	61%	0.608	16%	0.159	S	C	*	.	H	α-helix	trans	-68.1	-37.1	175.3	48.5	0	0	0	0	113.4	L92 K98	L92-S94 PolarHBondContact O-N 2.98Å; S94-K98 PolarHBondContact O-N 2.96Å
95	E	98.7	Very high	98.5	Very high	27 Å²	27	36 Å²	36	13%	0.126	20%	0.195	C	C	.	.	H	α-helix	trans	-68.3	-43.9	173.8	-63.2	-177.3	98.8	0	0	110.9	S68 T88 E89 L90 L92 K97 K98 F99	S68-E95 PolarHBondContact OG-OE1 2.85Å; T88-E95 HydrophobicContact CG2-CB 3.56Å; E89-E95 VanDerWaalsContact CB-OE1 3.29Å; E89-E95 WeakPolarHBondContact CB-OE1 3.12Å; E89-E95 PolarHBondContact N-OE1 3.39Å; L90-E95 PolarHBondContact N-OE2 2.94Å; L92-E95 HydrophobicContact CB-CG 4.05Å; L92-E95 WeakPolarHBondContact CB-OE2 3.23Å; L92-E95 WeakPolarHBondContact CG-OE2 3.16Å; L92-E95 PolarHBondContact N-OE2 3.05Å; L92-E95 VanDerWaalsContact N-OE2 3.09Å; L92-E95 WeakPolarHBondContact O-CA 3.45Å; L92-E95 WeakPolarHBondContact O-CB 3.49Å; L92-E95 PolarHBondContact O-N 3.01Å; E95-K97 VanDerWaalsContact C-N 3.29Å; E95-K97 PolarHBondContact O-N 3.3Å; E95-K98 WeakPolarHBondContact O-CB 3.47Å; E95-K98 PolarHBondContact O-N 3Å; E95-K98 VanDerWaalsContact O-N 3.14Å; E95-F99 WeakPolarHBondContact O-CB 3.36Å; E95-F99 PolarHBondContact O-N 3.28Å
96	V	98.8	Very high	98.5	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-42.9	176.2	-176.8	0	0	0	0	110.4	F87 T88 L92 F99 N100 F122 V152 L155 L156	F87-V96 HydrophobicContact CE2-CG1 4.45Å; F87-V96 HydrophobicContact CE2-CG2 4.31Å; T88-V96 HydrophobicContact CG2-CG2 3.96Å; L92-V96 WeakPolarHBondContact O-CG2 3.44Å; L92-V96 PolarHBondContact O-N 2.85Å; V96-F99 PolarHBondContact O-N 2.97Å; V96-N100 WeakPolarHBondContact O-CB 3.43Å; V96-N100 PolarHBondContact O-N 2.92Å; V96-F122 HydrophobicContact CG1-CZ 4.11Å; V96-F122 HydrophobicContact CG2-CE2 3.72Å; V96-F122 HydrophobicContact CG2-CZ 4.12Å; V96-V152 HydrophobicContact CB-CG2 4.38Å; V96-V152 HydrophobicContact CG1-CG2 4.47Å; V96-V152 HydrophobicContact CG2-CG2 3.81Å; V96-L155 HydrophobicContact CB-CD1 4.3Å; V96-L155 HydrophobicContact CG1-CB 3.78Å; V96-L155 HydrophobicContact CG1-CD1 4.34Å; V96-L156 HydrophobicContact CG1-CD2 3.66Å; V96-L156 HydrophobicContact CG1-CG 3.82Å
97	K	98.6	Very high	98.5	Very high	109 Å²	109	42.4 Å²	42.4	47%	0.474	24%	0.236	S	C	.	.	H	α-helix	trans	-62.3	-47	173.9	-170.9	-168.6	180	-50.5	0	111.7	P93 E95 F99 N100 D101	P93-K97 WeakPolarHBondContact O-CB 3.42Å; P93-K97 PolarHBondContact O-N 3.11Å; E95-K97 VanDerWaalsContact C-N 3.29Å; E95-K97 PolarHBondContact O-N 3.3Å; K97-F99 VanDerWaalsContact C-N 3.31Å; K97-F99 PolarHBondContact O-N 3.5Å; K97-N100 PolarHBondContact O-N 2.99Å; K97-D101 IonicContact NZ-OD1 3.36Å; K97-D101 PolarHBondContact NZ-OD1 2.76Å; K97-D101 IonicContact NZ-OD2 3.51Å; K97-D101 PolarHBondContact NZ-OD2 3.07Å; K97-D101 PolarHBondContact O-N 3.45Å
98	K	98.8	Very high	98.5	Very high	77 Å²	77	42.7 Å²	42.7	34%	0.335	24%	0.237	S	C	.	.	H	α-helix	trans	-57.4	-45.9	177.8	-178.5	-172.1	177.1	-172.3	0	111	S68 D71 S94 E95 D101 W102	S68-K98 PolarHBondContact O-NZ 2.98Å; D71-K98 WeakPolarHBondContact OD2-CE 3.37Å; D71-K98 IonicContact OD2-NZ 3.75Å; D71-K98 PolarHBondContact OD2-NZ 3.41Å; S94-K98 PolarHBondContact O-N 2.96Å; E95-K98 WeakPolarHBondContact O-CB 3.47Å; E95-K98 PolarHBondContact O-N 3Å; E95-K98 VanDerWaalsContact O-N 3.14Å; K98-D101 PolarHBondContact O-N 3.02Å; K98-W102 PolarHBondContact O-N 2.95Å
99	F	98.9	Very high	98.5	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.009	26%	0.26	C	S	.	.	H	α-helix	trans	-62.2	-44.7	176.9	177.3	-111.2	0	0	0	111.6	T70 H83 F87 E95 V96 K97 D101 W102 L103 V113 L156	T70-F99 HydrophobicContact CG2-CD2 4.1Å; T70-F99 HydrophobicContact CG2-CE2 4.48Å; H83-F99 HydrophobicContact CB-CZ 4.34Å; H83-F99 AromaticContact CD2-CE2 3.66Å; H83-F99 AromaticContact CD2-CZ 3.63Å; H83-F99 AromaticContact CG-CZ 3.86Å; H83-F99 AromaticContact NE2-CE2 3.75Å; F87-F99 HydrophobicContact CB-CD1 3.82Å; F87-F99 HydrophobicContact CB-CD2 3.65Å; F87-F99 HydrophobicContact CB-CE1 3.68Å; F87-F99 HydrophobicContact CB-CE2 3.53Å; F87-F99 HydrophobicContact CB-CG 3.79Å; F87-F99 HydrophobicContact CB-CZ 3.54Å; F87-F99 HydrophobicContact CD1-CE1 4.1Å; F87-F99 HydrophobicContact CD1-CZ 4.48Å; F87-F99 HydrophobicContact CD2-CB 4.18Å; F87-F99 AromaticContact CD2-CD1 3.37Å; F87-F99 HydrophobicContact CD2-CD1 3.37Å; F87-F99 AromaticContact CD2-CE1 3.78Å; F87-F99 HydrophobicContact CD2-CE1 3.78Å; F87-F99 AromaticContact CD2-CG 3.78Å; F87-F99 HydrophobicContact CD2-CG 3.78Å; F87-F99 HydrophobicContact CE2-CD1 4.05Å; F87-F99 HydrophobicContact CE2-CE1 4.45Å; F87-F99 AromaticContact CG-CD1 3.67Å; F87-F99 HydrophobicContact CG-CD1 3.67Å; F87-F99 HydrophobicContact CG-CD2 4.42Å; F87-F99 AromaticContact CG-CE1 3.59Å; F87-F99 HydrophobicContact CG-CE1 3.59Å; F87-F99 HydrophobicContact CG-CE2 4.37Å; F87-F99 HydrophobicContact CG-CG 4.08Å; F87-F99 AromaticContact CG-CZ 3.97Å; F87-F99 HydrophobicContact CG-CZ 3.97Å; E95-F99 WeakPolarHBondContact O-CB 3.36Å; E95-F99 PolarHBondContact O-N 3.28Å; V96-F99 PolarHBondContact O-N 2.97Å; K97-F99 VanDerWaalsContact C-N 3.31Å; K97-F99 PolarHBondContact O-N 3.5Å; F99-D101 PolarHBondContact O-N 2.9Å; F99-W102 AromaticContact CD2-CE3 3.96Å; F99-W102 HydrophobicContact CD2-CE3 3.96Å; F99-W102 HydrophobicContact CD2-CZ3 4.32Å; F99-W102 AromaticContact CE2-CE3 3.76Å; F99-W102 HydrophobicContact CE2-CE3 3.76Å; F99-W102 AromaticContact CE2-CZ3 3.67Å; F99-W102 HydrophobicContact CE2-CZ3 3.67Å; F99-W102 HydrophobicContact CZ-CZ3 4.42Å; F99-W102 WeakPolarHBondContact O-CB 3.33Å; F99-W102 PolarHBondContact O-N 3.16Å; F99-L103 HydrophobicContact CD1-CD1 3.99Å; F99-L103 HydrophobicContact CD1-CG 4.38Å; F99-L103 HydrophobicContact CE1-CD1 3.51Å; F99-L103 HydrophobicContact CE1-CD2 4.4Å; F99-L103 HydrophobicContact CE1-CG 4.02Å; F99-L103 HydrophobicContact CE2-CD2 4.29Å; F99-L103 HydrophobicContact CE2-CG 4.35Å; F99-L103 HydrophobicContact CZ-CD1 3.91Å; F99-L103 HydrophobicContact CZ-CD2 3.93Å; F99-L103 HydrophobicContact CZ-CG 4Å; F99-L103 WeakPolarHBondContact O-CG 3.36Å; F99-L103 PolarHBondContact O-N 2.87Å; F99-V113 HydrophobicContact CE1-CG1 4.09Å; F99-V113 HydrophobicContact CE1-CG2 4.09Å; F99-V113 HydrophobicContact CZ-CG2 4.32Å; F99-L156 HydrophobicContact CD1-CD2 3.7Å; F99-L156 HydrophobicContact CE1-CD2 4.15Å
100	N	98.9	Very high	98.5	Very high	9 Å²	9	48 Å²	48	5%	0.048	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-40.2	175.9	-174.8	63.5	0	0	0	113.1	V96 K97 W102 L103 G104 L155 L156 T157 N158	V96-N100 WeakPolarHBondContact O-CB 3.43Å; V96-N100 PolarHBondContact O-N 2.92Å; K97-N100 PolarHBondContact O-N 2.99Å; N100-W102 VanDerWaalsContact C-N 3.31Å; N100-L103 PolarHBondContact O-N 3.21Å; N100-G104 PolarHBondContact O-N 3.41Å; N100-L155 WeakPolarHBondContact CB-O 3.49Å; N100-L155 PolarHBondContact ND2-O 3.36Å; N100-L155 VanDerWaalsContact ND2-O 3.13Å; N100-L155 PolarHBondContact OD1-O 3.11Å; N100-L156 HydrophobicContact CB-CD2 4.37Å; N100-L156 WeakPolarHBondContact OD1-CA 3.46Å; N100-T157 PolarHBondContact ND2-OG1 2.85Å; N100-T157 PolarHBondContact OD1-N 2.88Å; N100-N158 PolarHBondContact ND2-ND2 3.07Å; N100-N158 PolarHBondContact O-ND2 2.7Å; N100-N158 WeakPolarHBondContact OD1-CB 3.32Å; N100-N158 PolarHBondContact OD1-N 2.8Å
101	D	98.8	Very high	98.6	Very high	69 Å²	69	47.7 Å²	47.7	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-62.8	-40.5	175.5	-65.9	-19.9	0	0	0	110.4	K97 K98 F99 G104 N105	K97-D101 IonicContact NZ-OD1 3.36Å; K97-D101 PolarHBondContact NZ-OD1 2.76Å; K97-D101 IonicContact NZ-OD2 3.51Å; K97-D101 PolarHBondContact NZ-OD2 3.07Å; K97-D101 PolarHBondContact O-N 3.45Å; K98-D101 PolarHBondContact O-N 3.02Å; F99-D101 PolarHBondContact O-N 2.9Å; D101-G104 PolarHBondContact O-N 2.92Å; D101-N105 PolarHBondContact O-N 2.92Å; D101-N105 PolarHBondContact O-ND2 2.87Å
102	W	98.8	Very high	98.6	Very high	30 Å²	30	47.7 Å²	47.7	11%	0.114	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-48	172.8	174	80.7	0	0	0	112	T70 M75 L81 K98 F99 N100 G104 N105 L106	T70-W102 HydrophobicContact CG2-CD2 3.63Å; T70-W102 HydrophobicContact CG2-CE3 3.75Å; T70-W102 HydrophobicContact CG2-CG 4.02Å; T70-W102 HydrophobicContact CG2-CH2 4.37Å; T70-W102 HydrophobicContact CG2-CZ2 4.26Å; T70-W102 HydrophobicContact CG2-CZ3 4.13Å; M75-W102 HydrophobicContact CE-CH2 4.02Å; M75-W102 HydrophobicContact CE-CZ2 4.12Å; M75-W102 HydrophobicContact CG-CZ2 3.84Å; M75-W102 HydrophobicContact SD-CH2 4.11Å; M75-W102 HydrophobicContact SD-CZ2 3.71Å; L81-W102 HydrophobicContact CD2-CH2 4.44Å; L81-W102 HydrophobicContact CD2-CZ3 4.29Å; K98-W102 PolarHBondContact O-N 2.95Å; F99-W102 AromaticContact CD2-CE3 3.96Å; F99-W102 HydrophobicContact CD2-CE3 3.96Å; F99-W102 HydrophobicContact CD2-CZ3 4.32Å; F99-W102 AromaticContact CE2-CE3 3.76Å; F99-W102 HydrophobicContact CE2-CE3 3.76Å; F99-W102 AromaticContact CE2-CZ3 3.67Å; F99-W102 HydrophobicContact CE2-CZ3 3.67Å; F99-W102 HydrophobicContact CZ-CZ3 4.42Å; F99-W102 WeakPolarHBondContact O-CB 3.33Å; F99-W102 PolarHBondContact O-N 3.16Å; N100-W102 VanDerWaalsContact C-N 3.31Å; W102-G104 PolarHBondContact O-N 2.68Å; W102-N105 PolarHBondContact O-N 3.12Å; W102-N105 VanDerWaalsContact O-N 3.1Å; W102-L106 HydrophobicContact CD2-CD1 4.07Å; W102-L106 HydrophobicContact CE3-CD1 3.97Å; W102-L106 HydrophobicContact CH2-CD1 3.64Å; W102-L106 HydrophobicContact CZ2-CD1 3.73Å; W102-L106 HydrophobicContact CZ2-CD2 4.35Å; W102-L106 HydrophobicContact CZ3-CD1 3.76Å
103	L	98.8	Very high	98.6	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-56.2	-39	176.3	-70.4	179.3	0	0	0	112.7	L81 F99 N100 N105 L106 K111 V113 N158	L81-L103 HydrophobicContact CD2-CD2 3.54Å; F99-L103 HydrophobicContact CD1-CD1 3.99Å; F99-L103 HydrophobicContact CD1-CG 4.38Å; F99-L103 HydrophobicContact CE1-CD1 3.51Å; F99-L103 HydrophobicContact CE1-CD2 4.4Å; F99-L103 HydrophobicContact CE1-CG 4.02Å; F99-L103 HydrophobicContact CE2-CD2 4.29Å; F99-L103 HydrophobicContact CE2-CG 4.35Å; F99-L103 HydrophobicContact CZ-CD1 3.91Å; F99-L103 HydrophobicContact CZ-CD2 3.93Å; F99-L103 HydrophobicContact CZ-CG 4Å; F99-L103 WeakPolarHBondContact O-CG 3.36Å; F99-L103 PolarHBondContact O-N 2.87Å; N100-L103 PolarHBondContact O-N 3.21Å; L103-N105 PolarHBondContact O-N 2.81Å; L103-L106 HydrophobicContact CD2-CD1 4.28Å; L103-L106 PolarHBondContact O-N 3.17Å; L103-L106 VanDerWaalsContact O-N 3.15Å; L103-K111 HydrophobicContact CD2-CB 4.25Å; L103-K111 HydrophobicContact CD2-CG 4.21Å; L103-K111 WeakPolarHBondContact O-CE 3.39Å; L103-V113 HydrophobicContact CD1-CG2 4.09Å; L103-N158 HydrophobicContact CB-CB 4Å
104	G	98.6	Very high	98.7	Very high	37 Å²	37	44.6 Å²	44.6	38%	0.381	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-23.9	179.9	0	0	0	0	0	114.2	N100 D101 W102 N158	N100-G104 PolarHBondContact O-N 3.41Å; D101-G104 PolarHBondContact O-N 2.92Å; W102-G104 PolarHBondContact O-N 2.68Å; G104-N158 WeakPolarHBondContact CA-ND2 3.34Å
105	N	98.4	Very high	98.7	Very high	142 Å²	142	40.5 Å²	40.5	76%	0.759	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.2	177.5	-67.3	-47.3	0	0	0	113.4	D101 W102 L103	D101-N105 PolarHBondContact O-N 2.92Å; D101-N105 PolarHBondContact O-ND2 2.87Å; W102-N105 PolarHBondContact O-N 3.12Å; W102-N105 VanDerWaalsContact O-N 3.1Å; L103-N105 PolarHBondContact O-N 2.81Å
106	L	98.7	Very high	98.7	Very high	20 Å²	20	39.2 Å²	39.2	11%	0.105	20%	0.203	C	C	.	.	S	Bend	trans	-87.1	139.2	-179.2	-58.7	174.9	0	0	0	111.4	M75 L81 W102 L103 Y108 K111	M75-L106 HydrophobicContact CB-CD2 4.07Å; M75-L106 HydrophobicContact CE-CD1 4.36Å; M75-L106 HydrophobicContact CG-CD2 3.78Å; L81-L106 HydrophobicContact CD2-CD1 3.86Å; W102-L106 HydrophobicContact CD2-CD1 4.07Å; W102-L106 HydrophobicContact CE3-CD1 3.97Å; W102-L106 HydrophobicContact CH2-CD1 3.64Å; W102-L106 HydrophobicContact CZ2-CD1 3.73Å; W102-L106 HydrophobicContact CZ2-CD2 4.35Å; W102-L106 HydrophobicContact CZ3-CD1 3.76Å; L103-L106 HydrophobicContact CD2-CD1 4.28Å; L103-L106 PolarHBondContact O-N 3.17Å; L103-L106 VanDerWaalsContact O-N 3.15Å; L106-Y108 HydrophobicContact CB-CD2 3.7Å; L106-Y108 HydrophobicContact CB-CE2 3.91Å; L106-Y108 HydrophobicContact CD1-CD2 4.16Å; L106-Y108 HydrophobicContact CD1-CE2 3.95Å; L106-Y108 HydrophobicContact CD2-CE2 4.47Å; L106-Y108 HydrophobicContact CG-CD2 4.49Å; L106-Y108 HydrophobicContact CG-CE2 4.33Å; L106-Y108 PolarHBondContact O-N 3.22Å; L106-K111 WeakPolarHBondContact O-CE 3.46Å; L106-K111 PolarHBondContact O-NZ 2.98Å
107	P	98.4	Very high	98.6	Very high	117 Å²	117	40.2 Å²	40.2	76%	0.76	21%	0.209	S	C	*	.			trans	-78.5	-1.7	-172	33.1	-37.6	0	0	0	114.4
108	Y	98.8	Very high	98.6	Very high	5 Å²	5	35.9 Å²	35.9	2%	0.02	19%	0.19	C	C	.	.			trans	-63.1	141.6	-176.3	-49	-56.2	0	0	0	111.9	V61 M75 P76 G78 L81 L106 Y110 K111	V61-Y108 HydrophobicContact CG2-CD1 4.41Å; V61-Y108 HydrophobicContact CG2-CE1 3.7Å; M75-Y108 WeakPolarHBondContact CB-OH 3.45Å; M75-Y108 HydrophobicContact CE-CE2 3.78Å; P76-Y108 VanDerWaalsContact O-CE1 3.32Å; P76-Y108 WeakPolarHBondContact O-CE1 3.45Å; P76-Y108 PolarHBondContact O-OH 3.16Å; G78-Y108 WeakPolarHBondContact O-CD1 3.48Å; L81-Y108 HydrophobicContact CB-CD2 3.65Å; L81-Y108 HydrophobicContact CB-CE2 4.16Å; L81-Y108 HydrophobicContact CB-CG 4.19Å; L81-Y108 HydrophobicContact CD1-CE2 4.42Å; L81-Y108 HydrophobicContact CD2-CD2 4.26Å; L81-Y108 HydrophobicContact CD2-CE2 4.44Å; L81-Y108 HydrophobicContact CG-CD2 4.43Å; L106-Y108 HydrophobicContact CB-CD2 3.7Å; L106-Y108 HydrophobicContact CB-CE2 3.91Å; L106-Y108 HydrophobicContact CD1-CD2 4.16Å; L106-Y108 HydrophobicContact CD1-CE2 3.95Å; L106-Y108 HydrophobicContact CD2-CE2 4.47Å; L106-Y108 HydrophobicContact CG-CD2 4.49Å; L106-Y108 HydrophobicContact CG-CE2 4.33Å; L106-Y108 PolarHBondContact O-N 3.22Å; Y108-Y110 VanDerWaalsContact C-N 3.35Å; Y108-Y110 PolarHBondContact O-N 3.05Å; Y108-K111 VanDerWaalsContact O-CE 3.23Å; Y108-K111 WeakPolarHBondContact O-CE 3.04Å; Y108-K111 PolarHBondContact O-NZ 2.8Å
109	E	97.6	Very high	98.6	Very high	103 Å²	103	32.2 Å²	32.2	48%	0.481	17%	0.174	S	C	.	.	S	Bend	trans	-64.9	-42.4	-179.1	-168.7	-175.1	161.2	0	0	110.7	D79 K170	D79-E109 PolarHBondContact O-N 3.09Å; E109-K170 IonicContact OE1-NZ 3.53Å; E109-K170 IonicContact OE2-NZ 3.34Å; E109-K170 PolarHBondContact OE2-NZ 3.37Å
110	Y	98.8	Very high	98.5	Very high	75 Å²	75	32.1 Å²	32.1	29%	0.294	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.3	175.8	-56.3	-81.5	0	0	0	110.9	I80 L81 Y108 I160 V169 K170	I80-Y110 WeakPolarHBondContact CA-O 3.35Å; I80-Y110 HydrophobicContact CD1-CD2 4.19Å; I80-Y110 HydrophobicContact CG1-CD2 4.15Å; L81-Y110 PolarHBondContact N-O 2.88Å; Y108-Y110 VanDerWaalsContact C-N 3.35Å; Y108-Y110 PolarHBondContact O-N 3.05Å; Y110-I160 HydrophobicContact CD1-CD1 3.94Å; Y110-V169 HydrophobicContact CD1-CG1 3.87Å; Y110-V169 HydrophobicContact CD2-CB 4.13Å; Y110-V169 HydrophobicContact CD2-CG1 4.34Å; Y110-V169 HydrophobicContact CE1-CG1 4.08Å; Y110-V169 HydrophobicContact CE2-CB 4.29Å; Y110-V169 HydrophobicContact CG-CB 4.27Å; Y110-V169 HydrophobicContact CG-CG1 4.02Å; Y110-K170 HydrophobicContact CD2-CG 4.48Å; Y110-K170 HydrophobicContact CE2-CD 4.47Å; Y110-K170 HydrophobicContact CE2-CG 3.99Å
111	K	98.9	Very high	98.5	Very high	28 Å²	28	31.7 Å²	31.7	12%	0.122	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	108.8	172.6	-61	85.7	167.8	-178.8	0	107.6	L81 L103 L106 Y108 S159 I160	L81-K111 HydrophobicContact CB-CB 4.33Å; L81-K111 HydrophobicContact CB-CG 4.06Å; L81-K111 HydrophobicContact CD2-CB 4.3Å; L81-K111 HydrophobicContact CD2-CG 3.99Å; L103-K111 HydrophobicContact CD2-CB 4.25Å; L103-K111 HydrophobicContact CD2-CG 4.21Å; L103-K111 WeakPolarHBondContact O-CE 3.39Å; L106-K111 WeakPolarHBondContact O-CE 3.46Å; L106-K111 PolarHBondContact O-NZ 2.98Å; Y108-K111 VanDerWaalsContact O-CE 3.23Å; Y108-K111 WeakPolarHBondContact O-CE 3.04Å; Y108-K111 PolarHBondContact O-NZ 2.8Å; K111-S159 CarbonylContact O-C 3.58Å; K111-S159 VanDerWaalsContact O-CA 3.27Å; K111-S159 WeakPolarHBondContact O-CA 3.33Å; K111-S159 WeakPolarHBondContact O-CB 3.35Å; K111-I160 PolarHBondContact O-N 2.95Å
112	I	98.9	Very high	98.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.4	-178.8	-42.7	-56.6	0	0	0	107.9	I80 L81 L82 H83 I160 L162 V167 I174 M211	I80-I112 HydrophobicContact CG2-CG1 4.02Å; L81-I112 PolarHBondContact O-N 3.17Å; L82-I112 HydrophobicContact CD2-CB 3.95Å; L82-I112 HydrophobicContact CD2-CG1 3.93Å; H83-I112 PolarHBondContact N-O 2.77Å; I112-I160 WeakPolarHBondContact CA-O 3.27Å; I112-I160 HydrophobicContact CD1-CB 3.83Å; I112-I160 HydrophobicContact CD1-CD1 3.87Å; I112-I160 HydrophobicContact CD1-CG1 4.18Å; I112-I160 HydrophobicContact CD1-CG2 4.49Å; I112-L162 HydrophobicContact CG2-CD1 3.52Å; I112-L162 HydrophobicContact CG2-CG 3.92Å; I112-V167 HydrophobicContact CD1-CG1 4.17Å; I112-I174 HydrophobicContact CG1-CD1 4.25Å; I112-I174 HydrophobicContact CG2-CG2 4.35Å; I112-M211 HydrophobicContact CB-CE 4.43Å; I112-M211 HydrophobicContact CB-SD 4.07Å; I112-M211 HydrophobicContact CG2-CE 4.28Å; I112-M211 HydrophobicContact CG2-SD 3.68Å
113	V	98.9	Very high	98.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.1	-173.2	179.8	0	0	0	0	109.1	H83 F87 F99 L103 L156 I160 Y161 L162	H83-V113 HydrophobicContact CB-CG2 4.17Å; F87-V113 HydrophobicContact CD1-CG1 3.73Å; F87-V113 HydrophobicContact CE1-CG1 3.56Å; F87-V113 HydrophobicContact CZ-CG1 4.37Å; F99-V113 HydrophobicContact CE1-CG1 4.09Å; F99-V113 HydrophobicContact CE1-CG2 4.09Å; F99-V113 HydrophobicContact CZ-CG2 4.32Å; L103-V113 HydrophobicContact CD1-CG2 4.09Å; V113-L156 HydrophobicContact CG1-CD1 4.45Å; V113-I160 PolarHBondContact N-O 3.39Å; V113-Y161 HydrophobicContact CG1-CD2 4.36Å; V113-Y161 CarbonylContact O-C 3.55Å; V113-Y161 WeakPolarHBondContact O-CA 3.23Å; V113-L162 PolarHBondContact O-N 2.96Å
114	I	98.9	Very high	98.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	162.2	161.2	60.7	167.3	0	0	0	108.9	H83 T84 G85 F87 L162 M211 H213	H83-I114 PolarHBondContact O-N 3.11Å; H83-I114 VanDerWaalsContact O-N 3.11Å; T84-I114 HydrophobicContact CG2-CD1 4.43Å; G85-I114 WeakPolarHBondContact CA-O 3.35Å; G85-I114 PolarHBondContact N-O 3.09Å; F87-I114 WeakPolarHBondContact CE1-O 3.42Å; I114-L162 HydrophobicContact CG2-CB 4.04Å; I114-L162 WeakPolarHBondContact CG2-O 3.22Å; I114-M211 HydrophobicContact CD1-CB 4.16Å; I114-M211 HydrophobicContact CG1-CE 4.39Å; I114-M211 HydrophobicContact CG2-CB 4.14Å; I114-M211 HydrophobicContact CG2-CE 4.29Å; I114-H213 HydrophobicContact CD1-CB 4.37Å
115	A	98.9	Very high	97.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.			trans	-77.9	160.5	168	0	0	0	0	0	111.6	G85 E119 Y161 P178 F188	G85-A115 VanDerWaalsContact CA-C 3.47Å; A115-E119 HydrophobicContact CB-CB 3.83Å; A115-E119 HydrophobicContact CB-CG 4.14Å; A115-Y161 HydrophobicContact CB-CE2 4.16Å; A115-Y161 WeakPolarHBondContact CB-OH 3.33Å; A115-P178 HydrophobicContact CB-CB 4.03Å; A115-P178 WeakPolarHBondContact O-CA 3.42Å; A115-P178 VanDerWaalsContact O-CB 3.24Å; A115-P178 WeakPolarHBondContact O-CB 3.28Å; A115-F188 HydrophobicContact CB-CD2 4.31Å; A115-F188 HydrophobicContact CB-CE2 3.69Å; A115-F188 HydrophobicContact CB-CZ 4.1Å
116	G	98.5	Very high	97.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.155	C	C	.	.			trans	-124.1	-167.2	166	0	0	0	0	0	111.6	D86 H118 E119 F188 H213	D86-G116 WeakPolarHBondContact OD1-CA 3.45Å; G116-H118 PolarHBondContact O-N 2.89Å; G116-E119 PolarHBondContact N-OE2 3.5Å; G116-E119 PolarHBondContact O-N 3.12Å; G116-F188 VanDerWaalsContact O-CD2 3.31Å; G116-F188 WeakPolarHBondContact O-CD2 3.32Å; G116-H213 WeakPolarHBondContact CA-CD2 3.45Å
117	N	97.6	Very high	97.4	Very high	21 Å²	21	31.1 Å²	31.1	11%	0.112	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.5	-174.6	64.7	-107.9	0	0	0	114.4	D86 L120 W186 G187 H213	D86-N117 PolarHBondContact OD1-N 3.25Å; N117-L120 WeakPolarHBondContact O-CD2 3.47Å; N117-W186 HydrophobicContact CB-CB 3.72Å; N117-G187 WeakPolarHBondContact CA-O 3.07Å; N117-G187 WeakPolarHBondContact CB-O 3.45Å; N117-G187 PolarHBondContact O-N 3.32Å; N117-G187 VanDerWaalsContact O-N 3.11Å; N117-H213 PolarHBondContact N-CD2 3.05Å; N117-H213 PolarHBondContact N-NE2 3.27Å; N117-H213 PolarHBondContact OD1-NE2 3.35Å
118	H	97.9	Very high	97	Very high	18 Å²	18	27.7 Å²	27.7	8%	0.083	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-15.6	175.3	-79.1	-107.4	0	0	0	114	H67 D86 T88 E89 L90 G91 G116 L120 W186	H67-H118 AromaticContact CE1-CD2 3.47Å; H67-H118 PolarHBondContact CE1-CD2 3.45Å; H67-H118 VanDerWaalsContact CE1-CD2 3.47Å; H67-H118 AromaticContact CE1-CE1 3.9Å; H67-H118 AromaticContact CE1-CG 3.8Å; H67-H118 AromaticContact CE1-NE2 3.58Å; H67-H118 AromaticContact ND1-CD2 3.89Å; H67-H118 AromaticContact ND1-CE1 3.95Å; H67-H118 AromaticContact ND1-CG 3.74Å; H67-H118 AromaticContact ND1-ND1 3.78Å; D86-H118 HydrophobicContact CB-CB 4.45Å; D86-H118 WeakPolarHBondContact OD1-CB 3.5Å; D86-H118 IonicContact OD1-CD2 2.8Å; D86-H118 IonicContact OD1-CG 3.39Å; D86-H118 PolarHBondContact OD1-N 2.8Å; D86-H118 IonicContact OD2-CD2 2.75Å; D86-H118 PolarHBondContact OD2-CD2 2.78Å; D86-H118 IonicContact OD2-CG 3.13Å; T88-H118 VanDerWaalsContact O-CB 3.24Å; T88-H118 WeakPolarHBondContact O-CB 3.13Å; E89-H118 PolarHBondContact O-ND1 2.86Å; L90-H118 CarbonylContact C-O 2.99Å; L90-H118 VanDerWaalsContact CA-O 3.23Å; L90-H118 WeakPolarHBondContact CA-O 3.32Å; G91-H118 PolarHBondContact N-O 2.8Å; G116-H118 PolarHBondContact O-N 2.89Å; H118-L120 PolarHBondContact O-N 2.97Å; H118-W186 AromaticContact CE1-CH2 3.43Å; H118-W186 VanDerWaalsContact CE1-CH2 3.43Å; H118-W186 WeakPolarHBondContact CE1-CH2 3.43Å; H118-W186 AromaticContact CE1-CZ2 3.96Å; H118-W186 AromaticContact CE1-CZ3 3.62Å; H118-W186 AromaticContact CG-CZ3 3.97Å; H118-W186 AromaticContact ND1-CH2 3.77Å; H118-W186 AromaticContact ND1-CZ3 3.53Å
119	E	98.4	Very high	96.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.152	C	C	.	.			trans	-77.9	56.2	175.8	-83.6	73.8	-117.2	0	0	112.4	D86 F87 T88 A115 G116 T121 F122 F188	D86-E119 WeakPolarHBondContact CA-OE2 3.36Å; D86-E119 PolarHBondContact N-OE2 3.29Å; F87-E119 HydrophobicContact CD1-CG 4.26Å; F87-E119 HydrophobicContact CD2-CG 4.41Å; F87-E119 HydrophobicContact CE1-CG 3.65Å; F87-E119 HydrophobicContact CE2-CG 3.8Å; F87-E119 HydrophobicContact CZ-CG 3.38Å; F87-E119 PolarHBondContact N-OE1 2.68Å; T88-E119 WeakPolarHBondContact CB-OE1 3.32Å; T88-E119 PolarHBondContact N-OE1 2.88Å; T88-E119 PolarHBondContact OG1-OE1 2.84Å; A115-E119 HydrophobicContact CB-CB 3.83Å; A115-E119 HydrophobicContact CB-CG 4.14Å; G116-E119 PolarHBondContact N-OE2 3.5Å; G116-E119 PolarHBondContact O-N 3.12Å; E119-T121 PolarHBondContact O-N 3.08Å; E119-T121 VanDerWaalsContact O-N 3.1Å; E119-F122 HydrophobicContact CB-CB 4.22Å; E119-F122 HydrophobicContact CB-CD2 3.73Å; E119-F122 HydrophobicContact CB-CE2 4.34Å; E119-F122 HydrophobicContact CB-CG 4.06Å; E119-F122 HydrophobicContact CG-CD2 3.97Å; E119-F122 HydrophobicContact CG-CE2 4.07Å; E119-F122 HydrophobicContact CG-CG 4.48Å; E119-F122 WeakPolarHBondContact O-CB 3.34Å; E119-F122 PolarHBondContact O-N 3.12Å; E119-F188 HydrophobicContact CB-CE2 4.41Å
120	L	97.2	Very high	95.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-54	-37.4	-171.8	-60.4	-178.5	0	0	0	113.6	L90 N117 H118 F122 D123 F126 M127 F138 V141 W186 G187	L90-L120 HydrophobicContact CD2-CD1 3.99Å; N117-L120 WeakPolarHBondContact O-CD2 3.47Å; H118-L120 PolarHBondContact O-N 2.97Å; L120-F122 VanDerWaalsContact C-N 3.25Å; L120-F122 PolarHBondContact O-N 3.22Å; L120-D123 PolarHBondContact O-N 3.04Å; L120-F126 HydrophobicContact CB-CD1 4.1Å; L120-F126 HydrophobicContact CB-CE1 3.93Å; L120-F126 HydrophobicContact CD1-CE1 3.92Å; L120-F126 HydrophobicContact CD1-CZ 4.27Å; L120-F126 HydrophobicContact CD2-CD1 4.06Å; L120-F126 HydrophobicContact CD2-CE1 3.64Å; L120-F126 HydrophobicContact CD2-CE2 4.35Å; L120-F126 HydrophobicContact CD2-CZ 3.8Å; L120-F126 HydrophobicContact CG-CE1 4.03Å; L120-M127 WeakPolarHBondContact O-CG 3.35Å; L120-F138 HydrophobicContact CD1-CD1 3.89Å; L120-F138 HydrophobicContact CD1-CD2 4.24Å; L120-F138 HydrophobicContact CD1-CE1 3.99Å; L120-F138 HydrophobicContact CD1-CE2 4.34Å; L120-F138 HydrophobicContact CD1-CG 4Å; L120-F138 HydrophobicContact CD1-CZ 4.21Å; L120-V141 HydrophobicContact CB-CG1 4.46Å; L120-V141 HydrophobicContact CD1-CG2 4.13Å; L120-W186 HydrophobicContact CD1-CE3 4.46Å; L120-W186 HydrophobicContact CD1-CZ3 4.41Å; L120-W186 HydrophobicContact CD2-CE3 4Å; L120-W186 HydrophobicContact CG-CE3 4.48Å; L120-G187 VanDerWaalsContact CD2-N 3.28Å
121	T	97.7	Very high	94.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-72	-15.2	-179.1	58.6	0	0	0	0	114.6	G91 E119 K124 M127 V141 L144 F149	G91-T121 WeakPolarHBondContact O-CB 3.32Å; G91-T121 WeakPolarHBondContact O-CG2 3.42Å; G91-T121 PolarHBondContact O-OG1 2.98Å; E119-T121 PolarHBondContact O-N 3.08Å; E119-T121 VanDerWaalsContact O-N 3.1Å; T121-K124 PolarHBondContact O-NZ 2.8Å; T121-M127 HydrophobicContact CG2-CE 4.38Å; T121-M127 HydrophobicContact CG2-SD 4.34Å; T121-V141 HydrophobicContact CG2-CG1 4.44Å; T121-L144 HydrophobicContact CG2-CD1 3.56Å; T121-F149 HydrophobicContact CG2-CB 4.15Å
122	F	98	Very high	93.9	Very high	9 Å²	9	33.4 Å²	33.4	4%	0.039	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-82.4	-27.2	175.1	-70.6	-119.1	0	0	0	110.7	F87 V96 E119 L120 K124 V152 Q153 L156 Y161 F188	F87-F122 HydrophobicContact CE2-CE2 4.43Å; F87-F122 HydrophobicContact CE2-CZ 4.16Å; F87-F122 HydrophobicContact CZ-CE1 4.15Å; F87-F122 HydrophobicContact CZ-CE2 4.19Å; F87-F122 AromaticContact CZ-CZ 3.74Å; F87-F122 HydrophobicContact CZ-CZ 3.74Å; V96-F122 HydrophobicContact CG1-CZ 4.11Å; V96-F122 HydrophobicContact CG2-CE2 3.72Å; V96-F122 HydrophobicContact CG2-CZ 4.12Å; E119-F122 HydrophobicContact CB-CB 4.22Å; E119-F122 HydrophobicContact CB-CD2 3.73Å; E119-F122 HydrophobicContact CB-CE2 4.34Å; E119-F122 HydrophobicContact CB-CG 4.06Å; E119-F122 HydrophobicContact CG-CD2 3.97Å; E119-F122 HydrophobicContact CG-CE2 4.07Å; E119-F122 HydrophobicContact CG-CG 4.48Å; E119-F122 WeakPolarHBondContact O-CB 3.34Å; E119-F122 PolarHBondContact O-N 3.12Å; L120-F122 VanDerWaalsContact C-N 3.25Å; L120-F122 PolarHBondContact O-N 3.22Å; F122-K124 PolarHBondContact O-N 3.2Å; F122-V152 HydrophobicContact CD1-CG1 4.31Å; F122-V152 HydrophobicContact CD2-CG1 3.57Å; F122-V152 HydrophobicContact CD2-CG2 4.43Å; F122-V152 HydrophobicContact CE1-CG1 4.39Å; F122-V152 HydrophobicContact CE2-CB 4.33Å; F122-V152 HydrophobicContact CE2-CG1 3.63Å; F122-V152 HydrophobicContact CE2-CG2 3.79Å; F122-V152 HydrophobicContact CG-CG1 3.92Å; F122-V152 HydrophobicContact CZ-CG1 4.05Å; F122-V152 HydrophobicContact CZ-CG2 4.27Å; F122-Q153 HydrophobicContact CD1-CB 4.12Å; F122-Q153 HydrophobicContact CE1-CB 3.73Å; F122-L156 HydrophobicContact CE1-CD1 4.04Å; F122-L156 HydrophobicContact CZ-CD1 4.1Å; F122-Y161 HydrophobicContact CD1-CE1 4.27Å; F122-Y161 AromaticContact CD1-CE2 3.97Å; F122-Y161 HydrophobicContact CD1-CE2 3.97Å; F122-Y161 AromaticContact CD1-CZ 3.64Å; F122-Y161 WeakPolarHBondContact CD1-OH 3.31Å; F122-Y161 HydrophobicContact CE1-CD2 4.39Å; F122-Y161 HydrophobicContact CE1-CE1 4.5Å; F122-Y161 AromaticContact CE1-CE2 3.87Å; F122-Y161 HydrophobicContact CE1-CE2 3.87Å; F122-Y161 AromaticContact CE1-CZ 3.95Å; F122-F188 HydrophobicContact CB-CE2 3.83Å; F122-F188 HydrophobicContact CB-CZ 3.64Å
123	D	96.9	Very high	92.7	Very high	15 Å²	15	39.6 Å²	39.6	8%	0.08	20%	0.198	C	C	.	.			trans	-85.7	98.7	174.7	-172.8	-18.5	0	0	0	110.6	L120 E125 F126 M127 F188	L120-D123 PolarHBondContact O-N 3.04Å; D123-E125 VanDerWaalsContact C-N 3.31Å; D123-E125 PolarHBondContact O-N 2.89Å; D123-E125 PolarHBondContact OD1-N 3.19Å; D123-E125 VanDerWaalsContact OD1-N 3.08Å; D123-F126 HydrophobicContact CB-CB 3.74Å; D123-F126 PolarHBondContact O-N 3.09Å; D123-F126 PolarHBondContact OD1-N 2.91Å; D123-M127 WeakPolarHBondContact O-CG 3.39Å; D123-M127 PolarHBondContact O-N 2.75Å; D123-F188 HydrophobicContact CB-CD1 4.3Å; D123-F188 HydrophobicContact CB-CD2 4.18Å; D123-F188 HydrophobicContact CB-CE1 4.06Å; D123-F188 HydrophobicContact CB-CE2 3.94Å; D123-F188 HydrophobicContact CB-CG 4.38Å; D123-F188 HydrophobicContact CB-CZ 3.89Å; D123-F188 PolarHBondContact OD2-N 3.48Å
124	K	94.2	Very high	91.4	Very high	86 Å²	86	42.7 Å²	42.7	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-66.6	-32	-177.8	-56.6	-53.4	-175.7	-172.7	0	112.9	T121 F122 A128 F149 D150	T121-K124 PolarHBondContact O-NZ 2.8Å; F122-K124 PolarHBondContact O-N 3.2Å; K124-A128 WeakPolarHBondContact O-CB 3.34Å; K124-A128 PolarHBondContact O-N 3.11Å; K124-A128 VanDerWaalsContact O-N 3.09Å; K124-F149 PolarHBondContact NZ-O 3.04Å; K124-D150 PolarHBondContact NZ-O 3.34Å; K124-D150 VanDerWaalsContact NZ-O 3.09Å
125	E	92.9	Very high	90.3	Very high	139 Å²	139	49.9 Å²	49.9	65%	0.65	24%	0.243	S	C	*	.	H	α-helix	trans	-70.8	-46.6	177.9	-67.8	-176.9	178.6	0	0	109.6	D123 M127 A128 D129	D123-E125 VanDerWaalsContact C-N 3.31Å; D123-E125 PolarHBondContact O-N 2.89Å; D123-E125 PolarHBondContact OD1-N 3.19Å; D123-E125 VanDerWaalsContact OD1-N 3.08Å; E125-M127 PolarHBondContact O-N 3.44Å; E125-A128 PolarHBondContact O-N 2.81Å; E125-A128 VanDerWaalsContact O-N 3.17Å; E125-D129 PolarHBondContact O-N 2.99Å
126	F	93.5	Very high	89.4	Confident	33 Å²	33	57.2 Å²	57.2	15%	0.145	27%	0.272	C	S	.	.	H	α-helix	trans	-56.2	-47.7	174.2	-179.1	-88.8	0	0	0	112.1	L120 D123 A128 D129 L130 F138 G185	L120-F126 HydrophobicContact CB-CD1 4.1Å; L120-F126 HydrophobicContact CB-CE1 3.93Å; L120-F126 HydrophobicContact CD1-CE1 3.92Å; L120-F126 HydrophobicContact CD1-CZ 4.27Å; L120-F126 HydrophobicContact CD2-CD1 4.06Å; L120-F126 HydrophobicContact CD2-CE1 3.64Å; L120-F126 HydrophobicContact CD2-CE2 4.35Å; L120-F126 HydrophobicContact CD2-CZ 3.8Å; L120-F126 HydrophobicContact CG-CE1 4.03Å; D123-F126 HydrophobicContact CB-CB 3.74Å; D123-F126 PolarHBondContact O-N 3.09Å; D123-F126 PolarHBondContact OD1-N 2.91Å; F126-A128 VanDerWaalsContact C-N 3.31Å; F126-A128 PolarHBondContact O-N 2.84Å; F126-D129 PolarHBondContact O-N 3.23Å; F126-L130 HydrophobicContact CE1-CB 4.24Å; F126-L130 HydrophobicContact CE1-CD2 3.96Å; F126-L130 HydrophobicContact CE1-CG 4.48Å; F126-L130 WeakPolarHBondContact O-CB 3.37Å; F126-L130 PolarHBondContact O-N 2.83Å; F126-F138 HydrophobicContact CZ-CD2 4.03Å; F126-F138 AromaticContact CZ-CE2 3.81Å; F126-F138 HydrophobicContact CZ-CE2 3.81Å; F126-G185 WeakPolarHBondContact CE2-O 3.32Å
127	M	93.7	Very high	88.8	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.025	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-39	178.5	-71.8	-62.9	-69.5	0	0	112.5	L120 T121 D123 E125 D129 V141 F149	L120-M127 WeakPolarHBondContact O-CG 3.35Å; T121-M127 HydrophobicContact CG2-CE 4.38Å; T121-M127 HydrophobicContact CG2-SD 4.34Å; D123-M127 WeakPolarHBondContact O-CG 3.39Å; D123-M127 PolarHBondContact O-N 2.75Å; E125-M127 PolarHBondContact O-N 3.44Å; M127-D129 VanDerWaalsContact C-N 3.3Å; M127-D129 PolarHBondContact O-N 3.32Å; M127-V141 HydrophobicContact CE-CG1 3.69Å; M127-V141 HydrophobicContact SD-CG1 3.38Å; M127-V141 WeakPolarHBondContact SD-CG1 3.44Å; M127-F149 HydrophobicContact CB-CE2 3.74Å; M127-F149 HydrophobicContact CB-CZ 4.02Å; M127-F149 HydrophobicContact CE-CD1 3.74Å; M127-F149 HydrophobicContact CE-CD2 4.07Å; M127-F149 HydrophobicContact CE-CE1 3.49Å; M127-F149 VanDerWaalsContact CE-CE1 3.49Å; M127-F149 HydrophobicContact CE-CE2 3.88Å; M127-F149 HydrophobicContact CE-CG 4.03Å; M127-F149 HydrophobicContact CE-CZ 3.58Å; M127-F149 HydrophobicContact CG-CD2 4.16Å; M127-F149 HydrophobicContact CG-CE2 3.84Å; M127-F149 HydrophobicContact CG-CZ 4.33Å
128	A	90.8	Very high	88.4	Confident	44 Å²	44	63 Å²	63	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-68.2	-28.7	178.2	0	0	0	0	0	113.2	K124 E125 F126 V131 K132	K124-A128 WeakPolarHBondContact O-CB 3.34Å; K124-A128 PolarHBondContact O-N 3.11Å; K124-A128 VanDerWaalsContact O-N 3.09Å; E125-A128 PolarHBondContact O-N 2.81Å; E125-A128 VanDerWaalsContact O-N 3.17Å; F126-A128 VanDerWaalsContact C-N 3.31Å; F126-A128 PolarHBondContact O-N 2.84Å; A128-V131 WeakPolarHBondContact O-CG2 3.21Å; A128-K132 WeakPolarHBondContact O-CD 3.47Å; A128-K132 VanDerWaalsContact O-CE 3.31Å; A128-K132 WeakPolarHBondContact O-CE 3.33Å
129	D	88.6	Confident	88	Confident	78 Å²	78	65.5 Å²	65.5	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-88.2	-37.2	178.7	-76.5	-14.6	0	0	0	112.9	E125 F126 M127 V131 K132 Q133	E125-D129 PolarHBondContact O-N 2.99Å; F126-D129 PolarHBondContact O-N 3.23Å; M127-D129 VanDerWaalsContact C-N 3.3Å; M127-D129 PolarHBondContact O-N 3.32Å; D129-V131 PolarHBondContact O-N 3.33Å; D129-K132 PolarHBondContact O-N 2.98Å; D129-Q133 PolarHBondContact O-N 2.65Å
130	L	85.4	Confident	87.7	Confident	12 Å²	12	68.2 Å²	68.2	6%	0.063	33%	0.329	C	S	.	.	H	α-helix	trans	-54.5	-42.2	178.3	178.4	64.1	0	0	0	111.8	F126 K132 D134 Y135 F138 V141 S142	F126-L130 HydrophobicContact CE1-CB 4.24Å; F126-L130 HydrophobicContact CE1-CD2 3.96Å; F126-L130 HydrophobicContact CE1-CG 4.48Å; F126-L130 WeakPolarHBondContact O-CB 3.37Å; F126-L130 PolarHBondContact O-N 2.83Å; L130-K132 PolarHBondContact O-N 2.97Å; L130-D134 PolarHBondContact O-N 3.11Å; L130-Y135 PolarHBondContact O-N 2.77Å; L130-F138 HydrophobicContact CD1-CB 4.44Å; L130-F138 HydrophobicContact CD1-CD2 3.91Å; L130-F138 HydrophobicContact CD2-CB 4.16Å; L130-V141 HydrophobicContact CD2-CB 4.2Å; L130-V141 HydrophobicContact CD2-CG1 3.82Å; L130-S142 WeakPolarHBondContact CD2-OG 3.14Å
131	V	75	Confident	87.4	Confident	88 Å²	88	68.2 Å²	68.2	53%	0.533	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.5	-179.6	-62.9	0	0	0	0	113.7	A128 D129	A128-V131 WeakPolarHBondContact O-CG2 3.21Å; D129-V131 PolarHBondContact O-N 3.33Å
132	K	80	Confident	87.1	Confident	154 Å²	154	69.6 Å²	69.6	67%	0.67	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-27.3	-178.2	-64.8	173.7	-169.6	158	0	113.7	A128 D129 L130	A128-K132 WeakPolarHBondContact O-CD 3.47Å; A128-K132 VanDerWaalsContact O-CE 3.31Å; A128-K132 WeakPolarHBondContact O-CE 3.33Å; D129-K132 PolarHBondContact O-N 2.98Å; L130-K132 PolarHBondContact O-N 2.97Å
133	Q	73.1	Confident	86.7	Confident	130 Å²	130	77 Å²	77	61%	0.607	37%	0.371	S	S	*	.	S	Bend	trans	-116.8	-65.8	-166.9	-59.6	-178.5	37.9	0	0	112.4	D129	D129-Q133 PolarHBondContact O-N 2.65Å
134	D	71.8	Confident	86.5	Confident	65 Å²	65	78 Å²	78	35%	0.348	38%	0.376	S	S	.	.			trans	-127.7	46.9	-165.8	-74.4	-40	0	0	0	112.9	L130 Y136 R137	L130-D134 PolarHBondContact O-N 3.11Å; D134-Y136 HydrophobicContact CB-CE1 4.46Å; D134-Y136 PolarHBondContact O-N 2.97Å; D134-Y136 PolarHBondContact OD1-OH 2.92Å; D134-R137 HydrophobicContact CB-CB 4.27Å; D134-R137 VanDerWaalsContact O-CB 3.3Å; D134-R137 WeakPolarHBondContact O-CB 3.19Å; D134-R137 PolarHBondContact O-N 3.28Å
135	Y	76.1	Confident	86.4	Confident	151 Å²	151	79.8 Å²	79.8	59%	0.592	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-22.3	-176.7	77.5	-89.2	0	0	0	114.5	L130 S142	L130-Y135 PolarHBondContact O-N 2.77Å; Y135-S142 WeakPolarHBondContact CA-OG 3.39Å; Y135-S142 VanDerWaalsContact O-CB 3.29Å; Y135-S142 WeakPolarHBondContact O-CB 3.49Å; Y135-S142 PolarHBondContact O-OG 3.08Å
136	Y	80.8	Confident	86.3	Confident	153 Å²	153	76.7 Å²	76.7	60%	0.6	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-15.5	178.8	57.3	-86.3	0	0	0	113.1	D134	D134-Y136 HydrophobicContact CB-CE1 4.46Å; D134-Y136 PolarHBondContact O-N 2.97Å; D134-Y136 PolarHBondContact OD1-OH 2.92Å
137	R	85.7	Confident	86.2	Confident	126 Å²	126	81.2 Å²	81.2	48%	0.475	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-36.8	178.7	-176.1	178.3	169.5	133	2.9	112.2	D134 N184	D134-R137 HydrophobicContact CB-CB 4.27Å; D134-R137 VanDerWaalsContact O-CB 3.3Å; D134-R137 WeakPolarHBondContact O-CB 3.19Å; D134-R137 PolarHBondContact O-N 3.28Å; R137-N184 PolarHBondContact NH2-O 2.79Å
138	F	88.9	Confident	86.2	Confident	16 Å²	16	84.6 Å²	84.6	7%	0.07	42%	0.416	C	S	.	.	S	Bend	trans	-126.4	68.5	178.5	-63.3	-72.3	0	0	0	110.6	L90 L120 F126 L130 S140 V141 S142 W186	L90-F138 HydrophobicContact CD2-CD1 3.68Å; L90-F138 HydrophobicContact CD2-CE1 3.97Å; L120-F138 HydrophobicContact CD1-CD1 3.89Å; L120-F138 HydrophobicContact CD1-CD2 4.24Å; L120-F138 HydrophobicContact CD1-CE1 3.99Å; L120-F138 HydrophobicContact CD1-CE2 4.34Å; L120-F138 HydrophobicContact CD1-CG 4Å; L120-F138 HydrophobicContact CD1-CZ 4.21Å; F126-F138 HydrophobicContact CZ-CD2 4.03Å; F126-F138 AromaticContact CZ-CE2 3.81Å; F126-F138 HydrophobicContact CZ-CE2 3.81Å; L130-F138 HydrophobicContact CD1-CB 4.44Å; L130-F138 HydrophobicContact CD1-CD2 3.91Å; L130-F138 HydrophobicContact CD2-CB 4.16Å; F138-S140 PolarHBondContact O-N 2.81Å; F138-S140 VanDerWaalsContact O-N 3.12Å; F138-V141 HydrophobicContact CB-CB 4.06Å; F138-V141 HydrophobicContact CB-CG2 4.24Å; F138-V141 PolarHBondContact O-N 2.71Å; F138-S142 PolarHBondContact O-N 3.5Å; F138-S142 PolarHBondContact O-OG 2.8Å; F138-W186 HydrophobicContact CE1-CE3 4.27Å; F138-W186 AromaticContact CE1-CH2 3.84Å; F138-W186 HydrophobicContact CE1-CH2 3.84Å; F138-W186 HydrophobicContact CE1-CZ2 4.35Å; F138-W186 AromaticContact CE1-CZ3 3.8Å; F138-W186 HydrophobicContact CE1-CZ3 3.8Å; F138-W186 HydrophobicContact CZ-CD2 4.36Å; F138-W186 HydrophobicContact CZ-CE3 4.18Å; F138-W186 HydrophobicContact CZ-CH2 4.33Å; F138-W186 HydrophobicContact CZ-CZ3 4.17Å
139	P	89.4	Confident	86.2	Confident	71 Å²	71	83.5 Å²	83.5	46%	0.461	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.4	-166.1	26.4	-35.5	0	0	0	113.7	K143	P139-K143 WeakPolarHBondContact O-CD 3.28Å; P139-K143 WeakPolarHBondContact O-CE 3.31Å; P139-K143 VanDerWaalsContact O-CG 3.22Å; P139-K143 WeakPolarHBondContact O-CG 3.31Å
140	S	91.7	Very high	86.3	Confident	58 Å²	58	84.6 Å²	84.6	41%	0.406	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-38.1	175.1	-59.5	0	0	0	0	111.9	F138	F138-S140 PolarHBondContact O-N 2.81Å; F138-S140 VanDerWaalsContact O-N 3.12Å
141	V	91.8	Very high	86.5	Confident	0 Å²	0	88.9 Å²	88.9	0%	0	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-42.7	179.9	-179.6	0	0	0	0	110.3	L90 L92 L120 T121 M127 L130 F138 K143 L144	L90-V141 HydrophobicContact CB-CG2 3.83Å; L90-V141 HydrophobicContact CD1-CG2 4.35Å; L90-V141 HydrophobicContact CD2-CG2 4.49Å; L90-V141 HydrophobicContact CG-CG2 4.46Å; L92-V141 HydrophobicContact CD2-CG2 4.07Å; L120-V141 HydrophobicContact CB-CG1 4.46Å; L120-V141 HydrophobicContact CD1-CG2 4.13Å; T121-V141 HydrophobicContact CG2-CG1 4.44Å; M127-V141 HydrophobicContact CE-CG1 3.69Å; M127-V141 HydrophobicContact SD-CG1 3.38Å; M127-V141 WeakPolarHBondContact SD-CG1 3.44Å; L130-V141 HydrophobicContact CD2-CB 4.2Å; L130-V141 HydrophobicContact CD2-CG1 3.82Å; F138-V141 HydrophobicContact CB-CB 4.06Å; F138-V141 HydrophobicContact CB-CG2 4.24Å; F138-V141 PolarHBondContact O-N 2.71Å; V141-K143 PolarHBondContact O-N 3.13Å; V141-K143 VanDerWaalsContact O-N 3.1Å; V141-L144 HydrophobicContact CG1-CD1 4.47Å; V141-L144 VanDerWaalsContact O-CB 3.29Å; V141-L144 WeakPolarHBondContact O-CB 3.25Å; V141-L144 WeakPolarHBondContact O-CG 3.18Å; V141-L144 PolarHBondContact O-N 3.47Å
142	S	90	Very high	87.5	Confident	29 Å²	29	84.9 Å²	84.9	20%	0.203	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-9.9	179.9	-56.5	0	0	0	0	114.7	L130 Y135 F138	L130-S142 WeakPolarHBondContact CD2-OG 3.14Å; Y135-S142 WeakPolarHBondContact CA-OG 3.39Å; Y135-S142 VanDerWaalsContact O-CB 3.29Å; Y135-S142 WeakPolarHBondContact O-CB 3.49Å; Y135-S142 PolarHBondContact O-OG 3.08Å; F138-S142 PolarHBondContact O-N 3.5Å; F138-S142 PolarHBondContact O-OG 2.8Å
143	K	91.1	Very high	88.3	Confident	164 Å²	164	82 Å²	82	71%	0.713	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-15	172.1	-75.3	170.2	-171.5	178.4	0	113.3	P139 V141	P139-K143 WeakPolarHBondContact O-CD 3.28Å; P139-K143 WeakPolarHBondContact O-CE 3.31Å; P139-K143 VanDerWaalsContact O-CG 3.22Å; P139-K143 WeakPolarHBondContact O-CG 3.31Å; V141-K143 PolarHBondContact O-N 3.13Å; V141-K143 VanDerWaalsContact O-N 3.1Å
144	L	92.6	Very high	89.4	Confident	36 Å²	36	78.7 Å²	78.7	19%	0.188	39%	0.387	C	S	.	.			trans	-68.4	136.6	179.3	-61.7	175	0	0	0	109.7	L92 T121 V141 D148 F149	L92-L144 HydrophobicContact CD2-CD1 4.13Å; T121-L144 HydrophobicContact CG2-CD1 3.56Å; V141-L144 HydrophobicContact CG1-CD1 4.47Å; V141-L144 VanDerWaalsContact O-CB 3.29Å; V141-L144 WeakPolarHBondContact O-CB 3.25Å; V141-L144 WeakPolarHBondContact O-CG 3.18Å; V141-L144 PolarHBondContact O-N 3.47Å; L144-D148 HydrophobicContact CB-CB 4.25Å; L144-D148 HydrophobicContact CD2-CB 4.02Å; L144-F149 HydrophobicContact CB-CD1 3.93Å; L144-F149 HydrophobicContact CB-CE1 4.36Å
145	K	91.6	Very high	90.7	Very high	124 Å²	124	78.6 Å²	78.6	54%	0.539	39%	0.387	S	S	.	.			trans	-83.9	156.4	168.4	-57.9	-177	-176.5	176.7	0	109.4	E147 D148 F149	K145-E147 VanDerWaalsContact CB-CD 3.44Å; K145-E147 HydrophobicContact CB-CG 4Å; K145-E147 WeakPolarHBondContact CB-OE2 3.32Å; K145-E147 WeakPolarHBondContact CD-OE1 3.41Å; K145-E147 PolarHBondContact O-N 2.88Å; K145-E147 VanDerWaalsContact O-N 3.17Å; K145-D148 PolarHBondContact N-OD2 2.64Å; K145-D148 VanDerWaalsContact O-CB 3.31Å; K145-D148 WeakPolarHBondContact O-CB 3.49Å; K145-D148 PolarHBondContact O-N 2.75Å; K145-F149 WeakPolarHBondContact O-CD1 3.41Å; K145-F149 VanDerWaalsContact O-CE1 3.3Å; K145-F149 WeakPolarHBondContact O-CE1 3.21Å
146	P	90.8	Very high	91.8	Very high	74 Å²	74	71.7 Å²	71.7	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-47	-45.4	176.4	-29.7	37	0	0	0	113.2	D148 F149 D150	P146-D148 PolarHBondContact O-N 2.85Å; P146-D148 VanDerWaalsContact O-N 3.1Å; P146-F149 PolarHBondContact O-N 2.56Å; P146-F149 VanDerWaalsContact O-N 3.07Å; P146-D150 WeakPolarHBondContact O-CB 3.43Å; P146-D150 PolarHBondContact O-N 3.02Å
147	E	92.4	Very high	92.6	Very high	128 Å²	128	69.4 Å²	69.4	60%	0.598	36%	0.362	S	S	*	.	H	α-helix	trans	-60	-23.5	178.4	57.4	-96.4	-147.8	0	0	114.8	K145 F149	K145-E147 VanDerWaalsContact CB-CD 3.44Å; K145-E147 HydrophobicContact CB-CG 4Å; K145-E147 WeakPolarHBondContact CB-OE2 3.32Å; K145-E147 WeakPolarHBondContact CD-OE1 3.41Å; K145-E147 PolarHBondContact O-N 2.88Å; K145-E147 VanDerWaalsContact O-N 3.17Å; E147-F149 VanDerWaalsContact C-N 3.34Å
148	D	91.6	Very high	93.3	Very high	76 Å²	76	66.5 Å²	66.5	41%	0.406	36%	0.356	S	S	.	.	H	α-helix	trans	-75.3	-24.6	179.4	-61.4	-40.8	0	0	0	112.1	P93 L144 K145 P146	P93-D148 WeakPolarHBondContact CG-O 3.38Å; L144-D148 HydrophobicContact CB-CB 4.25Å; L144-D148 HydrophobicContact CD2-CB 4.02Å; K145-D148 PolarHBondContact N-OD2 2.64Å; K145-D148 VanDerWaalsContact O-CB 3.31Å; K145-D148 WeakPolarHBondContact O-CB 3.49Å; K145-D148 PolarHBondContact O-N 2.75Å; P146-D148 PolarHBondContact O-N 2.85Å; P146-D148 VanDerWaalsContact O-N 3.1Å
149	F	91.8	Very high	93.7	Very high	20 Å²	20	66.9 Å²	66.9	9%	0.088	36%	0.36	C	S	.	.	H	α-helix	trans	-129.1	-8.2	-174	67.1	-89.5	0	0	0	115.5	T121 K124 M127 L144 K145 P146 E147 N151 V152	T121-F149 HydrophobicContact CG2-CB 4.15Å; K124-F149 PolarHBondContact NZ-O 3.04Å; M127-F149 HydrophobicContact CB-CE2 3.74Å; M127-F149 HydrophobicContact CB-CZ 4.02Å; M127-F149 HydrophobicContact CE-CD1 3.74Å; M127-F149 HydrophobicContact CE-CD2 4.07Å; M127-F149 HydrophobicContact CE-CE1 3.49Å; M127-F149 VanDerWaalsContact CE-CE1 3.49Å; M127-F149 HydrophobicContact CE-CE2 3.88Å; M127-F149 HydrophobicContact CE-CG 4.03Å; M127-F149 HydrophobicContact CE-CZ 3.58Å; M127-F149 HydrophobicContact CG-CD2 4.16Å; M127-F149 HydrophobicContact CG-CE2 3.84Å; M127-F149 HydrophobicContact CG-CZ 4.33Å; L144-F149 HydrophobicContact CB-CD1 3.93Å; L144-F149 HydrophobicContact CB-CE1 4.36Å; K145-F149 WeakPolarHBondContact O-CD1 3.41Å; K145-F149 VanDerWaalsContact O-CE1 3.3Å; K145-F149 WeakPolarHBondContact O-CE1 3.21Å; P146-F149 PolarHBondContact O-N 2.56Å; P146-F149 VanDerWaalsContact O-N 3.07Å; E147-F149 VanDerWaalsContact C-N 3.34Å; F149-N151 PolarHBondContact O-N 3.31Å; F149-V152 WeakPolarHBondContact O-CB 3.47Å; F149-V152 PolarHBondContact O-N 3.42Å; F149-V152 VanDerWaalsContact O-N 3.07Å
150	D	90.3	Very high	94.2	Very high	102 Å²	102	66.1 Å²	66.1	55%	0.545	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-41	-178.4	-85.1	-16.5	0	0	0	112.6	K124 P146	K124-D150 PolarHBondContact NZ-O 3.34Å; K124-D150 VanDerWaalsContact NZ-O 3.09Å; P146-D150 WeakPolarHBondContact O-CB 3.43Å; P146-D150 PolarHBondContact O-N 3.02Å
151	N	89.3	Confident	94.5	Very high	101 Å²	101	65 Å²	65	54%	0.54	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	33.8	178.6	-160.2	15.6	0	0	0	113.7	F149 Q153 S154	F149-N151 PolarHBondContact O-N 3.31Å; N151-Q153 PolarHBondContact O-N 3.35Å; N151-Q153 VanDerWaalsContact O-N 3.16Å; N151-S154 VanDerWaalsContact CG-CB 3.49Å; N151-S154 WeakPolarHBondContact ND2-CB 3.35Å; N151-S154 PolarHBondContact ND2-OG 2.97Å; N151-S154 VanDerWaalsContact ND2-OG 3.11Å; N151-S154 WeakPolarHBondContact O-CB 3.29Å; N151-S154 PolarHBondContact O-N 2.9Å; N151-S154 PolarHBondContact O-OG 3.17Å; N151-S154 WeakPolarHBondContact OD1-CB 3.24Å
152	V	96.3	Very high	94.9	Very high	4 Å²	4	65.1 Å²	65.1	2%	0.024	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-55	-35.8	-175.2	67.8	0	0	0	0	113.4	V96 F122 F149 S154 L155	V96-V152 HydrophobicContact CB-CG2 4.38Å; V96-V152 HydrophobicContact CG1-CG2 4.47Å; V96-V152 HydrophobicContact CG2-CG2 3.81Å; F122-V152 HydrophobicContact CD1-CG1 4.31Å; F122-V152 HydrophobicContact CD2-CG1 3.57Å; F122-V152 HydrophobicContact CD2-CG2 4.43Å; F122-V152 HydrophobicContact CE1-CG1 4.39Å; F122-V152 HydrophobicContact CE2-CB 4.33Å; F122-V152 HydrophobicContact CE2-CG1 3.63Å; F122-V152 HydrophobicContact CE2-CG2 3.79Å; F122-V152 HydrophobicContact CG-CG1 3.92Å; F122-V152 HydrophobicContact CZ-CG1 4.05Å; F122-V152 HydrophobicContact CZ-CG2 4.27Å; F149-V152 WeakPolarHBondContact O-CB 3.47Å; F149-V152 PolarHBondContact O-N 3.42Å; F149-V152 VanDerWaalsContact O-N 3.07Å; V152-S154 PolarHBondContact O-N 2.8Å; V152-L155 HydrophobicContact CG2-CD1 4.16Å; V152-L155 VanDerWaalsContact O-CB 3.3Å; V152-L155 WeakPolarHBondContact O-CB 3.45Å; V152-L155 WeakPolarHBondContact O-CG 3.38Å; V152-L155 PolarHBondContact O-N 3Å; V152-L155 VanDerWaalsContact O-N 3.1Å
153	Q	96.8	Very high	95.3	Very high	95 Å²	95	66.8 Å²	66.8	44%	0.444	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-59.7	-28.5	176.5	64	176	83.7	0	0	113.4	F122 N151 L155 L156 Y161	F122-Q153 HydrophobicContact CD1-CB 4.12Å; F122-Q153 HydrophobicContact CE1-CB 3.73Å; N151-Q153 PolarHBondContact O-N 3.35Å; N151-Q153 VanDerWaalsContact O-N 3.16Å; Q153-L155 PolarHBondContact O-N 3.38Å; Q153-L156 WeakPolarHBondContact O-CB 3.41Å; Q153-L156 PolarHBondContact O-N 2.96Å; Q153-L156 VanDerWaalsContact O-N 3.14Å; Q153-Y161 HydrophobicContact CB-CD1 4.1Å; Q153-Y161 HydrophobicContact CB-CE1 4.23Å
154	S	97.6	Very high	95.6	Very high	59 Å²	59	60.7 Å²	60.7	41%	0.413	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-68.5	-15.1	179.2	69.6	0	0	0	0	113.7	N151 V152 L156 T157	N151-S154 VanDerWaalsContact CG-CB 3.49Å; N151-S154 WeakPolarHBondContact ND2-CB 3.35Å; N151-S154 PolarHBondContact ND2-OG 2.97Å; N151-S154 VanDerWaalsContact ND2-OG 3.11Å; N151-S154 WeakPolarHBondContact O-CB 3.29Å; N151-S154 PolarHBondContact O-N 2.9Å; N151-S154 PolarHBondContact O-OG 3.17Å; N151-S154 WeakPolarHBondContact OD1-CB 3.24Å; V152-S154 PolarHBondContact O-N 2.8Å; S154-L156 PolarHBondContact O-N 3.31Å; S154-T157 WeakPolarHBondContact O-CG2 3.41Å
155	L	98.4	Very high	95.9	Very high	63 Å²	63	61 Å²	61	33%	0.33	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-69.2	-18.2	174	-60.6	176.4	0	0	0	112.2	P93 V96 N100 V152 Q153 T157	P93-L155 HydrophobicContact CB-CD1 3.88Å; V96-L155 HydrophobicContact CB-CD1 4.3Å; V96-L155 HydrophobicContact CG1-CB 3.78Å; V96-L155 HydrophobicContact CG1-CD1 4.34Å; N100-L155 WeakPolarHBondContact CB-O 3.49Å; N100-L155 PolarHBondContact ND2-O 3.36Å; N100-L155 VanDerWaalsContact ND2-O 3.13Å; N100-L155 PolarHBondContact OD1-O 3.11Å; V152-L155 HydrophobicContact CG2-CD1 4.16Å; V152-L155 VanDerWaalsContact O-CB 3.3Å; V152-L155 WeakPolarHBondContact O-CB 3.45Å; V152-L155 WeakPolarHBondContact O-CG 3.38Å; V152-L155 PolarHBondContact O-N 3Å; V152-L155 VanDerWaalsContact O-N 3.1Å; Q153-L155 PolarHBondContact O-N 3.38Å; L155-T157 PolarHBondContact O-N 3.17Å
156	L	98.7	Very high	96.3	Very high	6 Å²	6	59 Å²	59	3%	0.031	32%	0.317	C	S	.	.			trans	-82.5	50.3	178.9	-62.4	174.4	0	0	0	112.7	F87 V96 F99 N100 V113 F122 Q153 S154 N158 S159 Y161	F87-L156 HydrophobicContact CE2-CD1 4.42Å; F87-L156 HydrophobicContact CE2-CD2 4.22Å; F87-L156 HydrophobicContact CZ-CD1 3.97Å; V96-L156 HydrophobicContact CG1-CD2 3.66Å; V96-L156 HydrophobicContact CG1-CG 3.82Å; F99-L156 HydrophobicContact CD1-CD2 3.7Å; F99-L156 HydrophobicContact CE1-CD2 4.15Å; N100-L156 HydrophobicContact CB-CD2 4.37Å; N100-L156 WeakPolarHBondContact OD1-CA 3.46Å; V113-L156 HydrophobicContact CG1-CD1 4.45Å; F122-L156 HydrophobicContact CE1-CD1 4.04Å; F122-L156 HydrophobicContact CZ-CD1 4.1Å; Q153-L156 WeakPolarHBondContact O-CB 3.41Å; Q153-L156 PolarHBondContact O-N 2.96Å; Q153-L156 VanDerWaalsContact O-N 3.14Å; S154-L156 PolarHBondContact O-N 3.31Å; L156-N158 PolarHBondContact O-N 3.07Å; L156-N158 VanDerWaalsContact O-N 3.16Å; L156-S159 WeakPolarHBondContact CB-OG 3.27Å; L156-S159 PolarHBondContact O-N 3.34Å; L156-S159 VanDerWaalsContact O-N 3.09Å; L156-S159 PolarHBondContact O-OG 3.1Å; L156-Y161 HydrophobicContact CD1-CD2 3.76Å; L156-Y161 HydrophobicContact CD1-CE2 4.48Å; L156-Y161 HydrophobicContact CD1-CG 4.24Å
157	T	98.8	Very high	96.7	Very high	105 Å²	105	56.9 Å²	56.9	64%	0.644	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.4	-175.2	63.8	0	0	0	0	114.9	N100 S154 L155 S159	N100-T157 PolarHBondContact ND2-OG1 2.85Å; N100-T157 PolarHBondContact OD1-N 2.88Å; S154-T157 WeakPolarHBondContact O-CG2 3.41Å; L155-T157 PolarHBondContact O-N 3.17Å; T157-S159 VanDerWaalsContact C-N 3.33Å
158	N	98.8	Very high	97	Very high	65 Å²	65	54.8 Å²	54.8	35%	0.348	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	14.5	179	-64.3	-47.5	0	0	0	112.6	N100 L103 G104 L156	N100-N158 PolarHBondContact ND2-ND2 3.07Å; N100-N158 PolarHBondContact O-ND2 2.7Å; N100-N158 WeakPolarHBondContact OD1-CB 3.32Å; N100-N158 PolarHBondContact OD1-N 2.8Å; L103-N158 HydrophobicContact CB-CB 4Å; G104-N158 WeakPolarHBondContact CA-ND2 3.34Å; L156-N158 PolarHBondContact O-N 3.07Å; L156-N158 VanDerWaalsContact O-N 3.16Å
159	S	98.7	Very high	97.3	Very high	24 Å²	24	51.5 Å²	51.5	17%	0.168	28%	0.282	C	S	.	.	S	Bend	trans	-134.8	164.4	-178.4	82.5	0	0	0	0	112.9	K111 L156 T157	K111-S159 CarbonylContact O-C 3.58Å; K111-S159 VanDerWaalsContact O-CA 3.27Å; K111-S159 WeakPolarHBondContact O-CA 3.33Å; K111-S159 WeakPolarHBondContact O-CB 3.35Å; L156-S159 WeakPolarHBondContact CB-OG 3.27Å; L156-S159 PolarHBondContact O-N 3.34Å; L156-S159 VanDerWaalsContact O-N 3.09Å; L156-S159 PolarHBondContact O-OG 3.1Å; T157-S159 VanDerWaalsContact C-N 3.33Å
160	I	98.9	Very high	97.5	Very high	55 Å²	55	54.4 Å²	54.4	28%	0.282	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	103.1	157.9	-54.6	179.3	0	0	0	106.3	Y110 K111 I112 V113 L162 V167 V169	Y110-I160 HydrophobicContact CD1-CD1 3.94Å; K111-I160 PolarHBondContact O-N 2.95Å; I112-I160 WeakPolarHBondContact CA-O 3.27Å; I112-I160 HydrophobicContact CD1-CB 3.83Å; I112-I160 HydrophobicContact CD1-CD1 3.87Å; I112-I160 HydrophobicContact CD1-CG1 4.18Å; I112-I160 HydrophobicContact CD1-CG2 4.49Å; V113-I160 PolarHBondContact N-O 3.39Å; I160-L162 HydrophobicContact CG2-CD2 4.14Å; I160-V167 HydrophobicContact CD1-CG2 4.14Å; I160-V167 HydrophobicContact CG2-CB 4.14Å; I160-V167 HydrophobicContact CG2-CG1 4.15Å; I160-V167 HydrophobicContact CG2-CG2 4.14Å; I160-V169 HydrophobicContact CD1-CG1 4Å
161	Y	98.9	Very high	97.8	Very high	34 Å²	34	51.4 Å²	51.4	13%	0.133	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.4	176.3	178.9	-104.9	0	0	0	110.6	V113 A115 F122 Q153 L156 Q163	V113-Y161 HydrophobicContact CG1-CD2 4.36Å; V113-Y161 CarbonylContact O-C 3.55Å; V113-Y161 WeakPolarHBondContact O-CA 3.23Å; A115-Y161 HydrophobicContact CB-CE2 4.16Å; A115-Y161 WeakPolarHBondContact CB-OH 3.33Å; F122-Y161 HydrophobicContact CD1-CE1 4.27Å; F122-Y161 AromaticContact CD1-CE2 3.97Å; F122-Y161 HydrophobicContact CD1-CE2 3.97Å; F122-Y161 AromaticContact CD1-CZ 3.64Å; F122-Y161 WeakPolarHBondContact CD1-OH 3.31Å; F122-Y161 HydrophobicContact CE1-CD2 4.39Å; F122-Y161 HydrophobicContact CE1-CE1 4.5Å; F122-Y161 AromaticContact CE1-CE2 3.87Å; F122-Y161 HydrophobicContact CE1-CE2 3.87Å; F122-Y161 AromaticContact CE1-CZ 3.95Å; Q153-Y161 HydrophobicContact CB-CD1 4.1Å; Q153-Y161 HydrophobicContact CB-CE1 4.23Å; L156-Y161 HydrophobicContact CD1-CD2 3.76Å; L156-Y161 HydrophobicContact CD1-CE2 4.48Å; L156-Y161 HydrophobicContact CD1-CG 4.24Å; Y161-Q163 HydrophobicContact CE1-CB 3.68Å; Y161-Q163 PolarHBondContact OH-OE1 3.1Å
162	L	98.9	Very high	98.3	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.021	26%	0.262	C	S	.	.			trans	-116.8	137.1	176.1	-57.1	-179.6	0	0	0	110.6	I112 V113 I114 I160 S165 V167 I174	I112-L162 HydrophobicContact CG2-CD1 3.52Å; I112-L162 HydrophobicContact CG2-CG 3.92Å; V113-L162 PolarHBondContact O-N 2.96Å; I114-L162 HydrophobicContact CG2-CB 4.04Å; I114-L162 WeakPolarHBondContact CG2-O 3.22Å; I160-L162 HydrophobicContact CG2-CD2 4.14Å; L162-S165 WeakPolarHBondContact CA-OG 3.19Å; L162-V167 HydrophobicContact CD1-CG1 4.18Å; L162-V167 HydrophobicContact CD2-CB 4.16Å; L162-V167 HydrophobicContact CD2-CG1 4.18Å; L162-I174 HydrophobicContact CD1-CG2 4.3Å
163	Q	98.8	Very high	98.4	Very high	63 Å²	63	49.7 Å²	49.7	29%	0.294	27%	0.273	S	S	.	.	S	Bend	trans	-150.5	106.6	171.8	178.2	176.5	-45.4	0	0	108.6	Y161 S165 P178	Y161-Q163 HydrophobicContact CE1-CB 3.68Å; Y161-Q163 PolarHBondContact OH-OE1 3.1Å; Q163-S165 PolarHBondContact N-OG 3.21Å; Q163-S165 VanDerWaalsContact N-OG 3.09Å; Q163-S165 PolarHBondContact O-N 2.79Å; Q163-P178 HydrophobicContact CG-CG 4.14Å
164	D	98.8	Very high	98.5	Very high	37 Å²	37	45.1 Å²	45.1	20%	0.198	25%	0.252	C	S	.	.	S	Bend	trans	54	33.6	-171.4	-59.3	-28.4	0	0	0	112.1	Y175 G176 A177 W179 K199 L202	D164-Y175 VanDerWaalsContact C-CZ 3.45Å; D164-Y175 WeakPolarHBondContact CA-OH 3.14Å; D164-Y175 PolarHBondContact O-OH 3.46Å; D164-Y175 VanDerWaalsContact O-OH 3.05Å; D164-G176 PolarHBondContact N-O 2.73Å; D164-A177 WeakPolarHBondContact OD1-CB 3.23Å; D164-W179 PolarHBondContact OD1-NE1 3.4Å; D164-W179 PolarHBondContact OD2-NE1 3.06Å; D164-K199 IonicContact OD2-NZ 3.57Å; D164-K199 PolarHBondContact OD2-NZ 2.99Å; D164-L202 HydrophobicContact CB-CD1 4.1Å
165	S	98.8	Very high	98.5	Very high	42 Å²	42	42.6 Å²	42.6	29%	0.294	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	164.5	-170.7	66.4	0	0	0	0	112.5	L162 Q163 G176	L162-S165 WeakPolarHBondContact CA-OG 3.19Å; Q163-S165 PolarHBondContact N-OG 3.21Å; Q163-S165 VanDerWaalsContact N-OG 3.09Å; Q163-S165 PolarHBondContact O-N 2.79Å; S165-G176 PolarHBondContact N-O 3.42Å; S165-G176 PolarHBondContact O-N 2.78Å
166	E	98.8	Very high	98.6	Very high	82 Å²	82	39.6 Å²	39.6	38%	0.383	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	162.2	176.2	63.9	175.8	-176	0	0	113.7	R173 I174 Y175 I207	E166-R173 IonicContact OE1-NH2 3.34Å; E166-R173 PolarHBondContact OE1-NH2 3.34Å; E166-R173 VanDerWaalsContact OE1-NH2 3.13Å; E166-R173 IonicContact OE2-CZ 2.67Å; E166-R173 IonicContact OE2-NE 2.82Å; E166-R173 PolarHBondContact OE2-NE 3.14Å; E166-R173 IonicContact OE2-NH2 3.1Å; E166-R173 PolarHBondContact OE2-NH2 3.41Å; E166-I174 CarbonylContact C-O 3.53Å; E166-I174 WeakPolarHBondContact CA-O 3.44Å; E166-I174 VanDerWaalsContact CB-O 3.32Å; E166-I174 WeakPolarHBondContact CB-O 3.47Å; E166-Y175 HydrophobicContact CB-CD2 3.96Å; E166-I207 WeakPolarHBondContact OE2-CD1 3.38Å
167	V	98.8	Very high	98.6	Very high	30 Å²	30	39.3 Å²	39.3	18%	0.182	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	148.9	165.8	67.8	0	0	0	0	110	I112 I160 L162 V169 I174	I112-V167 HydrophobicContact CD1-CG1 4.17Å; I160-V167 HydrophobicContact CD1-CG2 4.14Å; I160-V167 HydrophobicContact CG2-CB 4.14Å; I160-V167 HydrophobicContact CG2-CG1 4.15Å; I160-V167 HydrophobicContact CG2-CG2 4.14Å; L162-V167 HydrophobicContact CD1-CG1 4.18Å; L162-V167 HydrophobicContact CD2-CB 4.16Å; L162-V167 HydrophobicContact CD2-CG1 4.18Å; V167-V169 HydrophobicContact CG1-CG1 4.38Å; V167-V169 HydrophobicContact CG2-CG1 4Å; V167-I174 HydrophobicContact CG1-CB 4.26Å; V167-I174 PolarHBondContact N-O 2.84Å; V167-I174 PolarHBondContact O-N 3.2Å
168	T	98.6	Very high	98.6	Very high	84 Å²	84	34.3 Å²	34.3	52%	0.515	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.3	168.6	-56.8	0	0	0	0	109.9	F172	T168-F172 VanDerWaalsContact CA-O 3.25Å; T168-F172 WeakPolarHBondContact CA-O 3.2Å
169	V	97.9	Very high	98.6	Very high	7 Å²	7	32.1 Å²	32.1	4%	0.042	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.3	176.3	-68.3	0	0	0	0	110.1	I80 Y110 I160 V167 G171 F172 I174	I80-V169 HydrophobicContact CD1-CB 4.46Å; I80-V169 HydrophobicContact CD1-CG2 3.78Å; Y110-V169 HydrophobicContact CD1-CG1 3.87Å; Y110-V169 HydrophobicContact CD2-CB 4.13Å; Y110-V169 HydrophobicContact CD2-CG1 4.34Å; Y110-V169 HydrophobicContact CE1-CG1 4.08Å; Y110-V169 HydrophobicContact CE2-CB 4.29Å; Y110-V169 HydrophobicContact CG-CB 4.27Å; Y110-V169 HydrophobicContact CG-CG1 4.02Å; I160-V169 HydrophobicContact CD1-CG1 4Å; V167-V169 HydrophobicContact CG1-CG1 4.38Å; V167-V169 HydrophobicContact CG2-CG1 4Å; V169-G171 PolarHBondContact O-N 2.85Å; V169-F172 PolarHBondContact N-O 2.66Å; V169-F172 WeakPolarHBondContact O-CB 3.35Å; V169-F172 PolarHBondContact O-N 3.31Å; V169-I174 HydrophobicContact CG2-CD1 3.55Å; V169-I174 HydrophobicContact CG2-CG1 4.35Å
170	K	96.7	Very high	98.5	Very high	81 Å²	81	31.5 Å²	31.5	35%	0.352	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	32.9	-176.1	-49.4	-175.1	80.1	77.8	0	113.6	T58 I80 E109 Y110 F172	T58-K170 HydrophobicContact CG2-CD 4.28Å; I80-K170 HydrophobicContact CD1-CD 3.95Å; I80-K170 HydrophobicContact CD1-CG 4.29Å; I80-K170 HydrophobicContact CG1-CD 4.45Å; E109-K170 IonicContact OE1-NZ 3.53Å; E109-K170 IonicContact OE2-NZ 3.34Å; E109-K170 PolarHBondContact OE2-NZ 3.37Å; Y110-K170 HydrophobicContact CD2-CG 4.48Å; Y110-K170 HydrophobicContact CE2-CD 4.47Å; Y110-K170 HydrophobicContact CE2-CG 3.99Å; K170-F172 VanDerWaalsContact C-N 3.29Å; K170-F172 HydrophobicContact CB-CD2 4.27Å; K170-F172 PolarHBondContact O-N 2.85Å
171	G	97.2	Very high	98.3	Very high	39 Å²	39	29.7 Å²	29.7	40%	0.402	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-11	-177.2	0	0	0	0	0	115.6	V169	V169-G171 PolarHBondContact O-N 2.85Å
172	F	98.6	Very high	97.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	129.4	175.4	-65.6	-85.2	0	0	0	110.9	T58 F60 T168 V169 K170 I174 D208 I209 L288 P289 T290 P291	T58-F172 HydrophobicContact CG2-CE2 4.01Å; F60-F172 HydrophobicContact CE2-CE1 4.13Å; F60-F172 HydrophobicContact CE2-CE2 4.18Å; F60-F172 AromaticContact CE2-CZ 3.9Å; F60-F172 HydrophobicContact CE2-CZ 3.9Å; F60-F172 HydrophobicContact CZ-CD1 4.13Å; F60-F172 AromaticContact CZ-CD2 3.83Å; F60-F172 HydrophobicContact CZ-CD2 3.83Å; F60-F172 HydrophobicContact CZ-CE1 4.11Å; F60-F172 AromaticContact CZ-CE2 3.83Å; F60-F172 HydrophobicContact CZ-CE2 3.83Å; F60-F172 AromaticContact CZ-CG 3.96Å; F60-F172 HydrophobicContact CZ-CG 3.96Å; F60-F172 AromaticContact CZ-CZ 3.95Å; F60-F172 HydrophobicContact CZ-CZ 3.95Å; T168-F172 VanDerWaalsContact CA-O 3.25Å; T168-F172 WeakPolarHBondContact CA-O 3.2Å; V169-F172 PolarHBondContact N-O 2.66Å; V169-F172 WeakPolarHBondContact O-CB 3.35Å; V169-F172 PolarHBondContact O-N 3.31Å; K170-F172 VanDerWaalsContact C-N 3.29Å; K170-F172 HydrophobicContact CB-CD2 4.27Å; K170-F172 PolarHBondContact O-N 2.85Å; F172-I174 HydrophobicContact CB-CG1 4.23Å; F172-D208 HydrophobicContact CD1-CB 4.07Å; F172-I209 HydrophobicContact CD1-CD1 4.34Å; F172-L288 HydrophobicContact CE1-CB 3.68Å; F172-L288 HydrophobicContact CE1-CD1 4.05Å; F172-L288 HydrophobicContact CZ-CB 3.94Å; F172-P289 WeakPolarHBondContact CZ-O 3.13Å; F172-T290 HydrophobicContact CE2-CG2 4.19Å; F172-P291 HydrophobicContact CD1-CG 3.96Å; F172-P291 HydrophobicContact CD2-CG 4.48Å; F172-P291 HydrophobicContact CE1-CG 4.08Å; F172-P291 HydrophobicContact CG-CG 4.19Å; F172-P291 HydrophobicContact CZ-CG 4.41Å
173	R	98.8	Very high	96.9	Very high	68 Å²	68	40.8 Å²	40.8	26%	0.257	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	118.6	168.4	-67	-177	66.1	-153	4.5	109.9	E166 E205 G206 I207 D208 I209	E166-R173 IonicContact OE1-NH2 3.34Å; E166-R173 PolarHBondContact OE1-NH2 3.34Å; E166-R173 VanDerWaalsContact OE1-NH2 3.13Å; E166-R173 IonicContact OE2-CZ 2.67Å; E166-R173 IonicContact OE2-NE 2.82Å; E166-R173 PolarHBondContact OE2-NE 3.14Å; E166-R173 IonicContact OE2-NH2 3.1Å; E166-R173 PolarHBondContact OE2-NH2 3.41Å; R173-E205 PolarHBondContact NH1-O 3.03Å; R173-G206 PolarHBondContact NH1-O 3.1Å; R173-I207 HydrophobicContact CB-CD1 4.05Å; R173-D208 PolarHBondContact N-OD2 2.85Å; R173-D208 VanDerWaalsContact N-OD2 3.07Å; R173-D208 PolarHBondContact O-N 2.94Å; R173-I209 PolarHBondContact O-N 3.42Å; R173-I209 VanDerWaalsContact O-N 3.13Å
174	I	98.9	Very high	96	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.4	-176.3	-48.9	-174.7	0	0	0	108.7	F60 L82 I112 L162 E166 V167 V169 F172 I209 M211	F60-I174 HydrophobicContact CE1-CD1 4.34Å; L82-I174 HydrophobicContact CD2-CD1 4.3Å; I112-I174 HydrophobicContact CG1-CD1 4.25Å; I112-I174 HydrophobicContact CG2-CG2 4.35Å; L162-I174 HydrophobicContact CD1-CG2 4.3Å; E166-I174 CarbonylContact C-O 3.53Å; E166-I174 WeakPolarHBondContact CA-O 3.44Å; E166-I174 VanDerWaalsContact CB-O 3.32Å; E166-I174 WeakPolarHBondContact CB-O 3.47Å; V167-I174 HydrophobicContact CG1-CB 4.26Å; V167-I174 PolarHBondContact N-O 2.84Å; V167-I174 PolarHBondContact O-N 3.2Å; V169-I174 HydrophobicContact CG2-CD1 3.55Å; V169-I174 HydrophobicContact CG2-CG1 4.35Å; F172-I174 HydrophobicContact CB-CG1 4.23Å; I174-I209 VanDerWaalsContact CA-O 3.32Å; I174-I209 WeakPolarHBondContact CA-O 3.17Å; I174-I209 HydrophobicContact CB-CB 4.49Å; I174-I209 HydrophobicContact CD1-CD1 4.18Å; I174-I209 HydrophobicContact CG1-CB 4.14Å; I174-I209 HydrophobicContact CG1-CD1 4.27Å; I174-I209 HydrophobicContact CG2-CB 4.17Å; I174-I209 HydrophobicContact CG2-CG2 4.26Å; I174-M211 HydrophobicContact CG2-CG 4.29Å; I174-M211 HydrophobicContact CG2-SD 3.83Å
175	Y	98.9	Very high	95.4	Very high	6 Å²	6	41.1 Å²	41.1	2%	0.024	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.3	176.4	-171.6	-83	0	0	0	110.4	D164 E166 A177 L202 I203 P204 I209 L210 M211	D164-Y175 VanDerWaalsContact C-CZ 3.45Å; D164-Y175 WeakPolarHBondContact CA-OH 3.14Å; D164-Y175 PolarHBondContact O-OH 3.46Å; D164-Y175 VanDerWaalsContact O-OH 3.05Å; E166-Y175 HydrophobicContact CB-CD2 3.96Å; Y175-A177 HydrophobicContact CE1-CB 4.05Å; Y175-L202 VanDerWaalsContact OH-CB 3.31Å; Y175-L202 WeakPolarHBondContact OH-CB 3.47Å; Y175-I203 HydrophobicContact CD1-CB 4.4Å; Y175-I203 HydrophobicContact CD1-CG1 3.87Å; Y175-I203 HydrophobicContact CD1-CG2 4.21Å; Y175-I203 HydrophobicContact CE1-CB 4.39Å; Y175-I203 HydrophobicContact CE1-CG1 3.65Å; Y175-I203 HydrophobicContact CG-CG2 4.25Å; Y175-P204 VanDerWaalsContact CD2-CD 3.41Å; Y175-P204 HydrophobicContact CD2-CG 4.29Å; Y175-I209 PolarHBondContact N-O 3.28Å; Y175-L210 HydrophobicContact CD1-CD1 3.9Å; Y175-M211 PolarHBondContact O-N 2.8Å
176	G	98.9	Very high	95.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.7	-177.3	0	0	0	0	0	113.8	D164 S165 M211	D164-G176 PolarHBondContact N-O 2.73Å; S165-G176 PolarHBondContact N-O 3.42Å; S165-G176 PolarHBondContact O-N 2.78Å; G176-M211 WeakPolarHBondContact CA-O 3.43Å
177	A	98.9	Very high	95	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	138.4	175.8	0	0	0	0	0	112.7	D164 Y175 W200 M211 T212 H213	D164-A177 WeakPolarHBondContact OD1-CB 3.23Å; Y175-A177 HydrophobicContact CE1-CB 4.05Å; A177-W200 HydrophobicContact CB-CZ3 4.01Å; A177-M211 PolarHBondContact N-O 3.31Å; A177-T212 VanDerWaalsContact O-CA 3.29Å; A177-T212 WeakPolarHBondContact O-CA 3.3Å; A177-H213 PolarHBondContact O-N 3.22Å
178	P	98.8	Very high	94.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.181	C	C	.	.			trans	-87.6	-12.7	-172.1	35.1	-38.1	0	0	0	114.6	A115 Q163 F188 H213	A115-P178 HydrophobicContact CB-CB 4.03Å; A115-P178 WeakPolarHBondContact O-CA 3.42Å; A115-P178 VanDerWaalsContact O-CB 3.24Å; A115-P178 WeakPolarHBondContact O-CB 3.28Å; Q163-P178 HydrophobicContact CG-CG 4.14Å; P178-F188 HydrophobicContact CB-CB 4.09Å; P178-F188 HydrophobicContact CB-CD1 3.84Å; P178-F188 HydrophobicContact CB-CD2 4.08Å; P178-F188 HydrophobicContact CB-CE1 4.23Å; P178-F188 HydrophobicContact CB-CE2 4.45Å; P178-F188 HydrophobicContact CB-CG 3.73Å; P178-F188 HydrophobicContact CG-CB 4.29Å; P178-F188 HydrophobicContact CG-CD1 3.32Å; P178-F188 HydrophobicContact CG-CD2 4.43Å; P178-F188 HydrophobicContact CG-CE1 3.58Å; P178-F188 HydrophobicContact CG-CG 3.77Å; P178-F188 HydrophobicContact CG-CZ 4.23Å; P178-H213 WeakPolarHBondContact O-CB 3.25Å
179	W	98.7	Very high	94.9	Very high	19 Å²	19	33.4 Å²	33.4	7%	0.072	16%	0.163	C	C	.	.			trans	-64.4	137.6	-164.8	-53.4	100.8	0	0	0	113.9	D164 F188 L190 L196 K199 W200	D164-W179 PolarHBondContact OD1-NE1 3.4Å; D164-W179 PolarHBondContact OD2-NE1 3.06Å; W179-F188 WeakPolarHBondContact CA-O 3.44Å; W179-F188 HydrophobicContact CD2-CD1 4.46Å; W179-F188 HydrophobicContact CE3-CB 4.15Å; W179-F188 HydrophobicContact CE3-CD1 4.17Å; W179-F188 HydrophobicContact CH2-CD1 4.06Å; W179-F188 HydrophobicContact CZ2-CD1 4.31Å; W179-F188 HydrophobicContact CZ3-CB 4.48Å; W179-F188 AromaticContact CZ3-CD1 3.98Å; W179-F188 HydrophobicContact CZ3-CD1 3.98Å; W179-L190 HydrophobicContact CB-CD1 4.48Å; W179-L190 HydrophobicContact CD2-CD1 3.77Å; W179-L190 HydrophobicContact CD2-CG 4.39Å; W179-L190 HydrophobicContact CE3-CD1 3.45Å; W179-L190 VanDerWaalsContact CE3-CD1 3.45Å; W179-L190 HydrophobicContact CE3-CD2 4.43Å; W179-L190 HydrophobicContact CE3-CG 3.6Å; W179-L190 HydrophobicContact CG-CD1 4.21Å; W179-L190 HydrophobicContact CZ3-CD1 3.96Å; W179-L190 HydrophobicContact CZ3-CD2 4.29Å; W179-L190 HydrophobicContact CZ3-CG 3.95Å; W179-L196 HydrophobicContact CB-CD2 3.9Å; W179-K199 HydrophobicContact CD2-CD 4.36Å; W179-K199 HydrophobicContact CD2-CG 4.15Å; W179-K199 HydrophobicContact CG-CB 4.27Å; W179-K199 HydrophobicContact CG-CD 4.36Å; W179-K199 HydrophobicContact CG-CG 3.83Å; W179-K199 HydrophobicContact CZ2-CD 4.35Å; W179-K199 VanDerWaalsContact CZ2-CE 3.44Å; W179-W200 HydrophobicContact CB-CH2 3.94Å; W179-W200 HydrophobicContact CB-CZ2 4.44Å; W179-W200 VanDerWaalsContact O-CH2 3.25Å; W179-W200 WeakPolarHBondContact O-CH2 3.12Å
180	T	97.3	Very high	94.9	Very high	11 Å²	11	34.4 Å²	34.4	7%	0.067	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.3	174.8	52.2	0	0	0	0	111.4	W182 F188 N189 L190 H213	T180-W182 PolarHBondContact O-N 2.98Å; T180-F188 PolarHBondContact N-O 2.71Å; T180-N189 WeakPolarHBondContact O-CA 3.33Å; T180-N189 PolarHBondContact OG1-ND2 3.44Å; T180-L190 PolarHBondContact O-N 3.31Å; T180-H213 HydrophobicContact CG2-CB 4.12Å
181	P	95.3	Very high	94.9	Very high	17 Å²	17	34.2 Å²	34.2	11%	0.11	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	134.3	166.4	-21.8	31.9	0	0	0	111.2	F183 R192 L196 C232	P181-F183 PolarHBondContact O-N 2.89Å; P181-R192 HydrophobicContact CB-CG 3.83Å; P181-R192 VanDerWaalsContact CB-CZ 3.45Å; P181-R192 HydrophobicContact CG-CG 4.49Å; P181-L196 HydrophobicContact CB-CD1 4.04Å; P181-L196 HydrophobicContact CG-CD1 3.67Å; P181-C232 HydrophobicContact CG-CB 3.85Å
182	W	86.3	Confident	95	Very high	171 Å²	171	35.6 Å²	35.6	65%	0.648	17%	0.168	S	C	*	.			trans	-45.4	130.9	-175.1	-175	89.7	0	0	0	114.3	T180 N189 L190	T180-W182 PolarHBondContact O-N 2.98Å; W182-N189 HydrophobicContact CB-CB 4.32Å; W182-N189 HydrophobicContact CG-CB 4.37Å; W182-L190 PolarHBondContact N-O 3.13Å
183	F	80.6	Confident	95	Very high	100 Å²	100	35.9 Å²	35.9	44%	0.439	17%	0.17	S	C	.	.			trans	-150.5	114	178.6	-178.9	-107.1	0	0	0	110.7	P181 G185 N189	P181-F183 PolarHBondContact O-N 2.89Å; F183-G185 PolarHBondContact O-N 2.96Å; F183-N189 PolarHBondContact N-OD1 3.31Å; F183-N189 PolarHBondContact O-OD1 2.9Å
184	N	80.6	Confident	95	Very high	84 Å²	84	37.2 Å²	37.2	45%	0.449	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	14.6	170.6	-68.7	-31.7	0	0	0	116.8	R137	R137-N184 PolarHBondContact NH2-O 2.79Å
185	G	85.5	Confident	95	Very high	22 Å²	22	39.4 Å²	39.4	23%	0.227	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	43.5	174.9	0	0	0	0	0	113.6	F126 F183	F126-G185 WeakPolarHBondContact CE2-O 3.32Å; F183-G185 PolarHBondContact O-N 2.96Å
186	W	93.8	Very high	94.9	Very high	52 Å²	52	39.1 Å²	39.1	20%	0.197	19%	0.194	C	C	.	.			trans	-93.4	176.7	168.1	-70.4	94.3	0	0	0	111	L90 N117 H118 L120 F138	L90-W186 HydrophobicContact CD2-CH2 4.37Å; L90-W186 HydrophobicContact CD2-CZ3 4.05Å; N117-W186 HydrophobicContact CB-CB 3.72Å; H118-W186 AromaticContact CE1-CH2 3.43Å; H118-W186 VanDerWaalsContact CE1-CH2 3.43Å; H118-W186 WeakPolarHBondContact CE1-CH2 3.43Å; H118-W186 AromaticContact CE1-CZ2 3.96Å; H118-W186 AromaticContact CE1-CZ3 3.62Å; H118-W186 AromaticContact CG-CZ3 3.97Å; H118-W186 AromaticContact ND1-CH2 3.77Å; H118-W186 AromaticContact ND1-CZ3 3.53Å; L120-W186 HydrophobicContact CD1-CE3 4.46Å; L120-W186 HydrophobicContact CD1-CZ3 4.41Å; L120-W186 HydrophobicContact CD2-CE3 4Å; L120-W186 HydrophobicContact CG-CE3 4.48Å; F138-W186 HydrophobicContact CE1-CE3 4.27Å; F138-W186 AromaticContact CE1-CH2 3.84Å; F138-W186 HydrophobicContact CE1-CH2 3.84Å; F138-W186 HydrophobicContact CE1-CZ2 4.35Å; F138-W186 AromaticContact CE1-CZ3 3.8Å; F138-W186 HydrophobicContact CE1-CZ3 3.8Å; F138-W186 HydrophobicContact CZ-CD2 4.36Å; F138-W186 HydrophobicContact CZ-CE3 4.18Å; F138-W186 HydrophobicContact CZ-CH2 4.33Å; F138-W186 HydrophobicContact CZ-CZ3 4.17Å
187	G	95.9	Very high	94.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	160.7	179	0	0	0	0	0	112.8	N117 L120 N189	N117-G187 WeakPolarHBondContact CA-O 3.07Å; N117-G187 WeakPolarHBondContact CB-O 3.45Å; N117-G187 PolarHBondContact O-N 3.32Å; N117-G187 VanDerWaalsContact O-N 3.11Å; L120-G187 VanDerWaalsContact CD2-N 3.28Å; G187-N189 PolarHBondContact O-N 3.24Å
188	F	97.8	Very high	94.9	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	25	176.7	-59.2	-74.6	0	0	0	115	A115 G116 E119 F122 D123 P178 W179 T180	A115-F188 HydrophobicContact CB-CD2 4.31Å; A115-F188 HydrophobicContact CB-CE2 3.69Å; A115-F188 HydrophobicContact CB-CZ 4.1Å; G116-F188 VanDerWaalsContact O-CD2 3.31Å; G116-F188 WeakPolarHBondContact O-CD2 3.32Å; E119-F188 HydrophobicContact CB-CE2 4.41Å; F122-F188 HydrophobicContact CB-CE2 3.83Å; F122-F188 HydrophobicContact CB-CZ 3.64Å; D123-F188 HydrophobicContact CB-CD1 4.3Å; D123-F188 HydrophobicContact CB-CD2 4.18Å; D123-F188 HydrophobicContact CB-CE1 4.06Å; D123-F188 HydrophobicContact CB-CE2 3.94Å; D123-F188 HydrophobicContact CB-CG 4.38Å; D123-F188 HydrophobicContact CB-CZ 3.89Å; D123-F188 PolarHBondContact OD2-N 3.48Å; P178-F188 HydrophobicContact CB-CB 4.09Å; P178-F188 HydrophobicContact CB-CD1 3.84Å; P178-F188 HydrophobicContact CB-CD2 4.08Å; P178-F188 HydrophobicContact CB-CE1 4.23Å; P178-F188 HydrophobicContact CB-CE2 4.45Å; P178-F188 HydrophobicContact CB-CG 3.73Å; P178-F188 HydrophobicContact CG-CB 4.29Å; P178-F188 HydrophobicContact CG-CD1 3.32Å; P178-F188 HydrophobicContact CG-CD2 4.43Å; P178-F188 HydrophobicContact CG-CE1 3.58Å; P178-F188 HydrophobicContact CG-CG 3.77Å; P178-F188 HydrophobicContact CG-CZ 4.23Å; W179-F188 WeakPolarHBondContact CA-O 3.44Å; W179-F188 HydrophobicContact CD2-CD1 4.46Å; W179-F188 HydrophobicContact CE3-CB 4.15Å; W179-F188 HydrophobicContact CE3-CD1 4.17Å; W179-F188 HydrophobicContact CH2-CD1 4.06Å; W179-F188 HydrophobicContact CZ2-CD1 4.31Å; W179-F188 HydrophobicContact CZ3-CB 4.48Å; W179-F188 AromaticContact CZ3-CD1 3.98Å; W179-F188 HydrophobicContact CZ3-CD1 3.98Å; T180-F188 PolarHBondContact N-O 2.71Å
189	N	97	Very high	94.9	Very high	23 Å²	23	45.6 Å²	45.6	12%	0.123	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	128.2	174.3	-83.8	-174	0	0	0	110.9	T180 W182 F183 G187	T180-N189 WeakPolarHBondContact O-CA 3.33Å; T180-N189 PolarHBondContact OG1-ND2 3.44Å; W182-N189 HydrophobicContact CB-CB 4.32Å; W182-N189 HydrophobicContact CG-CB 4.37Å; F183-N189 PolarHBondContact N-OD1 3.31Å; F183-N189 PolarHBondContact O-OD1 2.9Å; G187-N189 PolarHBondContact O-N 3.24Å
190	L	97.8	Very high	94.9	Very high	29 Å²	29	44.8 Å²	44.8	15%	0.152	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	153.6	171.1	-70.9	173.4	0	0	0	111.2	W179 T180 W182 L196 K199	W179-L190 HydrophobicContact CB-CD1 4.48Å; W179-L190 HydrophobicContact CD2-CD1 3.77Å; W179-L190 HydrophobicContact CD2-CG 4.39Å; W179-L190 HydrophobicContact CE3-CD1 3.45Å; W179-L190 VanDerWaalsContact CE3-CD1 3.45Å; W179-L190 HydrophobicContact CE3-CD2 4.43Å; W179-L190 HydrophobicContact CE3-CG 3.6Å; W179-L190 HydrophobicContact CG-CD1 4.21Å; W179-L190 HydrophobicContact CZ3-CD1 3.96Å; W179-L190 HydrophobicContact CZ3-CD2 4.29Å; W179-L190 HydrophobicContact CZ3-CG 3.95Å; T180-L190 PolarHBondContact O-N 3.31Å; W182-L190 PolarHBondContact N-O 3.13Å; L190-L196 HydrophobicContact CB-CD2 3.87Å; L190-L196 HydrophobicContact CB-CG 4.05Å; L190-L196 HydrophobicContact CD1-CD2 4.37Å; L190-K199 HydrophobicContact CD1-CG 3.77Å
191	P	98	Very high	95	Very high	77 Å²	77	47.7 Å²	47.7	50%	0.5	24%	0.238	S	C	.	.			trans	-55.5	144.4	168.4	-24.3	34.6	0	0	0	111.8
192	R	98.6	Very high	95.2	Very high	68 Å²	68	51.2 Å²	51.2	26%	0.257	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	156.7	170.3	-68.5	178.3	-178.8	-84.6	-5.8	110.7	S19 P181 V230 G231	S19-R192 WeakPolarHBondContact O-CD 3.49Å; P181-R192 HydrophobicContact CB-CG 3.83Å; P181-R192 VanDerWaalsContact CB-CZ 3.45Å; P181-R192 HydrophobicContact CG-CG 4.49Å; R192-V230 PolarHBondContact NH2-O 3.06Å; R192-G231 PolarHBondContact NH1-O 2.96Å
193	G	98.5	Very high	95.8	Very high	5 Å²	5	43.1 Å²	43.1	5%	0.052	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	-131	-179.5	0	0	0	0	0	111.9	S19 S195 L196 L197	S19-G193 WeakPolarHBondContact OG-CA 3.13Å; S19-G193 PolarHBondContact OG-N 2.88Å; G193-S195 PolarHBondContact O-N 3.04Å; G193-L196 PolarHBondContact O-N 3.44Å; G193-L197 PolarHBondContact O-N 3.45Å
194	Q	98.7	Very high	96.6	Very high	96 Å²	96	40.1 Å²	40.1	45%	0.449	22%	0.215	S	C	.	.	H	α-helix	trans	-62.1	-40.5	-166.2	-167.6	62.4	52.1	0	0	113.1	V15 L196 L197 D198	V15-Q194 HydrophobicContact CG2-CB 4.02Å; V15-Q194 VanDerWaalsContact CG2-OE1 3.31Å; Q194-L196 VanDerWaalsContact C-N 3.31Å; Q194-L196 PolarHBondContact O-N 2.71Å; Q194-L197 PolarHBondContact O-N 3.17Å; Q194-L197 VanDerWaalsContact O-N 3.09Å; Q194-D198 PolarHBondContact NE2-OD1 3.29Å; Q194-D198 PolarHBondContact O-N 3.24Å
195	S	98.4	Very high	97.4	Very high	46 Å²	46	40.5 Å²	40.5	32%	0.322	22%	0.215	S	C	.	.	H	α-helix	trans	-58.7	-42	-178.2	-50.9	0	0	0	0	112.5	G193	G193-S195 PolarHBondContact O-N 3.04Å
196	L	98.8	Very high	97.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-74.7	-40.1	173.8	-77.4	175.8	0	0	0	112	W179 P181 L190 G193 Q194 D198 K199 W200 C232	W179-L196 HydrophobicContact CB-CD2 3.9Å; P181-L196 HydrophobicContact CB-CD1 4.04Å; P181-L196 HydrophobicContact CG-CD1 3.67Å; L190-L196 HydrophobicContact CB-CD2 3.87Å; L190-L196 HydrophobicContact CB-CG 4.05Å; L190-L196 HydrophobicContact CD1-CD2 4.37Å; G193-L196 PolarHBondContact O-N 3.44Å; Q194-L196 VanDerWaalsContact C-N 3.31Å; Q194-L196 PolarHBondContact O-N 2.71Å; L196-D198 PolarHBondContact O-N 3.47Å; L196-K199 WeakPolarHBondContact O-CB 3.44Å; L196-K199 PolarHBondContact O-N 3.37Å; L196-W200 HydrophobicContact CD2-CZ2 3.88Å; L196-W200 PolarHBondContact O-N 2.86Å; L196-W200 PolarHBondContact O-NE1 3.36Å; L196-C232 HydrophobicContact CD1-CB 4.5Å
197	L	98.8	Very high	98	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-58.7	-37.6	177	-176.3	56.2	0	0	0	112.3	I13 V15 G193 Q194 K199 W200 N201 E234	I13-L197 HydrophobicContact CB-CD1 4.02Å; I13-L197 HydrophobicContact CG2-CD1 3.67Å; V15-L197 HydrophobicContact CG2-CB 4.49Å; V15-L197 HydrophobicContact CG2-CD2 3.76Å; G193-L197 PolarHBondContact O-N 3.45Å; Q194-L197 PolarHBondContact O-N 3.17Å; Q194-L197 VanDerWaalsContact O-N 3.09Å; L197-K199 PolarHBondContact O-N 2.83Å; L197-W200 CarbonylContact O-C 3.55Å; L197-W200 PolarHBondContact O-N 3.3Å; L197-W200 VanDerWaalsContact O-N 3.14Å; L197-N201 WeakPolarHBondContact O-CB 3.37Å; L197-N201 PolarHBondContact O-N 3Å; L197-N201 PolarHBondContact O-ND2 2.89Å; L197-E234 HydrophobicContact CB-CB 4.27Å; L197-E234 HydrophobicContact CB-CG 3.88Å; L197-E234 HydrophobicContact CD1-CB 4.19Å; L197-E234 HydrophobicContact CD1-CG 4.25Å; L197-E234 HydrophobicContact CG-CG 4.43Å
198	D	98.8	Very high	98.1	Very high	82 Å²	82	40.7 Å²	40.7	44%	0.439	23%	0.226	S	C	.	.	H	α-helix	trans	-58.7	-39.3	176.1	-70.5	-23.5	0	0	0	111.2	Q194 L196	Q194-D198 PolarHBondContact NE2-OD1 3.29Å; Q194-D198 PolarHBondContact O-N 3.24Å; L196-D198 PolarHBondContact O-N 3.47Å
199	K	98.8	Very high	98.2	Very high	53 Å²	53	40.7 Å²	40.7	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-68.9	-46	172.9	-58.3	-58.3	-169.9	164.6	0	111.6	D164 W179 L190 L196 L197 N201 L202	D164-K199 IonicContact OD2-NZ 3.57Å; D164-K199 PolarHBondContact OD2-NZ 2.99Å; W179-K199 HydrophobicContact CD2-CD 4.36Å; W179-K199 HydrophobicContact CD2-CG 4.15Å; W179-K199 HydrophobicContact CG-CB 4.27Å; W179-K199 HydrophobicContact CG-CD 4.36Å; W179-K199 HydrophobicContact CG-CG 3.83Å; W179-K199 HydrophobicContact CZ2-CD 4.35Å; W179-K199 VanDerWaalsContact CZ2-CE 3.44Å; L190-K199 HydrophobicContact CD1-CG 3.77Å; L196-K199 WeakPolarHBondContact O-CB 3.44Å; L196-K199 PolarHBondContact O-N 3.37Å; L197-K199 PolarHBondContact O-N 2.83Å; K199-N201 PolarHBondContact O-N 3Å; K199-L202 HydrophobicContact CD-CD1 4.44Å; K199-L202 VanDerWaalsContact O-CB 3.27Å; K199-L202 WeakPolarHBondContact O-CB 3.3Å; K199-L202 PolarHBondContact O-N 3.1Å
200	W	98.8	Very high	98.3	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-67.3	-23.4	179.9	-50.5	144.4	0	0	0	113.8	A177 W179 L196 L197 L202 I203 T212 C232 L235 T238 R242	A177-W200 HydrophobicContact CB-CZ3 4.01Å; W179-W200 HydrophobicContact CB-CH2 3.94Å; W179-W200 HydrophobicContact CB-CZ2 4.44Å; W179-W200 VanDerWaalsContact O-CH2 3.25Å; W179-W200 WeakPolarHBondContact O-CH2 3.12Å; L196-W200 HydrophobicContact CD2-CZ2 3.88Å; L196-W200 PolarHBondContact O-N 2.86Å; L196-W200 PolarHBondContact O-NE1 3.36Å; L197-W200 CarbonylContact O-C 3.55Å; L197-W200 PolarHBondContact O-N 3.3Å; L197-W200 VanDerWaalsContact O-N 3.14Å; W200-L202 PolarHBondContact O-N 2.8Å; W200-I203 HydrophobicContact CB-CD1 4.29Å; W200-I203 HydrophobicContact CE3-CD1 4.02Å; W200-I203 WeakPolarHBondContact O-CB 3.31Å; W200-I203 WeakPolarHBondContact O-CG1 3.24Å; W200-I203 PolarHBondContact O-N 3.39Å; W200-T212 HydrophobicContact CH2-CG2 4.13Å; W200-T212 HydrophobicContact CZ3-CG2 3.93Å; W200-C232 PolarHBondContact NE1-SG 3.32Å; W200-L235 HydrophobicContact CD2-CB 4.47Å; W200-L235 HydrophobicContact CD2-CD1 3.83Å; W200-L235 HydrophobicContact CE3-CD1 4.01Å; W200-L235 HydrophobicContact CG-CD1 4.22Å; W200-L235 HydrophobicContact CH2-CD2 4.46Å; W200-L235 HydrophobicContact CZ2-CB 4.41Å; W200-L235 HydrophobicContact CZ2-CD1 4.37Å; W200-L235 HydrophobicContact CZ2-CD2 4.2Å; W200-L235 HydrophobicContact CZ3-CD1 4.35Å; W200-T238 HydrophobicContact CB-CG2 4.25Å; W200-R242 PolarHBondContact O-NH2 3.11Å
201	N	98.7	Very high	98.3	Very high	72 Å²	72	38.2 Å²	38.2	39%	0.385	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-20	172.6	-78.1	-26.4	0	0	0	113	L197 K199 I203	L197-N201 WeakPolarHBondContact O-CB 3.37Å; L197-N201 PolarHBondContact O-N 3Å; L197-N201 PolarHBondContact O-ND2 2.89Å; K199-N201 PolarHBondContact O-N 3Å; N201-I203 VanDerWaalsContact C-N 3.29Å
202	L	98.7	Very high	98.4	Very high	91 Å²	91	34.5 Å²	34.5	48%	0.476	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.6	175.1	-57.1	176.4	0	0	0	112.5	D164 Y175 K199 W200 P204	D164-L202 HydrophobicContact CB-CD1 4.1Å; Y175-L202 VanDerWaalsContact OH-CB 3.31Å; Y175-L202 WeakPolarHBondContact OH-CB 3.47Å; K199-L202 HydrophobicContact CD-CD1 4.44Å; K199-L202 VanDerWaalsContact O-CB 3.27Å; K199-L202 WeakPolarHBondContact O-CB 3.3Å; K199-L202 PolarHBondContact O-N 3.1Å; W200-L202 PolarHBondContact O-N 2.8Å; L202-P204 WeakPolarHBondContact O-CD 3.37Å
203	I	98.8	Very high	98.4	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.177	C	C	.	.	S	Bend	trans	-64.9	117.3	-179	-52.9	167.7	0	0	0	109	Y175 W200 N201 I207 L210 L235 T238 R242 V243	Y175-I203 HydrophobicContact CD1-CB 4.4Å; Y175-I203 HydrophobicContact CD1-CG1 3.87Å; Y175-I203 HydrophobicContact CD1-CG2 4.21Å; Y175-I203 HydrophobicContact CE1-CB 4.39Å; Y175-I203 HydrophobicContact CE1-CG1 3.65Å; Y175-I203 HydrophobicContact CG-CG2 4.25Å; W200-I203 HydrophobicContact CB-CD1 4.29Å; W200-I203 HydrophobicContact CE3-CD1 4.02Å; W200-I203 WeakPolarHBondContact O-CB 3.31Å; W200-I203 WeakPolarHBondContact O-CG1 3.24Å; W200-I203 PolarHBondContact O-N 3.39Å; N201-I203 VanDerWaalsContact C-N 3.29Å; I203-I207 HydrophobicContact CG2-CG1 4.17Å; I203-L210 HydrophobicContact CD1-CD1 3.92Å; I203-L210 HydrophobicContact CD1-CD2 4.15Å; I203-L210 HydrophobicContact CG1-CD1 4.32Å; I203-L210 HydrophobicContact CG2-CD1 4.15Å; I203-L235 HydrophobicContact CD1-CD1 4.39Å; I203-T238 HydrophobicContact CD1-CG2 4.27Å; I203-R242 VanDerWaalsContact O-CZ 3.3Å; I203-R242 PolarHBondContact O-NH1 2.96Å; I203-R242 PolarHBondContact O-NH2 3.34Å; I203-V243 HydrophobicContact CB-CG2 4.05Å; I203-V243 HydrophobicContact CG2-CB 4.4Å; I203-V243 HydrophobicContact CG2-CG1 3.83Å; I203-V243 HydrophobicContact CG2-CG2 3.69Å
204	P	98	Very high	98.4	Very high	37 Å²	37	31.4 Å²	31.4	24%	0.24	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-64.5	158.1	178.9	-21.5	34	0	0	0	112.4	Y175 L202 I207	Y175-P204 VanDerWaalsContact CD2-CD 3.41Å; Y175-P204 HydrophobicContact CD2-CG 4.29Å; L202-P204 WeakPolarHBondContact O-CD 3.37Å; P204-I207 HydrophobicContact CB-CD1 4.34Å; P204-I207 HydrophobicContact CB-CG1 4.31Å; P204-I207 HydrophobicContact CG-CD1 4.31Å; P204-I207 WeakPolarHBondContact O-CG1 3.46Å
205	E	96.6	Very high	98.4	Very high	93 Å²	93	27.2 Å²	27.2	44%	0.435	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	152.5	163.2	-68.9	171.3	-154.9	0	0	110.1	R173 R242	R173-E205 PolarHBondContact NH1-O 3.03Å; E205-R242 HydrophobicContact CG-CG 4.37Å
206	G	94.6	Very high	98.4	Very high	49 Å²	49	25 Å²	25	51%	0.505	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	22.4	179.1	0	0	0	0	0	114.7	R173	R173-G206 PolarHBondContact NH1-O 3.1Å
207	I	98.1	Very high	98.4	Very high	4 Å²	4	25 Å²	25	2%	0.021	14%	0.143	C	C	.	.			trans	-72	130.2	166.2	-67.5	-57.9	0	0	0	108.7	E166 R173 I203 P204 I209 V243 P245	E166-I207 WeakPolarHBondContact OE2-CD1 3.38Å; R173-I207 HydrophobicContact CB-CD1 4.05Å; I203-I207 HydrophobicContact CG2-CG1 4.17Å; P204-I207 HydrophobicContact CB-CD1 4.34Å; P204-I207 HydrophobicContact CB-CG1 4.31Å; P204-I207 HydrophobicContact CG-CD1 4.31Å; P204-I207 WeakPolarHBondContact O-CG1 3.46Å; I207-I209 VanDerWaalsContact CG2-C 3.43Å; I207-I209 WeakPolarHBondContact CG2-O 3.48Å; I207-V243 HydrophobicContact CB-CG1 4.03Å; I207-P245 VanDerWaalsContact O-CA 3.32Å; I207-P245 WeakPolarHBondContact O-CA 3.37Å
208	D	98.8	Very high	98.4	Very high	25 Å²	25	25 Å²	25	13%	0.134	14%	0.144	C	C	.	.	S	Bend	trans	-79.6	-41.3	174.1	-69.3	-74.7	0	0	0	111.1	F172 R173 K246 L247	F172-D208 HydrophobicContact CD1-CB 4.07Å; R173-D208 PolarHBondContact N-OD2 2.85Å; R173-D208 VanDerWaalsContact N-OD2 3.07Å; R173-D208 PolarHBondContact O-N 2.94Å; D208-K246 PolarHBondContact O-N 3.42Å; D208-K246 IonicContact OD1-NZ 3.97Å; D208-K246 PolarHBondContact OD1-NZ 2.82Å; D208-L247 PolarHBondContact O-N 2.85Å
209	I	98.9	Very high	98.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.2	-174	-51.8	179.3	0	0	0	110	F60 L82 F172 R173 I174 Y175 I207 L247 L288	F60-I209 HydrophobicContact CD1-CD1 3.84Å; F60-I209 HydrophobicContact CD2-CD1 4.34Å; F60-I209 HydrophobicContact CE1-CD1 3.29Å; F60-I209 HydrophobicContact CE2-CD1 3.88Å; F60-I209 HydrophobicContact CG-CD1 4.33Å; F60-I209 HydrophobicContact CZ-CD1 3.32Å; L82-I209 HydrophobicContact CD1-CG2 3.95Å; F172-I209 HydrophobicContact CD1-CD1 4.34Å; R173-I209 PolarHBondContact O-N 3.42Å; R173-I209 VanDerWaalsContact O-N 3.13Å; I174-I209 VanDerWaalsContact CA-O 3.32Å; I174-I209 WeakPolarHBondContact CA-O 3.17Å; I174-I209 HydrophobicContact CB-CB 4.49Å; I174-I209 HydrophobicContact CD1-CD1 4.18Å; I174-I209 HydrophobicContact CG1-CB 4.14Å; I174-I209 HydrophobicContact CG1-CD1 4.27Å; I174-I209 HydrophobicContact CG2-CB 4.17Å; I174-I209 HydrophobicContact CG2-CG2 4.26Å; Y175-I209 PolarHBondContact N-O 3.28Å; I207-I209 VanDerWaalsContact CG2-C 3.43Å; I207-I209 WeakPolarHBondContact CG2-O 3.48Å; I209-L247 CarbonylContact C-O 3.55Å; I209-L247 VanDerWaalsContact CA-O 3.32Å; I209-L247 WeakPolarHBondContact CA-O 3.4Å; I209-L247 HydrophobicContact CD1-CD2 4.43Å; I209-L247 HydrophobicContact CG1-CB 4.29Å; I209-L247 HydrophobicContact CG1-CD2 4.5Å; I209-L247 HydrophobicContact CG2-CB 4.34Å; I209-L247 HydrophobicContact CG2-CD2 4.09Å; I209-L247 HydrophobicContact CG2-CG 4.26Å; I209-L288 HydrophobicContact CD1-CD1 3.95Å; I209-L288 HydrophobicContact CG1-CD1 4Å
210	L	98.9	Very high	98.4	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	172.2	-179.5	62	0	0	0	109.9	Y175 I203 T212 L235 V239 P245 L247 H248 V249	Y175-L210 HydrophobicContact CD1-CD1 3.9Å; I203-L210 HydrophobicContact CD1-CD1 3.92Å; I203-L210 HydrophobicContact CD1-CD2 4.15Å; I203-L210 HydrophobicContact CG1-CD1 4.32Å; I203-L210 HydrophobicContact CG2-CD1 4.15Å; L210-T212 HydrophobicContact CD1-CG2 4.31Å; L210-T212 HydrophobicContact CD2-CG2 4.4Å; L210-T212 HydrophobicContact CG-CG2 4.21Å; L210-L235 HydrophobicContact CD2-CD1 4.21Å; L210-V239 HydrophobicContact CD2-CG2 3.61Å; L210-P245 HydrophobicContact CB-CB 4.26Å; L210-P245 HydrophobicContact CB-CG 4.03Å; L210-L247 PolarHBondContact N-O 3.46Å; L210-H248 HydrophobicContact CB-CB 4.47Å; L210-H248 CarbonylContact O-C 3.56Å; L210-H248 WeakPolarHBondContact O-CA 3.06Å; L210-H248 PolarHBondContact O-CD2 3.2Å; L210-V249 PolarHBondContact O-N 3.39Å
211	M	98.9	Very high	98.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118.5	171.2	-65.2	173.9	66.9	0	0	108.8	L82 H83 T84 I112 I114 I174 Y175 G176 A177 V249	L82-M211 HydrophobicContact CB-CE 4.07Å; L82-M211 HydrophobicContact CB-SD 4.28Å; L82-M211 HydrophobicContact CD2-SD 3.89Å; H83-M211 WeakPolarHBondContact O-CE 3.43Å; T84-M211 HydrophobicContact CG2-CB 4.16Å; T84-M211 HydrophobicContact CG2-CE 3.87Å; T84-M211 HydrophobicContact CG2-CG 4.23Å; I112-M211 HydrophobicContact CB-CE 4.43Å; I112-M211 HydrophobicContact CB-SD 4.07Å; I112-M211 HydrophobicContact CG2-CE 4.28Å; I112-M211 HydrophobicContact CG2-SD 3.68Å; I114-M211 HydrophobicContact CD1-CB 4.16Å; I114-M211 HydrophobicContact CG1-CE 4.39Å; I114-M211 HydrophobicContact CG2-CB 4.14Å; I114-M211 HydrophobicContact CG2-CE 4.29Å; I174-M211 HydrophobicContact CG2-CG 4.29Å; I174-M211 HydrophobicContact CG2-SD 3.83Å; Y175-M211 PolarHBondContact O-N 2.8Å; G176-M211 WeakPolarHBondContact CA-O 3.43Å; A177-M211 PolarHBondContact N-O 3.31Å; M211-V249 WeakPolarHBondContact CA-O 3.29Å
212	T	98.9	Very high	98.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	155.3	166.6	58.4	0	0	0	0	109.5	A177 W200 L210 G214 L235 H248 V249 F250	A177-T212 VanDerWaalsContact O-CA 3.29Å; A177-T212 WeakPolarHBondContact O-CA 3.3Å; W200-T212 HydrophobicContact CH2-CG2 4.13Å; W200-T212 HydrophobicContact CZ3-CG2 3.93Å; L210-T212 HydrophobicContact CD1-CG2 4.31Å; L210-T212 HydrophobicContact CD2-CG2 4.4Å; L210-T212 HydrophobicContact CG-CG2 4.21Å; T212-G214 PolarHBondContact OG1-O 2.92Å; T212-L235 HydrophobicContact CG2-CD1 4.15Å; T212-L235 HydrophobicContact CG2-CD2 4.08Å; T212-H248 PolarHBondContact OG1-NE2 3.06Å; T212-V249 PolarHBondContact N-O 2.85Å; T212-V249 VanDerWaalsContact N-O 3.12Å; T212-F250 WeakPolarHBondContact O-CA 3.45Å; T212-F250 WeakPolarHBondContact O-CB 3.4Å
213	H	98.9	Very high	98.4	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.101	C	C	.	.	S	Bend	trans	-70.3	-48.3	177.9	178.2	50.1	0	0	0	111.5	D65 T84 D86 I114 G116 N117 A177 P178 T180 G251	D65-H213 IonicContact OD1-CE1 2.79Å; D65-H213 PolarHBondContact OD1-CE1 3.04Å; T84-H213 WeakPolarHBondContact O-CA 3.35Å; T84-H213 PolarHBondContact O-ND1 2.81Å; D86-H213 IonicContact OD1-CE1 3.64Å; D86-H213 IonicContact OD1-NE2 2.66Å; D86-H213 IonicContact OD2-CE1 2.95Å; D86-H213 PolarHBondContact OD2-CE1 2.91Å; D86-H213 IonicContact OD2-NE2 3.32Å; D86-H213 PolarHBondContact OD2-NE2 3.03Å; I114-H213 HydrophobicContact CD1-CB 4.37Å; G116-H213 WeakPolarHBondContact CA-CD2 3.45Å; N117-H213 PolarHBondContact N-CD2 3.05Å; N117-H213 PolarHBondContact N-NE2 3.27Å; N117-H213 PolarHBondContact OD1-NE2 3.35Å; A177-H213 PolarHBondContact O-N 3.22Å; P178-H213 WeakPolarHBondContact O-CB 3.25Å; T180-H213 HydrophobicContact CG2-CB 4.12Å; H213-G251 CarbonylContact O-C 3.14Å; H213-G251 WeakPolarHBondContact O-CA 3.37Å; H213-G251 PolarHBondContact O-N 3.25Å
214	G	98.3	Very high	98.3	Very high	7 Å²	7	21.4 Å²	21.4	7%	0.072	12%	0.12	C	C	.	.	S	Bend	trans	-98.8	167.1	178.1	0	0	0	0	0	114.6	T212	T212-G214 PolarHBondContact OG1-O 2.92Å
215	P	98.8	Very high	98.1	Very high	7 Å²	7	29 Å²	29	5%	0.045	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-77.6	154.4	-176.1	30.1	-36	0	0	0	114.3	D221 G231 C232 F250 I253	P215-D221 HydrophobicContact CB-CB 3.77Å; P215-D221 HydrophobicContact CG-CB 3.48Å; P215-D221 VanDerWaalsContact CG-CB 3.48Å; P215-G231 VanDerWaalsContact O-CA 3.22Å; P215-G231 WeakPolarHBondContact O-CA 3.33Å; P215-C232 PolarHBondContact O-N 3.05Å; P215-F250 HydrophobicContact CB-CD2 3.65Å; P215-F250 HydrophobicContact CB-CE2 3.42Å; P215-F250 VanDerWaalsContact CB-CE2 3.42Å; P215-F250 HydrophobicContact CB-CG 4.37Å; P215-F250 HydrophobicContact CB-CZ 4Å; P215-I253 HydrophobicContact CG-CG1 3.75Å
216	P	98.9	Very high	98	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-71.2	157	158.9	32.3	-30.4	0	0	0	110.3	G218 F219 L235 L236 F250 Y267	P216-G218 PolarHBondContact O-N 3.21Å; P216-F219 HydrophobicContact CG-CB 4.25Å; P216-L235 HydrophobicContact CB-CB 4.4Å; P216-L235 HydrophobicContact CB-CD2 4.25Å; P216-L235 HydrophobicContact CB-CG 4.07Å; P216-L236 HydrophobicContact CB-CB 4Å; P216-L236 HydrophobicContact CB-CD1 4.31Å; P216-F250 VanDerWaalsContact CD-CE1 3.46Å; P216-F250 HydrophobicContact CG-CE1 4.23Å; P216-Y267 HydrophobicContact CG-CD1 3.79Å; P216-Y267 HydrophobicContact CG-CE1 3.81Å
217	L	98.9	Very high	98.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50	133.3	176.8	173.7	70.9	0	0	0	112.3	P22 A25 F26 Y29 F36 F219 R229 C232 V233 L236	P22-L217 HydrophobicContact CB-CD1 3.79Å; P22-L217 WeakPolarHBondContact O-CD1 3.38Å; A25-L217 HydrophobicContact CB-CD2 3.58Å; F26-L217 HydrophobicContact CB-CD1 4.19Å; Y29-L217 HydrophobicContact CD2-CD2 4.38Å; F36-L217 HydrophobicContact CZ-CD2 4.21Å; F36-L217 HydrophobicContact CZ-CG 4.28Å; L217-F219 VanDerWaalsContact C-N 3.27Å; L217-F219 WeakPolarHBondContact O-CD2 3.27Å; L217-F219 PolarHBondContact O-N 3Å; L217-R229 HydrophobicContact CD1-CB 4.12Å; L217-C232 PolarHBondContact N-O 3.09Å; L217-V233 HydrophobicContact CB-CG2 4.5Å; L217-V233 HydrophobicContact CD2-CB 4.48Å; L217-V233 HydrophobicContact CD2-CG1 4.17Å; L217-V233 HydrophobicContact CD2-CG2 4.07Å; L217-L236 HydrophobicContact CB-CB 4Å; L217-L236 HydrophobicContact CB-CD2 3.94Å; L217-L236 HydrophobicContact CD2-CD2 4.09Å; L217-L236 HydrophobicContact CG-CD2 4.22Å; L217-L236 WeakPolarHBondContact O-CD2 3.46Å
218	G	98.8	Very high	98.1	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.021	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	83	-15.4	168.2	0	0	0	0	0	116	P216 D221 R229	P216-G218 PolarHBondContact O-N 3.21Å; G218-D221 VanDerWaalsContact C-OD1 3.27Å; G218-D221 WeakPolarHBondContact CA-OD1 3.31Å; G218-D221 PolarHBondContact N-OD1 2.97Å; G218-D221 PolarHBondContact N-OD2 3.05Å; G218-R229 PolarHBondContact O-NH1 3.13Å
219	F	98.9	Very high	98.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-106.3	105.7	178.5	-67.2	-91.9	0	0	0	109.9	F36 V41 P216 L217 D221 L236 F250 M260 D262 Y267	F36-F219 HydrophobicContact CD1-CE2 4.1Å; F36-F219 HydrophobicContact CD1-CZ 4.48Å; F36-F219 HydrophobicContact CE1-CD2 4.48Å; F36-F219 AromaticContact CE1-CE2 3.99Å; F36-F219 HydrophobicContact CE1-CE2 3.99Å; V41-F219 HydrophobicContact CG1-CE1 4.02Å; V41-F219 HydrophobicContact CG1-CZ 4.31Å; V41-F219 HydrophobicContact CG2-CZ 4.26Å; P216-F219 HydrophobicContact CG-CB 4.25Å; L217-F219 VanDerWaalsContact C-N 3.27Å; L217-F219 WeakPolarHBondContact O-CD2 3.27Å; L217-F219 PolarHBondContact O-N 3Å; F219-D221 PolarHBondContact O-N 3.39Å; F219-L236 HydrophobicContact CD2-CD1 3.74Å; F219-L236 HydrophobicContact CE2-CD1 3.56Å; F219-F250 WeakPolarHBondContact O-CZ 3.48Å; F219-M260 HydrophobicContact CD1-CB 3.89Å; F219-M260 HydrophobicContact CD1-CE 4.11Å; F219-M260 HydrophobicContact CD1-SD 4.43Å; F219-M260 HydrophobicContact CE1-CB 4.48Å; F219-M260 HydrophobicContact CE1-CE 4.36Å; F219-D262 HydrophobicContact CE1-CB 4.04Å; F219-D262 HydrophobicContact CZ-CB 3.76Å; F219-Y267 HydrophobicContact CB-CD1 3.99Å; F219-Y267 HydrophobicContact CB-CD2 4.44Å; F219-Y267 HydrophobicContact CB-CG 3.91Å; F219-Y267 HydrophobicContact CD1-CD1 4.25Å; F219-Y267 AromaticContact CD1-CD2 3.27Å; F219-Y267 HydrophobicContact CD1-CD2 3.27Å; F219-Y267 AromaticContact CD1-CE2 3.62Å; F219-Y267 HydrophobicContact CD1-CE2 3.62Å; F219-Y267 AromaticContact CD1-CG 3.62Å; F219-Y267 HydrophobicContact CD1-CG 3.62Å; F219-Y267 HydrophobicContact CD2-CD1 4.41Å; F219-Y267 HydrophobicContact CD2-CE1 4.18Å; F219-Y267 HydrophobicContact CD2-CE2 4.31Å; F219-Y267 AromaticContact CE1-CD2 3.55Å; F219-Y267 HydrophobicContact CE1-CD2 3.55Å; F219-Y267 AromaticContact CE1-CE2 3.48Å; F219-Y267 HydrophobicContact CE1-CE2 3.48Å; F219-Y267 VanDerWaalsContact CE1-CE2 3.48Å; F219-Y267 HydrophobicContact CE1-CG 4.34Å; F219-Y267 HydrophobicContact CE2-CE2 4.21Å; F219-Y267 AromaticContact CG-CD1 3.95Å; F219-Y267 HydrophobicContact CG-CD1 3.95Å; F219-Y267 AromaticContact CG-CD2 3.83Å; F219-Y267 HydrophobicContact CG-CD2 3.83Å; F219-Y267 HydrophobicContact CG-CE1 4.16Å; F219-Y267 HydrophobicContact CG-CE2 4.06Å; F219-Y267 AromaticContact CG-CG 3.77Å; F219-Y267 HydrophobicContact CG-CG 3.77Å; F219-Y267 HydrophobicContact CZ-CD2 4.32Å; F219-Y267 AromaticContact CZ-CE2 3.81Å; F219-Y267 HydrophobicContact CZ-CE2 3.81Å
220	R	98.6	Very high	98.1	Very high	50 Å²	50	37.8 Å²	37.8	19%	0.189	18%	0.18	C	C	.	.	S	Bend	trans	55.9	33.2	176.6	-48.1	-50.5	-63.2	159.3	-1.6	114.4	M43 F250 G256 Y257 M260 N269	M43-R220 PolarHBondContact SD-NH1 2.83Å; R220-F250 HydrophobicContact CB-CE2 3.96Å; R220-F250 HydrophobicContact CB-CZ 4.17Å; R220-F250 HydrophobicContact CG-CZ 4.4Å; R220-G256 WeakPolarHBondContact CB-O 3.33Å; R220-G256 VanDerWaalsContact CZ-O 3.28Å; R220-G256 PolarHBondContact NE-O 3.41Å; R220-G256 PolarHBondContact NH2-O 3.22Å; R220-G256 VanDerWaalsContact NH2-O 3.13Å; R220-Y257 PolarHBondContact NH2-O 3Å; R220-M260 WeakPolarHBondContact CD-SD 3.49Å; R220-M260 HydrophobicContact CG-CG 4.45Å; R220-M260 HydrophobicContact CG-SD 4.26Å; R220-N269 HydrophobicContact CB-CB 3.64Å; R220-N269 HydrophobicContact CG-CB 3.96Å; R220-N269 PolarHBondContact O-ND2 3.02Å
221	D	98.6	Very high	98	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.18	C	C	.	.			trans	-120.5	16.2	-172.5	76.3	-38.3	0	0	0	114.2	P215 G218 F219 R229 V230 G231	P215-D221 HydrophobicContact CB-CB 3.77Å; P215-D221 HydrophobicContact CG-CB 3.48Å; P215-D221 VanDerWaalsContact CG-CB 3.48Å; G218-D221 VanDerWaalsContact C-OD1 3.27Å; G218-D221 WeakPolarHBondContact CA-OD1 3.31Å; G218-D221 PolarHBondContact N-OD1 2.97Å; G218-D221 PolarHBondContact N-OD2 3.05Å; F219-D221 PolarHBondContact O-N 3.39Å; D221-R229 WeakPolarHBondContact O-CA 3.27Å; D221-R229 WeakPolarHBondContact OD1-CD 3.48Å; D221-R229 IonicContact OD1-CZ 3.62Å; D221-R229 IonicContact OD1-NE 3.78Å; D221-R229 IonicContact OD1-NH1 2.71Å; D221-R229 PolarHBondContact OD1-NH1 3.43Å; D221-V230 PolarHBondContact O-N 3.42Å; D221-G231 WeakPolarHBondContact OD2-CA 3.43Å; D221-G231 PolarHBondContact OD2-N 3.35Å
222	W	98.5	Very high	98	Very high	96 Å²	96	37.8 Å²	37.8	36%	0.364	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.3	176.7	178.4	-103.6	0	0	0	110	P224 L227 Q228 R229	W222-P224 WeakPolarHBondContact O-CD 3.5Å; W222-L227 HydrophobicContact CH2-CB 4.28Å; W222-L227 WeakPolarHBondContact CH2-O 3.18Å; W222-L227 HydrophobicContact CZ2-CB 4.3Å; W222-L227 HydrophobicContact CZ2-CD2 4.09Å; W222-Q228 VanDerWaalsContact CE3-C 3.48Å; W222-R229 HydrophobicContact CE3-CG 4.06Å; W222-R229 HydrophobicContact CZ3-CG 4.43Å
223	V	97.8	Very high	98	Very high	13 Å²	13	37.8 Å²	37.8	8%	0.079	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	102.5	175.6	-179.2	0	0	0	0	108.4	K225 E226 L227 Q228 V230 I253	V223-K225 VanDerWaalsContact C-N 3.31Å; V223-K225 PolarHBondContact O-N 3.09Å; V223-E226 HydrophobicContact CB-CB 4.36Å; V223-E226 HydrophobicContact CG1-CB 4.02Å; V223-E226 HydrophobicContact CG1-CG 3.9Å; V223-E226 PolarHBondContact O-N 2.95Å; V223-L227 PolarHBondContact O-N 3.26Å; V223-Q228 PolarHBondContact N-O 3.08Å; V223-V230 HydrophobicContact CB-CG1 4.47Å; V223-V230 HydrophobicContact CG2-CB 4.38Å; V223-V230 HydrophobicContact CG2-CG1 3.73Å; V223-V230 HydrophobicContact CG2-CG2 3.69Å; V223-I253 HydrophobicContact CG2-CD1 4.41Å; V223-I253 HydrophobicContact CG2-CG2 3.94Å
224	P	96.4	Very high	98	Very high	65 Å²	65	37.8 Å²	37.8	42%	0.422	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-37.6	-173.5	-24.3	33.9	0	0	0	113.9	W222 E226 L227 E255	W222-P224 WeakPolarHBondContact O-CD 3.5Å; P224-E226 PolarHBondContact O-N 3.42Å; P224-L227 WeakPolarHBondContact O-CD2 3.43Å; P224-L227 PolarHBondContact O-N 3.17Å; P224-E255 HydrophobicContact CG-CB 4.26Å; P224-E255 HydrophobicContact CG-CG 4.22Å
225	K	94.6	Very high	98.1	Very high	196 Å²	196	37.5 Å²	37.5	85%	0.852	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-30.8	-178.5	-174.8	-179.4	175.6	-174.4	0	112.7	V223	V223-K225 VanDerWaalsContact C-N 3.31Å; V223-K225 PolarHBondContact O-N 3.09Å
226	E	94.6	Very high	98.1	Very high	85 Å²	85	37.2 Å²	37.2	40%	0.397	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-7.3	-177.6	-62.9	-179.4	174.7	0	0	112.4	V223 P224 Q228	V223-E226 HydrophobicContact CB-CB 4.36Å; V223-E226 HydrophobicContact CG1-CB 4.02Å; V223-E226 HydrophobicContact CG1-CG 3.9Å; V223-E226 PolarHBondContact O-N 2.95Å; P224-E226 PolarHBondContact O-N 3.42Å; E226-Q228 HydrophobicContact CB-CG 3.68Å; E226-Q228 PolarHBondContact O-N 3.24Å; E226-Q228 PolarHBondContact OE2-NE2 2.97Å
227	L	97.3	Very high	98.1	Very high	126 Å²	126	37.3 Å²	37.3	66%	0.66	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	40.2	-175.7	-59.3	175.4	0	0	0	112.6	W222 V223 P224	W222-L227 HydrophobicContact CH2-CB 4.28Å; W222-L227 WeakPolarHBondContact CH2-O 3.18Å; W222-L227 HydrophobicContact CZ2-CB 4.3Å; W222-L227 HydrophobicContact CZ2-CD2 4.09Å; V223-L227 PolarHBondContact O-N 3.26Å; P224-L227 WeakPolarHBondContact O-CD2 3.43Å; P224-L227 PolarHBondContact O-N 3.17Å
228	Q	97.9	Very high	98.1	Very high	79 Å²	79	37.3 Å²	37.3	37%	0.369	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	159.4	-176.5	72.2	179.9	7.6	0	0	113.6	T23 W222 V223 E226 V230	T23-Q228 WeakPolarHBondContact OG1-CA 3.37Å; T23-Q228 WeakPolarHBondContact OG1-CB 3.18Å; W222-Q228 VanDerWaalsContact CE3-C 3.48Å; V223-Q228 PolarHBondContact N-O 3.08Å; E226-Q228 HydrophobicContact CB-CG 3.68Å; E226-Q228 PolarHBondContact O-N 3.24Å; E226-Q228 PolarHBondContact OE2-NE2 2.97Å; Q228-V230 HydrophobicContact CG-CG1 3.94Å
229	R	98.4	Very high	98.1	Very high	42 Å²	42	37.2 Å²	37.2	16%	0.158	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	140.7	165.8	-65.2	-72.2	177.7	170.9	2	108.9	P22 T23 F26 L217 G218 D221 W222	P22-R229 HydrophobicContact CB-CB 4.21Å; P22-R229 WeakPolarHBondContact CB-O 3.41Å; P22-R229 WeakPolarHBondContact CG-O 3.08Å; T23-R229 PolarHBondContact OG1-N 3.35Å; F26-R229 HydrophobicContact CB-CG 4.06Å; F26-R229 HydrophobicContact CD2-CG 4.45Å; F26-R229 HydrophobicContact CG-CG 4.21Å; L217-R229 HydrophobicContact CD1-CB 4.12Å; G218-R229 PolarHBondContact O-NH1 3.13Å; D221-R229 WeakPolarHBondContact O-CA 3.27Å; D221-R229 WeakPolarHBondContact OD1-CD 3.48Å; D221-R229 IonicContact OD1-CZ 3.62Å; D221-R229 IonicContact OD1-NE 3.78Å; D221-R229 IonicContact OD1-NH1 2.71Å; D221-R229 PolarHBondContact OD1-NH1 3.43Å; W222-R229 HydrophobicContact CE3-CG 4.06Å; W222-R229 HydrophobicContact CZ3-CG 4.43Å
230	V	98.4	Very high	98.1	Very high	24 Å²	24	38.9 Å²	38.9	15%	0.145	18%	0.182	C	C	.	.			trans	-124.8	-3.3	-179.7	-58	0	0	0	0	113.6	R192 D221 V223 Q228 I253	R192-V230 PolarHBondContact NH2-O 3.06Å; D221-V230 PolarHBondContact O-N 3.42Å; V223-V230 HydrophobicContact CB-CG1 4.47Å; V223-V230 HydrophobicContact CG2-CB 4.38Å; V223-V230 HydrophobicContact CG2-CG1 3.73Å; V223-V230 HydrophobicContact CG2-CG2 3.69Å; Q228-V230 HydrophobicContact CG-CG1 3.94Å; V230-I253 HydrophobicContact CG2-CD1 3.48Å; V230-I253 VanDerWaalsContact CG2-CD1 3.48Å; V230-I253 HydrophobicContact CG2-CG1 3.7Å
231	G	98.6	Very high	98.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-63.4	158.4	179.4	0	0	0	0	0	113	R192 P215 D221	R192-G231 PolarHBondContact NH1-O 2.96Å; P215-G231 VanDerWaalsContact O-CA 3.22Å; P215-G231 WeakPolarHBondContact O-CA 3.33Å; D221-G231 WeakPolarHBondContact OD2-CA 3.43Å; D221-G231 PolarHBondContact OD2-N 3.35Å
232	C	98.9	Very high	98.1	Very high	1 Å²	1	43 Å²	43	1%	0.007	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-80.5	127.1	179.6	179.9	0	0	0	0	111.3	P181 L196 W200 P215 L217 L235 L236	P181-C232 HydrophobicContact CG-CB 3.85Å; L196-C232 HydrophobicContact CD1-CB 4.5Å; W200-C232 PolarHBondContact NE1-SG 3.32Å; P215-C232 PolarHBondContact O-N 3.05Å; L217-C232 PolarHBondContact N-O 3.09Å; C232-L235 HydrophobicContact CB-CB 3.65Å; C232-L235 HydrophobicContact CB-CD2 4.48Å; C232-L235 PolarHBondContact SG-N 3.42Å; C232-L235 VanDerWaalsContact SG-N 3.42Å; C232-L236 PolarHBondContact O-N 2.82Å
233	V	98.9	Very high	98.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-70.4	-45.4	-179.7	-170.5	0	0	0	0	111	D16 A25 Y29 L217 L235 L236 N237	D16-V233 HydrophobicContact CB-CB 4.32Å; D16-V233 HydrophobicContact CB-CG1 3.5Å; D16-V233 VanDerWaalsContact CG-CG1 3.48Å; D16-V233 WeakPolarHBondContact OD2-CG1 3.41Å; A25-V233 HydrophobicContact CB-CG1 4.27Å; A25-V233 HydrophobicContact CB-CG2 3.94Å; Y29-V233 HydrophobicContact CE2-CG1 4.36Å; L217-V233 HydrophobicContact CB-CG2 4.5Å; L217-V233 HydrophobicContact CD2-CB 4.48Å; L217-V233 HydrophobicContact CD2-CG1 4.17Å; L217-V233 HydrophobicContact CD2-CG2 4.07Å; V233-L235 VanDerWaalsContact C-N 3.28Å; V233-L235 PolarHBondContact O-N 2.98Å; V233-L236 PolarHBondContact O-N 2.71Å; V233-N237 PolarHBondContact O-N 3.29Å
234	E	98.9	Very high	98.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-37.6	177.4	-73.8	57.8	-121	0	0	111.7	D16 S19 L197 N237 T238	D16-E234 WeakPolarHBondContact CB-OE1 3.44Å; D16-E234 PolarHBondContact N-OE1 3.38Å; S19-E234 WeakPolarHBondContact CB-OE1 3.29Å; S19-E234 PolarHBondContact OG-OE1 2.89Å; S19-E234 VanDerWaalsContact OG-OE1 3.13Å; S19-E234 PolarHBondContact OG-OE2 3.44Å; L197-E234 HydrophobicContact CB-CB 4.27Å; L197-E234 HydrophobicContact CB-CG 3.88Å; L197-E234 HydrophobicContact CD1-CB 4.19Å; L197-E234 HydrophobicContact CD1-CG 4.25Å; L197-E234 HydrophobicContact CG-CG 4.43Å; E234-N237 PolarHBondContact O-N 3.12Å; E234-T238 VanDerWaalsContact O-CB 3.31Å; E234-T238 WeakPolarHBondContact O-CB 3.36Å; E234-T238 PolarHBondContact O-N 3.05Å; E234-T238 PolarHBondContact O-OG1 3.27Å
235	L	98.9	Very high	98.2	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-47.3	176	-175.1	57.8	0	0	0	110.7	W200 I203 L210 T212 P216 C232 V233 N237 T238 V239	W200-L235 HydrophobicContact CD2-CB 4.47Å; W200-L235 HydrophobicContact CD2-CD1 3.83Å; W200-L235 HydrophobicContact CE3-CD1 4.01Å; W200-L235 HydrophobicContact CG-CD1 4.22Å; W200-L235 HydrophobicContact CH2-CD2 4.46Å; W200-L235 HydrophobicContact CZ2-CB 4.41Å; W200-L235 HydrophobicContact CZ2-CD1 4.37Å; W200-L235 HydrophobicContact CZ2-CD2 4.2Å; W200-L235 HydrophobicContact CZ3-CD1 4.35Å; I203-L235 HydrophobicContact CD1-CD1 4.39Å; L210-L235 HydrophobicContact CD2-CD1 4.21Å; T212-L235 HydrophobicContact CG2-CD1 4.15Å; T212-L235 HydrophobicContact CG2-CD2 4.08Å; P216-L235 HydrophobicContact CB-CB 4.4Å; P216-L235 HydrophobicContact CB-CD2 4.25Å; P216-L235 HydrophobicContact CB-CG 4.07Å; C232-L235 HydrophobicContact CB-CB 3.65Å; C232-L235 HydrophobicContact CB-CD2 4.48Å; C232-L235 PolarHBondContact SG-N 3.42Å; C232-L235 VanDerWaalsContact SG-N 3.42Å; V233-L235 VanDerWaalsContact C-N 3.28Å; V233-L235 PolarHBondContact O-N 2.98Å; L235-N237 VanDerWaalsContact C-N 3.34Å; L235-N237 PolarHBondContact O-N 3.43Å; L235-T238 PolarHBondContact O-N 3.14Å; L235-V239 HydrophobicContact CD1-CG2 4.12Å; L235-V239 HydrophobicContact CG-CG2 4.37Å; L235-V239 WeakPolarHBondContact O-CB 3.45Å; L235-V239 VanDerWaalsContact O-CG2 3.27Å; L235-V239 WeakPolarHBondContact O-CG2 3.35Å; L235-V239 PolarHBondContact O-N 3.03Å
236	L	98.9	Very high	98.4	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.1	-47.1	176.1	178.1	68.1	0	0	0	111.7	F36 P216 L217 F219 C232 V233 T238 V239 Q240	F36-L236 HydrophobicContact CE1-CD2 3.77Å; F36-L236 HydrophobicContact CZ-CD2 3.66Å; P216-L236 HydrophobicContact CB-CB 4Å; P216-L236 HydrophobicContact CB-CD1 4.31Å; L217-L236 HydrophobicContact CB-CB 4Å; L217-L236 HydrophobicContact CB-CD2 3.94Å; L217-L236 HydrophobicContact CD2-CD2 4.09Å; L217-L236 HydrophobicContact CG-CD2 4.22Å; L217-L236 WeakPolarHBondContact O-CD2 3.46Å; F219-L236 HydrophobicContact CD2-CD1 3.74Å; F219-L236 HydrophobicContact CE2-CD1 3.56Å; C232-L236 PolarHBondContact O-N 2.82Å; V233-L236 PolarHBondContact O-N 2.71Å; L236-T238 VanDerWaalsContact C-N 3.29Å; L236-T238 PolarHBondContact O-N 2.71Å; L236-V239 PolarHBondContact O-N 3.25Å; L236-Q240 HydrophobicContact CD1-CG 3.94Å; L236-Q240 WeakPolarHBondContact O-CB 3.35Å; L236-Q240 PolarHBondContact O-N 2.81Å
237	N	98.9	Very high	98.6	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.011	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-40.8	178.7	-74.2	-22.8	0	0	0	111.3	I13 D16 R35 V233 E234 L235 R241	I13-N237 HydrophobicContact CG2-CB 4.02Å; D16-N237 PolarHBondContact OD2-ND2 2.92Å; R35-N237 PolarHBondContact NH1-OD1 2.93Å; R35-N237 PolarHBondContact NH2-OD1 2.94Å; V233-N237 PolarHBondContact O-N 3.29Å; E234-N237 PolarHBondContact O-N 3.12Å; L235-N237 VanDerWaalsContact C-N 3.34Å; L235-N237 PolarHBondContact O-N 3.43Å; N237-R241 WeakPolarHBondContact O-CB 3.38Å; N237-R241 WeakPolarHBondContact O-CG 3.23Å; N237-R241 PolarHBondContact O-N 3.2Å; N237-R241 PolarHBondContact OD1-NH2 2.84Å
238	T	98.9	Very high	98.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64	-49.3	176.2	-61.6	0	0	0	0	112.1	W200 I203 E234 L235 L236 R242 V243	W200-T238 HydrophobicContact CB-CG2 4.25Å; I203-T238 HydrophobicContact CD1-CG2 4.27Å; E234-T238 VanDerWaalsContact O-CB 3.31Å; E234-T238 WeakPolarHBondContact O-CB 3.36Å; E234-T238 PolarHBondContact O-N 3.05Å; E234-T238 PolarHBondContact O-OG1 3.27Å; L235-T238 PolarHBondContact O-N 3.14Å; L236-T238 VanDerWaalsContact C-N 3.29Å; L236-T238 PolarHBondContact O-N 2.71Å; T238-R242 PolarHBondContact O-N 3.01Å; T238-V243 HydrophobicContact CG2-CG2 3.64Å; T238-V243 PolarHBondContact O-N 3.38Å
239	V	98.8	Very high	98.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	9%	0.087	C	C	.	.	I	π-helix	trans	-60.7	-51.3	-179.8	170.9	0	0	0	0	110.7	L210 L235 L236 R244 P245 T265 Y267	L210-V239 HydrophobicContact CD2-CG2 3.61Å; L235-V239 HydrophobicContact CD1-CG2 4.12Å; L235-V239 HydrophobicContact CG-CG2 4.37Å; L235-V239 WeakPolarHBondContact O-CB 3.45Å; L235-V239 VanDerWaalsContact O-CG2 3.27Å; L235-V239 WeakPolarHBondContact O-CG2 3.35Å; L235-V239 PolarHBondContact O-N 3.03Å; L236-V239 PolarHBondContact O-N 3.25Å; V239-R244 WeakPolarHBondContact O-CA 3.19Å; V239-R244 PolarHBondContact O-N 2.93Å; V239-P245 HydrophobicContact CG1-CG 4.15Å; V239-T265 HydrophobicContact CG1-CG2 4.12Å; V239-Y267 HydrophobicContact CG1-CE1 3.86Å
240	Q	98.7	Very high	98.8	Very high	35 Å²	35	19.1 Å²	19.1	16%	0.164	8%	0.08	C	C	.	.	I	π-helix	trans	-80.4	-32.8	-172.8	-69	-170.4	-38.9	0	0	114.4	R35 L236 R244 D262 Y267	R35-Q240 VanDerWaalsContact CZ-OE1 3.22Å; L236-Q240 HydrophobicContact CD1-CG 3.94Å; L236-Q240 WeakPolarHBondContact O-CB 3.35Å; L236-Q240 PolarHBondContact O-N 2.81Å; Q240-R244 WeakPolarHBondContact O-CG 3.35Å; Q240-D262 WeakPolarHBondContact CG-OD2 3.34Å; Q240-D262 PolarHBondContact NE2-OD2 3.34Å; Q240-Y267 WeakPolarHBondContact CG-OH 3.31Å
241	R	98.4	Very high	98.8	Very high	105 Å²	105	18 Å²	18	40%	0.396	7%	0.073	S	C	.	.	I	π-helix	trans	-100.6	-28.8	-171.4	-54.6	178.5	179.5	162.3	3.9	113.4	V11 I13 Y29 R35 N237	V11-R241 HydrophobicContact CG1-CB 4.38Å; I13-R241 HydrophobicContact CD1-CB 3.92Å; Y29-R241 PolarHBondContact OH-NH2 2.95Å; Y29-R241 VanDerWaalsContact OH-NH2 3.14Å; R35-R241 VanDerWaalsContact NH1-NH2 3.16Å; N237-R241 WeakPolarHBondContact O-CB 3.38Å; N237-R241 WeakPolarHBondContact O-CG 3.23Å; N237-R241 PolarHBondContact O-N 3.2Å; N237-R241 PolarHBondContact OD1-NH2 2.84Å
242	R	98.6	Very high	98.7	Very high	31 Å²	31	19 Å²	19	12%	0.117	8%	0.084	C	C	.	.	I	π-helix	trans	-116	-59.6	-172.8	-171	178	68.5	73.8	-3.8	113.3	V11 I13 W200 I203 E205 T238	V11-R242 HydrophobicContact CB-CB 4.36Å; V11-R242 HydrophobicContact CB-CG 4.29Å; V11-R242 HydrophobicContact CG1-CB 4.22Å; V11-R242 WeakPolarHBondContact O-CD 3.37Å; I13-R242 HydrophobicContact CD1-CB 4.16Å; I13-R242 HydrophobicContact CG1-CB 4.09Å; W200-R242 PolarHBondContact O-NH2 3.11Å; I203-R242 VanDerWaalsContact O-CZ 3.3Å; I203-R242 PolarHBondContact O-NH1 2.96Å; I203-R242 PolarHBondContact O-NH2 3.34Å; E205-R242 HydrophobicContact CG-CG 4.37Å; T238-R242 PolarHBondContact O-N 3.01Å
243	V	98.6	Very high	98.7	Very high	8 Å²	8	20.5 Å²	20.5	5%	0.048	9%	0.091	C	C	.	.	I	π-helix	trans	-81.6	-47.1	-169.4	178.6	0	0	0	0	111.7	I203 I207 T238	I203-V243 HydrophobicContact CB-CG2 4.05Å; I203-V243 HydrophobicContact CG2-CB 4.4Å; I203-V243 HydrophobicContact CG2-CG1 3.83Å; I203-V243 HydrophobicContact CG2-CG2 3.69Å; I207-V243 HydrophobicContact CB-CG1 4.03Å; T238-V243 HydrophobicContact CG2-CG2 3.64Å; T238-V243 PolarHBondContact O-N 3.38Å
244	R	98.5	Very high	98.7	Very high	121 Å²	121	21.4 Å²	21.4	46%	0.457	10%	0.095	S	C	.	.			trans	48.7	62.4	-179.3	-54.1	-172.7	68.9	-157.6	-1.7	112.5	V239 Q240 Y264	V239-R244 WeakPolarHBondContact O-CA 3.19Å; V239-R244 PolarHBondContact O-N 2.93Å; Q240-R244 WeakPolarHBondContact O-CG 3.35Å; R244-Y264 HydrophobicContact CB-CD1 4.32Å; R244-Y264 HydrophobicContact CB-CE1 3.83Å; R244-Y264 VanDerWaalsContact O-CE1 3.23Å; R244-Y264 WeakPolarHBondContact O-CE1 3.43Å
245	P	98.8	Very high	98.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.113	C	C	.	.			trans	-68.3	156.1	172.2	33.4	-34.2	0	0	0	110.5	I207 L210 V239 L247 T265	I207-P245 VanDerWaalsContact O-CA 3.32Å; I207-P245 WeakPolarHBondContact O-CA 3.37Å; L210-P245 HydrophobicContact CB-CB 4.26Å; L210-P245 HydrophobicContact CB-CG 4.03Å; V239-P245 HydrophobicContact CG1-CG 4.15Å; P245-L247 VanDerWaalsContact C-N 3.29Å; P245-T265 HydrophobicContact CG-CG2 4.16Å; P245-T265 WeakPolarHBondContact O-CG2 3.24Å; P245-T265 PolarHBondContact O-OG1 2.74Å
246	K	98.8	Very high	98.6	Very high	73 Å²	73	25.3 Å²	25.3	32%	0.317	11%	0.114	S	C	.	.	S	Bend	trans	-70.8	-33.5	171.8	-66	172.2	-172.7	144.7	0	110.8	D208 T266 L288	D208-K246 PolarHBondContact O-N 3.42Å; D208-K246 IonicContact OD1-NZ 3.97Å; D208-K246 PolarHBondContact OD1-NZ 2.82Å; K246-T266 PolarHBondContact O-N 2.89Å; K246-L288 HydrophobicContact CB-CD2 4.01Å; K246-L288 HydrophobicContact CD-CD2 4.27Å
247	L	98.9	Very high	98.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	132.2	-177.5	179.3	64.1	0	0	0	110.5	L82 D208 I209 L210 P245 V249 T266 I268 F286 L288	L82-L247 HydrophobicContact CD1-CD2 4.31Å; D208-L247 PolarHBondContact O-N 2.85Å; I209-L247 CarbonylContact C-O 3.55Å; I209-L247 VanDerWaalsContact CA-O 3.32Å; I209-L247 WeakPolarHBondContact CA-O 3.4Å; I209-L247 HydrophobicContact CD1-CD2 4.43Å; I209-L247 HydrophobicContact CG1-CB 4.29Å; I209-L247 HydrophobicContact CG1-CD2 4.5Å; I209-L247 HydrophobicContact CG2-CB 4.34Å; I209-L247 HydrophobicContact CG2-CD2 4.09Å; I209-L247 HydrophobicContact CG2-CG 4.26Å; L210-L247 PolarHBondContact N-O 3.46Å; P245-L247 VanDerWaalsContact C-N 3.29Å; L247-V249 HydrophobicContact CD1-CG2 3.96Å; L247-V249 HydrophobicContact CD2-CG2 3.66Å; L247-V249 HydrophobicContact CG-CG2 3.6Å; L247-T266 CarbonylContact C-O 3.5Å; L247-T266 WeakPolarHBondContact CA-O 3.22Å; L247-T266 HydrophobicContact CD1-CG2 4.22Å; L247-I268 HydrophobicContact CD1-CD1 3.58Å; L247-I268 HydrophobicContact CD1-CG1 3.77Å; L247-F286 HydrophobicContact CD1-CD1 4.11Å; L247-F286 HydrophobicContact CD1-CE1 4.27Å; L247-F286 HydrophobicContact CD2-CD1 4.09Å; L247-L288 HydrophobicContact CB-CD1 4.15Å; L247-L288 HydrophobicContact CD2-CD1 4.41Å
248	H	98.9	Very high	98.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	110.2	168.5	-175.4	-173.4	0	0	0	108.6	L210 T212 F250 T265 T266 Y267 I268	L210-H248 HydrophobicContact CB-CB 4.47Å; L210-H248 CarbonylContact O-C 3.56Å; L210-H248 WeakPolarHBondContact O-CA 3.06Å; L210-H248 PolarHBondContact O-CD2 3.2Å; T212-H248 PolarHBondContact OG1-NE2 3.06Å; H248-F250 AromaticContact CD2-CD1 3.79Å; H248-F250 AromaticContact NE2-CD1 3.78Å; H248-T265 HydrophobicContact CB-CG2 4.1Å; H248-T266 PolarHBondContact N-O 2.46Å; H248-Y267 HydrophobicContact CB-CD1 4Å; H248-Y267 HydrophobicContact CB-CE1 4.34Å; H248-Y267 AromaticContact ND1-CD1 3.93Å; H248-Y267 AromaticContact ND1-CE1 3.98Å; H248-Y267 WeakPolarHBondContact O-CA 3.34Å; H248-I268 PolarHBondContact O-N 3.2Å
249	V	99	Very high	98.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138.8	178.2	-165.8	0	0	0	0	109.3	C62 L82 T84 L210 M211 T212 L247 I268 A270	C62-V249 HydrophobicContact CB-CG1 3.88Å; L82-V249 HydrophobicContact CD1-CG2 3.89Å; T84-V249 HydrophobicContact CG2-CB 3.92Å; T84-V249 HydrophobicContact CG2-CG1 3.72Å; L210-V249 PolarHBondContact O-N 3.39Å; M211-V249 WeakPolarHBondContact CA-O 3.29Å; T212-V249 PolarHBondContact N-O 2.85Å; T212-V249 VanDerWaalsContact N-O 3.12Å; L247-V249 HydrophobicContact CD1-CG2 3.96Å; L247-V249 HydrophobicContact CD2-CG2 3.66Å; L247-V249 HydrophobicContact CG-CG2 3.6Å; V249-I268 WeakPolarHBondContact CA-O 3.42Å; V249-I268 HydrophobicContact CG1-CB 4.27Å; V249-I268 HydrophobicContact CG1-CG2 4.36Å; V249-I268 HydrophobicContact CG2-CB 4.46Å; V249-A270 HydrophobicContact CG1-CB 4.03Å
250	F	98.9	Very high	98.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	-179.8	176.7	51.4	-95	0	0	0	111.2	T84 T212 P215 P216 F219 R220 H248 Y267 I268 N269 A270	T84-F250 VanDerWaalsContact OG1-C 3.23Å; T84-F250 PolarHBondContact OG1-O 3.18Å; T212-F250 WeakPolarHBondContact O-CA 3.45Å; T212-F250 WeakPolarHBondContact O-CB 3.4Å; P215-F250 HydrophobicContact CB-CD2 3.65Å; P215-F250 HydrophobicContact CB-CE2 3.42Å; P215-F250 VanDerWaalsContact CB-CE2 3.42Å; P215-F250 HydrophobicContact CB-CG 4.37Å; P215-F250 HydrophobicContact CB-CZ 4Å; P216-F250 VanDerWaalsContact CD-CE1 3.46Å; P216-F250 HydrophobicContact CG-CE1 4.23Å; F219-F250 WeakPolarHBondContact O-CZ 3.48Å; R220-F250 HydrophobicContact CB-CE2 3.96Å; R220-F250 HydrophobicContact CB-CZ 4.17Å; R220-F250 HydrophobicContact CG-CZ 4.4Å; H248-F250 AromaticContact CD2-CD1 3.79Å; H248-F250 AromaticContact NE2-CD1 3.78Å; F250-Y267 HydrophobicContact CE1-CD1 4.14Å; F250-I268 PolarHBondContact N-O 3.29Å; F250-I268 VanDerWaalsContact O-O 3.13Å; F250-N269 HydrophobicContact CD2-CB 4.08Å; F250-N269 HydrophobicContact CE2-CB 3.64Å; F250-N269 HydrophobicContact CZ-CB 4.44Å; F250-N269 CarbonylContact O-C 3.5Å; F250-N269 VanDerWaalsContact O-CA 3.28Å; F250-N269 WeakPolarHBondContact O-CA 3.47Å; F250-A270 PolarHBondContact O-N 2.92Å
251	G	98.6	Very high	98.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.132	C	C	.	.			trans	-147.2	-129.8	174.9	0	0	0	0	0	111.6	S64 D65 H213 I253	S64-G251 WeakPolarHBondContact OG-CA 3.38Å; D65-G251 VanDerWaalsContact OD2-CA 3.27Å; D65-G251 WeakPolarHBondContact OD2-CA 3.23Å; H213-G251 CarbonylContact O-C 3.14Å; H213-G251 WeakPolarHBondContact O-CA 3.37Å; H213-G251 PolarHBondContact O-N 3.25Å; G251-I253 PolarHBondContact O-N 3.17Å
252	G	97.8	Very high	98.6	Very high	22 Å²	22	24.8 Å²	24.8	23%	0.227	12%	0.12	C	C	.	.	S	Bend	trans	74	-45.8	176	0	0	0	0	0	114.5	D65 H254	D65-G252 VanDerWaalsContact CG-N 3.31Å; D65-G252 VanDerWaalsContact OD1-CA 3.23Å; D65-G252 WeakPolarHBondContact OD1-CA 3.41Å; D65-G252 PolarHBondContact OD1-N 3.18Å; D65-G252 PolarHBondContact OD2-N 3.25Å; G252-H254 PolarHBondContact O-CD2 2.88Å; G252-H254 PolarHBondContact O-N 2.98Å
253	I	98.2	Very high	98.6	Very high	31 Å²	31	25.9 Å²	25.9	16%	0.159	14%	0.14	C	C	.	.			trans	-94.1	89.9	177.8	-51.4	-52.4	0	0	0	109.3	P215 V223 V230 G251 E255 G256 N269	P215-I253 HydrophobicContact CG-CG1 3.75Å; V223-I253 HydrophobicContact CG2-CD1 4.41Å; V223-I253 HydrophobicContact CG2-CG2 3.94Å; V230-I253 HydrophobicContact CG2-CD1 3.48Å; V230-I253 VanDerWaalsContact CG2-CD1 3.48Å; V230-I253 HydrophobicContact CG2-CG1 3.7Å; G251-I253 PolarHBondContact O-N 3.17Å; I253-E255 VanDerWaalsContact C-N 3.27Å; I253-E255 PolarHBondContact O-N 3.42Å; I253-G256 WeakPolarHBondContact O-CA 3.4Å; I253-G256 PolarHBondContact O-N 2.95Å; I253-N269 PolarHBondContact O-ND2 2.99Å
254	H	98.1	Very high	98.6	Very high	19 Å²	19	30.8 Å²	30.8	9%	0.088	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-59.6	-35.1	-172.1	-63.1	-177.7	0	0	0	113.3	D65 H67 G252 G256 Y257 C273 T274 V275	D65-H254 WeakPolarHBondContact CB-NE2 3.25Å; D65-H254 IonicContact OD1-NE2 2.82Å; H67-H254 AromaticContact NE2-CE1 3.58Å; H67-H254 AromaticContact NE2-NE2 3.59Å; G252-H254 PolarHBondContact O-CD2 2.88Å; G252-H254 PolarHBondContact O-N 2.98Å; H254-G256 PolarHBondContact O-N 2.9Å; H254-G256 VanDerWaalsContact O-N 3.17Å; H254-Y257 PolarHBondContact O-N 3.42Å; H254-C273 WeakPolarHBondContact CB-O 3.5Å; H254-C273 VanDerWaalsContact CG-O 3.3Å; H254-C273 PolarHBondContact ND1-O 3.27Å; H254-T274 PolarHBondContact ND1-O 2.95Å; H254-V275 HydrophobicContact CB-CG1 4.37Å
255	E	98.1	Very high	98.6	Very high	81 Å²	81	25.1 Å²	25.1	38%	0.379	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-61.3	-22.3	175.2	-61.7	97.1	142.9	0	0	112.9	P224 I253 V275	P224-E255 HydrophobicContact CG-CB 4.26Å; P224-E255 HydrophobicContact CG-CG 4.22Å; I253-E255 VanDerWaalsContact C-N 3.27Å; I253-E255 PolarHBondContact O-N 3.42Å; E255-V275 VanDerWaalsContact CD-CG1 3.49Å; E255-V275 HydrophobicContact CG-CG1 3.45Å; E255-V275 VanDerWaalsContact CG-CG1 3.45Å
256	G	98.4	Very high	98.6	Very high	4 Å²	4	26 Å²	26	4%	0.041	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-86.1	-2.4	-177.6	0	0	0	0	0	114.8	R220 I253 H254 G258 N269	R220-G256 WeakPolarHBondContact CB-O 3.33Å; R220-G256 VanDerWaalsContact CZ-O 3.28Å; R220-G256 PolarHBondContact NE-O 3.41Å; R220-G256 PolarHBondContact NH2-O 3.22Å; R220-G256 VanDerWaalsContact NH2-O 3.13Å; I253-G256 WeakPolarHBondContact O-CA 3.4Å; I253-G256 PolarHBondContact O-N 2.95Å; H254-G256 PolarHBondContact O-N 2.9Å; H254-G256 VanDerWaalsContact O-N 3.17Å; G256-G258 PolarHBondContact O-N 3.48Å; G256-N269 VanDerWaalsContact C-CG 3.49Å; G256-N269 VanDerWaalsContact C-ND2 3.3Å; G256-N269 WeakPolarHBondContact CA-ND2 3.47Å; G256-N269 VanDerWaalsContact O-CB 3.27Å; G256-N269 WeakPolarHBondContact O-CB 3.22Å; G256-N269 PolarHBondContact O-ND2 3.38Å
257	Y	98.8	Very high	98.6	Very high	52 Å²	52	22.5 Å²	22.5	20%	0.204	13%	0.128	C	C	.	.			trans	-42.8	130.8	-178.5	168.2	-97	0	0	0	112.7	R220 H254 S271 N281 P282 I284	R220-Y257 PolarHBondContact NH2-O 3Å; H254-Y257 PolarHBondContact O-N 3.42Å; Y257-S271 WeakPolarHBondContact CD2-O 3.44Å; Y257-N281 WeakPolarHBondContact CB-ND2 3.2Å; Y257-N281 HydrophobicContact CD1-CB 4.21Å; Y257-N281 HydrophobicContact CD2-CB 3.68Å; Y257-N281 HydrophobicContact CE1-CB 4.3Å; Y257-N281 HydrophobicContact CE2-CB 3.75Å; Y257-N281 HydrophobicContact CG-CB 3.92Å; Y257-P282 WeakPolarHBondContact CE2-O 3.05Å; Y257-P282 WeakPolarHBondContact OH-CG 3.46Å; Y257-P282 PolarHBondContact OH-O 3.45Å; Y257-I284 HydrophobicContact CD2-CD1 4.11Å; Y257-I284 HydrophobicContact CE2-CD1 3.46Å; Y257-I284 VanDerWaalsContact CE2-CD1 3.46Å; Y257-I284 HydrophobicContact CE2-CG1 3.69Å; Y257-I284 WeakPolarHBondContact OH-CG1 3.41Å
258	G	98.8	Very high	98.6	Very high	10 Å²	10	22.5 Å²	22.5	10%	0.103	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	129.6	-171	179.8	0	0	0	0	0	114.7	G256 N269	G256-G258 PolarHBondContact O-N 3.48Å; G258-N269 PolarHBondContact N-O 3.34Å; G258-N269 PolarHBondContact O-N 3.49Å
259	I	98.9	Very high	98.6	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.021	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	137.4	-166.7	-43.3	174.1	0	0	0	111.1	M43 V44 P46 T266 Y267 I268 I284	M43-I259 VanDerWaalsContact CE-O 3.23Å; M43-I259 WeakPolarHBondContact CE-O 3.45Å; V44-I259 HydrophobicContact CB-CB 4.05Å; V44-I259 HydrophobicContact CB-CG2 3.76Å; V44-I259 HydrophobicContact CG1-CG2 4.37Å; V44-I259 HydrophobicContact CG2-CG2 4.31Å; V44-I259 PolarHBondContact N-O 3.13Å; P46-I259 HydrophobicContact CB-CD1 4.39Å; I259-T266 HydrophobicContact CG2-CG2 3.48Å; I259-T266 VanDerWaalsContact CG2-CG2 3.48Å; I259-Y267 WeakPolarHBondContact CA-O 3.39Å; I259-I268 HydrophobicContact CG1-CG1 4.23Å; I259-I268 HydrophobicContact CG2-CG1 4Å; I259-I284 HydrophobicContact CD1-CG2 3.62Å; I259-I284 HydrophobicContact CG1-CD1 4.11Å; I259-I284 HydrophobicContact CG1-CG2 4.07Å
260	M	98.9	Very high	98.6	Very high	25 Å²	25	22.6 Å²	22.6	12%	0.123	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	160.7	168	-79.5	174.5	75.7	0	0	110.5	V41 H42 M43 F219 R220 Y267	V41-M260 HydrophobicContact CG1-CE 3.64Å; H42-M260 WeakPolarHBondContact O-CA 3.29Å; M43-M260 HydrophobicContact CE-CG 4.37Å; M43-M260 HydrophobicContact SD-CG 3.33Å; M43-M260 WeakPolarHBondContact SD-CG 3.32Å; M43-M260 HydrophobicContact SD-SD 3.91Å; F219-M260 HydrophobicContact CD1-CB 3.89Å; F219-M260 HydrophobicContact CD1-CE 4.11Å; F219-M260 HydrophobicContact CD1-SD 4.43Å; F219-M260 HydrophobicContact CE1-CB 4.48Å; F219-M260 HydrophobicContact CE1-CE 4.36Å; R220-M260 WeakPolarHBondContact CD-SD 3.49Å; R220-M260 HydrophobicContact CG-CG 4.45Å; R220-M260 HydrophobicContact CG-SD 4.26Å; M260-Y267 PolarHBondContact N-O 3.37Å; M260-Y267 PolarHBondContact O-N 3.02Å
261	T	98.8	Very high	98.6	Very high	16 Å²	16	22.6 Å²	22.6	10%	0.098	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	155.4	168.6	-176	0	0	0	0	110.2	V41 H42 V44 G263 T265	V41-T261 VanDerWaalsContact CA-O 3.3Å; V41-T261 WeakPolarHBondContact CA-O 3.1Å; H42-T261 WeakPolarHBondContact CE1-CG2 3.16Å; H42-T261 PolarHBondContact N-O 2.99Å; H42-T261 WeakPolarHBondContact NE2-CG2 3.47Å; H42-T261 PolarHBondContact O-N 3.32Å; V44-T261 HydrophobicContact CG2-CG2 3.79Å; T261-G263 PolarHBondContact OG1-N 3.13Å; T261-T265 WeakPolarHBondContact CA-O 3.39Å; T261-T265 PolarHBondContact OG1-O 2.96Å
262	D	98.6	Very high	98.6	Very high	24 Å²	24	22.6 Å²	22.6	13%	0.128	13%	0.129	C	C	.	.			trans	-104	12.7	165.4	67.3	15.4	0	0	0	113.6	H40 V41 F219 Q240 Y264 T265 Y267	H40-D262 CarbonylContact O-C 3.59Å; V41-D262 HydrophobicContact CG2-CB 4.18Å; F219-D262 HydrophobicContact CE1-CB 4.04Å; F219-D262 HydrophobicContact CZ-CB 3.76Å; Q240-D262 WeakPolarHBondContact CG-OD2 3.34Å; Q240-D262 PolarHBondContact NE2-OD2 3.34Å; D262-Y264 VanDerWaalsContact C-N 3.31Å; D262-Y264 PolarHBondContact OD1-N 3.3Å; D262-T265 PolarHBondContact N-O 2.92Å; D262-T265 VanDerWaalsContact N-O 3.17Å; D262-T265 PolarHBondContact OD1-N 2.92Å; D262-Y267 HydrophobicContact CB-CE2 4Å; D262-Y267 WeakPolarHBondContact OD2-CE2 3.49Å; D262-Y267 PolarHBondContact OD2-OH 3.34Å
263	G	98.3	Very high	98.7	Very high	54 Å²	54	21.6 Å²	21.6	56%	0.557	12%	0.118	S	C	*	.	S	Bend	trans	90.3	-9.9	-174.4	0	0	0	0	0	113.5	H40 T261	H40-G263 PolarHBondContact O-N 2.65Å; H40-G263 VanDerWaalsContact O-N 3.16Å; T261-G263 PolarHBondContact OG1-N 3.13Å
264	Y	98.6	Very high	98.6	Very high	111 Å²	111	21.3 Å²	21.3	44%	0.435	12%	0.118	S	C	.	.	S	Bend	trans	-129.3	-59.5	171.7	-177.4	-85.3	0	0	0	111.8	R244 D262	R244-Y264 HydrophobicContact CB-CD1 4.32Å; R244-Y264 HydrophobicContact CB-CE1 3.83Å; R244-Y264 VanDerWaalsContact O-CE1 3.23Å; R244-Y264 WeakPolarHBondContact O-CE1 3.43Å; D262-Y264 VanDerWaalsContact C-N 3.31Å; D262-Y264 PolarHBondContact OD1-N 3.3Å
265	T	98.9	Very high	98.3	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	14%	0.14	C	C	.	.			trans	-86.1	133.5	180	-48.1	0	0	0	0	108.8	V239 P245 H248 T261 D262 Y267	V239-T265 HydrophobicContact CG1-CG2 4.12Å; P245-T265 HydrophobicContact CG-CG2 4.16Å; P245-T265 WeakPolarHBondContact O-CG2 3.24Å; P245-T265 PolarHBondContact O-OG1 2.74Å; H248-T265 HydrophobicContact CB-CG2 4.1Å; T261-T265 WeakPolarHBondContact CA-O 3.39Å; T261-T265 PolarHBondContact OG1-O 2.96Å; D262-T265 PolarHBondContact N-O 2.92Å; D262-T265 VanDerWaalsContact N-O 3.17Å; D262-T265 PolarHBondContact OD1-N 2.92Å; T265-Y267 HydrophobicContact CG2-CD1 4.37Å; T265-Y267 HydrophobicContact CG2-CD2 4.29Å; T265-Y267 HydrophobicContact CG2-CE1 3.96Å; T265-Y267 HydrophobicContact CG2-CE2 3.86Å; T265-Y267 WeakPolarHBondContact O-CD2 3.2Å; T265-Y267 WeakPolarHBondContact O-CE2 3.37Å
266	T	98.9	Very high	98	Very high	18 Å²	18	24.5 Å²	24.5	11%	0.11	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.2	165.1	-57.3	0	0	0	0	109.3	K246 L247 H248 I259 I268 F286	K246-T266 PolarHBondContact O-N 2.89Å; L247-T266 CarbonylContact C-O 3.5Å; L247-T266 WeakPolarHBondContact CA-O 3.22Å; L247-T266 HydrophobicContact CD1-CG2 4.22Å; H248-T266 PolarHBondContact N-O 2.46Å; I259-T266 HydrophobicContact CG2-CG2 3.48Å; I259-T266 VanDerWaalsContact CG2-CG2 3.48Å; T266-I268 HydrophobicContact CG2-CG1 4.17Å; T266-F286 HydrophobicContact CG2-CD2 4.38Å; T266-F286 HydrophobicContact CG2-CE2 3.73Å; T266-F286 HydrophobicContact CG2-CZ 3.84Å; T266-F286 WeakPolarHBondContact OG1-CZ 3.49Å
267	Y	98.9	Very high	97.7	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118.4	-180	-58.9	-94.4	0	0	0	108.7	P216 F219 V239 Q240 H248 F250 I259 M260 D262 T265	P216-Y267 HydrophobicContact CG-CD1 3.79Å; P216-Y267 HydrophobicContact CG-CE1 3.81Å; F219-Y267 HydrophobicContact CB-CD1 3.99Å; F219-Y267 HydrophobicContact CB-CD2 4.44Å; F219-Y267 HydrophobicContact CB-CG 3.91Å; F219-Y267 HydrophobicContact CD1-CD1 4.25Å; F219-Y267 AromaticContact CD1-CD2 3.27Å; F219-Y267 HydrophobicContact CD1-CD2 3.27Å; F219-Y267 AromaticContact CD1-CE2 3.62Å; F219-Y267 HydrophobicContact CD1-CE2 3.62Å; F219-Y267 AromaticContact CD1-CG 3.62Å; F219-Y267 HydrophobicContact CD1-CG 3.62Å; F219-Y267 HydrophobicContact CD2-CD1 4.41Å; F219-Y267 HydrophobicContact CD2-CE1 4.18Å; F219-Y267 HydrophobicContact CD2-CE2 4.31Å; F219-Y267 AromaticContact CE1-CD2 3.55Å; F219-Y267 HydrophobicContact CE1-CD2 3.55Å; F219-Y267 AromaticContact CE1-CE2 3.48Å; F219-Y267 HydrophobicContact CE1-CE2 3.48Å; F219-Y267 VanDerWaalsContact CE1-CE2 3.48Å; F219-Y267 HydrophobicContact CE1-CG 4.34Å; F219-Y267 HydrophobicContact CE2-CE2 4.21Å; F219-Y267 AromaticContact CG-CD1 3.95Å; F219-Y267 HydrophobicContact CG-CD1 3.95Å; F219-Y267 AromaticContact CG-CD2 3.83Å; F219-Y267 HydrophobicContact CG-CD2 3.83Å; F219-Y267 HydrophobicContact CG-CE1 4.16Å; F219-Y267 HydrophobicContact CG-CE2 4.06Å; F219-Y267 AromaticContact CG-CG 3.77Å; F219-Y267 HydrophobicContact CG-CG 3.77Å; F219-Y267 HydrophobicContact CZ-CD2 4.32Å; F219-Y267 AromaticContact CZ-CE2 3.81Å; F219-Y267 HydrophobicContact CZ-CE2 3.81Å; V239-Y267 HydrophobicContact CG1-CE1 3.86Å; Q240-Y267 WeakPolarHBondContact CG-OH 3.31Å; H248-Y267 HydrophobicContact CB-CD1 4Å; H248-Y267 HydrophobicContact CB-CE1 4.34Å; H248-Y267 AromaticContact ND1-CD1 3.93Å; H248-Y267 AromaticContact ND1-CE1 3.98Å; H248-Y267 WeakPolarHBondContact O-CA 3.34Å; F250-Y267 HydrophobicContact CE1-CD1 4.14Å; I259-Y267 WeakPolarHBondContact CA-O 3.39Å; M260-Y267 PolarHBondContact N-O 3.37Å; M260-Y267 PolarHBondContact O-N 3.02Å; D262-Y267 HydrophobicContact CB-CE2 4Å; D262-Y267 WeakPolarHBondContact OD2-CE2 3.49Å; D262-Y267 PolarHBondContact OD2-OH 3.34Å; T265-Y267 HydrophobicContact CG2-CD1 4.37Å; T265-Y267 HydrophobicContact CG2-CD2 4.29Å; T265-Y267 HydrophobicContact CG2-CE1 3.96Å; T265-Y267 HydrophobicContact CG2-CE2 3.86Å; T265-Y267 WeakPolarHBondContact O-CD2 3.2Å; T265-Y267 WeakPolarHBondContact O-CE2 3.37Å
268	I	98.9	Very high	97.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.6	179.1	-59.6	-176.4	0	0	0	108.6	C62 L247 H248 V249 F250 I259 T266 A270 I284 F286	C62-I268 HydrophobicContact CB-CG2 4.11Å; L247-I268 HydrophobicContact CD1-CD1 3.58Å; L247-I268 HydrophobicContact CD1-CG1 3.77Å; H248-I268 PolarHBondContact O-N 3.2Å; V249-I268 WeakPolarHBondContact CA-O 3.42Å; V249-I268 HydrophobicContact CG1-CB 4.27Å; V249-I268 HydrophobicContact CG1-CG2 4.36Å; V249-I268 HydrophobicContact CG2-CB 4.46Å; F250-I268 PolarHBondContact N-O 3.29Å; F250-I268 VanDerWaalsContact O-O 3.13Å; I259-I268 HydrophobicContact CG1-CG1 4.23Å; I259-I268 HydrophobicContact CG2-CG1 4Å; T266-I268 HydrophobicContact CG2-CG1 4.17Å; I268-A270 HydrophobicContact CG2-CB 4.19Å; I268-I284 HydrophobicContact CD1-CG2 3.96Å; I268-I284 HydrophobicContact CG2-CB 4.12Å; I268-I284 HydrophobicContact CG2-CD1 3.66Å; I268-I284 HydrophobicContact CG2-CG1 4.49Å; I268-I284 HydrophobicContact CG2-CG2 3.94Å; I268-F286 HydrophobicContact CD1-CB 3.82Å; I268-F286 HydrophobicContact CD1-CD2 4.21Å; I268-F286 HydrophobicContact CD1-CG 4.02Å
269	N	98.9	Very high	97.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	108	160.9	-176.1	-33.8	0	0	0	108	R220 F250 I253 G256 G258 S271	R220-N269 HydrophobicContact CB-CB 3.64Å; R220-N269 HydrophobicContact CG-CB 3.96Å; R220-N269 PolarHBondContact O-ND2 3.02Å; F250-N269 HydrophobicContact CD2-CB 4.08Å; F250-N269 HydrophobicContact CE2-CB 3.64Å; F250-N269 HydrophobicContact CZ-CB 4.44Å; F250-N269 CarbonylContact O-C 3.5Å; F250-N269 VanDerWaalsContact O-CA 3.28Å; F250-N269 WeakPolarHBondContact O-CA 3.47Å; I253-N269 PolarHBondContact O-ND2 2.99Å; G256-N269 VanDerWaalsContact C-CG 3.49Å; G256-N269 VanDerWaalsContact C-ND2 3.3Å; G256-N269 WeakPolarHBondContact CA-ND2 3.47Å; G256-N269 VanDerWaalsContact O-CB 3.27Å; G256-N269 WeakPolarHBondContact O-CB 3.22Å; G256-N269 PolarHBondContact O-ND2 3.38Å; G258-N269 PolarHBondContact N-O 3.34Å; G258-N269 PolarHBondContact O-N 3.49Å; N269-S271 WeakPolarHBondContact OD1-CB 3.34Å; N269-S271 PolarHBondContact OD1-N 2.67Å; N269-S271 VanDerWaalsContact OD1-N 3.11Å; N269-S271 PolarHBondContact OD1-OG 2.94Å
270	A	98.9	Very high	97.5	Very high	2 Å²	2	36.4 Å²	36.4	2%	0.017	21%	0.209	C	C	.	.			trans	-97.8	18.8	-173.8	0	0	0	0	0	113.5	C62 V63 S64 V249 F250 I268 T272	C62-A270 HydrophobicContact CB-CB 3.92Å; V63-A270 CarbonylContact C-O 3.58Å; S64-A270 WeakPolarHBondContact CB-O 3.19Å; S64-A270 PolarHBondContact N-O 2.97Å; V249-A270 HydrophobicContact CG1-CB 4.03Å; F250-A270 PolarHBondContact O-N 2.92Å; I268-A270 HydrophobicContact CG2-CB 4.19Å; A270-T272 PolarHBondContact O-N 2.66Å; A270-T272 PolarHBondContact O-OG1 3.19Å
271	S	98.8	Very high	97.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-54.2	111.3	-180	-57	0	0	0	0	111	D65 Y257 N269 N281	D65-S271 WeakPolarHBondContact OD2-CA 3.38Å; D65-S271 PolarHBondContact OD2-OG 2.66Å; Y257-S271 WeakPolarHBondContact CD2-O 3.44Å; N269-S271 WeakPolarHBondContact OD1-CB 3.34Å; N269-S271 PolarHBondContact OD1-N 2.67Å; N269-S271 VanDerWaalsContact OD1-N 3.11Å; N269-S271 PolarHBondContact OD1-OG 2.94Å; S271-N281 WeakPolarHBondContact O-CB 3.44Å; S271-N281 PolarHBondContact O-ND2 2.79Å
272	T	98.8	Very high	97.5	Very high	1 Å²	1	39 Å²	39	1%	0.006	23%	0.226	C	C	.	.			trans	-83.4	-40.8	-175.9	-60.3	0	0	0	0	110.9	V63 S64 T66 I73 A270 P279 T280 N281	V63-T272 WeakPolarHBondContact CG1-OG1 3.33Å; S64-T272 PolarHBondContact N-OG1 3.47Å; S64-T272 WeakPolarHBondContact O-CB 3.17Å; S64-T272 PolarHBondContact O-N 3.26Å; S64-T272 PolarHBondContact O-OG1 3.3Å; T66-T272 HydrophobicContact CG2-CG2 4.32Å; I73-T272 HydrophobicContact CD1-CG2 4Å; A270-T272 PolarHBondContact O-N 2.66Å; A270-T272 PolarHBondContact O-OG1 3.19Å; T272-P279 HydrophobicContact CG2-CB 4.03Å; T272-P279 CarbonylContact O-C 3.44Å; T272-P279 WeakPolarHBondContact O-CA 3.3Å; T272-T280 PolarHBondContact O-N 3.14Å; T272-N281 WeakPolarHBondContact O-CB 3.19Å; T272-N281 PolarHBondContact O-N 3.26Å; T272-N281 VanDerWaalsContact O-N 3.11Å
273	C	98.4	Very high	97.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-70.2	142.3	167.2	-76.6	0	0	0	0	111.4	D65 H254 Q278	D65-C273 WeakPolarHBondContact O-CB 3.15Å; D65-C273 PolarHBondContact O-N 2.85Å; D65-C273 PolarHBondContact O-SG 3.39Å; H254-C273 WeakPolarHBondContact CB-O 3.5Å; H254-C273 VanDerWaalsContact CG-O 3.3Å; H254-C273 PolarHBondContact ND1-O 3.27Å; C273-Q278 CarbonylContact C-O 3.59Å; C273-Q278 VanDerWaalsContact CA-O 3.31Å; C273-Q278 WeakPolarHBondContact CA-O 3.36Å
274	T	97.2	Very high	97.5	Very high	25 Å²	25	35.8 Å²	35.8	15%	0.153	20%	0.197	C	C	.	.			trans	-86.6	179.4	169	64.8	0	0	0	0	110.7	H254 S276 F277 Q278 T280	H254-T274 PolarHBondContact ND1-O 2.95Å; T274-S276 PolarHBondContact O-N 3.13Å; T274-S276 VanDerWaalsContact O-N 3.13Å; T274-S276 PolarHBondContact OG1-N 3.17Å; T274-S276 PolarHBondContact OG1-OG 3.21Å; T274-F277 WeakPolarHBondContact O-CA 3.38Å; T274-F277 PolarHBondContact O-N 2.97Å; T274-Q278 PolarHBondContact N-O 2.88Å; T274-Q278 PolarHBondContact OG1-O 2.97Å; T274-T280 VanDerWaalsContact CG2-OG1 3.28Å; T274-T280 WeakPolarHBondContact CG2-OG1 3.43Å
275	V	92	Very high	97.5	Very high	91 Å²	91	30.8 Å²	30.8	55%	0.552	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-18.6	171.1	-63.3	0	0	0	0	114.3	H254 E255	H254-V275 HydrophobicContact CB-CG1 4.37Å; E255-V275 VanDerWaalsContact CD-CG1 3.49Å; E255-V275 HydrophobicContact CG-CG1 3.45Å; E255-V275 VanDerWaalsContact CG-CG1 3.45Å
276	S	92.4	Very high	97.5	Very high	76 Å²	76	32.5 Å²	32.5	53%	0.531	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	12.5	173	61.4	0	0	0	0	112.7	T274 Q278	T274-S276 PolarHBondContact O-N 3.13Å; T274-S276 VanDerWaalsContact O-N 3.13Å; T274-S276 PolarHBondContact OG1-N 3.17Å; T274-S276 PolarHBondContact OG1-OG 3.21Å; S276-Q278 PolarHBondContact O-N 3.43Å; S276-Q278 PolarHBondContact O-NE2 2.89Å
277	F	90.7	Very high	97.5	Very high	100 Å²	100	32.9 Å²	32.9	44%	0.439	19%	0.186	S	C	.	.	S	Bend	trans	51.1	44.8	-176.3	-67.1	-91.4	0	0	0	111.4	R69 T274	R69-F277 PolarHBondContact NH1-O 3.44Å; R69-F277 PolarHBondContact NH2-O 2.97Å; T274-F277 WeakPolarHBondContact O-CA 3.38Å; T274-F277 PolarHBondContact O-N 2.97Å
278	Q	96.9	Very high	97.5	Very high	91 Å²	91	33.4 Å²	33.4	43%	0.425	19%	0.189	S	C	.	.			trans	-113.1	131.2	172	-61.2	-57.5	-46.8	0	0	109.4	C273 T274 S276 T280	C273-Q278 CarbonylContact C-O 3.59Å; C273-Q278 VanDerWaalsContact CA-O 3.31Å; C273-Q278 WeakPolarHBondContact CA-O 3.36Å; T274-Q278 PolarHBondContact N-O 2.88Å; T274-Q278 PolarHBondContact OG1-O 2.97Å; S276-Q278 PolarHBondContact O-N 3.43Å; S276-Q278 PolarHBondContact O-NE2 2.89Å; Q278-T280 HydrophobicContact CB-CG2 3.99Å; Q278-T280 PolarHBondContact O-N 3.41Å
279	P	97.5	Very high	97.5	Very high	30 Å²	30	36.7 Å²	36.7	20%	0.195	21%	0.211	C	C	.	.			trans	-78.7	59.7	-176.7	35.8	-39.5	0	0	0	111.4	R69 I73 T272	R69-P279 HydrophobicContact CB-CB 4.32Å; R69-P279 HydrophobicContact CB-CG 3.96Å; I73-P279 HydrophobicContact CD1-CB 4.34Å; I73-P279 HydrophobicContact CG1-CB 4.33Å; T272-P279 HydrophobicContact CG2-CB 4.03Å; T272-P279 CarbonylContact O-C 3.44Å; T272-P279 WeakPolarHBondContact O-CA 3.3Å
280	T	98.1	Very high	97.4	Very high	99 Å²	99	38.8 Å²	38.8	61%	0.607	22%	0.223	S	C	*	.			trans	-108.1	-9.5	-171.5	54.4	0	0	0	0	113.8	T272 T274 Q278	T272-T280 PolarHBondContact O-N 3.14Å; T274-T280 VanDerWaalsContact CG2-OG1 3.28Å; T274-T280 WeakPolarHBondContact CG2-OG1 3.43Å; Q278-T280 HydrophobicContact CB-CG2 3.99Å; Q278-T280 PolarHBondContact O-N 3.41Å
281	N	98.6	Very high	97.1	Very high	29 Å²	29	40.6 Å²	40.6	16%	0.155	24%	0.235	C	C	.	.	S	Bend	trans	-71.7	127.9	169.7	-70	-24.2	0	0	0	108.4	Y257 S271 T272	Y257-N281 WeakPolarHBondContact CB-ND2 3.2Å; Y257-N281 HydrophobicContact CD1-CB 4.21Å; Y257-N281 HydrophobicContact CD2-CB 3.68Å; Y257-N281 HydrophobicContact CE1-CB 4.3Å; Y257-N281 HydrophobicContact CE2-CB 3.75Å; Y257-N281 HydrophobicContact CG-CB 3.92Å; S271-N281 WeakPolarHBondContact O-CB 3.44Å; S271-N281 PolarHBondContact O-ND2 2.79Å; T272-N281 WeakPolarHBondContact O-CB 3.19Å; T272-N281 PolarHBondContact O-N 3.26Å; T272-N281 VanDerWaalsContact O-N 3.11Å
282	P	98.6	Very high	96.4	Very high	67 Å²	67	49.6 Å²	49.6	44%	0.435	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-68.4	145.1	-177.8	23.5	-28.2	0	0	0	110.9	Y49 Y257 I284	Y49-P282 VanDerWaalsContact OH-CB 3.29Å; Y49-P282 WeakPolarHBondContact OH-CB 3.47Å; Y257-P282 WeakPolarHBondContact CE2-O 3.05Å; Y257-P282 WeakPolarHBondContact OH-CG 3.46Å; Y257-P282 PolarHBondContact OH-O 3.45Å; P282-I284 PolarHBondContact O-N 2.9Å
283	P	98.9	Very high	94.8	Very high	8 Å²	8	53.3 Å²	53.3	5%	0.052	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-50.1	136.8	167.7	-29	34.5	0	0	0	111.8	Y49 V61 V63 I73 M75 P76	Y49-P283 VanDerWaalsContact CE1-O 3.23Å; Y49-P283 WeakPolarHBondContact CE1-O 3.43Å; Y49-P283 VanDerWaalsContact OH-CD 3.23Å; Y49-P283 WeakPolarHBondContact OH-CD 3.37Å; Y49-P283 PolarHBondContact OH-O 3.18Å; V61-P283 HydrophobicContact CG1-CB 3.91Å; V63-P283 HydrophobicContact CG2-CB 3.83Å; V63-P283 HydrophobicContact CG2-CG 4.05Å; I73-P283 HydrophobicContact CG2-CG 4.02Å; M75-P283 HydrophobicContact SD-CG 3.77Å; P76-P283 HydrophobicContact CG-CB 4.08Å
284	I	98.9	Very high	92	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.015	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.8	178.7	-68.8	171	0	0	0	108.9	C62 Y257 I259 I268 P282	C62-I284 HydrophobicContact CB-CB 4.34Å; C62-I284 WeakPolarHBondContact CB-O 3.48Å; C62-I284 PolarHBondContact N-O 2.98Å; C62-I284 PolarHBondContact O-N 3.02Å; C62-I284 VanDerWaalsContact O-N 3.08Å; Y257-I284 HydrophobicContact CD2-CD1 4.11Å; Y257-I284 HydrophobicContact CE2-CD1 3.46Å; Y257-I284 VanDerWaalsContact CE2-CD1 3.46Å; Y257-I284 HydrophobicContact CE2-CG1 3.69Å; Y257-I284 WeakPolarHBondContact OH-CG1 3.41Å; I259-I284 HydrophobicContact CD1-CG2 3.62Å; I259-I284 HydrophobicContact CG1-CD1 4.11Å; I259-I284 HydrophobicContact CG1-CG2 4.07Å; I268-I284 HydrophobicContact CD1-CG2 3.96Å; I268-I284 HydrophobicContact CG2-CB 4.12Å; I268-I284 HydrophobicContact CG2-CD1 3.66Å; I268-I284 HydrophobicContact CG2-CG1 4.49Å; I268-I284 HydrophobicContact CG2-CG2 3.94Å; P282-I284 PolarHBondContact O-N 2.9Å
285	I	98.9	Very high	91.8	Very high	5 Å²	5	64.3 Å²	64.3	3%	0.026	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	141	171.5	59.4	165.7	0	0	0	111.2	I47 Y49 R59 F60 V61 P76	I47-I285 HydrophobicContact CD1-CD1 3.94Å; I47-I285 HydrophobicContact CD1-CG1 4.1Å; I47-I285 HydrophobicContact CG1-CD1 3.79Å; I47-I285 HydrophobicContact CG1-CG1 3.69Å; Y49-I285 HydrophobicContact CD1-CD1 4.02Å; Y49-I285 HydrophobicContact CD1-CG1 4.12Å; Y49-I285 HydrophobicContact CD1-CG2 4.16Å; Y49-I285 HydrophobicContact CE1-CG1 4.46Å; Y49-I285 HydrophobicContact CE1-CG2 4.19Å; R59-I285 HydrophobicContact CG-CB 4.21Å; R59-I285 HydrophobicContact CG-CG2 4.46Å; F60-I285 CarbonylContact O-C 3.57Å; F60-I285 VanDerWaalsContact O-CA 3.29Å; F60-I285 WeakPolarHBondContact O-CA 3.45Å; V61-I285 HydrophobicContact CG2-CG2 4.21Å; P76-I285 HydrophobicContact CB-CG2 4.02Å; P76-I285 HydrophobicContact CG-CG2 3.56Å
286	F	98.8	Very high	91.7	Very high	38 Å²	38	62.9 Å²	62.9	17%	0.167	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	131.5	178.6	-167.1	-101.2	0	0	0	111	F60 L247 T266 I268 L288	F60-F286 PolarHBondContact N-O 2.89Å; F60-F286 PolarHBondContact O-N 3.26Å; L247-F286 HydrophobicContact CD1-CD1 4.11Å; L247-F286 HydrophobicContact CD1-CE1 4.27Å; L247-F286 HydrophobicContact CD2-CD1 4.09Å; T266-F286 HydrophobicContact CG2-CD2 4.38Å; T266-F286 HydrophobicContact CG2-CE2 3.73Å; T266-F286 HydrophobicContact CG2-CZ 3.84Å; T266-F286 WeakPolarHBondContact OG1-CZ 3.49Å; I268-F286 HydrophobicContact CD1-CB 3.82Å; I268-F286 HydrophobicContact CD1-CD2 4.21Å; I268-F286 HydrophobicContact CD1-CG 4.02Å; F286-L288 HydrophobicContact CD1-CD2 4.35Å; F286-L288 HydrophobicContact CD1-CG 4.06Å; F286-L288 HydrophobicContact CE1-CD2 3.65Å; F286-L288 HydrophobicContact CE1-CG 3.88Å
287	D	98.8	Very high	91.7	Very high	25 Å²	25	62.2 Å²	62.2	13%	0.134	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.7	-176.8	-65.1	-28.9	0	0	0	110.1	P54 H57 T58 R59	P54-D287 WeakPolarHBondContact CD-OD2 3.36Å; H57-D287 HydrophobicContact CB-CB 4.28Å; T58-D287 WeakPolarHBondContact O-CA 3.3Å; R59-D287 VanDerWaalsContact CA-OD1 3.26Å; R59-D287 WeakPolarHBondContact CA-OD1 3.38Å; R59-D287 WeakPolarHBondContact CB-OD1 3.33Å; R59-D287 VanDerWaalsContact CG-OD1 3.26Å; R59-D287 WeakPolarHBondContact CG-OD1 3.36Å; R59-D287 IonicContact CZ-OD1 3.75Å; R59-D287 IonicContact CZ-OD2 3.6Å; R59-D287 IonicContact NE-OD1 3.91Å; R59-D287 PolarHBondContact NE-OD1 3.16Å; R59-D287 IonicContact NE-OD2 2.78Å; R59-D287 IonicContact NH2-OD1 2.67Å; R59-D287 IonicContact NH2-OD2 3.69Å; R59-D287 PolarHBondContact NH2-OD2 3.31Å
288	L	98.6	Very high	91.8	Very high	11 Å²	11	59.9 Å²	59.9	6%	0.058	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	145.1	170	-73.8	171.8	0	0	0	110.9	H57 T58 F60 F172 I209 K246 L247 F286 T290	H57-L288 CarbonylContact C-O 3.56Å; H57-L288 VanDerWaalsContact CA-O 3.24Å; H57-L288 WeakPolarHBondContact CA-O 3.27Å; H57-L288 WeakPolarHBondContact CB-O 3.46Å; T58-L288 PolarHBondContact N-O 3.07Å; T58-L288 PolarHBondContact O-N 3.35Å; F60-L288 HydrophobicContact CD2-CB 4.49Å; F60-L288 HydrophobicContact CD2-CD1 4.35Å; F60-L288 HydrophobicContact CE2-CB 4Å; F60-L288 HydrophobicContact CE2-CD1 4Å; F60-L288 HydrophobicContact CE2-CG 4.32Å; F172-L288 HydrophobicContact CE1-CB 3.68Å; F172-L288 HydrophobicContact CE1-CD1 4.05Å; F172-L288 HydrophobicContact CZ-CB 3.94Å; I209-L288 HydrophobicContact CD1-CD1 3.95Å; I209-L288 HydrophobicContact CG1-CD1 4Å; K246-L288 HydrophobicContact CB-CD2 4.01Å; K246-L288 HydrophobicContact CD-CD2 4.27Å; L247-L288 HydrophobicContact CB-CD1 4.15Å; L247-L288 HydrophobicContact CD2-CD1 4.41Å; F286-L288 HydrophobicContact CD1-CD2 4.35Å; F286-L288 HydrophobicContact CD1-CG 4.06Å; F286-L288 HydrophobicContact CE1-CD2 3.65Å; F286-L288 HydrophobicContact CE1-CG 3.88Å; L288-T290 PolarHBondContact O-N 3.13Å
289	P	98.1	Very high	91.5	Very high	70 Å²	70	58 Å²	58	46%	0.455	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	125.5	170	-17.4	26.6	0	0	0	109.5	H57 F172 P291	H57-P289 VanDerWaalsContact CD2-N 3.25Å; H57-P289 WeakPolarHBondContact NE2-CG 3.43Å; F172-P289 WeakPolarHBondContact CZ-O 3.13Å; P289-P291 WeakPolarHBondContact O-CD 3.41Å
290	T	97.1	Very high	91.1	Very high	43 Å²	43	59.9 Å²	59.9	26%	0.264	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-66.8	124.9	178.8	-49.4	0	0	0	0	108.4	G56 H57 T58 F172 L288 Q292	G56-T290 WeakPolarHBondContact O-CB 3.37Å; G56-T290 PolarHBondContact O-N 2.88Å; G56-T290 PolarHBondContact O-OG1 2.89Å; H57-T290 VanDerWaalsContact C-OG1 3.32Å; T58-T290 PolarHBondContact N-OG1 2.82Å; T58-T290 PolarHBondContact OG1-OG1 3.13Å; F172-T290 HydrophobicContact CE2-CG2 4.19Å; L288-T290 PolarHBondContact O-N 3.13Å; T290-Q292 PolarHBondContact O-N 3.32Å; T290-Q292 VanDerWaalsContact O-N 3.09Å
291	P	94.3	Very high	90.6	Very high	41 Å²	41	57.1 Å²	57.1	27%	0.266	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-55.5	119.7	174.1	-26.6	35.9	0	0	0	109.3	F172 P289 G293	F172-P291 HydrophobicContact CD1-CG 3.96Å; F172-P291 HydrophobicContact CD2-CG 4.48Å; F172-P291 HydrophobicContact CE1-CG 4.08Å; F172-P291 HydrophobicContact CG-CG 4.19Å; F172-P291 HydrophobicContact CZ-CG 4.41Å; P289-P291 WeakPolarHBondContact O-CD 3.41Å; P291-G293 PolarHBondContact O-N 3.07Å
292	Q	82.9	Confident	89.9	Confident	189 Å²	189	59.2 Å²	59.2	88%	0.883	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-72.3	123.2	168.7	-64.8	-176	2.6	0	0	106.1	T290 S294	T290-Q292 PolarHBondContact O-N 3.32Å; T290-Q292 VanDerWaalsContact O-N 3.09Å; Q292-S294 PolarHBondContact O-N 2.78Å
293	G	64.6	Low	89.2	Confident	78 Å²	78	58.6 Å²	58.6	80%	0.804	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-52.6	129.3	176.8	0	0	0	0	0	109.9	P291	P291-G293 PolarHBondContact O-N 3.07Å
294	S	40.8	Very low	88.3	Confident	192 Å²	192	63.2 Å²	63.2	100%	1.343	40%	0.401	S	S	*	.			trans	-70.6	0	162.6	54.3	0	0	0	0	110.5	Q292	Q292-S294 PolarHBondContact O-N 2.78Å

Retrieved 294 of 294 residues in 104.1 ms (Link to these results)

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