A0A077Z2E0_TRITR Loading...

ATP-dependent (S)-NAD(P)H-hydrate dehydratase

Catalyzes the dehydration of the S-form of NAD(P)HX at the expense of ATP, which is converted to ADP. Together with NAD(P)HX epimerase, which catalyzes the epimerization of the S- and R-forms, the enzyme allows the repair of both epimers of NAD(P)HX, a damaged form of NAD(P)H that is a result of enzymatic or heat-dependent hydration.

AlphaFold DB , UniProt , Accession A0A077Z2E0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 327 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	45.7	Very low	45.9	Very low	223 Å²	223	103.6 Å²	103.6	100%	1.099	59%	0.593	S	S	*	*				0	-32.4	0	-110.7	176	-168.5	0	0	113.6	G3 F4	M1-G3 VanDerWaalsContact C-N 3.32Å; M1-G3 PolarHBondContact O-N 3.05Å; M1-F4 PolarHBondContact O-N 3.47Å
2	V	46.2	Very low	46.1	Very low	118 Å²	118	97 Å²	97	72%	0.715	56%	0.56	S	S	*	*	H	α-helix	trans	-61.3	-30	-173.2	-169	0	0	0	0	114.6	T5	V2-T5 PolarHBondContact O-OG1 2.88Å
3	G	44.6	Very low	46.3	Very low	59 Å²	59	93.5 Å²	93.5	61%	0.608	55%	0.545	S	S	*	.	H	α-helix	trans	-80.7	-17.1	-176.1	0	0	0	0	0	116.8	M1	M1-G3 VanDerWaalsContact C-N 3.32Å; M1-G3 PolarHBondContact O-N 3.05Å
4	F	39.7	Very low	46.5	Very low	169 Å²	169	95.4 Å²	95.4	74%	0.741	55%	0.545	S	S	*	.	H	α-helix	trans	-87	-32.2	-174.3	-129.3	-89.8	0	0	0	112.4	M1 M8	M1-F4 PolarHBondContact O-N 3.47Å; F4-M8 VanDerWaalsContact O-CG 3.24Å; F4-M8 WeakPolarHBondContact O-CG 3.4Å; F4-M8 PolarHBondContact O-N 2.89Å
5	T	47.1	Very low	46.7	Very low	78 Å²	78	89.7 Å²	89.7	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-70.5	-40.8	178.1	41.4	0	0	0	0	112	V2 A7 M8 H9	V2-T5 PolarHBondContact O-OG1 2.88Å; T5-A7 PolarHBondContact O-N 2.98Å; T5-M8 PolarHBondContact O-N 3.36Å; T5-H9 PolarHBondContact O-CD2 3.02Å; T5-H9 VanDerWaalsContact O-CD2 3.27Å; T5-H9 PolarHBondContact O-N 3.22Å
6	D	47.6	Very low	47	Very low	104 Å²	104	91 Å²	91	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-67.1	-37.5	-178.9	-71.4	-9	0	0	0	112.1	H9 S10	D6-H9 PolarHBondContact O-N 3.28Å; D6-S10 VanDerWaalsContact O-CB 3.24Å; D6-S10 WeakPolarHBondContact O-CB 3.44Å; D6-S10 PolarHBondContact O-N 3.35Å
7	A	47.3	Very low	46.9	Very low	62 Å²	62	93.6 Å²	93.6	51%	0.512	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-39	174.9	0	0	0	0	0	112.1	T5 S10 A11	T5-A7 PolarHBondContact O-N 2.98Å; A7-S10 PolarHBondContact O-N 2.88Å; A7-A11 WeakPolarHBondContact O-CB 3.45Å; A7-A11 PolarHBondContact O-N 3.47Å
8	M	45.8	Very low	46.8	Very low	95 Å²	95	94.7 Å²	94.7	47%	0.468	52%	0.524	S	S	.	.	H	α-helix	trans	-67.5	-43.7	176.1	-66.6	-100.3	80.2	0	0	111.4	F4 T5 A11 A12	F4-M8 VanDerWaalsContact O-CG 3.24Å; F4-M8 WeakPolarHBondContact O-CG 3.4Å; F4-M8 PolarHBondContact O-N 2.89Å; T5-M8 PolarHBondContact O-N 3.36Å; M8-A11 PolarHBondContact O-N 3.42Å; M8-A12 VanDerWaalsContact O-CB 3.3Å; M8-A12 WeakPolarHBondContact O-CB 3.39Å; M8-A12 PolarHBondContact O-N 3.12Å
9	H	46.4	Very low	46.8	Very low	139 Å²	139	91.4 Å²	91.4	64%	0.644	50%	0.504	S	S	*	.	H	α-helix	trans	-66.1	-37	175.1	-80	-64.7	0	0	0	112.7	T5 D6 S13	T5-H9 PolarHBondContact O-CD2 3.02Å; T5-H9 VanDerWaalsContact O-CD2 3.27Å; T5-H9 PolarHBondContact O-N 3.22Å; D6-H9 PolarHBondContact O-N 3.28Å; H9-S13 WeakPolarHBondContact O-CB 3.36Å; H9-S13 PolarHBondContact O-N 2.84Å; H9-S13 PolarHBondContact O-OG 3.49Å; H9-S13 VanDerWaalsContact O-OG 3.12Å
10	S	46.6	Very low	46.9	Very low	57 Å²	57	90.6 Å²	90.6	40%	0.399	51%	0.505	S	S	.	.	H	α-helix	trans	-66.6	-43.2	175.1	178.3	0	0	0	0	111.6	D6 A7 S13 Q14	D6-S10 VanDerWaalsContact O-CB 3.24Å; D6-S10 WeakPolarHBondContact O-CB 3.44Å; D6-S10 PolarHBondContact O-N 3.35Å; A7-S10 PolarHBondContact O-N 2.88Å; S10-S13 PolarHBondContact O-N 2.9Å; S10-S13 PolarHBondContact O-OG 2.97Å; S10-Q14 PolarHBondContact O-N 3.45Å
11	A	47.7	Very low	46.9	Very low	36 Å²	36	90.7 Å²	90.7	30%	0.298	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-45	175.2	0	0	0	0	0	111.4	A7 M8 S13 Q14 V15	A7-A11 WeakPolarHBondContact O-CB 3.45Å; A7-A11 PolarHBondContact O-N 3.47Å; M8-A11 PolarHBondContact O-N 3.42Å; A11-S13 VanDerWaalsContact C-N 3.35Å; A11-S13 PolarHBondContact O-N 3.02Å; A11-Q14 PolarHBondContact O-N 2.91Å; A11-V15 VanDerWaalsContact O-CB 3.3Å; A11-V15 WeakPolarHBondContact O-CB 3.24Å; A11-V15 WeakPolarHBondContact O-CG2 3.46Å; A11-V15 PolarHBondContact O-N 2.78Å
12	A	48	Very low	47.2	Very low	24 Å²	24	82.4 Å²	82.4	20%	0.198	48%	0.484	C	S	.	.	H	α-helix	trans	-61.5	-40.9	176.9	0	0	0	0	0	112.1	M8 V15 Q16	M8-A12 VanDerWaalsContact O-CB 3.3Å; M8-A12 WeakPolarHBondContact O-CB 3.39Å; M8-A12 PolarHBondContact O-N 3.12Å; A12-V15 PolarHBondContact O-N 2.88Å; A12-Q16 PolarHBondContact O-N 3.24Å
13	S	49.3	Very low	47.7	Very low	52 Å²	52	77.5 Å²	77.5	36%	0.364	45%	0.454	S	S	.	.	H	α-helix	trans	-72.3	-39.4	179.4	66.6	0	0	0	0	113.1	H9 S10 A11 V15 Q16 Q17	H9-S13 WeakPolarHBondContact O-CB 3.36Å; H9-S13 PolarHBondContact O-N 2.84Å; H9-S13 PolarHBondContact O-OG 3.49Å; H9-S13 VanDerWaalsContact O-OG 3.12Å; S10-S13 PolarHBondContact O-N 2.9Å; S10-S13 PolarHBondContact O-OG 2.97Å; A11-S13 VanDerWaalsContact C-N 3.35Å; A11-S13 PolarHBondContact O-N 3.02Å; S13-V15 VanDerWaalsContact C-N 3.28Å; S13-V15 PolarHBondContact O-N 3.33Å; S13-Q16 PolarHBondContact O-N 3.41Å; S13-Q17 WeakPolarHBondContact O-CG 3.4Å; S13-Q17 PolarHBondContact O-N 3.3Å
14	Q	48.5	Very low	49	Very low	119 Å²	119	80.7 Å²	80.7	56%	0.556	45%	0.448	S	S	*	.	H	α-helix	trans	-62	-39.2	171.9	-79.7	-175.8	-0.4	0	0	111.5	S10 A11 Q17 L18	S10-Q14 PolarHBondContact O-N 3.45Å; A11-Q14 PolarHBondContact O-N 2.91Å; Q14-Q17 PolarHBondContact O-N 3.35Å; Q14-L18 WeakPolarHBondContact O-CB 3.13Å; Q14-L18 WeakPolarHBondContact O-CG 3.3Å; Q14-L18 PolarHBondContact O-N 3.47Å
15	V	50.2	Low	50.7	Low	11 Å²	11	77 Å²	77	7%	0.067	44%	0.443	C	S	.	.	H	α-helix	trans	-65.5	-46.6	175.8	171.3	0	0	0	0	110.1	A11 A12 S13 Q17 L18 F19 N324	A11-V15 VanDerWaalsContact O-CB 3.3Å; A11-V15 WeakPolarHBondContact O-CB 3.24Å; A11-V15 WeakPolarHBondContact O-CG2 3.46Å; A11-V15 PolarHBondContact O-N 2.78Å; A12-V15 PolarHBondContact O-N 2.88Å; S13-V15 VanDerWaalsContact C-N 3.28Å; S13-V15 PolarHBondContact O-N 3.33Å; V15-Q17 VanDerWaalsContact C-N 3.32Å; V15-Q17 PolarHBondContact O-N 3.02Å; V15-L18 PolarHBondContact O-N 2.7Å; V15-F19 HydrophobicContact CB-CD2 4.47Å; V15-F19 HydrophobicContact CG1-CD2 3.32Å; V15-F19 HydrophobicContact CG1-CE2 3.21Å; V15-F19 WeakPolarHBondContact O-CB 3.1Å; V15-F19 WeakPolarHBondContact O-CD2 3.35Å; V15-F19 PolarHBondContact O-N 2.74Å; V15-N324 HydrophobicContact CG1-CB 4.1Å
16	Q	50.7	Low	52.4	Low	110 Å²	110	75 Å²	75	51%	0.514	43%	0.432	S	S	.	.	H	α-helix	trans	-59.8	-36.2	173.3	-79.6	178	-14.5	0	0	113.4	A12 S13 F19 S20	A12-Q16 PolarHBondContact O-N 3.24Å; S13-Q16 PolarHBondContact O-N 3.41Å; Q16-F19 PolarHBondContact O-N 2.97Å; Q16-S20 WeakPolarHBondContact O-CB 3.16Å; Q16-S20 PolarHBondContact O-N 3.41Å; Q16-S20 PolarHBondContact O-OG 2.87Å
17	Q	46.6	Very low	54.3	Low	136 Å²	136	70 Å²	70	64%	0.636	41%	0.405	S	S	*	.	H	α-helix	trans	-70.3	-39.2	175	-76.7	-175.3	-7.7	0	0	112.8	S13 Q14 V15 S20 S21	S13-Q17 WeakPolarHBondContact O-CG 3.4Å; S13-Q17 PolarHBondContact O-N 3.3Å; Q14-Q17 PolarHBondContact O-N 3.35Å; V15-Q17 VanDerWaalsContact C-N 3.32Å; V15-Q17 PolarHBondContact O-N 3.02Å; Q17-S20 WeakPolarHBondContact CA-OG 3.34Å; Q17-S20 PolarHBondContact O-OG 3.4Å; Q17-S21 PolarHBondContact O-N 3.3Å; Q17-S21 PolarHBondContact O-OG 2.88Å
18	L	44.1	Very low	56.2	Low	112 Å²	112	72.5 Å²	72.5	59%	0.586	40%	0.401	S	S	*	.	H	α-helix	trans	-67.4	-38.2	172	-75.9	164.1	0	0	0	111.4	Q14 V15 S21 G22	Q14-L18 WeakPolarHBondContact O-CB 3.13Å; Q14-L18 WeakPolarHBondContact O-CG 3.3Å; Q14-L18 PolarHBondContact O-N 3.47Å; V15-L18 PolarHBondContact O-N 2.7Å; L18-S21 PolarHBondContact O-OG 3.45Å; L18-G22 PolarHBondContact O-N 3.41Å
19	F	47.3	Very low	58.4	Low	32 Å²	32	69.3 Å²	69.3	14%	0.14	39%	0.389	C	S	.	.	H	α-helix	trans	-66.1	-42	176.1	-90.3	-68.9	0	0	0	112.5	V15 Q16 L23 V240 L325	V15-F19 HydrophobicContact CB-CD2 4.47Å; V15-F19 HydrophobicContact CG1-CD2 3.32Å; V15-F19 HydrophobicContact CG1-CE2 3.21Å; V15-F19 WeakPolarHBondContact O-CB 3.1Å; V15-F19 WeakPolarHBondContact O-CD2 3.35Å; V15-F19 PolarHBondContact O-N 2.74Å; Q16-F19 PolarHBondContact O-N 2.97Å; F19-L23 HydrophobicContact CD1-CD1 3.48Å; F19-L23 VanDerWaalsContact CD1-CD1 3.48Å; F19-L23 HydrophobicContact CD1-CD2 4.07Å; F19-L23 HydrophobicContact CD1-CG 4.44Å; F19-L23 HydrophobicContact CE1-CD1 3.99Å; F19-L23 HydrophobicContact CG-CD1 4.46Å; F19-V240 HydrophobicContact CE1-CG1 4.41Å; F19-V240 HydrophobicContact CE1-CG2 3.87Å; F19-V240 HydrophobicContact CZ-CG1 3.91Å; F19-V240 HydrophobicContact CZ-CG2 4.16Å; F19-L325 HydrophobicContact CE1-CD2 3.78Å; F19-L325 HydrophobicContact CE2-CD2 3.79Å; F19-L325 HydrophobicContact CZ-CD2 3.18Å; F19-L325 HydrophobicContact CZ-CG 4.46Å
20	S	48.2	Very low	60.6	Low	75 Å²	75	62.7 Å²	62.7	52%	0.524	36%	0.358	S	S	.	.	H	α-helix	trans	-68	-36.7	-178.7	49.7	0	0	0	0	112.5	Q16 Q17 R28	Q16-S20 WeakPolarHBondContact O-CB 3.16Å; Q16-S20 PolarHBondContact O-N 3.41Å; Q16-S20 PolarHBondContact O-OG 2.87Å; Q17-S20 WeakPolarHBondContact CA-OG 3.34Å; Q17-S20 PolarHBondContact O-OG 3.4Å; S20-R28 PolarHBondContact O-NH1 3.45Å
21	S	47.8	Very low	62.9	Low	93 Å²	93	60.8 Å²	60.8	65%	0.65	34%	0.343	S	S	*	.	H	α-helix	trans	-86.6	-31.6	-177.5	56	0	0	0	0	114.7	Q17 L18	Q17-S21 PolarHBondContact O-N 3.3Å; Q17-S21 PolarHBondContact O-OG 2.88Å; L18-S21 PolarHBondContact O-OG 3.45Å
22	G	50.6	Low	65.1	Low	50 Å²	50	66.5 Å²	66.5	52%	0.515	36%	0.357	S	S	.	.	H	α-helix	trans	-92.1	-30.2	-170.6	0	0	0	0	0	116.9	L18	L18-G22 PolarHBondContact O-N 3.41Å
23	L	57.2	Low	67.3	Low	15 Å²	15	66.6 Å²	66.6	8%	0.079	35%	0.353	C	S	.	.	S	Bend	trans	-74.4	139.4	-170.8	-91.3	67	0	0	0	112.5	F19 R28	F19-L23 HydrophobicContact CD1-CD1 3.48Å; F19-L23 VanDerWaalsContact CD1-CD1 3.48Å; F19-L23 HydrophobicContact CD1-CD2 4.07Å; F19-L23 HydrophobicContact CD1-CG 4.44Å; F19-L23 HydrophobicContact CE1-CD1 3.99Å; F19-L23 HydrophobicContact CG-CD1 4.46Å; L23-R28 HydrophobicContact CB-CG 3.69Å; L23-R28 HydrophobicContact CD2-CG 4.42Å; L23-R28 PolarHBondContact O-NH1 2.92Å; L23-R28 PolarHBondContact O-NH2 2.9Å
24	R	72.3	Confident	69.5	Low	126 Å²	126	64.1 Å²	64.1	48%	0.475	34%	0.336	S	S	.	.			trans	-59.5	153.8	166.9	-62.1	-176.9	178.2	-149.4	-3.6	110.3	S26 S27 R28	R24-S26 PolarHBondContact O-N 3.33Å; R24-S27 PolarHBondContact O-N 2.94Å; R24-S27 VanDerWaalsContact O-N 3.08Å; R24-R28 PolarHBondContact O-N 3.46Å
25	S	75.2	Confident	71.8	Confident	92 Å²	92	61.9 Å²	61.9	64%	0.643	33%	0.325	S	S	*	.	H	α-helix	trans	-54.6	-39.3	178.9	52.2	0	0	0	0	112.7	R28 S29	S25-R28 PolarHBondContact O-N 3.27Å; S25-S29 PolarHBondContact O-N 3.24Å
26	S	82.1	Confident	73.8	Confident	35 Å²	35	66.3 Å²	66.3	25%	0.245	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-48.1	174.6	52.8	0	0	0	0	112.3	R24 R28 S29 A30 Y280	R24-S26 PolarHBondContact O-N 3.33Å; S26-R28 VanDerWaalsContact C-N 3.35Å; S26-R28 PolarHBondContact O-N 3.25Å; S26-S29 PolarHBondContact O-N 3.45Å; S26-A30 WeakPolarHBondContact O-CB 3.33Å; S26-A30 PolarHBondContact O-N 2.78Å; S26-Y280 WeakPolarHBondContact CA-OH 3.38Å; S26-Y280 WeakPolarHBondContact CB-OH 3.33Å; S26-Y280 PolarHBondContact O-OH 2.84Å
27	S	87.5	Confident	75.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.1	-38.7	177.9	-52.9	0	0	0	0	112.4	R24 A30 M31 Q237	R24-S27 PolarHBondContact O-N 2.94Å; R24-S27 VanDerWaalsContact O-N 3.08Å; S27-A30 PolarHBondContact O-N 2.9Å; S27-M31 WeakPolarHBondContact O-CB 3.3Å; S27-M31 PolarHBondContact O-N 3.32Å; S27-Q237 PolarHBondContact OG-O 3.08Å
28	R	89.1	Confident	78.1	Confident	114 Å²	114	56.2 Å²	56.2	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-64.4	-42.5	173.4	-73.9	-168.1	-74.7	-105.1	-9.8	112.2	S20 L23 R24 S25 S26 M31 R32	S20-R28 PolarHBondContact O-NH1 3.45Å; L23-R28 HydrophobicContact CB-CG 3.69Å; L23-R28 HydrophobicContact CD2-CG 4.42Å; L23-R28 PolarHBondContact O-NH1 2.92Å; L23-R28 PolarHBondContact O-NH2 2.9Å; R24-R28 PolarHBondContact O-N 3.46Å; S25-R28 PolarHBondContact O-N 3.27Å; S26-R28 VanDerWaalsContact C-N 3.35Å; S26-R28 PolarHBondContact O-N 3.25Å; R28-M31 PolarHBondContact O-N 3.26Å; R28-R32 PolarHBondContact O-N 3.11Å; R28-R32 VanDerWaalsContact O-N 3.09Å
29	S	91.2	Very high	80.4	Confident	28 Å²	28	52.7 Å²	52.7	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-45.3	176.6	-168.5	0	0	0	0	111.4	S25 S26 R32 M33	S25-S29 PolarHBondContact O-N 3.24Å; S26-S29 PolarHBondContact O-N 3.45Å; S29-R32 PolarHBondContact O-N 3.27Å; S29-M33 WeakPolarHBondContact O-CG 3.5Å; S29-M33 PolarHBondContact O-N 3.42Å
30	A	93.3	Very high	82.4	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-47.7	176.9	0	0	0	0	0	111.6	S26 S27 R32 M33 V34 L236 Y280 L285 F288	S26-A30 WeakPolarHBondContact O-CB 3.33Å; S26-A30 PolarHBondContact O-N 2.78Å; S27-A30 PolarHBondContact O-N 2.9Å; A30-R32 VanDerWaalsContact C-N 3.32Å; A30-R32 PolarHBondContact O-N 2.79Å; A30-M33 PolarHBondContact O-N 2.84Å; A30-M33 VanDerWaalsContact O-N 3.08Å; A30-V34 WeakPolarHBondContact O-CG2 3.34Å; A30-V34 PolarHBondContact O-N 2.97Å; A30-L236 HydrophobicContact CB-CD1 3.61Å; A30-L236 HydrophobicContact CB-CD2 4.34Å; A30-Y280 HydrophobicContact CB-CD2 3.94Å; A30-Y280 HydrophobicContact CB-CE2 3.76Å; A30-L285 HydrophobicContact CB-CD2 4.13Å; A30-F288 HydrophobicContact CB-CD1 3.81Å; A30-F288 HydrophobicContact CB-CE1 3.9Å; A30-F288 HydrophobicContact CB-CG 4.29Å; A30-F288 HydrophobicContact CB-CZ 4.43Å
31	M	95	Very high	84.1	Confident	16 Å²	16	64.4 Å²	64.4	8%	0.079	33%	0.332	C	S	.	.	H	α-helix	trans	-57.8	-43.9	177.4	-173.3	58.9	76.9	0	0	111.9	S27 R28 M33 V34 K35 F288 L325 F326	S27-M31 WeakPolarHBondContact O-CB 3.3Å; S27-M31 PolarHBondContact O-N 3.32Å; R28-M31 PolarHBondContact O-N 3.26Å; M31-M33 VanDerWaalsContact C-N 3.33Å; M31-M33 PolarHBondContact O-N 2.98Å; M31-V34 PolarHBondContact O-N 2.76Å; M31-K35 WeakPolarHBondContact O-CG 3.48Å; M31-K35 PolarHBondContact O-N 3.3Å; M31-F288 HydrophobicContact CB-CE1 4.2Å; M31-F288 HydrophobicContact CE-CE1 4.03Å; M31-L325 HydrophobicContact CE-CD2 3.97Å; M31-F326 HydrophobicContact CE-CE1 4.23Å; M31-F326 HydrophobicContact SD-CD1 3.71Å; M31-F326 HydrophobicContact SD-CE1 3.57Å; M31-F326 VanDerWaalsContact SD-CE1 3.57Å
32	R	93.7	Very high	86	Confident	156 Å²	156	62.8 Å²	62.8	59%	0.589	32%	0.32	S	S	*	.	H	α-helix	trans	-60.6	-41	175.6	-177.6	-178.6	62.4	177.3	-2.6	112.1	R28 S29 A30 Q36	R28-R32 PolarHBondContact O-N 3.11Å; R28-R32 VanDerWaalsContact O-N 3.09Å; S29-R32 PolarHBondContact O-N 3.27Å; A30-R32 VanDerWaalsContact C-N 3.32Å; A30-R32 PolarHBondContact O-N 2.79Å; R32-Q36 WeakPolarHBondContact O-CG 3.35Å; R32-Q36 PolarHBondContact O-N 3.05Å
33	M	94	Very high	87.6	Confident	26 Å²	26	71.9 Å²	71.9	13%	0.128	34%	0.341	C	S	.	.	H	α-helix	trans	-68.4	-38.8	176.8	-69.6	-179.1	75.6	0	0	112.2	S29 A30 M31 Q36 C37 Y280 L285	S29-M33 WeakPolarHBondContact O-CG 3.5Å; S29-M33 PolarHBondContact O-N 3.42Å; A30-M33 PolarHBondContact O-N 2.84Å; A30-M33 VanDerWaalsContact O-N 3.08Å; M31-M33 VanDerWaalsContact C-N 3.33Å; M31-M33 PolarHBondContact O-N 2.98Å; M33-Q36 WeakPolarHBondContact O-CB 3.17Å; M33-Q36 PolarHBondContact O-N 3Å; M33-C37 PolarHBondContact O-N 3.47Å; M33-C37 PolarHBondContact O-SG 3.08Å; M33-Y280 HydrophobicContact SD-CD2 3.71Å; M33-Y280 HydrophobicContact SD-CE2 4.46Å; M33-Y280 HydrophobicContact SD-CG 4.49Å; M33-L285 HydrophobicContact CB-CD1 3.99Å; M33-L285 HydrophobicContact CB-CD2 3.81Å; M33-L285 HydrophobicContact CE-CD1 3.97Å; M33-L285 HydrophobicContact SD-CD2 4.49Å
34	V	95.5	Very high	88.9	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.006	38%	0.377	C	S	.	.	H	α-helix	trans	-58.3	-49.2	174.1	169.6	0	0	0	0	110.6	A30 M31 Q36 C37 I38 F261 L285 F288 A289 F326	A30-V34 WeakPolarHBondContact O-CG2 3.34Å; A30-V34 PolarHBondContact O-N 2.97Å; M31-V34 PolarHBondContact O-N 2.76Å; V34-Q36 PolarHBondContact O-N 2.78Å; V34-Q36 VanDerWaalsContact O-N 3.14Å; V34-C37 WeakPolarHBondContact O-CB 3.42Å; V34-C37 PolarHBondContact O-N 3.36Å; V34-I38 HydrophobicContact CG1-CD1 4.32Å; V34-I38 PolarHBondContact O-N 3.23Å; V34-F261 HydrophobicContact CG1-CE1 4.2Å; V34-L285 HydrophobicContact CG2-CB 4.18Å; V34-L285 HydrophobicContact CG2-CD2 4.08Å; V34-F288 HydrophobicContact CG2-CD1 4.4Å; V34-A289 HydrophobicContact CB-CB 4.39Å; V34-A289 HydrophobicContact CG1-CB 3.53Å; V34-A289 HydrophobicContact CG2-CB 3.88Å; V34-F326 HydrophobicContact CG1-CD1 3.91Å; V34-F326 HydrophobicContact CG1-CE1 3.62Å; V34-F326 HydrophobicContact CG1-CZ 4.42Å
35	K	95.5	Very high	89.3	Confident	72 Å²	72	77.4 Å²	77.4	31%	0.313	37%	0.372	S	S	.	.	H	α-helix	trans	-54.6	-34.3	177.2	-70.3	-173.5	175.5	-123.6	0	112.9	M31 C37 L325 F326 D327	M31-K35 WeakPolarHBondContact O-CG 3.48Å; M31-K35 PolarHBondContact O-N 3.3Å; K35-C37 VanDerWaalsContact C-N 3.3Å; K35-C37 PolarHBondContact O-N 2.94Å; K35-L325 WeakPolarHBondContact CE-O 3.43Å; K35-L325 PolarHBondContact NZ-O 3.22Å; K35-F326 VanDerWaalsContact CD-O 3.31Å; K35-F326 WeakPolarHBondContact CD-O 3.29Å; K35-F326 VanDerWaalsContact CE-O 3.26Å; K35-F326 WeakPolarHBondContact CE-O 3.48Å; K35-F326 WeakPolarHBondContact CG-O 3.5Å; K35-F326 PolarHBondContact NZ-O 2.75Å; K35-D327 PolarHBondContact NZ-O 2.81Å; K35-D327 PolarHBondContact NZ-OXT 2.73Å
36	Q	92.6	Very high	89.8	Confident	103 Å²	103	79.5 Å²	79.5	48%	0.481	37%	0.372	S	S	.	.	H	α-helix	trans	-76.2	-14.6	178.1	-67	173.4	8.4	0	0	114.4	R32 M33 V34 R268	R32-Q36 WeakPolarHBondContact O-CG 3.35Å; R32-Q36 PolarHBondContact O-N 3.05Å; M33-Q36 WeakPolarHBondContact O-CB 3.17Å; M33-Q36 PolarHBondContact O-N 3Å; V34-Q36 PolarHBondContact O-N 2.78Å; V34-Q36 VanDerWaalsContact O-N 3.14Å; Q36-R268 PolarHBondContact O-NE 3.41Å
37	C	93.8	Very high	89.8	Confident	9 Å²	9	85.8 Å²	85.8	6%	0.061	40%	0.395	C	S	.	.	H	α-helix	trans	-95.6	-17.8	178.6	-59.6	0	0	0	0	113.1	M33 V34 K35 T265 R268	M33-C37 PolarHBondContact O-N 3.47Å; M33-C37 PolarHBondContact O-SG 3.08Å; V34-C37 WeakPolarHBondContact O-CB 3.42Å; V34-C37 PolarHBondContact O-N 3.36Å; K35-C37 VanDerWaalsContact C-N 3.3Å; K35-C37 PolarHBondContact O-N 2.94Å; C37-T265 HydrophobicContact CB-CG2 3.97Å; C37-R268 HydrophobicContact CB-CB 4.1Å; C37-R268 HydrophobicContact CB-CG 4.38Å
38	I	95.2	Very high	89.7	Confident	25 Å²	25	85.9 Å²	85.9	13%	0.128	40%	0.396	C	S	.	.	S	Bend	trans	-69.6	124	178.6	-66.9	166.5	0	0	0	108.9	V34 F261 W264 F322 F326	V34-I38 HydrophobicContact CG1-CD1 4.32Å; V34-I38 PolarHBondContact O-N 3.23Å; I38-F261 HydrophobicContact CD1-CE1 4.24Å; I38-F261 HydrophobicContact CG1-CE1 4.09Å; I38-W264 HydrophobicContact CB-CE3 4.5Å; I38-W264 HydrophobicContact CG1-CE3 4Å; I38-W264 HydrophobicContact CG1-CZ3 4.04Å; I38-W264 HydrophobicContact CG2-CZ3 4.2Å; I38-F322 HydrophobicContact CD1-CE1 4.13Å; I38-F322 HydrophobicContact CD1-CZ 3.71Å; I38-F322 HydrophobicContact CG1-CZ 4.17Å; I38-F322 HydrophobicContact CG2-CE1 4.17Å; I38-F322 HydrophobicContact CG2-CZ 3.8Å; I38-F326 HydrophobicContact CD1-CB 3.45Å; I38-F326 VanDerWaalsContact CD1-CB 3.45Å; I38-F326 HydrophobicContact CD1-CD1 3.92Å; I38-F326 HydrophobicContact CD1-CD2 4.05Å; I38-F326 HydrophobicContact CD1-CG 3.53Å
39	P	92.4	Very high	89.7	Confident	38 Å²	38	81.6 Å²	81.6	25%	0.247	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-65.9	138	-179.6	27.4	-34	0	0	0	110.4	W264	P39-W264 HydrophobicContact CG-CD2 4.04Å; P39-W264 HydrophobicContact CG-CG 4.11Å; P39-W264 HydrophobicContact CG-CZ2 4.16Å
40	Q	89	Confident	89.7	Confident	159 Å²	159	81.3 Å²	81.3	74%	0.743	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-76	136.8	171.2	-65.5	-64	-57	0	0	109.1	S42	Q40-S42 PolarHBondContact O-N 3.05Å
41	M	83.4	Confident	89.8	Confident	195 Å²	195	81.3 Å²	81.3	96%	0.961	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-67.1	125.9	173.4	-66.3	-175.1	-69.6	0	0	109.4
42	S	86.6	Confident	89.9	Confident	58 Å²	58	84.1 Å²	84.1	41%	0.406	39%	0.391	S	S	.	.			trans	-141.2	144.7	-179.9	174	0	0	0	0	110.3	Q40 E44 M45	Q40-S42 PolarHBondContact O-N 3.05Å; S42-E44 PolarHBondContact O-N 2.88Å; S42-E44 PolarHBondContact OG-N 3.22Å; S42-M45 WeakPolarHBondContact O-CB 3.15Å; S42-M45 PolarHBondContact O-N 3.48Å
43	Y	86	Confident	90.2	Very high	242 Å²	242	76.7 Å²	76.7	95%	0.949	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-15	174.7	-68.6	-74.9	0	0	0	113.4
44	E	83.1	Confident	90.4	Very high	177 Å²	177	75.4 Å²	75.4	83%	0.827	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-17.9	177.1	-61.8	177.4	168.5	0	0	112.7	S42 H46	S42-E44 PolarHBondContact O-N 2.88Å; S42-E44 PolarHBondContact OG-N 3.22Å; E44-H46 PolarHBondContact O-N 3.21Å
45	M	81.8	Confident	90.5	Very high	79 Å²	79	75.4 Å²	75.4	39%	0.389	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-71.2	130.8	178.5	-67.2	-74.9	-85.7	0	0	109.6	S42	S42-M45 WeakPolarHBondContact O-CB 3.15Å; S42-M45 PolarHBondContact O-N 3.48Å
46	H	85	Confident	90.7	Very high	136 Å²	136	72 Å²	72	63%	0.63	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-92.3	163.8	175.6	62.3	75.1	0	0	0	110.7	E44 G48 S49	E44-H46 PolarHBondContact O-N 3.21Å; H46-G48 PolarHBondContact O-N 3.23Å; H46-G48 VanDerWaalsContact O-N 3.17Å; H46-S49 PolarHBondContact CD2-OG 2.9Å; H46-S49 PolarHBondContact CE1-OG 3.2Å; H46-S49 PolarHBondContact N-OG 2.91Å; H46-S49 PolarHBondContact ND1-OG 3.11Å; H46-S49 PolarHBondContact NE2-OG 3.31Å; H46-S49 VanDerWaalsContact O-CB 3.32Å; H46-S49 WeakPolarHBondContact O-CB 3.48Å; H46-S49 PolarHBondContact O-N 2.81Å; H46-S49 PolarHBondContact O-OG 3.03Å
47	K	82.8	Confident	90.9	Very high	168 Å²	168	67 Å²	67	73%	0.73	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	125.7	174.5	-177.5	176.7	179.5	175.9	0	110.3	L80	K47-L80 VanDerWaalsContact CE-CD2 3.48Å
48	G	85	Confident	91.1	Very high	2 Å²	2	66.7 Å²	66.7	2%	0.021	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.4	-14.1	179.7	0	0	0	0	0	114.2	H46 S50 G51 D79 H123	H46-G48 PolarHBondContact O-N 3.23Å; H46-G48 VanDerWaalsContact O-N 3.17Å; G48-S50 VanDerWaalsContact C-N 3.29Å; G48-S50 PolarHBondContact O-N 2.92Å; G48-G51 PolarHBondContact O-N 3.49Å; G48-D79 VanDerWaalsContact CA-OD2 3.22Å; G48-D79 WeakPolarHBondContact CA-OD2 3.45Å; G48-D79 PolarHBondContact N-OD2 3.28Å; G48-H123 PolarHBondContact O-CE1 2.82Å
49	S	88	Confident	91.1	Very high	24 Å²	24	66 Å²	66	17%	0.168	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-36.5	179.8	-59.7	0	0	0	0	112.1	H46 G51 D79 H263	H46-S49 PolarHBondContact CD2-OG 2.9Å; H46-S49 PolarHBondContact CE1-OG 3.2Å; H46-S49 PolarHBondContact N-OG 2.91Å; H46-S49 PolarHBondContact ND1-OG 3.11Å; H46-S49 PolarHBondContact NE2-OG 3.31Å; H46-S49 VanDerWaalsContact O-CB 3.32Å; H46-S49 WeakPolarHBondContact O-CB 3.48Å; H46-S49 PolarHBondContact O-N 2.81Å; H46-S49 PolarHBondContact O-OG 3.03Å; S49-G51 VanDerWaalsContact C-N 3.29Å; S49-G51 PolarHBondContact O-N 2.93Å; S49-D79 PolarHBondContact N-OD2 3.41Å; S49-H263 PolarHBondContact O-NE2 3.33Å
50	S	91.6	Very high	91.2	Very high	22 Å²	22	68.5 Å²	68.5	15%	0.154	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	0.9	-178.2	-49	0	0	0	0	113.5	G48 G77 D79 W264	G48-S50 VanDerWaalsContact C-N 3.29Å; G48-S50 PolarHBondContact O-N 2.92Å; S50-G77 WeakPolarHBondContact CB-O 3.47Å; S50-D79 WeakPolarHBondContact CB-OD1 3.4Å; S50-D79 PolarHBondContact N-OD2 3.09Å; S50-W264 PolarHBondContact O-NE1 3.43Å
51	G	95.8	Very high	91.4	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	32%	0.322	C	S	.	.			trans	135.1	140.4	174.4	0	0	0	0	0	113.8	G48 S49 D79 L80 H263	G48-G51 PolarHBondContact O-N 3.49Å; S49-G51 VanDerWaalsContact C-N 3.29Å; S49-G51 PolarHBondContact O-N 2.93Å; G51-D79 PolarHBondContact O-N 3.02Å; G51-L80 PolarHBondContact O-N 3.48Å; G51-H263 WeakPolarHBondContact CA-CD2 3.22Å; G51-H263 PolarHBondContact N-CD2 2.78Å
52	R	97.9	Very high	92.1	Very high	74 Å²	74	64.1 Å²	64.1	28%	0.279	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	92.5	176.4	-64.9	-179.4	-70.7	171.1	3	107.1	L80 F82 R121 V122 H123	R52-L80 HydrophobicContact CG-CB 4.25Å; R52-L80 HydrophobicContact CG-CD1 4.2Å; R52-F82 HydrophobicContact CB-CE2 4.17Å; R52-R121 WeakPolarHBondContact CB-O 3.39Å; R52-R121 WeakPolarHBondContact CD-O 3.41Å; R52-R121 PolarHBondContact NE-O 3.15Å; R52-R121 PolarHBondContact NH1-O 2.69Å; R52-V122 CarbonylContact O-C 3.55Å; R52-V122 WeakPolarHBondContact O-CA 3.31Å; R52-V122 WeakPolarHBondContact O-CB 3.32Å; R52-H123 PolarHBondContact N-ND1 3.36Å; R52-H123 PolarHBondContact NE-CE1 3.43Å; R52-H123 VanDerWaalsContact NE-CE1 3.3Å; R52-H123 PolarHBondContact NE-NE2 3Å; R52-H123 VanDerWaalsContact NE-NE2 3.17Å; R52-H123 PolarHBondContact NH2-CD2 2.84Å; R52-H123 PolarHBondContact NH2-NE2 3.29Å; R52-H123 PolarHBondContact O-N 3.45Å
53	V	98.6	Very high	92.6	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	131.6	-170.8	176.5	0	0	0	0	109.7	A73 A78 L80 F82 A259	V53-A73 HydrophobicContact CB-CB 3.91Å; V53-A73 HydrophobicContact CG1-CB 3.8Å; V53-A73 HydrophobicContact CG2-CB 4.07Å; V53-A78 HydrophobicContact CG2-CB 3.85Å; V53-L80 PolarHBondContact N-O 3.04Å; V53-F82 WeakPolarHBondContact O-CD2 3.35Å; V53-F82 PolarHBondContact O-N 3.37Å; V53-A259 HydrophobicContact CG1-CB 3.55Å; V53-A259 HydrophobicContact CG2-CB 4.25Å
54	C	98.7	Very high	93.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127	173.9	175.8	0	0	0	0	112.3	F82 L118 V122 S124 T125 V126	C54-F82 WeakPolarHBondContact CA-O 3.29Å; C54-F82 HydrophobicContact CB-CB 3.94Å; C54-L118 HydrophobicContact CB-CD1 4.19Å; C54-V122 HydrophobicContact CB-CB 4.26Å; C54-V122 HydrophobicContact CB-CG1 3.65Å; C54-S124 PolarHBondContact N-O 2.86Å; C54-T125 HydrophobicContact CB-CG2 4.05Å; C54-T125 CarbonylContact O-C 3.51Å; C54-T125 WeakPolarHBondContact O-CA 3.34Å; C54-V126 PolarHBondContact O-N 3.49Å
55	V	98.8	Very high	93.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.8	173.4	-176.3	0	0	0	0	109.1	P66 A70 F82 V83 V84 V126 P129	V55-P66 HydrophobicContact CG1-CB 4.06Å; V55-A70 HydrophobicContact CB-CB 4.44Å; V55-A70 HydrophobicContact CG2-CB 3.83Å; V55-F82 PolarHBondContact N-O 2.73Å; V55-V83 CarbonylContact O-C 3.53Å; V55-V83 VanDerWaalsContact O-CA 3.31Å; V55-V83 WeakPolarHBondContact O-CA 3.48Å; V55-V84 PolarHBondContact O-N 3.34Å; V55-V126 CarbonylContact C-O 3.52Å; V55-V126 WeakPolarHBondContact CA-O 3.46Å; V55-V126 HydrophobicContact CB-CB 4.46Å; V55-V126 HydrophobicContact CG1-CB 4.28Å; V55-V126 HydrophobicContact CG1-CG1 4.47Å; V55-V126 HydrophobicContact CG2-CB 4.13Å; V55-V126 HydrophobicContact CG2-CG2 4.32Å; V55-P129 HydrophobicContact CG1-CB 4.31Å; V55-P129 HydrophobicContact CG1-CG 4.15Å
56	I	98.4	Very high	94.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	107.6	173.2	-62	161	0	0	0	107.1	V84 L106 F111 V126 L127 G128 I141 F144	I56-V84 WeakPolarHBondContact CA-O 3.49Å; I56-V84 HydrophobicContact CG1-CB 4.15Å; I56-V84 HydrophobicContact CG1-CG2 4.42Å; I56-L106 HydrophobicContact CG2-CD1 3.9Å; I56-F111 HydrophobicContact CD1-CZ 4.33Å; I56-F111 HydrophobicContact CG2-CE2 4.34Å; I56-F111 HydrophobicContact CG2-CZ 4.16Å; I56-V126 PolarHBondContact N-O 3.04Å; I56-L127 HydrophobicContact CB-CD1 3.99Å; I56-L127 HydrophobicContact CG2-CD1 3.76Å; I56-L127 WeakPolarHBondContact O-CA 3.33Å; I56-G128 PolarHBondContact O-N 3.4Å; I56-I141 HydrophobicContact CG2-CD1 4.25Å; I56-F144 HydrophobicContact CD1-CD1 3.78Å; I56-F144 HydrophobicContact CD1-CD2 3.73Å; I56-F144 HydrophobicContact CD1-CE1 3.31Å; I56-F144 HydrophobicContact CD1-CE2 3.26Å; I56-F144 HydrophobicContact CD1-CG 3.99Å; I56-F144 HydrophobicContact CD1-CZ 3.05Å
57	G	97.7	Very high	95.3	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.			trans	174.7	166.2	-163.9	0	0	0	0	0	111.2	V84 C85 P129	G57-V84 PolarHBondContact N-O 2.94Å; G57-C85 WeakPolarHBondContact O-CA 3.39Å; G57-C85 WeakPolarHBondContact O-CB 3.42Å; G57-P129 CarbonylContact C-O 3.59Å; G57-P129 WeakPolarHBondContact CA-O 3.33Å
58	G	97.4	Very high	96.1	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.01	15%	0.152	C	C	.	.			trans	98.5	122.6	-178.5	0	0	0	0	0	113.3	Y62 D86 P129 G130	G58-Y62 WeakPolarHBondContact CA-O 3.27Å; G58-D86 WeakPolarHBondContact O-CB 3.43Å; G58-D86 PolarHBondContact O-N 2.9Å; G58-P129 PolarHBondContact N-O 3.26Å; G58-G130 CarbonylContact C-O 3.34Å; G58-G130 WeakPolarHBondContact CA-O 3.43Å; G58-G130 PolarHBondContact N-O 3.47Å; G58-G130 VanDerWaalsContact N-O 3.13Å
59	S	96	Very high	96.7	Very high	10 Å²	10	29.7 Å²	29.7	7%	0.07	15%	0.151	C	C	.	.			trans	-123.3	178.6	174.6	77.9	0	0	0	0	110	E61 Y62 A89 G130	S59-E61 PolarHBondContact O-N 3.24Å; S59-E61 PolarHBondContact OG-N 3.49Å; S59-E61 PolarHBondContact OG-OE2 3.28Å; S59-Y62 PolarHBondContact O-N 3.08Å; S59-Y62 PolarHBondContact OG-N 2.98Å; S59-A89 WeakPolarHBondContact O-CB 3.24Å; S59-G130 WeakPolarHBondContact CB-O 3.44Å; S59-G130 PolarHBondContact N-O 3.41Å
60	V	93.8	Very high	97.2	Very high	91 Å²	91	28.5 Å²	28.5	55%	0.552	14%	0.143	S	C	*	.	S	Bend	trans	-47.5	-41.7	170.4	-179.3	0	0	0	0	111.4	T88	V60-T88 VanDerWaalsContact CG2-OG1 3.3Å; V60-T88 WeakPolarHBondContact CG2-OG1 3.38Å
61	E	94.1	Very high	97.6	Very high	134 Å²	134	27.6 Å²	27.6	63%	0.626	14%	0.137	S	C	*	.	S	Bend	trans	-88.3	-31.1	-175.7	-55.5	80	-175.1	0	0	113.9	S59	S59-E61 PolarHBondContact O-N 3.24Å; S59-E61 PolarHBondContact OG-N 3.49Å; S59-E61 PolarHBondContact OG-OE2 3.28Å
62	Y	96.5	Very high	97.7	Very high	128 Å²	128	27.6 Å²	27.6	50%	0.502	14%	0.137	S	C	.	.			trans	-120.3	70.1	-166.7	-59.3	-65.4	0	0	0	113.2	G58 S59 P66	G58-Y62 WeakPolarHBondContact CA-O 3.27Å; S59-Y62 PolarHBondContact O-N 3.08Å; S59-Y62 PolarHBondContact OG-N 2.98Å; Y62-P66 VanDerWaalsContact O-CD 3.27Å; Y62-P66 WeakPolarHBondContact O-CD 3.38Å
63	T	97.3	Very high	97.8	Very high	21 Å²	21	24.1 Å²	24.1	13%	0.129	12%	0.123	C	C	.	.	S	Bend	trans	-78.6	-29.4	177.8	60.7	0	0	0	0	113.4	P66 A89 V92 I93 Y96	T63-P66 WeakPolarHBondContact O-CD 3.26Å; T63-P66 WeakPolarHBondContact O-CG 3.4Å; T63-A89 HydrophobicContact CG2-CB 3.98Å; T63-V92 HydrophobicContact CG2-CB 3.98Å; T63-V92 HydrophobicContact CG2-CG1 3.95Å; T63-V92 HydrophobicContact CG2-CG2 4.47Å; T63-I93 WeakPolarHBondContact O-CG1 3.4Å; T63-Y96 PolarHBondContact OG1-OH 2.88Å
64	G	97.8	Very high	97.7	Very high	21 Å²	21	25.6 Å²	25.6	22%	0.216	13%	0.132	C	C	.	.	H	α-helix	trans	-73.9	-35.8	-174.4	0	0	0	0	0	114.4	Y67 F68	G64-Y67 WeakPolarHBondContact O-CB 3.33Å; G64-Y67 PolarHBondContact O-N 2.69Å; G64-F68 VanDerWaalsContact O-CD2 3.24Å; G64-F68 WeakPolarHBondContact O-CD2 3.38Å; G64-F68 WeakPolarHBondContact O-CG 3.41Å; G64-F68 PolarHBondContact O-N 2.66Å
65	A	98.1	Very high	97.7	Very high	17 Å²	17	30.6 Å²	30.6	14%	0.14	15%	0.154	C	C	.	.	H	α-helix	trans	-61.2	-52.9	-177	0	0	0	0	0	113.7	Y67 F68 S69 P129 D252	A65-Y67 VanDerWaalsContact C-N 3.27Å; A65-Y67 PolarHBondContact O-N 2.96Å; A65-F68 PolarHBondContact O-N 3.47Å; A65-S69 PolarHBondContact O-N 3.41Å; A65-S69 VanDerWaalsContact O-N 3.08Å; A65-P129 HydrophobicContact CB-CB 4.02Å; A65-D252 WeakPolarHBondContact CA-OD2 3.42Å; A65-D252 WeakPolarHBondContact CB-OD2 3.35Å
66	P	98.4	Very high	97.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.7	-33.3	177.3	29.8	-39.5	0	0	0	112.2	V55 Y62 T63 A70 V83 I93 P129	V55-P66 HydrophobicContact CG1-CB 4.06Å; Y62-P66 VanDerWaalsContact O-CD 3.27Å; Y62-P66 WeakPolarHBondContact O-CD 3.38Å; T63-P66 WeakPolarHBondContact O-CD 3.26Å; T63-P66 WeakPolarHBondContact O-CG 3.4Å; P66-A70 WeakPolarHBondContact O-CB 3.27Å; P66-A70 PolarHBondContact O-N 3.36Å; P66-V83 HydrophobicContact CB-CG1 3.9Å; P66-I93 HydrophobicContact CG-CD1 3.68Å; P66-P129 WeakPolarHBondContact CD-O 3.42Å
67	Y	98.6	Very high	97.6	Very high	43 Å²	43	32.3 Å²	32.3	17%	0.169	17%	0.17	C	C	.	.	H	α-helix	trans	-60.6	-52.7	173.4	163.7	-102.9	0	0	0	111.3	G64 A65 S69 A70 I71 Y96 L100	G64-Y67 WeakPolarHBondContact O-CB 3.33Å; G64-Y67 PolarHBondContact O-N 2.69Å; A65-Y67 VanDerWaalsContact C-N 3.27Å; A65-Y67 PolarHBondContact O-N 2.96Å; Y67-S69 VanDerWaalsContact C-N 3.26Å; Y67-S69 PolarHBondContact O-N 2.88Å; Y67-A70 PolarHBondContact O-N 2.92Å; Y67-I71 HydrophobicContact CD2-CB 4.47Å; Y67-I71 HydrophobicContact CE1-CG2 4.16Å; Y67-I71 HydrophobicContact CE2-CB 4.03Å; Y67-I71 HydrophobicContact CE2-CG1 4.34Å; Y67-I71 HydrophobicContact CE2-CG2 4.24Å; Y67-I71 WeakPolarHBondContact O-CB 3.34Å; Y67-I71 VanDerWaalsContact O-CG2 3.22Å; Y67-I71 WeakPolarHBondContact O-CG2 3.42Å; Y67-I71 PolarHBondContact O-N 3.49Å; Y67-Y96 HydrophobicContact CD1-CD2 4.09Å; Y67-Y96 HydrophobicContact CD2-CD2 4.14Å; Y67-Y96 HydrophobicContact CD2-CG 4.42Å; Y67-Y96 AromaticContact CG-CD2 3.75Å; Y67-Y96 HydrophobicContact CG-CD2 3.75Å; Y67-Y96 HydrophobicContact CG-CG 4.38Å; Y67-L100 HydrophobicContact CD2-CD1 3.76Å; Y67-L100 HydrophobicContact CE2-CD1 4.31Å
68	F	98.7	Very high	97.6	Very high	37 Å²	37	32.5 Å²	32.5	16%	0.162	17%	0.172	C	C	.	.	H	α-helix	trans	-61	-37.1	-178.6	-75.1	-44.8	0	0	0	112	G64 A65 S72 D252 T311 I315	G64-F68 VanDerWaalsContact O-CD2 3.24Å; G64-F68 WeakPolarHBondContact O-CD2 3.38Å; G64-F68 WeakPolarHBondContact O-CG 3.41Å; G64-F68 PolarHBondContact O-N 2.66Å; A65-F68 PolarHBondContact O-N 3.47Å; F68-S72 WeakPolarHBondContact O-CB 3.11Å; F68-S72 PolarHBondContact O-N 2.75Å; F68-S72 VanDerWaalsContact O-N 3.09Å; F68-S72 PolarHBondContact O-OG 3.3Å; F68-D252 HydrophobicContact CB-CB 3.59Å; F68-T311 HydrophobicContact CB-CG2 4.34Å; F68-T311 HydrophobicContact CD1-CG2 3.88Å; F68-T311 HydrophobicContact CD2-CG2 4.09Å; F68-T311 HydrophobicContact CE1-CG2 4.13Å; F68-T311 HydrophobicContact CE2-CG2 4.34Å; F68-T311 HydrophobicContact CG-CG2 3.86Å; F68-T311 HydrophobicContact CZ-CG2 4.36Å; F68-I315 HydrophobicContact CB-CD1 4.45Å; F68-I315 HydrophobicContact CD1-CD1 3.43Å; F68-I315 VanDerWaalsContact CD1-CD1 3.43Å; F68-I315 HydrophobicContact CE1-CD1 4.07Å; F68-I315 HydrophobicContact CG-CD1 4.3Å
69	S	98.8	Very high	97.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.5	-50.4	175.2	-171.2	0	0	0	0	111.5	A65 Y67 I71 S72 A73 D252 T255 G256	A65-S69 PolarHBondContact O-N 3.41Å; A65-S69 VanDerWaalsContact O-N 3.08Å; Y67-S69 VanDerWaalsContact C-N 3.26Å; Y67-S69 PolarHBondContact O-N 2.88Å; S69-I71 PolarHBondContact O-N 3.26Å; S69-S72 PolarHBondContact O-N 2.97Å; S69-A73 PolarHBondContact O-N 3.38Å; S69-D252 WeakPolarHBondContact CA-O 3.43Å; S69-D252 WeakPolarHBondContact CB-O 3.45Å; S69-D252 PolarHBondContact OG-O 3.21Å; S69-T255 PolarHBondContact OG-OG1 3.26Å; S69-G256 WeakPolarHBondContact O-CA 3.46Å; S69-G256 PolarHBondContact OG-N 3.4Å
70	A	98.8	Very high	97.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.8	-42.4	-177.4	0	0	0	0	0	112.9	V55 P66 Y67 S72 A73 V74 V83 L100	V55-A70 HydrophobicContact CB-CB 4.44Å; V55-A70 HydrophobicContact CG2-CB 3.83Å; P66-A70 WeakPolarHBondContact O-CB 3.27Å; P66-A70 PolarHBondContact O-N 3.36Å; Y67-A70 PolarHBondContact O-N 2.92Å; A70-S72 VanDerWaalsContact C-N 3.31Å; A70-S72 PolarHBondContact O-N 3.48Å; A70-A73 WeakPolarHBondContact O-CB 3.47Å; A70-A73 PolarHBondContact O-N 2.81Å; A70-V74 PolarHBondContact O-N 2.82Å; A70-V83 HydrophobicContact CB-CG2 3.47Å; A70-V83 VanDerWaalsContact CB-CG2 3.47Å; A70-L100 HydrophobicContact CB-CD1 3.84Å; A70-L100 HydrophobicContact CB-CD2 3.88Å; A70-L100 HydrophobicContact CB-CG 4.49Å
71	I	98.7	Very high	97.9	Very high	3 Å²	3	32 Å²	32	2%	0.015	17%	0.165	C	C	.	.	H	α-helix	trans	-68.1	-33.4	177.8	-165.1	59.2	0	0	0	111.6	Y67 S69 A73 V74 K75 E99 I315	Y67-I71 HydrophobicContact CD2-CB 4.47Å; Y67-I71 HydrophobicContact CE1-CG2 4.16Å; Y67-I71 HydrophobicContact CE2-CB 4.03Å; Y67-I71 HydrophobicContact CE2-CG1 4.34Å; Y67-I71 HydrophobicContact CE2-CG2 4.24Å; Y67-I71 WeakPolarHBondContact O-CB 3.34Å; Y67-I71 VanDerWaalsContact O-CG2 3.22Å; Y67-I71 WeakPolarHBondContact O-CG2 3.42Å; Y67-I71 PolarHBondContact O-N 3.49Å; S69-I71 PolarHBondContact O-N 3.26Å; I71-A73 VanDerWaalsContact C-N 3.34Å; I71-V74 PolarHBondContact O-N 3.31Å; I71-K75 HydrophobicContact CG1-CG 4.28Å; I71-K75 VanDerWaalsContact O-CB 3.31Å; I71-K75 WeakPolarHBondContact O-CB 3.47Å; I71-K75 VanDerWaalsContact O-CG 3.25Å; I71-K75 WeakPolarHBondContact O-CG 3.44Å; I71-K75 PolarHBondContact O-N 3.02Å; I71-E99 WeakPolarHBondContact CD1-OE2 3.29Å; I71-I315 HydrophobicContact CG2-CD1 3.84Å
72	S	98.8	Very high	98.1	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68.4	-35.5	175.5	-60.5	0	0	0	0	111.5	F68 S69 A70 T76 L253	F68-S72 WeakPolarHBondContact O-CB 3.11Å; F68-S72 PolarHBondContact O-N 2.75Å; F68-S72 VanDerWaalsContact O-N 3.09Å; F68-S72 PolarHBondContact O-OG 3.3Å; S69-S72 PolarHBondContact O-N 2.97Å; A70-S72 VanDerWaalsContact C-N 3.31Å; A70-S72 PolarHBondContact O-N 3.48Å; S72-T76 VanDerWaalsContact O-CB 3.27Å; S72-T76 WeakPolarHBondContact O-CB 3.44Å; S72-T76 PolarHBondContact O-N 3.08Å; S72-T76 PolarHBondContact O-OG1 2.96Å; S72-L253 WeakPolarHBondContact OG-CA 3.38Å
73	A	98.8	Very high	98.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60	-48.4	172.5	0	0	0	0	0	111.6	V53 S69 A70 I71 T76 G77 A78 G256 T260	V53-A73 HydrophobicContact CB-CB 3.91Å; V53-A73 HydrophobicContact CG1-CB 3.8Å; V53-A73 HydrophobicContact CG2-CB 4.07Å; S69-A73 PolarHBondContact O-N 3.38Å; A70-A73 WeakPolarHBondContact O-CB 3.47Å; A70-A73 PolarHBondContact O-N 2.81Å; I71-A73 VanDerWaalsContact C-N 3.34Å; A73-T76 PolarHBondContact O-N 3.3Å; A73-G77 PolarHBondContact O-N 2.98Å; A73-A78 WeakPolarHBondContact O-CB 3.47Å; A73-A78 PolarHBondContact O-N 2.88Å; A73-G256 WeakPolarHBondContact CA-O 3.27Å; A73-G256 WeakPolarHBondContact CB-O 3.33Å; A73-T260 WeakPolarHBondContact CA-OG1 3.46Å; A73-T260 PolarHBondContact O-OG1 2.85Å
74	V	98.5	Very high	98.3	Very high	31 Å²	31	18.9 Å²	18.9	19%	0.188	11%	0.107	C	C	.	.	H	α-helix	trans	-63.9	-47.8	177.9	175.7	0	0	0	0	111.3	A70 I71 T76 G77 A78 L100	A70-V74 PolarHBondContact O-N 2.82Å; I71-V74 PolarHBondContact O-N 3.31Å; V74-T76 VanDerWaalsContact C-N 3.25Å; V74-T76 PolarHBondContact O-N 3.01Å; V74-G77 WeakPolarHBondContact O-CA 3.39Å; V74-G77 PolarHBondContact O-N 3.14Å; V74-A78 WeakPolarHBondContact CA-O 3.5Å; V74-L100 HydrophobicContact CG2-CD2 4.13Å
75	K	98.3	Very high	98.3	Very high	105 Å²	105	17.9 Å²	17.9	46%	0.457	10%	0.097	S	C	.	.	H	α-helix	trans	-64.2	-27.9	177.9	-73.6	-79.3	179.6	-149	0	113.4	I71 G77 I315 I318	I71-K75 HydrophobicContact CG1-CG 4.28Å; I71-K75 VanDerWaalsContact O-CB 3.31Å; I71-K75 WeakPolarHBondContact O-CB 3.47Å; I71-K75 VanDerWaalsContact O-CG 3.25Å; I71-K75 WeakPolarHBondContact O-CG 3.44Å; I71-K75 PolarHBondContact O-N 3.02Å; K75-G77 VanDerWaalsContact C-N 3.29Å; K75-I315 HydrophobicContact CG-CG2 4Å; K75-I318 HydrophobicContact CB-CB 4.47Å; K75-I318 HydrophobicContact CB-CD1 3.69Å; K75-I318 HydrophobicContact CB-CG2 4.34Å; K75-I318 WeakPolarHBondContact O-CG2 3.02Å
76	T	98.5	Very high	98.2	Very high	7 Å²	7	18.8 Å²	18.8	4%	0.043	10%	0.099	C	C	.	.	H	α-helix	trans	-70.8	-28.9	173.2	-59.6	0	0	0	0	111.2	S72 A73 V74 A257 T260 F261 W264 L293 F322	S72-T76 VanDerWaalsContact O-CB 3.27Å; S72-T76 WeakPolarHBondContact O-CB 3.44Å; S72-T76 PolarHBondContact O-N 3.08Å; S72-T76 PolarHBondContact O-OG1 2.96Å; A73-T76 PolarHBondContact O-N 3.3Å; V74-T76 VanDerWaalsContact C-N 3.25Å; V74-T76 PolarHBondContact O-N 3.01Å; T76-A257 HydrophobicContact CG2-CB 4.32Å; T76-A257 WeakPolarHBondContact OG1-CB 3.3Å; T76-T260 HydrophobicContact CG2-CG2 3.99Å; T76-F261 HydrophobicContact CG2-CD2 4.44Å; T76-F261 HydrophobicContact CG2-CE2 3.95Å; T76-F261 HydrophobicContact CG2-CZ 4.33Å; T76-W264 HydrophobicContact CG2-CH2 4.3Å; T76-W264 HydrophobicContact CG2-CZ3 4.46Å; T76-W264 VanDerWaalsContact O-CH2 3.28Å; T76-W264 WeakPolarHBondContact O-CH2 3.5Å; T76-L293 HydrophobicContact CG2-CD2 3.97Å; T76-F322 HydrophobicContact CG2-CE2 4.3Å
77	G	96.9	Very high	98.2	Very high	29 Å²	29	20.5 Å²	20.5	30%	0.299	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	134.5	9.8	176.2	0	0	0	0	0	115.2	S50 A73 V74 K75	S50-G77 WeakPolarHBondContact CB-O 3.47Å; A73-G77 PolarHBondContact O-N 2.98Å; V74-G77 WeakPolarHBondContact O-CA 3.39Å; V74-G77 PolarHBondContact O-N 3.14Å; K75-G77 VanDerWaalsContact C-N 3.29Å
78	A	97.6	Very high	98.1	Very high	4 Å²	4	22.4 Å²	22.4	3%	0.033	13%	0.127	C	C	.	.			trans	-70.2	139.1	168.6	0	0	0	0	0	110.4	V53 A73 V74 T260	V53-A78 HydrophobicContact CG2-CB 3.85Å; A73-A78 WeakPolarHBondContact O-CB 3.47Å; A73-A78 PolarHBondContact O-N 2.88Å; V74-A78 WeakPolarHBondContact CA-O 3.5Å; A78-T260 HydrophobicContact CB-CG2 4.1Å
79	D	96.6	Very high	98	Very high	61 Å²	61	20.7 Å²	20.7	33%	0.326	12%	0.119	S	C	.	.	S	Bend	trans	-74.3	-28.9	-178.4	-67.3	-32	0	0	0	112.9	G48 S49 S50 G51	G48-D79 VanDerWaalsContact CA-OD2 3.22Å; G48-D79 WeakPolarHBondContact CA-OD2 3.45Å; G48-D79 PolarHBondContact N-OD2 3.28Å; S49-D79 PolarHBondContact N-OD2 3.41Å; S50-D79 WeakPolarHBondContact CB-OD1 3.4Å; S50-D79 PolarHBondContact N-OD2 3.09Å; G51-D79 PolarHBondContact O-N 3.02Å
80	L	97.7	Very high	98	Very high	30 Å²	30	20.8 Å²	20.8	16%	0.157	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	127.8	-178.3	-69.3	176.8	0	0	0	111.2	K47 G51 R52 V53 F82 I101	K47-L80 VanDerWaalsContact CE-CD2 3.48Å; G51-L80 PolarHBondContact O-N 3.48Å; R52-L80 HydrophobicContact CG-CB 4.25Å; R52-L80 HydrophobicContact CG-CD1 4.2Å; V53-L80 PolarHBondContact N-O 3.04Å; L80-F82 HydrophobicContact CB-CD2 4.48Å; L80-F82 HydrophobicContact CB-CE2 3.73Å; L80-F82 HydrophobicContact CB-CZ 4.07Å; L80-F82 HydrophobicContact CD1-CE2 4.29Å; L80-F82 HydrophobicContact CD1-CZ 3.92Å; L80-I101 HydrophobicContact CD2-CD1 4.14Å
81	G	98.1	Very high	98	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.6	169.9	0	0	0	0	0	110.9	I101	G81-I101 PolarHBondContact O-N 3.46Å
82	F	98.5	Very high	97.9	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.035	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	146.3	173.8	-55.3	-90	0	0	0	110.2	R52 V53 C54 V55 L80 I101 Y103 V122	R52-F82 HydrophobicContact CB-CE2 4.17Å; V53-F82 WeakPolarHBondContact O-CD2 3.35Å; V53-F82 PolarHBondContact O-N 3.37Å; C54-F82 WeakPolarHBondContact CA-O 3.29Å; C54-F82 HydrophobicContact CB-CB 3.94Å; V55-F82 PolarHBondContact N-O 2.73Å; L80-F82 HydrophobicContact CB-CD2 4.48Å; L80-F82 HydrophobicContact CB-CE2 3.73Å; L80-F82 HydrophobicContact CB-CZ 4.07Å; L80-F82 HydrophobicContact CD1-CE2 4.29Å; L80-F82 HydrophobicContact CD1-CZ 3.92Å; F82-I101 CarbonylContact C-O 3.57Å; F82-I101 VanDerWaalsContact CA-O 3.27Å; F82-I101 WeakPolarHBondContact CA-O 3.44Å; F82-I101 HydrophobicContact CD1-CB 3.63Å; F82-I101 HydrophobicContact CD1-CD1 4Å; F82-I101 HydrophobicContact CD1-CG1 4.39Å; F82-I101 HydrophobicContact CD1-CG2 3.74Å; F82-I101 HydrophobicContact CE1-CB 4.03Å; F82-I101 HydrophobicContact CE1-CD1 3.48Å; F82-I101 VanDerWaalsContact CE1-CD1 3.48Å; F82-I101 HydrophobicContact CE1-CG1 4.35Å; F82-I101 HydrophobicContact CE1-CG2 4.05Å; F82-I101 HydrophobicContact CZ-CD1 4.13Å; F82-Y103 HydrophobicContact CB-CE2 4.4Å; F82-Y103 AromaticContact CD1-CE2 3.6Å; F82-Y103 HydrophobicContact CD1-CE2 3.6Å; F82-Y103 HydrophobicContact CE1-CE2 4.32Å; F82-Y103 HydrophobicContact CG-CE2 4.39Å; F82-V122 HydrophobicContact CD2-CG1 4Å; F82-V122 HydrophobicContact CE2-CG1 4.23Å
83	V	98.7	Very high	97.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	125.7	170.3	178.4	0	0	0	0	108.8	V55 P66 A70 C85 I93 L100 I101 V102 Y103	V55-V83 CarbonylContact O-C 3.53Å; V55-V83 VanDerWaalsContact O-CA 3.31Å; V55-V83 WeakPolarHBondContact O-CA 3.48Å; P66-V83 HydrophobicContact CB-CG1 3.9Å; A70-V83 HydrophobicContact CB-CG2 3.47Å; A70-V83 VanDerWaalsContact CB-CG2 3.47Å; V83-C85 HydrophobicContact CG1-CB 3.94Å; V83-I93 HydrophobicContact CG1-CD1 4.2Å; V83-I93 HydrophobicContact CG1-CG2 4.48Å; V83-I93 HydrophobicContact CG2-CG2 4.5Å; V83-L100 HydrophobicContact CG2-CD1 4.28Å; V83-I101 PolarHBondContact N-O 2.99Å; V83-V102 HydrophobicContact CB-CG1 4.37Å; V83-V102 HydrophobicContact CB-CG2 4.32Å; V83-V102 CarbonylContact O-C 3.13Å; V83-V102 WeakPolarHBondContact O-CA 3.41Å; V83-Y103 PolarHBondContact O-N 3.47Å
84	V	98.5	Very high	97.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.9	167.6	-173.5	0	0	0	0	107.6	V55 I56 G57 Y103 L106 F111 L114 L118	V55-V84 PolarHBondContact O-N 3.34Å; I56-V84 WeakPolarHBondContact CA-O 3.49Å; I56-V84 HydrophobicContact CG1-CB 4.15Å; I56-V84 HydrophobicContact CG1-CG2 4.42Å; G57-V84 PolarHBondContact N-O 2.94Å; V84-Y103 HydrophobicContact CG2-CD2 4.11Å; V84-L106 HydrophobicContact CG1-CB 4.38Å; V84-F111 HydrophobicContact CG1-CD2 3.84Å; V84-F111 HydrophobicContact CG1-CE2 3.8Å; V84-L114 HydrophobicContact CG1-CD2 3.94Å; V84-L114 HydrophobicContact CG2-CD2 3.75Å; V84-L118 HydrophobicContact CG2-CD2 4.03Å
85	C	98	Very high	97.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	169.1	-169.2	61.1	0	0	0	0	111.8	G57 V83 A89 I93 Y103 S105 L106	G57-C85 WeakPolarHBondContact O-CA 3.39Å; G57-C85 WeakPolarHBondContact O-CB 3.42Å; V83-C85 HydrophobicContact CG1-CB 3.94Å; C85-A89 HydrophobicContact CB-CB 4.36Å; C85-I93 HydrophobicContact CB-CD1 3.9Å; C85-Y103 PolarHBondContact N-O 2.87Å; C85-Y103 VanDerWaalsContact N-O 3.1Å; C85-S105 PolarHBondContact O-N 2.87Å; C85-L106 VanDerWaalsContact O-CB 3.28Å; C85-L106 WeakPolarHBondContact O-CB 3.23Å; C85-L106 PolarHBondContact O-N 3.47Å
86	D	97.3	Very high	97.8	Very high	35 Å²	35	34.9 Å²	34.9	19%	0.187	20%	0.201	C	C	.	.			trans	-53	136.6	170.7	-175.2	-76.5	0	0	0	110.2	G58 T88 A89 A90	G58-D86 WeakPolarHBondContact O-CB 3.43Å; G58-D86 PolarHBondContact O-N 2.9Å; D86-T88 PolarHBondContact O-N 3.34Å; D86-T88 VanDerWaalsContact O-N 3.09Å; D86-T88 VanDerWaalsContact OD1-CB 3.28Å; D86-T88 WeakPolarHBondContact OD1-CB 3.34Å; D86-T88 WeakPolarHBondContact OD1-CG2 3.35Å; D86-T88 PolarHBondContact OD1-N 3.17Å; D86-T88 PolarHBondContact OD1-OG1 3.17Å; D86-A89 HydrophobicContact CB-CB 4.25Å; D86-A89 WeakPolarHBondContact O-CB 3.09Å; D86-A89 PolarHBondContact O-N 3.45Å; D86-A90 PolarHBondContact O-N 3.48Å
87	P	97.3	Very high	97.7	Very high	37 Å²	37	34.9 Å²	34.9	24%	0.24	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-32.5	-179.1	-26.8	33.5	0	0	0	114.4	P91 P104 E107	P87-P91 WeakPolarHBondContact O-CD 3.31Å; P87-P104 HydrophobicContact CB-CB 4.22Å; P87-E107 HydrophobicContact CG-CB 4.4Å; P87-E107 VanDerWaalsContact CG-CD 3.41Å; P87-E107 HydrophobicContact CG-CG 4.05Å; P87-E107 WeakPolarHBondContact CG-OE1 3.39Å
88	T	96.5	Very high	97.6	Very high	83 Å²	83	39.8 Å²	39.8	51%	0.509	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-28.3	178.8	69.6	0	0	0	0	112.8	V60 D86	V60-T88 VanDerWaalsContact CG2-OG1 3.3Å; V60-T88 WeakPolarHBondContact CG2-OG1 3.38Å; D86-T88 PolarHBondContact O-N 3.34Å; D86-T88 VanDerWaalsContact O-N 3.09Å; D86-T88 VanDerWaalsContact OD1-CB 3.28Å; D86-T88 WeakPolarHBondContact OD1-CB 3.34Å; D86-T88 WeakPolarHBondContact OD1-CG2 3.35Å; D86-T88 PolarHBondContact OD1-N 3.17Å; D86-T88 PolarHBondContact OD1-OG1 3.17Å
89	A	97.7	Very high	97.5	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.008	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-29.5	177.3	0	0	0	0	0	112.2	S59 T63 C85 D86 V92 I93	S59-A89 WeakPolarHBondContact O-CB 3.24Å; T63-A89 HydrophobicContact CG2-CB 3.98Å; C85-A89 HydrophobicContact CB-CB 4.36Å; D86-A89 HydrophobicContact CB-CB 4.25Å; D86-A89 WeakPolarHBondContact O-CB 3.09Å; D86-A89 PolarHBondContact O-N 3.45Å; A89-V92 WeakPolarHBondContact O-CB 3.46Å; A89-V92 PolarHBondContact O-N 3.11Å; A89-V92 VanDerWaalsContact O-N 3.16Å; A89-I93 HydrophobicContact CB-CD1 4.07Å; A89-I93 WeakPolarHBondContact O-CG1 3.26Å; A89-I93 PolarHBondContact O-N 2.84Å
90	A	98.3	Very high	97.6	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.008	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-45	-170.1	0	0	0	0	0	114.9	D86 V92 I93 K94 V102 P104	D86-A90 PolarHBondContact O-N 3.48Å; A90-V92 VanDerWaalsContact C-N 3.26Å; A90-V92 PolarHBondContact O-N 3.01Å; A90-I93 PolarHBondContact O-N 3.31Å; A90-K94 WeakPolarHBondContact O-CB 3.4Å; A90-K94 WeakPolarHBondContact O-CG 3.15Å; A90-K94 PolarHBondContact O-N 3.05Å; A90-V102 HydrophobicContact CB-CG1 3.91Å; A90-P104 HydrophobicContact CB-CB 3.61Å; A90-P104 HydrophobicContact CB-CG 4.5Å
91	P	98.1	Very high	97.6	Very high	86 Å²	86	43.8 Å²	43.8	56%	0.558	25%	0.245	S	C	*	.	H	α-helix	trans	-59.9	-37.7	177.5	-23.5	34.7	0	0	0	112.5	P87 S95	P87-P91 WeakPolarHBondContact O-CD 3.31Å; P91-S95 PolarHBondContact O-N 3.38Å
92	V	98.3	Very high	97.6	Very high	55 Å²	55	44.3 Å²	44.3	33%	0.333	25%	0.248	S	C	.	.	H	α-helix	trans	-67.7	-48.9	178.8	-179.5	0	0	0	0	110.3	T63 A89 A90 K94 S95 Y96	T63-V92 HydrophobicContact CG2-CB 3.98Å; T63-V92 HydrophobicContact CG2-CG1 3.95Å; T63-V92 HydrophobicContact CG2-CG2 4.47Å; A89-V92 WeakPolarHBondContact O-CB 3.46Å; A89-V92 PolarHBondContact O-N 3.11Å; A89-V92 VanDerWaalsContact O-N 3.16Å; A90-V92 VanDerWaalsContact C-N 3.26Å; A90-V92 PolarHBondContact O-N 3.01Å; V92-K94 VanDerWaalsContact C-N 3.33Å; V92-K94 PolarHBondContact O-N 3.38Å; V92-S95 WeakPolarHBondContact O-CB 3.37Å; V92-S95 PolarHBondContact O-N 3.44Å; V92-S95 PolarHBondContact O-OG 3.1Å; V92-Y96 HydrophobicContact CG1-CE1 3.87Å; V92-Y96 HydrophobicContact CG1-CE2 4.01Å; V92-Y96 VanDerWaalsContact CG1-CZ 3.44Å; V92-Y96 VanDerWaalsContact CG1-OH 3.22Å; V92-Y96 WeakPolarHBondContact CG1-OH 2.83Å; V92-Y96 PolarHBondContact O-N 2.88Å
93	I	98.2	Very high	97.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-42.4	179.6	-63.3	167.3	0	0	0	110.9	T63 P66 V83 C85 A89 A90 S95 Y96 V102	T63-I93 WeakPolarHBondContact O-CG1 3.4Å; P66-I93 HydrophobicContact CG-CD1 3.68Å; V83-I93 HydrophobicContact CG1-CD1 4.2Å; V83-I93 HydrophobicContact CG1-CG2 4.48Å; V83-I93 HydrophobicContact CG2-CG2 4.5Å; C85-I93 HydrophobicContact CB-CD1 3.9Å; A89-I93 HydrophobicContact CB-CD1 4.07Å; A89-I93 WeakPolarHBondContact O-CG1 3.26Å; A89-I93 PolarHBondContact O-N 2.84Å; A90-I93 PolarHBondContact O-N 3.31Å; I93-S95 PolarHBondContact O-N 3.49Å; I93-Y96 WeakPolarHBondContact O-CB 3.15Å; I93-Y96 PolarHBondContact O-N 2.93Å; I93-Y96 VanDerWaalsContact O-N 3.09Å; I93-V102 HydrophobicContact CB-CG1 4.36Å; I93-V102 HydrophobicContact CB-CG2 4.48Å; I93-V102 HydrophobicContact CG2-CG1 4.3Å; I93-V102 HydrophobicContact CG2-CG2 3.78Å
94	K	98.3	Very high	97.5	Very high	103 Å²	103	48.6 Å²	48.6	45%	0.448	27%	0.271	S	S	.	.	H	α-helix	trans	-59.5	-29.9	175.1	-72.6	171.2	-177.4	-179.8	0	112.7	A90 V92 V102	A90-K94 WeakPolarHBondContact O-CB 3.4Å; A90-K94 WeakPolarHBondContact O-CG 3.15Å; A90-K94 PolarHBondContact O-N 3.05Å; V92-K94 VanDerWaalsContact C-N 3.33Å; V92-K94 PolarHBondContact O-N 3.38Å; K94-V102 HydrophobicContact CD-CB 4.29Å; K94-V102 WeakPolarHBondContact CE-O 3.19Å; K94-V102 HydrophobicContact CG-CB 3.62Å; K94-V102 HydrophobicContact CG-CG1 4.12Å; K94-V102 HydrophobicContact CG-CG2 3.78Å
95	S	98	Very high	97.5	Very high	91 Å²	91	49.5 Å²	49.5	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-77.2	-20.6	177.9	79.5	0	0	0	0	113.7	P91 V92 I93	P91-S95 PolarHBondContact O-N 3.38Å; V92-S95 WeakPolarHBondContact O-CB 3.37Å; V92-S95 PolarHBondContact O-N 3.44Å; V92-S95 PolarHBondContact O-OG 3.1Å; I93-S95 PolarHBondContact O-N 3.49Å
96	Y	97.7	Very high	97.4	Very high	101 Å²	101	49.7 Å²	49.7	40%	0.396	28%	0.278	S	S	.	.	H	α-helix	trans	-75.5	-37.8	179.6	-63.4	-25.8	0	0	0	113.2	T63 Y67 V92 I93	T63-Y96 PolarHBondContact OG1-OH 2.88Å; Y67-Y96 HydrophobicContact CD1-CD2 4.09Å; Y67-Y96 HydrophobicContact CD2-CD2 4.14Å; Y67-Y96 HydrophobicContact CD2-CG 4.42Å; Y67-Y96 AromaticContact CG-CD2 3.75Å; Y67-Y96 HydrophobicContact CG-CD2 3.75Å; Y67-Y96 HydrophobicContact CG-CG 4.38Å; V92-Y96 HydrophobicContact CG1-CE1 3.87Å; V92-Y96 HydrophobicContact CG1-CE2 4.01Å; V92-Y96 VanDerWaalsContact CG1-CZ 3.44Å; V92-Y96 VanDerWaalsContact CG1-OH 3.22Å; V92-Y96 WeakPolarHBondContact CG1-OH 2.83Å; V92-Y96 PolarHBondContact O-N 2.88Å; I93-Y96 WeakPolarHBondContact O-CB 3.15Å; I93-Y96 PolarHBondContact O-N 2.93Å; I93-Y96 VanDerWaalsContact O-N 3.09Å
97	S	95.3	Very high	97.2	Very high	6 Å²	6	52.5 Å²	52.5	4%	0.042	29%	0.29	C	S	.	.			trans	-154.7	135.4	172.5	176.5	0	0	0	0	112	E99	S97-E99 PolarHBondContact O-N 3.25Å; S97-E99 VanDerWaalsContact OG-CB 3.3Å; S97-E99 WeakPolarHBondContact OG-CB 3.14Å; S97-E99 WeakPolarHBondContact OG-CG 3.48Å; S97-E99 PolarHBondContact OG-N 3.35Å; S97-E99 PolarHBondContact OG-OE2 3.31Å
98	P	94.6	Very high	97	Very high	132 Å²	132	57 Å²	57	86%	0.857	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-5	171.1	33.7	-36.5	0	0	0	113.3	L100	P98-L100 VanDerWaalsContact C-N 3.31Å
99	E	96.3	Very high	96.8	Very high	101 Å²	101	54.9 Å²	54.9	47%	0.472	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-21.1	-179	-62.5	164.9	112.4	0	0	112.7	I71 S97	I71-E99 WeakPolarHBondContact CD1-OE2 3.29Å; S97-E99 PolarHBondContact O-N 3.25Å; S97-E99 VanDerWaalsContact OG-CB 3.3Å; S97-E99 WeakPolarHBondContact OG-CB 3.14Å; S97-E99 WeakPolarHBondContact OG-CG 3.48Å; S97-E99 PolarHBondContact OG-N 3.35Å; S97-E99 PolarHBondContact OG-OE2 3.31Å
100	L	98.2	Very high	96.6	Very high	14 Å²	14	56.4 Å²	56.4	7%	0.073	32%	0.319	C	S	.	.	S	Bend	trans	-96.7	142.1	-173.8	-57.8	-178.1	0	0	0	112.3	Y67 A70 V74 V83 P98 V102	Y67-L100 HydrophobicContact CD2-CD1 3.76Å; Y67-L100 HydrophobicContact CE2-CD1 4.31Å; A70-L100 HydrophobicContact CB-CD1 3.84Å; A70-L100 HydrophobicContact CB-CD2 3.88Å; A70-L100 HydrophobicContact CB-CG 4.49Å; V74-L100 HydrophobicContact CG2-CD2 4.13Å; V83-L100 HydrophobicContact CG2-CD1 4.28Å; P98-L100 VanDerWaalsContact C-N 3.31Å; L100-V102 HydrophobicContact CB-CG2 4.2Å
101	I	97.8	Very high	96.5	Very high	65 Å²	65	56.4 Å²	56.4	33%	0.333	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	108.9	172.2	-60.3	167.8	0	0	0	108.3	L80 G81 F82 V83 Y103	L80-I101 HydrophobicContact CD2-CD1 4.14Å; G81-I101 PolarHBondContact O-N 3.46Å; F82-I101 CarbonylContact C-O 3.57Å; F82-I101 VanDerWaalsContact CA-O 3.27Å; F82-I101 WeakPolarHBondContact CA-O 3.44Å; F82-I101 HydrophobicContact CD1-CB 3.63Å; F82-I101 HydrophobicContact CD1-CD1 4Å; F82-I101 HydrophobicContact CD1-CG1 4.39Å; F82-I101 HydrophobicContact CD1-CG2 3.74Å; F82-I101 HydrophobicContact CE1-CB 4.03Å; F82-I101 HydrophobicContact CE1-CD1 3.48Å; F82-I101 VanDerWaalsContact CE1-CD1 3.48Å; F82-I101 HydrophobicContact CE1-CG1 4.35Å; F82-I101 HydrophobicContact CE1-CG2 4.05Å; F82-I101 HydrophobicContact CZ-CD1 4.13Å; V83-I101 PolarHBondContact N-O 2.99Å; I101-Y103 HydrophobicContact CG2-CE1 4.38Å; I101-Y103 HydrophobicContact CG2-CE2 3.89Å
102	V	98.5	Very high	96.3	Very high	11 Å²	11	55.8 Å²	55.8	7%	0.067	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.3	-172.6	-175	0	0	0	0	111.1	V83 A90 I93 K94 L100	V83-V102 HydrophobicContact CB-CG1 4.37Å; V83-V102 HydrophobicContact CB-CG2 4.32Å; V83-V102 CarbonylContact O-C 3.13Å; V83-V102 WeakPolarHBondContact O-CA 3.41Å; A90-V102 HydrophobicContact CB-CG1 3.91Å; I93-V102 HydrophobicContact CB-CG1 4.36Å; I93-V102 HydrophobicContact CB-CG2 4.48Å; I93-V102 HydrophobicContact CG2-CG1 4.3Å; I93-V102 HydrophobicContact CG2-CG2 3.78Å; K94-V102 HydrophobicContact CD-CB 4.29Å; K94-V102 WeakPolarHBondContact CE-O 3.19Å; K94-V102 HydrophobicContact CG-CB 3.62Å; K94-V102 HydrophobicContact CG-CG1 4.12Å; K94-V102 HydrophobicContact CG-CG2 3.78Å; L100-V102 HydrophobicContact CB-CG2 4.2Å
103	Y	98.1	Very high	96.1	Very high	49 Å²	49	58.5 Å²	58.5	19%	0.192	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	113.7	175.7	-62.9	-72	0	0	0	110.8	F82 V83 V84 C85 I101 S105 L114	F82-Y103 HydrophobicContact CB-CE2 4.4Å; F82-Y103 AromaticContact CD1-CE2 3.6Å; F82-Y103 HydrophobicContact CD1-CE2 3.6Å; F82-Y103 HydrophobicContact CE1-CE2 4.32Å; F82-Y103 HydrophobicContact CG-CE2 4.39Å; V83-Y103 PolarHBondContact O-N 3.47Å; V84-Y103 HydrophobicContact CG2-CD2 4.11Å; C85-Y103 PolarHBondContact N-O 2.87Å; C85-Y103 VanDerWaalsContact N-O 3.1Å; I101-Y103 HydrophobicContact CG2-CE1 4.38Å; I101-Y103 HydrophobicContact CG2-CE2 3.89Å; Y103-S105 PolarHBondContact O-N 3.08Å; Y103-L114 HydrophobicContact CD1-CD1 4.01Å; Y103-L114 HydrophobicContact CD1-CD2 4.25Å; Y103-L114 HydrophobicContact CD2-CD2 4.11Å; Y103-L114 HydrophobicContact CE1-CD1 4.12Å; Y103-L114 HydrophobicContact CG-CD1 4.23Å; Y103-L114 HydrophobicContact CG-CD2 3.76Å
104	P	97.3	Very high	95.9	Very high	50 Å²	50	59.6 Å²	59.6	33%	0.325	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	69.4	171.2	33	-32.7	0	0	0	109.1	P87 A90	P87-P104 HydrophobicContact CB-CB 4.22Å; A90-P104 HydrophobicContact CB-CB 3.61Å; A90-P104 HydrophobicContact CB-CG 4.5Å
105	S	97.2	Very high	95.6	Very high	19 Å²	19	55 Å²	55	13%	0.133	31%	0.312	C	S	.	.			trans	-141.3	14.9	-166.9	-52.4	0	0	0	0	113.1	C85 Y103 E107 F111	C85-S105 PolarHBondContact O-N 2.87Å; Y103-S105 PolarHBondContact O-N 3.08Å; S105-E107 PolarHBondContact O-N 3.42Å; S105-F111 WeakPolarHBondContact O-CA 3.4Å; S105-F111 WeakPolarHBondContact O-CB 3.47Å; S105-F111 WeakPolarHBondContact O-CD2 3.32Å; S105-F111 PolarHBondContact O-N 3.05Å; S105-F111 VanDerWaalsContact O-N 3.1Å
106	L	95.9	Very high	95.4	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.016	30%	0.302	C	S	.	.			trans	-84.5	60.9	171.7	-166.8	63.5	0	0	0	110.7	I56 V84 C85 F111 L131 L137 I141	I56-L106 HydrophobicContact CG2-CD1 3.9Å; V84-L106 HydrophobicContact CG1-CB 4.38Å; C85-L106 VanDerWaalsContact O-CB 3.28Å; C85-L106 WeakPolarHBondContact O-CB 3.23Å; C85-L106 PolarHBondContact O-N 3.47Å; L106-F111 HydrophobicContact CD1-CD2 4.12Å; L106-F111 HydrophobicContact CD1-CE1 4.39Å; L106-F111 HydrophobicContact CD1-CE2 3.99Å; L106-F111 HydrophobicContact CD1-CG 4.41Å; L106-F111 HydrophobicContact CD1-CZ 4.13Å; L106-L131 HydrophobicContact CD2-CD2 3.51Å; L106-L137 HydrophobicContact CD2-CD1 4.32Å; L106-L137 HydrophobicContact CG-CD2 4.06Å; L106-I141 HydrophobicContact CD1-CD1 4.18Å
107	E	94.4	Very high	95.2	Very high	95 Å²	95	52.6 Å²	52.6	44%	0.444	30%	0.302	S	S	.	.	S	Bend	trans	-148.5	162.2	176	65.1	-178.4	159.4	0	0	109.7	P87 S105 A110 F111	P87-E107 HydrophobicContact CG-CB 4.4Å; P87-E107 VanDerWaalsContact CG-CD 3.41Å; P87-E107 HydrophobicContact CG-CG 4.05Å; P87-E107 WeakPolarHBondContact CG-OE1 3.39Å; S105-E107 PolarHBondContact O-N 3.42Å; E107-A110 HydrophobicContact CG-CB 3.79Å; E107-A110 PolarHBondContact O-N 2.67Å; E107-F111 VanDerWaalsContact O-CB 3.29Å; E107-F111 WeakPolarHBondContact O-CB 3.48Å; E107-F111 PolarHBondContact O-N 3.35Å
108	D	91.6	Very high	95.1	Very high	130 Å²	130	52.5 Å²	52.5	70%	0.695	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	141.3	-176.5	-166.1	37	0	0	0	112	A110 Q112 L140	D108-A110 PolarHBondContact O-N 3.23Å; D108-Q112 PolarHBondContact OD1-NE2 3Å; D108-L140 HydrophobicContact CB-CD2 4.46Å
109	G	92.5	Very high	95.1	Very high	39 Å²	39	47 Å²	47	40%	0.402	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-56.6	-172.8	0	0	0	0	0	113.7	T113	G109-T113 PolarHBondContact O-N 3.16Å; G109-T113 PolarHBondContact O-OG1 3.46Å
110	A	94.9	Very high	94.9	Very high	33 Å²	33	44.9 Å²	44.9	27%	0.273	27%	0.269	S	S	.	.	H	α-helix	trans	-64.9	-41.9	-178.6	0	0	0	0	0	111.7	E107 D108 T113 L114	E107-A110 HydrophobicContact CG-CB 3.79Å; E107-A110 PolarHBondContact O-N 2.67Å; D108-A110 PolarHBondContact O-N 3.23Å; A110-T113 PolarHBondContact O-N 3.43Å; A110-L114 PolarHBondContact O-N 3.2Å; A110-L114 VanDerWaalsContact O-N 3.17Å
111	F	95.3	Very high	94.6	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-48.4	-179.6	-168.3	-132.5	0	0	0	111.6	I56 V84 S105 L106 E107 T113 L114 L115 L140 F144	I56-F111 HydrophobicContact CD1-CZ 4.33Å; I56-F111 HydrophobicContact CG2-CE2 4.34Å; I56-F111 HydrophobicContact CG2-CZ 4.16Å; V84-F111 HydrophobicContact CG1-CD2 3.84Å; V84-F111 HydrophobicContact CG1-CE2 3.8Å; S105-F111 WeakPolarHBondContact O-CA 3.4Å; S105-F111 WeakPolarHBondContact O-CB 3.47Å; S105-F111 WeakPolarHBondContact O-CD2 3.32Å; S105-F111 PolarHBondContact O-N 3.05Å; S105-F111 VanDerWaalsContact O-N 3.1Å; L106-F111 HydrophobicContact CD1-CD2 4.12Å; L106-F111 HydrophobicContact CD1-CE1 4.39Å; L106-F111 HydrophobicContact CD1-CE2 3.99Å; L106-F111 HydrophobicContact CD1-CG 4.41Å; L106-F111 HydrophobicContact CD1-CZ 4.13Å; E107-F111 VanDerWaalsContact O-CB 3.29Å; E107-F111 WeakPolarHBondContact O-CB 3.48Å; E107-F111 PolarHBondContact O-N 3.35Å; F111-T113 VanDerWaalsContact C-N 3.29Å; F111-T113 PolarHBondContact O-N 3.36Å; F111-L114 WeakPolarHBondContact O-CB 3.14Å; F111-L114 PolarHBondContact O-N 2.79Å; F111-L115 HydrophobicContact CD1-CD2 4.37Å; F111-L115 HydrophobicContact CD2-CD2 4.3Å; F111-L115 HydrophobicContact CE1-CD2 4.06Å; F111-L115 HydrophobicContact CE2-CD2 3.93Å; F111-L115 HydrophobicContact CZ-CD2 3.81Å; F111-L115 WeakPolarHBondContact O-CG 3.34Å; F111-L115 PolarHBondContact O-N 3.48Å; F111-L115 VanDerWaalsContact O-N 3.1Å; F111-L140 HydrophobicContact CD1-CB 3.83Å; F111-L140 HydrophobicContact CD1-CD2 4.49Å; F111-L140 HydrophobicContact CE1-CB 4.18Å; F111-F144 HydrophobicContact CE1-CB 3.63Å; F111-F144 HydrophobicContact CE1-CG 4.34Å; F111-F144 HydrophobicContact CZ-CB 3.78Å; F111-F144 HydrophobicContact CZ-CD2 4.17Å; F111-F144 AromaticContact CZ-CG 3.97Å; F111-F144 HydrophobicContact CZ-CG 3.97Å
112	Q	93.2	Very high	94.6	Very high	73 Å²	73	47.9 Å²	47.9	34%	0.341	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-39.3	-178.7	-69.1	87.3	-19.7	0	0	111.9	D108 L114 L115	D108-Q112 PolarHBondContact OD1-NE2 3Å; Q112-L114 VanDerWaalsContact C-N 3.29Å; Q112-L114 PolarHBondContact O-N 3.36Å; Q112-L115 PolarHBondContact O-N 3.01Å
113	T	94.4	Very high	94.5	Very high	112 Å²	112	49.4 Å²	49.4	69%	0.687	28%	0.282	S	S	*	.	H	α-helix	trans	-67.5	-31.5	177.7	-59.3	0	0	0	0	111.6	G109 A110 F111 P117	G109-T113 PolarHBondContact O-N 3.16Å; G109-T113 PolarHBondContact O-OG1 3.46Å; A110-T113 PolarHBondContact O-N 3.43Å; F111-T113 VanDerWaalsContact C-N 3.29Å; F111-T113 PolarHBondContact O-N 3.36Å; T113-P117 WeakPolarHBondContact O-CD 3.35Å
114	L	94.8	Very high	94.5	Very high	23 Å²	23	47 Å²	47	12%	0.12	27%	0.273	C	S	.	.	H	α-helix	trans	-77.4	-26.6	177.6	-178.2	62.2	0	0	0	113.2	V84 Y103 A110 F111 Q112 D116 P117 L118	V84-L114 HydrophobicContact CG1-CD2 3.94Å; V84-L114 HydrophobicContact CG2-CD2 3.75Å; Y103-L114 HydrophobicContact CD1-CD1 4.01Å; Y103-L114 HydrophobicContact CD1-CD2 4.25Å; Y103-L114 HydrophobicContact CD2-CD2 4.11Å; Y103-L114 HydrophobicContact CE1-CD1 4.12Å; Y103-L114 HydrophobicContact CG-CD1 4.23Å; Y103-L114 HydrophobicContact CG-CD2 3.76Å; A110-L114 PolarHBondContact O-N 3.2Å; A110-L114 VanDerWaalsContact O-N 3.17Å; F111-L114 WeakPolarHBondContact O-CB 3.14Å; F111-L114 PolarHBondContact O-N 2.79Å; Q112-L114 VanDerWaalsContact C-N 3.29Å; Q112-L114 PolarHBondContact O-N 3.36Å; L114-D116 PolarHBondContact O-N 2.83Å; L114-P117 WeakPolarHBondContact O-CD 3.45Å; L114-L118 HydrophobicContact CG-CB 4.29Å; L114-L118 WeakPolarHBondContact O-CB 3.32Å; L114-L118 PolarHBondContact O-N 3.3Å
115	L	92.4	Very high	94.6	Very high	8 Å²	8	44.7 Å²	44.7	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-55.9	-53.4	-169.7	-72.1	-170.9	0	0	0	113.5	F111 Q112 L118 F119 F144 K147	F111-L115 HydrophobicContact CD1-CD2 4.37Å; F111-L115 HydrophobicContact CD2-CD2 4.3Å; F111-L115 HydrophobicContact CE1-CD2 4.06Å; F111-L115 HydrophobicContact CE2-CD2 3.93Å; F111-L115 HydrophobicContact CZ-CD2 3.81Å; F111-L115 WeakPolarHBondContact O-CG 3.34Å; F111-L115 PolarHBondContact O-N 3.48Å; F111-L115 VanDerWaalsContact O-N 3.1Å; Q112-L115 PolarHBondContact O-N 3.01Å; L115-L118 PolarHBondContact O-N 3.1Å; L115-F119 HydrophobicContact CB-CD2 4.12Å; L115-F119 HydrophobicContact CB-CE2 3.99Å; L115-F119 HydrophobicContact CD1-CE2 4.49Å; L115-F119 HydrophobicContact CD2-CE2 4.12Å; L115-F119 HydrophobicContact CG-CE2 4.41Å; L115-F119 WeakPolarHBondContact O-CB 3.29Å; L115-F119 WeakPolarHBondContact O-CD2 3.5Å; L115-F119 WeakPolarHBondContact O-CG 2.96Å; L115-F119 PolarHBondContact O-N 2.96Å; L115-F144 HydrophobicContact CD2-CB 4.36Å; L115-F144 HydrophobicContact CD2-CD2 3.7Å; L115-F144 HydrophobicContact CD2-CG 4.48Å; L115-K147 HydrophobicContact CD1-CD 4.3Å
116	D	92.7	Very high	94.7	Very high	78 Å²	78	43.8 Å²	43.8	42%	0.417	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-49.8	-176.9	-79.3	-47.3	0	0	0	113.5	L114 L118 F119 G120 K147 R151	L114-D116 PolarHBondContact O-N 2.83Å; D116-L118 VanDerWaalsContact C-N 3.27Å; D116-L118 PolarHBondContact O-N 3.45Å; D116-F119 PolarHBondContact O-N 3.41Å; D116-G120 PolarHBondContact O-N 3.38Å; D116-G120 VanDerWaalsContact O-N 3.11Å; D116-K147 WeakPolarHBondContact OD1-CE 3.41Å; D116-K147 IonicContact OD1-NZ 3.45Å; D116-K147 PolarHBondContact OD1-NZ 2.84Å; D116-K147 IonicContact OD2-NZ 3.9Å; D116-K147 PolarHBondContact OD2-NZ 2.96Å; D116-R151 IonicContact OD1-CZ 3.99Å; D116-R151 IonicContact OD1-NH2 3.8Å; D116-R151 PolarHBondContact OD1-NH2 2.9Å
117	P	93.9	Very high	94.8	Very high	63 Å²	63	43.6 Å²	43.6	41%	0.409	25%	0.251	S	S	.	.	H	α-helix	trans	-56.7	-39.6	172	-26.4	33.5	0	0	0	113.4	T113 L114 R121	T113-P117 WeakPolarHBondContact O-CD 3.35Å; L114-P117 WeakPolarHBondContact O-CD 3.45Å; P117-R121 WeakPolarHBondContact O-CD 3.43Å; P117-R121 VanDerWaalsContact O-CG 3.25Å; P117-R121 WeakPolarHBondContact O-CG 3.26Å
118	L	93.3	Very high	94.9	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-51.3	-180	-176.8	69.4	0	0	0	110.9	C54 V84 L114 L115 D116 G120 R121 V122	C54-L118 HydrophobicContact CB-CD1 4.19Å; V84-L118 HydrophobicContact CG2-CD2 4.03Å; L114-L118 HydrophobicContact CG-CB 4.29Å; L114-L118 WeakPolarHBondContact O-CB 3.32Å; L114-L118 PolarHBondContact O-N 3.3Å; L115-L118 PolarHBondContact O-N 3.1Å; D116-L118 VanDerWaalsContact C-N 3.27Å; D116-L118 PolarHBondContact O-N 3.45Å; L118-G120 PolarHBondContact O-N 3.26Å; L118-R121 PolarHBondContact O-N 2.85Å; L118-V122 HydrophobicContact CD1-CG1 3.69Å; L118-V122 HydrophobicContact CG-CG1 4.17Å; L118-V122 WeakPolarHBondContact O-CG2 3.32Å; L118-V122 PolarHBondContact O-N 3.48Å; L118-V122 VanDerWaalsContact O-N 3.09Å
119	F	93.5	Very high	95.2	Very high	15 Å²	15	32.9 Å²	32.9	7%	0.066	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-30.2	178.9	-77.2	-58.9	0	0	0	113.1	L115 D116 R121 F144 K147 A148 L153	L115-F119 HydrophobicContact CB-CD2 4.12Å; L115-F119 HydrophobicContact CB-CE2 3.99Å; L115-F119 HydrophobicContact CD1-CE2 4.49Å; L115-F119 HydrophobicContact CD2-CE2 4.12Å; L115-F119 HydrophobicContact CG-CE2 4.41Å; L115-F119 WeakPolarHBondContact O-CB 3.29Å; L115-F119 WeakPolarHBondContact O-CD2 3.5Å; L115-F119 WeakPolarHBondContact O-CG 2.96Å; L115-F119 PolarHBondContact O-N 2.96Å; D116-F119 PolarHBondContact O-N 3.41Å; F119-R121 PolarHBondContact O-N 3.4Å; F119-F144 HydrophobicContact CE1-CD2 4.22Å; F119-F144 AromaticContact CE1-CE2 3.63Å; F119-F144 HydrophobicContact CE1-CE2 3.63Å; F119-F144 HydrophobicContact CE1-CZ 4.41Å; F119-F144 HydrophobicContact CE2-CD2 4.12Å; F119-F144 HydrophobicContact CE2-CE2 4.29Å; F119-F144 AromaticContact CZ-CD2 3.45Å; F119-F144 HydrophobicContact CZ-CD2 3.45Å; F119-F144 VanDerWaalsContact CZ-CD2 3.45Å; F119-F144 AromaticContact CZ-CE2 3.35Å; F119-F144 HydrophobicContact CZ-CE2 3.35Å; F119-F144 HydrophobicContact CZ-CZ 4.39Å; F119-K147 HydrophobicContact CD2-CD 4.04Å; F119-K147 HydrophobicContact CD2-CG 4.03Å; F119-K147 HydrophobicContact CE2-CB 3.91Å; F119-K147 HydrophobicContact CE2-CD 3.67Å; F119-K147 HydrophobicContact CE2-CG 3.55Å; F119-K147 HydrophobicContact CZ-CB 4.13Å; F119-K147 HydrophobicContact CZ-CG 4.14Å; F119-A148 HydrophobicContact CE1-CB 3.7Å; F119-A148 HydrophobicContact CZ-CB 3.92Å; F119-L153 HydrophobicContact CD1-CD2 3.78Å; F119-L153 HydrophobicContact CE1-CD2 3.68Å
120	G	92.3	Very high	95.4	Very high	57 Å²	57	31.3 Å²	31.3	59%	0.588	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.8	174.2	0	0	0	0	0	114.6	D116 L118	D116-G120 PolarHBondContact O-N 3.38Å; D116-G120 VanDerWaalsContact O-N 3.11Å; L118-G120 PolarHBondContact O-N 3.26Å
121	R	92.2	Very high	95.4	Very high	135 Å²	135	29.9 Å²	29.9	51%	0.509	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-22.6	-172.1	-68.4	175.5	-174.7	-159.7	1.8	114.4	R52 P117 L118 F119	R52-R121 WeakPolarHBondContact CB-O 3.39Å; R52-R121 WeakPolarHBondContact CD-O 3.41Å; R52-R121 PolarHBondContact NE-O 3.15Å; R52-R121 PolarHBondContact NH1-O 2.69Å; P117-R121 WeakPolarHBondContact O-CD 3.43Å; P117-R121 VanDerWaalsContact O-CG 3.25Å; P117-R121 WeakPolarHBondContact O-CG 3.26Å; L118-R121 PolarHBondContact O-N 2.85Å; F119-R121 PolarHBondContact O-N 3.4Å
122	V	97.3	Very high	95.2	Very high	8 Å²	8	30.1 Å²	30.1	5%	0.048	17%	0.17	C	C	.	.			trans	-101.9	146.7	-172.7	-56.8	0	0	0	0	111.3	R52 C54 F82 L118 T125 L153	R52-V122 CarbonylContact O-C 3.55Å; R52-V122 WeakPolarHBondContact O-CA 3.31Å; R52-V122 WeakPolarHBondContact O-CB 3.32Å; C54-V122 HydrophobicContact CB-CB 4.26Å; C54-V122 HydrophobicContact CB-CG1 3.65Å; F82-V122 HydrophobicContact CD2-CG1 4Å; F82-V122 HydrophobicContact CE2-CG1 4.23Å; L118-V122 HydrophobicContact CD1-CG1 3.69Å; L118-V122 HydrophobicContact CG-CG1 4.17Å; L118-V122 WeakPolarHBondContact O-CG2 3.32Å; L118-V122 PolarHBondContact O-N 3.48Å; L118-V122 VanDerWaalsContact O-N 3.09Å; V122-T125 HydrophobicContact CG2-CG2 4.13Å; V122-L153 HydrophobicContact CG2-CD1 4.26Å; V122-L153 HydrophobicContact CG2-CD2 4.06Å
123	H	97.5	Very high	94.9	Very high	42 Å²	42	35.2 Å²	35.2	19%	0.194	19%	0.187	C	C	.	.	S	Bend	trans	-95.8	-28.9	176.7	-61.9	153.6	0	0	0	112.7	G48 R52 P154 H263	G48-H123 PolarHBondContact O-CE1 2.82Å; R52-H123 PolarHBondContact N-ND1 3.36Å; R52-H123 PolarHBondContact NE-CE1 3.43Å; R52-H123 VanDerWaalsContact NE-CE1 3.3Å; R52-H123 PolarHBondContact NE-NE2 3Å; R52-H123 VanDerWaalsContact NE-NE2 3.17Å; R52-H123 PolarHBondContact NH2-CD2 2.84Å; R52-H123 PolarHBondContact NH2-NE2 3.29Å; R52-H123 PolarHBondContact O-N 3.45Å; H123-P154 VanDerWaalsContact O-CD 3.29Å; H123-P154 WeakPolarHBondContact O-CD 3.27Å; H123-H263 HydrophobicContact CB-CB 4.03Å; H123-H263 VanDerWaalsContact CB-ND1 3.34Å; H123-H263 WeakPolarHBondContact CB-ND1 3.41Å; H123-H263 AromaticContact CE1-CE1 3.59Å; H123-H263 AromaticContact CE1-NE2 3.85Å; H123-H263 AromaticContact CG-CE1 3.67Å; H123-H263 AromaticContact CG-ND1 3.42Å; H123-H263 AromaticContact ND1-CD2 3.77Å; H123-H263 AromaticContact ND1-CE1 3.22Å; H123-H263 PolarHBondContact ND1-CE1 3.43Å; H123-H263 AromaticContact ND1-CG 3.73Å; H123-H263 AromaticContact ND1-ND1 3.36Å; H123-H263 PolarHBondContact ND1-ND1 3.24Å; H123-H263 AromaticContact ND1-NE2 3.44Å; H123-H263 PolarHBondContact ND1-NE2 3.2Å
124	S	98.4	Very high	94.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	160.5	178.9	59.8	0	0	0	0	110.7	C54 P154 A259	C54-S124 PolarHBondContact N-O 2.86Å; S124-P154 CarbonylContact C-O 3.52Å; S124-P154 VanDerWaalsContact CA-O 3.25Å; S124-P154 WeakPolarHBondContact CA-O 3.13Å; S124-A259 WeakPolarHBondContact CB-O 3.4Å; S124-A259 PolarHBondContact OG-O 3.05Å
125	T	98.6	Very high	94.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152	-177.3	46.8	0	0	0	0	112.9	C54 V122 F144 L153 P154 M155 V156	C54-T125 HydrophobicContact CB-CG2 4.05Å; C54-T125 CarbonylContact O-C 3.51Å; C54-T125 WeakPolarHBondContact O-CA 3.34Å; V122-T125 HydrophobicContact CG2-CG2 4.13Å; T125-F144 HydrophobicContact CG2-CZ 4.08Å; T125-L153 HydrophobicContact CG2-CD2 3.49Å; T125-L153 VanDerWaalsContact CG2-CD2 3.49Å; T125-P154 PolarHBondContact N-O 2.9Å; T125-P154 PolarHBondContact OG1-O 3.13Å; T125-M155 CarbonylContact O-C 3.53Å; T125-M155 WeakPolarHBondContact O-CA 3.34Å; T125-V156 PolarHBondContact O-N 3.34Å
126	V	98.8	Very high	94	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.2	165.1	-178	0	0	0	0	107.4	C54 V55 I56 P129 V156 T255 A259	C54-V126 PolarHBondContact O-N 3.49Å; V55-V126 CarbonylContact C-O 3.52Å; V55-V126 WeakPolarHBondContact CA-O 3.46Å; V55-V126 HydrophobicContact CB-CB 4.46Å; V55-V126 HydrophobicContact CG1-CB 4.28Å; V55-V126 HydrophobicContact CG1-CG1 4.47Å; V55-V126 HydrophobicContact CG2-CB 4.13Å; V55-V126 HydrophobicContact CG2-CG2 4.32Å; I56-V126 PolarHBondContact N-O 3.04Å; V126-P129 HydrophobicContact CG1-CG 3.69Å; V126-V156 CarbonylContact C-O 3.56Å; V126-V156 WeakPolarHBondContact CA-O 3.27Å; V126-V156 HydrophobicContact CG2-CB 4.37Å; V126-T255 HydrophobicContact CG1-CG2 4.18Å; V126-T255 WeakPolarHBondContact CG2-O 3.28Å; V126-A259 HydrophobicContact CG2-CB 3.58Å
127	L	98.5	Very high	94	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.8	176.4	170.3	68.9	0	0	0	109.3	I56 P129 L131 I141 F144 M155 V156 I157 D158 F165	I56-L127 HydrophobicContact CB-CD1 3.99Å; I56-L127 HydrophobicContact CG2-CD1 3.76Å; I56-L127 WeakPolarHBondContact O-CA 3.33Å; L127-P129 VanDerWaalsContact C-CD 3.48Å; L127-L131 HydrophobicContact CD1-CD1 3.8Å; L127-L131 HydrophobicContact CG-CD1 4.43Å; L127-I141 HydrophobicContact CD1-CD1 3.76Å; L127-I141 HydrophobicContact CD1-CG2 4.09Å; L127-I141 HydrophobicContact CD2-CG2 3.71Å; L127-I141 HydrophobicContact CG-CG2 4.41Å; L127-F144 HydrophobicContact CD2-CD1 4.36Å; L127-F144 HydrophobicContact CD2-CE1 4.39Å; L127-M155 HydrophobicContact CB-SD 4.45Å; L127-M155 HydrophobicContact CD2-SD 4.43Å; L127-V156 PolarHBondContact N-O 3.25Å; L127-I157 HydrophobicContact CB-CG1 4.22Å; L127-I157 HydrophobicContact CD2-CD1 4.17Å; L127-I157 HydrophobicContact CD2-CG1 4.2Å; L127-I157 WeakPolarHBondContact O-CA 3.48Å; L127-D158 PolarHBondContact O-N 3.18Å; L127-D158 VanDerWaalsContact O-N 3.1Å; L127-F165 HydrophobicContact CD2-CE2 3.87Å; L127-F165 HydrophobicContact CD2-CZ 4.19Å
128	G	97.7	Very high	93.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.204	C	C	.	.			trans	131.3	-41.3	174.1	0	0	0	0	0	117.6	I56 G130 L131 D158	I56-G128 PolarHBondContact O-N 3.4Å; G128-G130 PolarHBondContact O-N 2.84Å; G128-L131 PolarHBondContact O-N 2.93Å; G128-D158 WeakPolarHBondContact CA-O 3.33Å
129	P	97.9	Very high	93.7	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	107	-173.7	-33	38.3	0	0	0	113	V55 G57 G58 A65 P66 V126 L127 L131	V55-P129 HydrophobicContact CG1-CB 4.31Å; V55-P129 HydrophobicContact CG1-CG 4.15Å; G57-P129 CarbonylContact C-O 3.59Å; G57-P129 WeakPolarHBondContact CA-O 3.33Å; G58-P129 PolarHBondContact N-O 3.26Å; A65-P129 HydrophobicContact CB-CB 4.02Å; P66-P129 WeakPolarHBondContact CD-O 3.42Å; V126-P129 HydrophobicContact CG1-CG 3.69Å; L127-P129 VanDerWaalsContact C-CD 3.48Å; P129-L131 PolarHBondContact O-N 2.87Å
130	G	96.1	Very high	93.7	Very high	6 Å²	6	44.7 Å²	44.7	6%	0.062	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	27.1	178.9	0	0	0	0	0	115.4	G58 S59 G128 G132	G58-G130 CarbonylContact C-O 3.34Å; G58-G130 WeakPolarHBondContact CA-O 3.43Å; G58-G130 PolarHBondContact N-O 3.47Å; G58-G130 VanDerWaalsContact N-O 3.13Å; S59-G130 WeakPolarHBondContact CB-O 3.44Å; S59-G130 PolarHBondContact N-O 3.41Å; G128-G130 PolarHBondContact O-N 2.84Å; G130-G132 PolarHBondContact O-N 3.01Å
131	L	94.3	Very high	93.9	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.211	C	C	.	.			trans	-63.7	-24.6	173.7	-74.5	176.8	0	0	0	112.7	L106 L127 G128 P129 I141 D160 F164	L106-L131 HydrophobicContact CD2-CD2 3.51Å; L127-L131 HydrophobicContact CD1-CD1 3.8Å; L127-L131 HydrophobicContact CG-CD1 4.43Å; G128-L131 PolarHBondContact O-N 2.93Å; P129-L131 PolarHBondContact O-N 2.87Å; L131-I141 HydrophobicContact CD1-CD1 4.39Å; L131-I141 HydrophobicContact CD1-CG1 4.48Å; L131-I141 HydrophobicContact CD2-CD1 4.42Å; L131-D160 HydrophobicContact CB-CB 3.97Å; L131-F164 HydrophobicContact CB-CE2 3.98Å; L131-F164 HydrophobicContact CD1-CD2 4.02Å; L131-F164 HydrophobicContact CD1-CE2 3.95Å
132	G	90.8	Very high	93.9	Very high	6 Å²	6	37.5 Å²	37.5	6%	0.062	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	-159.9	-169	0	0	0	0	0	111.2	G130 D160	G130-G132 PolarHBondContact O-N 3.01Å; G132-D160 WeakPolarHBondContact CA-OD2 3.13Å; G132-D160 PolarHBondContact N-OD2 3.48Å
133	R	88.4	Confident	93.7	Very high	181 Å²	181	39.2 Å²	39.2	68%	0.683	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.2	29.7	-173.2	-58.6	-172.7	-175.9	165.2	2.3	113	P135	R133-P135 WeakPolarHBondContact O-CD 3.35Å
134	N	88.4	Confident	93.6	Very high	80 Å²	80	37.2 Å²	37.2	43%	0.428	20%	0.204	S	C	.	.			trans	-68.2	115.5	180	-173.3	-11.9	0	0	0	110.1	S136 L137	N134-S136 PolarHBondContact ND2-OG 2.97Å; N134-S136 PolarHBondContact O-N 3.05Å; N134-S136 VanDerWaalsContact O-N 3.17Å; N134-S136 PolarHBondContact OD1-N 3.18Å; N134-S136 PolarHBondContact OD1-OG 2.81Å; N134-L137 HydrophobicContact CB-CD1 4.26Å; N134-L137 HydrophobicContact CB-CG 4.19Å; N134-L137 WeakPolarHBondContact O-CB 3.36Å; N134-L137 PolarHBondContact O-N 2.83Å; N134-L137 VanDerWaalsContact O-N 3.13Å
135	P	85.9	Confident	93.5	Very high	108 Å²	108	37.2 Å²	37.2	70%	0.701	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.7	-178.4	-22.4	34.8	0	0	0	113.6	R133 L137 A138	R133-P135 WeakPolarHBondContact O-CD 3.35Å; P135-L137 PolarHBondContact O-N 2.96Å; P135-A138 WeakPolarHBondContact O-CB 3.35Å; P135-A138 PolarHBondContact O-N 2.79Å
136	S	88	Confident	93.4	Very high	77 Å²	77	42 Å²	42	54%	0.538	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-26.7	178	70.3	0	0	0	0	112.5	N134 A138	N134-S136 PolarHBondContact ND2-OG 2.97Å; N134-S136 PolarHBondContact O-N 3.05Å; N134-S136 VanDerWaalsContact O-N 3.17Å; N134-S136 PolarHBondContact OD1-N 3.18Å; N134-S136 PolarHBondContact OD1-OG 2.81Å; S136-A138 VanDerWaalsContact C-N 3.31Å; S136-A138 PolarHBondContact O-N 2.95Å
137	L	91.7	Very high	93.2	Very high	13 Å²	13	44.2 Å²	44.2	7%	0.068	24%	0.236	C	C	.	.	H	α-helix	trans	-73.8	-20.8	178.8	-63.9	-177.6	0	0	0	112.7	L106 N134 P135 K139 L140 I141 F164	L106-L137 HydrophobicContact CD2-CD1 4.32Å; L106-L137 HydrophobicContact CG-CD2 4.06Å; N134-L137 HydrophobicContact CB-CD1 4.26Å; N134-L137 HydrophobicContact CB-CG 4.19Å; N134-L137 WeakPolarHBondContact O-CB 3.36Å; N134-L137 PolarHBondContact O-N 2.83Å; N134-L137 VanDerWaalsContact O-N 3.13Å; P135-L137 PolarHBondContact O-N 2.96Å; L137-K139 VanDerWaalsContact C-N 3.3Å; L137-K139 PolarHBondContact O-N 3.29Å; L137-L140 HydrophobicContact CD2-CD1 3.99Å; L137-L140 WeakPolarHBondContact O-CB 3.19Å; L137-L140 PolarHBondContact O-N 3.07Å; L137-I141 HydrophobicContact CB-CG1 4.3Å; L137-I141 WeakPolarHBondContact O-CG1 3.38Å; L137-I141 PolarHBondContact O-N 3.2Å; L137-F164 HydrophobicContact CB-CE1 4.08Å; L137-F164 HydrophobicContact CB-CZ 3.93Å; L137-F164 HydrophobicContact CD1-CZ 4.5Å
138	A	91	Very high	93.1	Very high	36 Å²	36	44.2 Å²	44.2	30%	0.298	24%	0.236	S	C	.	.	H	α-helix	trans	-55.9	-43.4	-172.7	0	0	0	0	0	112.7	P135 S136 T142 F164	P135-A138 WeakPolarHBondContact O-CB 3.35Å; P135-A138 PolarHBondContact O-N 2.79Å; S136-A138 VanDerWaalsContact C-N 3.31Å; S136-A138 PolarHBondContact O-N 2.95Å; A138-T142 WeakPolarHBondContact O-CB 3.44Å; A138-T142 PolarHBondContact O-N 3.49Å; A138-T142 PolarHBondContact O-OG1 3.5Å; A138-F164 HydrophobicContact CB-CD1 3.98Å; A138-F164 HydrophobicContact CB-CE1 4.19Å
139	K	91.2	Very high	93	Very high	179 Å²	179	48.7 Å²	48.7	78%	0.778	25%	0.253	S	S	*	.	H	α-helix	trans	-65.3	-42.8	176.8	-68.3	-176.7	-179.5	178.5	0	112.1	L137 A143	L137-K139 VanDerWaalsContact C-N 3.3Å; L137-K139 PolarHBondContact O-N 3.29Å; K139-A143 WeakPolarHBondContact O-CB 3.37Å; K139-A143 PolarHBondContact O-N 3.43Å
140	L	93.4	Very high	92.9	Very high	9 Å²	9	56.2 Å²	56.2	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-63.4	-48.1	179.2	-60.4	-174.9	0	0	0	111.3	D108 F111 L137 A143 F144	D108-L140 HydrophobicContact CB-CD2 4.46Å; F111-L140 HydrophobicContact CD1-CB 3.83Å; F111-L140 HydrophobicContact CD1-CD2 4.49Å; F111-L140 HydrophobicContact CE1-CB 4.18Å; L137-L140 HydrophobicContact CD2-CD1 3.99Å; L137-L140 WeakPolarHBondContact O-CB 3.19Å; L137-L140 PolarHBondContact O-N 3.07Å; L140-A143 PolarHBondContact O-N 3.31Å; L140-F144 WeakPolarHBondContact O-CB 3.23Å; L140-F144 PolarHBondContact O-N 2.79Å
141	I	95.2	Very high	92.8	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-41.8	-179.6	-64.7	-43.9	0	0	0	111.2	I56 L106 L127 L131 L137 F144 F145 F164 F165	I56-I141 HydrophobicContact CG2-CD1 4.25Å; L106-I141 HydrophobicContact CD1-CD1 4.18Å; L127-I141 HydrophobicContact CD1-CD1 3.76Å; L127-I141 HydrophobicContact CD1-CG2 4.09Å; L127-I141 HydrophobicContact CD2-CG2 3.71Å; L127-I141 HydrophobicContact CG-CG2 4.41Å; L131-I141 HydrophobicContact CD1-CD1 4.39Å; L131-I141 HydrophobicContact CD1-CG1 4.48Å; L131-I141 HydrophobicContact CD2-CD1 4.42Å; L137-I141 HydrophobicContact CB-CG1 4.3Å; L137-I141 WeakPolarHBondContact O-CG1 3.38Å; L137-I141 PolarHBondContact O-N 3.2Å; I141-F144 PolarHBondContact O-N 2.6Å; I141-F145 VanDerWaalsContact O-CB 3.29Å; I141-F145 WeakPolarHBondContact O-CB 3.38Å; I141-F145 PolarHBondContact O-N 3.43Å; I141-F164 HydrophobicContact CG2-CB 4.35Å; I141-F165 HydrophobicContact CG2-CE2 4Å; I141-F165 HydrophobicContact CG2-CZ 3.8Å
142	T	93.2	Very high	92.7	Very high	41 Å²	41	64.9 Å²	64.9	25%	0.252	32%	0.322	S	S	.	.	H	α-helix	trans	-61.4	-48.8	176.1	-56.7	0	0	0	0	110.9	A138 F144 F145 E146 L171	A138-T142 WeakPolarHBondContact O-CB 3.44Å; A138-T142 PolarHBondContact O-N 3.49Å; A138-T142 PolarHBondContact O-OG1 3.5Å; T142-F144 PolarHBondContact O-N 3.12Å; T142-F145 PolarHBondContact O-N 3.13Å; T142-E146 HydrophobicContact CG2-CG 4.49Å; T142-E146 WeakPolarHBondContact O-CG 3.48Å; T142-E146 PolarHBondContact O-N 2.93Å; T142-L171 HydrophobicContact CG2-CD1 4.16Å
143	A	92.5	Very high	93	Very high	43 Å²	43	65.3 Å²	65.3	36%	0.355	32%	0.323	S	S	.	.	H	α-helix	trans	-62.2	-40.4	178.7	0	0	0	0	0	112.7	K139 L140 K147	K139-A143 WeakPolarHBondContact O-CB 3.37Å; K139-A143 PolarHBondContact O-N 3.43Å; L140-A143 PolarHBondContact O-N 3.31Å; A143-K147 WeakPolarHBondContact O-CB 3.48Å; A143-K147 PolarHBondContact O-N 2.98Å; A143-K147 VanDerWaalsContact O-N 3.15Å
144	F	95.8	Very high	93.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-47.4	173.2	164.3	-102	0	0	0	111.7	I56 F111 L115 F119 T125 L127 L140 I141 T142 K147 A148 M155	I56-F144 HydrophobicContact CD1-CD1 3.78Å; I56-F144 HydrophobicContact CD1-CD2 3.73Å; I56-F144 HydrophobicContact CD1-CE1 3.31Å; I56-F144 HydrophobicContact CD1-CE2 3.26Å; I56-F144 HydrophobicContact CD1-CG 3.99Å; I56-F144 HydrophobicContact CD1-CZ 3.05Å; F111-F144 HydrophobicContact CE1-CB 3.63Å; F111-F144 HydrophobicContact CE1-CG 4.34Å; F111-F144 HydrophobicContact CZ-CB 3.78Å; F111-F144 HydrophobicContact CZ-CD2 4.17Å; F111-F144 AromaticContact CZ-CG 3.97Å; F111-F144 HydrophobicContact CZ-CG 3.97Å; L115-F144 HydrophobicContact CD2-CB 4.36Å; L115-F144 HydrophobicContact CD2-CD2 3.7Å; L115-F144 HydrophobicContact CD2-CG 4.48Å; F119-F144 HydrophobicContact CE1-CD2 4.22Å; F119-F144 AromaticContact CE1-CE2 3.63Å; F119-F144 HydrophobicContact CE1-CE2 3.63Å; F119-F144 HydrophobicContact CE1-CZ 4.41Å; F119-F144 HydrophobicContact CE2-CD2 4.12Å; F119-F144 HydrophobicContact CE2-CE2 4.29Å; F119-F144 AromaticContact CZ-CD2 3.45Å; F119-F144 HydrophobicContact CZ-CD2 3.45Å; F119-F144 VanDerWaalsContact CZ-CD2 3.45Å; F119-F144 AromaticContact CZ-CE2 3.35Å; F119-F144 HydrophobicContact CZ-CE2 3.35Å; F119-F144 HydrophobicContact CZ-CZ 4.39Å; T125-F144 HydrophobicContact CG2-CZ 4.08Å; L127-F144 HydrophobicContact CD2-CD1 4.36Å; L127-F144 HydrophobicContact CD2-CE1 4.39Å; L140-F144 WeakPolarHBondContact O-CB 3.23Å; L140-F144 PolarHBondContact O-N 2.79Å; I141-F144 PolarHBondContact O-N 2.6Å; T142-F144 PolarHBondContact O-N 3.12Å; F144-K147 PolarHBondContact O-N 3.46Å; F144-A148 HydrophobicContact CE2-CB 4.47Å; F144-A148 HydrophobicContact CZ-CB 4.29Å; F144-A148 WeakPolarHBondContact O-CB 3.36Å; F144-A148 PolarHBondContact O-N 2.9Å; F144-M155 HydrophobicContact CD1-CE 4.23Å; F144-M155 HydrophobicContact CE1-CE 3.26Å; F144-M155 HydrophobicContact CE1-SD 4.2Å; F144-M155 HydrophobicContact CZ-CE 3.47Å; F144-M155 VanDerWaalsContact CZ-CE 3.47Å
145	F	96.9	Very high	93.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-45.9	-178.8	173.8	-89.5	0	0	0	112	I141 T142 K147 A148 R149 M155 I157 F165 L171 F172 Y175 L178	I141-F145 VanDerWaalsContact O-CB 3.29Å; I141-F145 WeakPolarHBondContact O-CB 3.38Å; I141-F145 PolarHBondContact O-N 3.43Å; T142-F145 PolarHBondContact O-N 3.13Å; F145-K147 PolarHBondContact O-N 2.99Å; F145-A148 PolarHBondContact O-N 3.03Å; F145-R149 WeakPolarHBondContact O-CB 3.27Å; F145-R149 PolarHBondContact O-N 3.41Å; F145-M155 HydrophobicContact CD2-SD 4.02Å; F145-M155 HydrophobicContact CE2-SD 4.49Å; F145-I157 HydrophobicContact CD2-CD1 3.9Å; F145-I157 HydrophobicContact CE2-CD1 3.88Å; F145-F165 HydrophobicContact CB-CE1 3.96Å; F145-F165 HydrophobicContact CB-CZ 3.67Å; F145-F165 AromaticContact CD1-CE1 3.95Å; F145-F165 HydrophobicContact CD1-CE1 3.95Å; F145-F165 HydrophobicContact CD1-CZ 4.37Å; F145-F165 HydrophobicContact CD2-CE1 4.12Å; F145-F165 HydrophobicContact CD2-CE2 4.49Å; F145-F165 AromaticContact CD2-CZ 3.8Å; F145-F165 HydrophobicContact CD2-CZ 3.8Å; F145-F165 AromaticContact CG-CE1 3.72Å; F145-F165 HydrophobicContact CG-CE1 3.72Å; F145-F165 AromaticContact CG-CZ 3.67Å; F145-F165 HydrophobicContact CG-CZ 3.67Å; F145-L171 HydrophobicContact CD1-CB 4.39Å; F145-L171 HydrophobicContact CE1-CB 3.88Å; F145-L171 WeakPolarHBondContact CE1-O 3.16Å; F145-L171 WeakPolarHBondContact CZ-O 3.4Å; F145-F172 AromaticContact CE2-CD1 3.77Å; F145-F172 HydrophobicContact CE2-CD1 3.77Å; F145-F172 HydrophobicContact CE2-CE1 4.02Å; F145-F172 AromaticContact CZ-CD1 3.66Å; F145-F172 HydrophobicContact CZ-CD1 3.66Å; F145-F172 HydrophobicContact CZ-CE1 4.27Å; F145-Y175 AromaticContact CE2-CD1 3.77Å; F145-Y175 HydrophobicContact CE2-CD1 3.77Å; F145-Y175 HydrophobicContact CE2-CE1 4.01Å; F145-Y175 AromaticContact CZ-CD1 3.7Å; F145-Y175 HydrophobicContact CZ-CD1 3.7Å; F145-Y175 HydrophobicContact CZ-CE1 4.28Å; F145-L178 HydrophobicContact CE2-CD1 4.45Å; F145-L178 HydrophobicContact CE2-CD2 3.91Å; F145-L178 HydrophobicContact CZ-CD2 4.23Å
146	E	95.3	Very high	94.6	Very high	102 Å²	102	48.2 Å²	48.2	48%	0.477	24%	0.24	S	C	.	.	H	α-helix	trans	-60.5	-44.6	177.4	-71.7	178.5	147.9	0	0	111.7	T142 R149 E150	T142-E146 HydrophobicContact CG2-CG 4.49Å; T142-E146 WeakPolarHBondContact O-CG 3.48Å; T142-E146 PolarHBondContact O-N 2.93Å; E146-R149 WeakPolarHBondContact O-CB 3.43Å; E146-R149 PolarHBondContact O-N 2.88Å; E146-E150 PolarHBondContact O-N 3.39Å
147	K	95.5	Very high	95.1	Very high	46 Å²	46	44.5 Å²	44.5	20%	0.2	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-37.8	177.9	-169.3	164.4	-179.9	170.5	0	112.6	L115 D116 F119 A143 F144 F145 R149 E150 R151	L115-K147 HydrophobicContact CD1-CD 4.3Å; D116-K147 WeakPolarHBondContact OD1-CE 3.41Å; D116-K147 IonicContact OD1-NZ 3.45Å; D116-K147 PolarHBondContact OD1-NZ 2.84Å; D116-K147 IonicContact OD2-NZ 3.9Å; D116-K147 PolarHBondContact OD2-NZ 2.96Å; F119-K147 HydrophobicContact CD2-CD 4.04Å; F119-K147 HydrophobicContact CD2-CG 4.03Å; F119-K147 HydrophobicContact CE2-CB 3.91Å; F119-K147 HydrophobicContact CE2-CD 3.67Å; F119-K147 HydrophobicContact CE2-CG 3.55Å; F119-K147 HydrophobicContact CZ-CB 4.13Å; F119-K147 HydrophobicContact CZ-CG 4.14Å; A143-K147 WeakPolarHBondContact O-CB 3.48Å; A143-K147 PolarHBondContact O-N 2.98Å; A143-K147 VanDerWaalsContact O-N 3.15Å; F144-K147 PolarHBondContact O-N 3.46Å; F145-K147 PolarHBondContact O-N 2.99Å; K147-R149 VanDerWaalsContact C-N 3.34Å; K147-E150 PolarHBondContact O-N 3.23Å; K147-R151 WeakPolarHBondContact O-CG 3.43Å; K147-R151 PolarHBondContact O-N 2.89Å; K147-R151 VanDerWaalsContact O-N 3.14Å
148	A	96.9	Very high	95.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.7	-42	174	0	0	0	0	0	111.2	F119 F144 F145 R151 Q152 L153 M155 Y175	F119-A148 HydrophobicContact CE1-CB 3.7Å; F119-A148 HydrophobicContact CZ-CB 3.92Å; F144-A148 HydrophobicContact CE2-CB 4.47Å; F144-A148 HydrophobicContact CZ-CB 4.29Å; F144-A148 WeakPolarHBondContact O-CB 3.36Å; F144-A148 PolarHBondContact O-N 2.9Å; F145-A148 PolarHBondContact O-N 3.03Å; A148-R151 CarbonylContact O-C 3.12Å; A148-R151 PolarHBondContact O-N 2.73Å; A148-Q152 PolarHBondContact O-N 3.4Å; A148-L153 HydrophobicContact CB-CB 4.31Å; A148-L153 PolarHBondContact O-N 2.97Å; A148-M155 HydrophobicContact CB-CE 3.26Å; A148-Y175 PolarHBondContact O-OH 3.06Å
149	R	95.5	Very high	95.1	Very high	94 Å²	94	43.9 Å²	43.9	36%	0.355	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-45.9	176.1	-177.2	176.8	176.4	-134.4	4.9	112.2	F145 E146 K147 R151 Q152 R173 Y175	F145-R149 WeakPolarHBondContact O-CB 3.27Å; F145-R149 PolarHBondContact O-N 3.41Å; E146-R149 WeakPolarHBondContact O-CB 3.43Å; E146-R149 PolarHBondContact O-N 2.88Å; K147-R149 VanDerWaalsContact C-N 3.34Å; R149-R151 PolarHBondContact O-N 3.27Å; R149-Q152 PolarHBondContact O-N 3.33Å; R149-Q152 PolarHBondContact O-NE2 3.29Å; R149-R173 PolarHBondContact NH2-O 3.45Å; R149-Y175 VanDerWaalsContact CA-CZ 3.46Å; R149-Y175 HydrophobicContact CB-CD1 3.71Å; R149-Y175 HydrophobicContact CB-CE1 3.63Å; R149-Y175 HydrophobicContact CB-CE2 4.48Å; R149-Y175 HydrophobicContact CB-CG 4.16Å; R149-Y175 HydrophobicContact CG-CD1 3.82Å; R149-Y175 HydrophobicContact CG-CD2 4.21Å; R149-Y175 HydrophobicContact CG-CE1 4.22Å; R149-Y175 HydrophobicContact CG-CG 3.8Å; R149-Y175 PolarHBondContact N-OH 2.88Å
150	E	94.8	Very high	95.1	Very high	158 Å²	158	36.8 Å²	36.8	74%	0.738	18%	0.18	S	C	*	.	H	α-helix	trans	-55.3	-43.1	174.8	-174.6	-174.5	-170.6	0	0	111.1	E146 K147 Q152	E146-E150 PolarHBondContact O-N 3.39Å; K147-E150 PolarHBondContact O-N 3.23Å; E150-Q152 VanDerWaalsContact C-N 3.26Å; E150-Q152 PolarHBondContact O-N 3.48Å
151	R	93.4	Very high	95	Very high	114 Å²	114	36.3 Å²	36.3	43%	0.43	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.6	178	-66.3	-173.7	180	-152	4.6	114.6	D116 K147 A148 R149 L153	D116-R151 IonicContact OD1-CZ 3.99Å; D116-R151 IonicContact OD1-NH2 3.8Å; D116-R151 PolarHBondContact OD1-NH2 2.9Å; K147-R151 WeakPolarHBondContact O-CG 3.43Å; K147-R151 PolarHBondContact O-N 2.89Å; K147-R151 VanDerWaalsContact O-N 3.14Å; A148-R151 CarbonylContact O-C 3.12Å; A148-R151 PolarHBondContact O-N 2.73Å; R149-R151 PolarHBondContact O-N 3.27Å; R151-L153 PolarHBondContact O-N 3.47Å
152	Q	93.6	Very high	94.9	Very high	76 Å²	76	37.1 Å²	37.1	36%	0.355	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	42.4	-173.5	-64.2	-66	-55.7	0	0	111.4	A148 R149 E150 P154 R177	A148-Q152 PolarHBondContact O-N 3.4Å; R149-Q152 PolarHBondContact O-N 3.33Å; R149-Q152 PolarHBondContact O-NE2 3.29Å; E150-Q152 VanDerWaalsContact C-N 3.26Å; E150-Q152 PolarHBondContact O-N 3.48Å; Q152-P154 WeakPolarHBondContact O-CD 3.49Å; Q152-R177 WeakPolarHBondContact O-CD 3.5Å; Q152-R177 PolarHBondContact O-NH1 3.16Å
153	L	96.3	Very high	94.9	Very high	14 Å²	14	39.3 Å²	39.3	7%	0.073	19%	0.189	C	C	.	.			trans	-72.4	130.6	177.2	-175.4	70.2	0	0	0	109.6	F119 V122 T125 A148 R151 M155 Y175	F119-L153 HydrophobicContact CD1-CD2 3.78Å; F119-L153 HydrophobicContact CE1-CD2 3.68Å; V122-L153 HydrophobicContact CG2-CD1 4.26Å; V122-L153 HydrophobicContact CG2-CD2 4.06Å; T125-L153 HydrophobicContact CG2-CD2 3.49Å; T125-L153 VanDerWaalsContact CG2-CD2 3.49Å; A148-L153 HydrophobicContact CB-CB 4.31Å; A148-L153 PolarHBondContact O-N 2.97Å; R151-L153 PolarHBondContact O-N 3.47Å; L153-M155 PolarHBondContact O-N 3.14Å; L153-Y175 WeakPolarHBondContact O-CE2 3.49Å; L153-Y175 VanDerWaalsContact O-CZ 3.27Å; L153-Y175 PolarHBondContact O-OH 3.23Å
154	P	98.2	Very high	94.8	Very high	10 Å²	10	39 Å²	39	7%	0.065	18%	0.18	C	C	.	.			trans	-57.9	130.1	170.1	-25.2	33.9	0	0	0	112.1	H123 S124 T125 Q152 R177 L262 Y266	H123-P154 VanDerWaalsContact O-CD 3.29Å; H123-P154 WeakPolarHBondContact O-CD 3.27Å; S124-P154 CarbonylContact C-O 3.52Å; S124-P154 VanDerWaalsContact CA-O 3.25Å; S124-P154 WeakPolarHBondContact CA-O 3.13Å; T125-P154 PolarHBondContact N-O 2.9Å; T125-P154 PolarHBondContact OG1-O 3.13Å; Q152-P154 WeakPolarHBondContact O-CD 3.49Å; P154-R177 WeakPolarHBondContact CA-O 3.23Å; P154-L262 HydrophobicContact CB-CB 3.99Å; P154-L262 HydrophobicContact CB-CD1 4.24Å; P154-Y266 HydrophobicContact CB-CD2 3.92Å; P154-Y266 HydrophobicContact CB-CE2 3.98Å; P154-Y266 HydrophobicContact CG-CD2 3.49Å; P154-Y266 VanDerWaalsContact CG-CD2 3.49Å; P154-Y266 HydrophobicContact CG-CE2 3.85Å; P154-Y266 HydrophobicContact CG-CG 4.31Å
155	M	98.6	Very high	94.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141	-173.7	-175.8	178.9	-64.3	0	0	112.1	T125 L127 F144 F145 A148 L153 I157 R177 L178 V179	T125-M155 CarbonylContact O-C 3.53Å; T125-M155 WeakPolarHBondContact O-CA 3.34Å; L127-M155 HydrophobicContact CB-SD 4.45Å; L127-M155 HydrophobicContact CD2-SD 4.43Å; F144-M155 HydrophobicContact CD1-CE 4.23Å; F144-M155 HydrophobicContact CE1-CE 3.26Å; F144-M155 HydrophobicContact CE1-SD 4.2Å; F144-M155 HydrophobicContact CZ-CE 3.47Å; F144-M155 VanDerWaalsContact CZ-CE 3.47Å; F145-M155 HydrophobicContact CD2-SD 4.02Å; F145-M155 HydrophobicContact CE2-SD 4.49Å; A148-M155 HydrophobicContact CB-CE 3.26Å; L153-M155 PolarHBondContact O-N 3.14Å; M155-I157 HydrophobicContact CG-CG1 4.11Å; M155-I157 HydrophobicContact SD-CD1 3.96Å; M155-I157 HydrophobicContact SD-CG1 3.88Å; M155-R177 PolarHBondContact N-O 2.59Å; M155-L178 HydrophobicContact CB-CD1 3.97Å; M155-L178 HydrophobicContact CG-CD1 3.98Å; M155-L178 CarbonylContact O-C 3.55Å; M155-L178 WeakPolarHBondContact O-CA 3.35Å; M155-L178 HydrophobicContact SD-CD1 4.18Å; M155-V179 PolarHBondContact O-N 2.86Å
156	V	98.8	Very high	94.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	132	166.3	-171.2	0	0	0	0	108.8	T125 V126 L127 V179 T181 T255 M258 A259 L262	T125-V156 PolarHBondContact O-N 3.34Å; V126-V156 CarbonylContact C-O 3.56Å; V126-V156 WeakPolarHBondContact CA-O 3.27Å; V126-V156 HydrophobicContact CG2-CB 4.37Å; L127-V156 PolarHBondContact N-O 3.25Å; V156-V179 CarbonylContact C-O 3.53Å; V156-V179 WeakPolarHBondContact CA-O 3.33Å; V156-T181 HydrophobicContact CG1-CG2 3.75Å; V156-T255 HydrophobicContact CG1-CG2 3.94Å; V156-M258 HydrophobicContact CG1-SD 3.84Å; V156-M258 HydrophobicContact CG2-CB 4.12Å; V156-M258 HydrophobicContact CG2-CG 3.86Å; V156-M258 HydrophobicContact CG2-SD 3.85Å; V156-A259 HydrophobicContact CG2-CB 4.46Å; V156-L262 HydrophobicContact CG2-CD1 3.51Å
157	I	98.5	Very high	93.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.5	170.4	-58.4	177.4	0	0	0	109.2	L127 F145 M155 L162 F165 F172 L178 V179 L180 T181	L127-I157 HydrophobicContact CB-CG1 4.22Å; L127-I157 HydrophobicContact CD2-CD1 4.17Å; L127-I157 HydrophobicContact CD2-CG1 4.2Å; L127-I157 WeakPolarHBondContact O-CA 3.48Å; F145-I157 HydrophobicContact CD2-CD1 3.9Å; F145-I157 HydrophobicContact CE2-CD1 3.88Å; M155-I157 HydrophobicContact CG-CG1 4.11Å; M155-I157 HydrophobicContact SD-CD1 3.96Å; M155-I157 HydrophobicContact SD-CG1 3.88Å; I157-L162 HydrophobicContact CB-CD2 4.25Å; I157-L162 HydrophobicContact CG2-CD2 3.77Å; I157-L162 HydrophobicContact CG2-CG 4.04Å; I157-F165 HydrophobicContact CD1-CD2 4.33Å; I157-F165 HydrophobicContact CD1-CE2 3.92Å; I157-F172 HydrophobicContact CD1-CD1 4.43Å; I157-F172 HydrophobicContact CD1-CE1 3.63Å; I157-F172 HydrophobicContact CD1-CZ 4.35Å; I157-L178 HydrophobicContact CD1-CD1 3.65Å; I157-L178 HydrophobicContact CD1-CD2 4.45Å; I157-L178 HydrophobicContact CG1-CD1 3.72Å; I157-V179 PolarHBondContact N-O 2.91Å; I157-L180 HydrophobicContact CB-CD2 3.81Å; I157-L180 HydrophobicContact CD1-CD2 4.14Å; I157-L180 HydrophobicContact CG1-CD2 4.32Å; I157-T181 PolarHBondContact O-N 3.43Å; I157-T181 PolarHBondContact O-OG1 3.31Å
158	D	95	Very high	93.6	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.021	23%	0.227	C	C	.	.			trans	-135.1	163.6	179.4	-165	18	0	0	0	111.9	L127 G128 D160 G161 T181 K223 T255	L127-D158 PolarHBondContact O-N 3.18Å; L127-D158 VanDerWaalsContact O-N 3.1Å; G128-D158 WeakPolarHBondContact CA-O 3.33Å; D158-D160 PolarHBondContact O-N 2.91Å; D158-G161 WeakPolarHBondContact O-CA 3.43Å; D158-G161 PolarHBondContact O-N 3.36Å; D158-T181 WeakPolarHBondContact CA-OG1 3.28Å; D158-T181 WeakPolarHBondContact CB-OG1 3.24Å; D158-T181 PolarHBondContact OD1-OG1 3.26Å; D158-K223 IonicContact OD1-NZ 3.86Å; D158-K223 PolarHBondContact OD1-NZ 3.34Å; D158-K223 IonicContact OD2-NZ 2.66Å; D158-K223 PolarHBondContact OD2-NZ 2.99Å; D158-T255 HydrophobicContact CB-CG2 3.43Å; D158-T255 VanDerWaalsContact CB-CG2 3.43Å; D158-T255 WeakPolarHBondContact OD2-CG2 3.48Å
159	A	89.6	Confident	93.4	Very high	32 Å²	32	47.5 Å²	47.5	26%	0.264	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	-124.7	168.5	0	0	0	0	0	113.4	G161 L162	A159-G161 PolarHBondContact O-N 3.38Å; A159-G161 VanDerWaalsContact O-N 3.12Å; A159-L162 WeakPolarHBondContact O-CB 3.33Å; A159-L162 PolarHBondContact O-N 2.87Å
160	D	90.2	Very high	93.3	Very high	29 Å²	29	46.8 Å²	46.8	16%	0.155	23%	0.232	C	C	.	.	H	α-helix	trans	-58.1	-26.5	-179.6	-68	-32.9	0	0	0	112.5	L131 G132 D158 L162 H163 F164	L131-D160 HydrophobicContact CB-CB 3.97Å; G132-D160 WeakPolarHBondContact CA-OD2 3.13Å; G132-D160 PolarHBondContact N-OD2 3.48Å; D158-D160 PolarHBondContact O-N 2.91Å; D160-L162 VanDerWaalsContact C-N 3.31Å; D160-L162 PolarHBondContact O-N 3.11Å; D160-H163 WeakPolarHBondContact O-CB 3.45Å; D160-H163 PolarHBondContact O-N 3.41Å; D160-H163 VanDerWaalsContact O-N 3.07Å; D160-F164 VanDerWaalsContact O-CD2 3.22Å; D160-F164 WeakPolarHBondContact O-CD2 3.22Å; D160-F164 PolarHBondContact O-N 3.43Å
161	G	91.1	Very high	93.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.9	-43	172.7	0	0	0	0	0	111.9	D158 A159 H163 F164 F165	D158-G161 WeakPolarHBondContact O-CA 3.43Å; D158-G161 PolarHBondContact O-N 3.36Å; A159-G161 PolarHBondContact O-N 3.38Å; A159-G161 VanDerWaalsContact O-N 3.12Å; G161-H163 VanDerWaalsContact C-N 3.26Å; G161-H163 PolarHBondContact O-N 3.49Å; G161-F164 PolarHBondContact O-N 2.87Å; G161-F165 WeakPolarHBondContact O-CD2 3.31Å
162	L	93.5	Very high	93.5	Very high	16 Å²	16	35.2 Å²	35.2	8%	0.084	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-31.3	176.3	-65.4	173	0	0	0	112	I157 A159 D160 F165 S166 L180 P182 E186	I157-L162 HydrophobicContact CB-CD2 4.25Å; I157-L162 HydrophobicContact CG2-CD2 3.77Å; I157-L162 HydrophobicContact CG2-CG 4.04Å; A159-L162 WeakPolarHBondContact O-CB 3.33Å; A159-L162 PolarHBondContact O-N 2.87Å; D160-L162 VanDerWaalsContact C-N 3.31Å; D160-L162 PolarHBondContact O-N 3.11Å; L162-F165 PolarHBondContact O-N 3.42Å; L162-S166 PolarHBondContact O-N 2.92Å; L162-L180 HydrophobicContact CD2-CB 4.03Å; L162-L180 HydrophobicContact CD2-CD2 3.86Å; L162-L180 HydrophobicContact CD2-CG 4.36Å; L162-P182 HydrophobicContact CD1-CB 4.01Å; L162-E186 HydrophobicContact CD1-CB 4.39Å
163	H	92.1	Very high	93.6	Very high	87 Å²	87	35.2 Å²	35.2	40%	0.403	18%	0.181	S	C	.	.	H	α-helix	trans	-66.4	-39.7	179.5	179.7	49.3	0	0	0	112.2	D160 G161 F165 S166	D160-H163 WeakPolarHBondContact O-CB 3.45Å; D160-H163 PolarHBondContact O-N 3.41Å; D160-H163 VanDerWaalsContact O-N 3.07Å; G161-H163 VanDerWaalsContact C-N 3.26Å; G161-H163 PolarHBondContact O-N 3.49Å; H163-F165 PolarHBondContact O-N 2.82Å; H163-F165 VanDerWaalsContact O-N 3.11Å; H163-S166 PolarHBondContact ND1-OG 3.31Å; H163-S166 VanDerWaalsContact O-CB 3.3Å; H163-S166 WeakPolarHBondContact O-CB 3.3Å; H163-S166 PolarHBondContact O-N 2.7Å; H163-S166 PolarHBondContact O-OG 2.98Å
164	F	91	Very high	93.6	Very high	38 Å²	38	36 Å²	36	17%	0.167	19%	0.192	C	C	.	.	H	α-helix	trans	-60.3	-22.6	178.2	-79.9	-74.3	0	0	0	114.1	L131 L137 A138 I141 D160 G161	L131-F164 HydrophobicContact CB-CE2 3.98Å; L131-F164 HydrophobicContact CD1-CD2 4.02Å; L131-F164 HydrophobicContact CD1-CE2 3.95Å; L137-F164 HydrophobicContact CB-CE1 4.08Å; L137-F164 HydrophobicContact CB-CZ 3.93Å; L137-F164 HydrophobicContact CD1-CZ 4.5Å; A138-F164 HydrophobicContact CB-CD1 3.98Å; A138-F164 HydrophobicContact CB-CE1 4.19Å; I141-F164 HydrophobicContact CG2-CB 4.35Å; D160-F164 VanDerWaalsContact O-CD2 3.22Å; D160-F164 WeakPolarHBondContact O-CD2 3.22Å; D160-F164 PolarHBondContact O-N 3.43Å; G161-F164 PolarHBondContact O-N 2.87Å
165	F	92.8	Very high	93.5	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.009	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	5	176.8	-58.1	-81.2	0	0	0	113.1	L127 I141 F145 I157 G161 L162 H163 E167 N168 L171 F172	L127-F165 HydrophobicContact CD2-CE2 3.87Å; L127-F165 HydrophobicContact CD2-CZ 4.19Å; I141-F165 HydrophobicContact CG2-CE2 4Å; I141-F165 HydrophobicContact CG2-CZ 3.8Å; F145-F165 HydrophobicContact CB-CE1 3.96Å; F145-F165 HydrophobicContact CB-CZ 3.67Å; F145-F165 AromaticContact CD1-CE1 3.95Å; F145-F165 HydrophobicContact CD1-CE1 3.95Å; F145-F165 HydrophobicContact CD1-CZ 4.37Å; F145-F165 HydrophobicContact CD2-CE1 4.12Å; F145-F165 HydrophobicContact CD2-CE2 4.49Å; F145-F165 AromaticContact CD2-CZ 3.8Å; F145-F165 HydrophobicContact CD2-CZ 3.8Å; F145-F165 AromaticContact CG-CE1 3.72Å; F145-F165 HydrophobicContact CG-CE1 3.72Å; F145-F165 AromaticContact CG-CZ 3.67Å; F145-F165 HydrophobicContact CG-CZ 3.67Å; I157-F165 HydrophobicContact CD1-CD2 4.33Å; I157-F165 HydrophobicContact CD1-CE2 3.92Å; G161-F165 WeakPolarHBondContact O-CD2 3.31Å; L162-F165 PolarHBondContact O-N 3.42Å; H163-F165 PolarHBondContact O-N 2.82Å; H163-F165 VanDerWaalsContact O-N 3.11Å; F165-E167 PolarHBondContact O-N 2.86Å; F165-N168 CarbonylContact O-C 3.57Å; F165-N168 PolarHBondContact O-N 3.35Å; F165-L171 HydrophobicContact CD1-CB 4.29Å; F165-L171 HydrophobicContact CD1-CD1 3.86Å; F165-L171 HydrophobicContact CE1-CD1 4.1Å; F165-F172 HydrophobicContact CB-CE1 3.78Å; F165-F172 HydrophobicContact CB-CE2 3.68Å; F165-F172 HydrophobicContact CB-CZ 3.16Å; F165-F172 AromaticContact CD1-CE1 3.9Å; F165-F172 HydrophobicContact CD1-CE1 3.9Å; F165-F172 HydrophobicContact CD1-CZ 4.2Å; F165-F172 AromaticContact CD2-CE1 3.58Å; F165-F172 HydrophobicContact CD2-CE1 3.58Å; F165-F172 AromaticContact CD2-CZ 3.51Å; F165-F172 HydrophobicContact CD2-CZ 3.51Å; F165-F172 HydrophobicContact CE1-CE1 4.42Å; F165-F172 HydrophobicContact CE2-CE1 4.15Å; F165-F172 HydrophobicContact CE2-CZ 4.48Å; F165-F172 AromaticContact CG-CE1 3.46Å; F165-F172 HydrophobicContact CG-CE1 3.46Å; F165-F172 VanDerWaalsContact CG-CE1 3.46Å; F165-F172 HydrophobicContact CG-CE2 4.31Å; F165-F172 AromaticContact CG-CZ 3.36Å; F165-F172 HydrophobicContact CG-CZ 3.36Å
166	S	87.9	Confident	93.4	Very high	50 Å²	50	41.2 Å²	41.2	35%	0.35	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-28.9	-175	60.4	0	0	0	0	113.5	L162 H163	L162-S166 PolarHBondContact O-N 2.92Å; H163-S166 PolarHBondContact ND1-OG 3.31Å; H163-S166 VanDerWaalsContact O-CB 3.3Å; H163-S166 WeakPolarHBondContact O-CB 3.3Å; H163-S166 PolarHBondContact O-N 2.7Å; H163-S166 PolarHBondContact O-OG 2.98Å
167	E	86	Confident	93.3	Very high	191 Å²	191	45.1 Å²	45.1	89%	0.893	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-18.8	175.3	-62.1	-175.6	165	0	0	113.2	F165	F165-E167 PolarHBondContact O-N 2.86Å
168	N	90.8	Very high	93.3	Very high	75 Å²	75	45.1 Å²	45.1	40%	0.401	23%	0.228	S	C	.	.			trans	-141.7	64.9	-178.1	-168.1	2.4	0	0	0	111.6	F165 D170 L171	F165-N168 CarbonylContact O-C 3.57Å; F165-N168 PolarHBondContact O-N 3.35Å; N168-D170 PolarHBondContact O-N 3.48Å; N168-D170 VanDerWaalsContact O-N 3.17Å; N168-L171 HydrophobicContact CB-CD1 4.29Å; N168-L171 HydrophobicContact CB-CG 4.49Å; N168-L171 PolarHBondContact O-N 2.99Å
169	P	92.9	Very high	93.5	Very high	8 Å²	8	45 Å²	45	5%	0.052	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-66	-15.4	178.7	28.6	-35.9	0	0	0	112.6	L171 F172 L190 A193	P169-L171 PolarHBondContact O-N 3.3Å; P169-F172 HydrophobicContact CB-CD2 4.27Å; P169-F172 WeakPolarHBondContact O-CB 3.31Å; P169-F172 WeakPolarHBondContact O-CD2 3.43Å; P169-F172 PolarHBondContact O-N 3.37Å; P169-L190 HydrophobicContact CB-CD1 3.69Å; P169-A193 HydrophobicContact CG-CB 4.04Å
170	D	93.2	Very high	93.9	Very high	78 Å²	78	43.4 Å²	43.4	42%	0.417	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-60.3	-24.5	176.4	-82.6	-20	0	0	0	113.2	N168 F172 R173	N168-D170 PolarHBondContact O-N 3.48Å; N168-D170 VanDerWaalsContact O-N 3.17Å; D170-F172 PolarHBondContact O-N 3.47Å; D170-R173 VanDerWaalsContact CG-NH1 3.33Å; D170-R173 WeakPolarHBondContact O-CB 3.32Å; D170-R173 PolarHBondContact O-N 3.14Å; D170-R173 WeakPolarHBondContact OD1-CD 3.25Å; D170-R173 IonicContact OD1-CZ 2.71Å; D170-R173 IonicContact OD1-NE 2.73Å; D170-R173 PolarHBondContact OD1-NE 3.32Å; D170-R173 IonicContact OD1-NH1 2.81Å; D170-R173 PolarHBondContact OD1-NH1 3.46Å; D170-R173 IonicContact OD1-NH2 2.98Å; D170-R173 IonicContact OD2-NH1 3.67Å; D170-R173 PolarHBondContact OD2-NH1 2.92Å
171	L	95.5	Very high	94.3	Very high	29 Å²	29	42 Å²	42	15%	0.152	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-58.1	-29.9	173.1	-70.9	173.4	0	0	0	112.3	T142 F145 F165 N168 P169 R173	T142-L171 HydrophobicContact CG2-CD1 4.16Å; F145-L171 HydrophobicContact CD1-CB 4.39Å; F145-L171 HydrophobicContact CE1-CB 3.88Å; F145-L171 WeakPolarHBondContact CE1-O 3.16Å; F145-L171 WeakPolarHBondContact CZ-O 3.4Å; F165-L171 HydrophobicContact CD1-CB 4.29Å; F165-L171 HydrophobicContact CD1-CD1 3.86Å; F165-L171 HydrophobicContact CE1-CD1 4.1Å; N168-L171 HydrophobicContact CB-CD1 4.29Å; N168-L171 HydrophobicContact CB-CG 4.49Å; N168-L171 PolarHBondContact O-N 2.99Å; P169-L171 PolarHBondContact O-N 3.3Å; L171-R173 VanDerWaalsContact C-N 3.3Å; L171-R173 PolarHBondContact O-N 2.91Å
172	F	97.2	Very high	94.6	Very high	1 Å²	1	42 Å²	42	0%	0.004	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-70.5	-24.9	178	-57.1	-41.2	0	0	0	113.4	F145 I157 F165 P169 D170 G174 Y175 L178 L180 L190 L215 V218	F145-F172 AromaticContact CE2-CD1 3.77Å; F145-F172 HydrophobicContact CE2-CD1 3.77Å; F145-F172 HydrophobicContact CE2-CE1 4.02Å; F145-F172 AromaticContact CZ-CD1 3.66Å; F145-F172 HydrophobicContact CZ-CD1 3.66Å; F145-F172 HydrophobicContact CZ-CE1 4.27Å; I157-F172 HydrophobicContact CD1-CD1 4.43Å; I157-F172 HydrophobicContact CD1-CE1 3.63Å; I157-F172 HydrophobicContact CD1-CZ 4.35Å; F165-F172 HydrophobicContact CB-CE1 3.78Å; F165-F172 HydrophobicContact CB-CE2 3.68Å; F165-F172 HydrophobicContact CB-CZ 3.16Å; F165-F172 AromaticContact CD1-CE1 3.9Å; F165-F172 HydrophobicContact CD1-CE1 3.9Å; F165-F172 HydrophobicContact CD1-CZ 4.2Å; F165-F172 AromaticContact CD2-CE1 3.58Å; F165-F172 HydrophobicContact CD2-CE1 3.58Å; F165-F172 AromaticContact CD2-CZ 3.51Å; F165-F172 HydrophobicContact CD2-CZ 3.51Å; F165-F172 HydrophobicContact CE1-CE1 4.42Å; F165-F172 HydrophobicContact CE2-CE1 4.15Å; F165-F172 HydrophobicContact CE2-CZ 4.48Å; F165-F172 AromaticContact CG-CE1 3.46Å; F165-F172 HydrophobicContact CG-CE1 3.46Å; F165-F172 VanDerWaalsContact CG-CE1 3.46Å; F165-F172 HydrophobicContact CG-CE2 4.31Å; F165-F172 AromaticContact CG-CZ 3.36Å; F165-F172 HydrophobicContact CG-CZ 3.36Å; P169-F172 HydrophobicContact CB-CD2 4.27Å; P169-F172 WeakPolarHBondContact O-CB 3.31Å; P169-F172 WeakPolarHBondContact O-CD2 3.43Å; P169-F172 PolarHBondContact O-N 3.37Å; D170-F172 PolarHBondContact O-N 3.47Å; F172-G174 PolarHBondContact O-N 2.82Å; F172-G174 VanDerWaalsContact O-N 3.15Å; F172-Y175 WeakPolarHBondContact O-CB 3.35Å; F172-Y175 PolarHBondContact O-N 2.8Å; F172-Y175 VanDerWaalsContact O-N 3.09Å; F172-L178 HydrophobicContact CB-CD2 4.06Å; F172-L178 HydrophobicContact CD1-CD2 3.55Å; F172-L178 HydrophobicContact CE1-CD2 4.26Å; F172-L178 HydrophobicContact CG-CD2 4.06Å; F172-L180 HydrophobicContact CD1-CD2 4.33Å; F172-L180 HydrophobicContact CD2-CD1 3.68Å; F172-L180 HydrophobicContact CE1-CD2 4.08Å; F172-L180 HydrophobicContact CE2-CD1 3.82Å; F172-L180 HydrophobicContact CE2-CD2 4.33Å; F172-L180 HydrophobicContact CG-CD1 4.11Å; F172-L180 HydrophobicContact CZ-CD1 4.35Å; F172-L180 HydrophobicContact CZ-CD2 4.02Å; F172-L190 HydrophobicContact CD2-CD1 4.42Å; F172-L190 HydrophobicContact CE2-CD1 4.15Å; F172-L215 HydrophobicContact CB-CD2 4.3Å; F172-V218 HydrophobicContact CB-CG2 4.41Å; F172-V218 WeakPolarHBondContact O-CG2 3.35Å
173	R	96.7	Very high	94.7	Very high	76 Å²	76	44 Å²	44	29%	0.287	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	121.3	-167.5	-80	177.1	157.6	161.2	-3.8	112.2	R149 D170 L171 Y175 E214 L215 K216	R149-R173 PolarHBondContact NH2-O 3.45Å; D170-R173 VanDerWaalsContact CG-NH1 3.33Å; D170-R173 WeakPolarHBondContact O-CB 3.32Å; D170-R173 PolarHBondContact O-N 3.14Å; D170-R173 WeakPolarHBondContact OD1-CD 3.25Å; D170-R173 IonicContact OD1-CZ 2.71Å; D170-R173 IonicContact OD1-NE 2.73Å; D170-R173 PolarHBondContact OD1-NE 3.32Å; D170-R173 IonicContact OD1-NH1 2.81Å; D170-R173 PolarHBondContact OD1-NH1 3.46Å; D170-R173 IonicContact OD1-NH2 2.98Å; D170-R173 IonicContact OD2-NH1 3.67Å; D170-R173 PolarHBondContact OD2-NH1 2.92Å; L171-R173 VanDerWaalsContact C-N 3.3Å; L171-R173 PolarHBondContact O-N 2.91Å; R173-Y175 VanDerWaalsContact C-N 3.3Å; R173-Y175 PolarHBondContact O-N 3.04Å; R173-E214 IonicContact CZ-OE1 3.27Å; R173-E214 PolarHBondContact NE-O 2.65Å; R173-E214 IonicContact NH2-OE1 2.68Å; R173-E214 PolarHBondContact NH2-OE1 3.16Å; R173-L215 WeakPolarHBondContact CA-O 3.35Å; R173-L215 HydrophobicContact CG-CD2 4.16Å; R173-K216 HydrophobicContact CB-CG 4.38Å
174	G	95.3	Very high	94.8	Very high	30 Å²	30	42 Å²	42	31%	0.309	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	2.2	172.8	0	0	0	0	0	115.1	F172 K176 L215	F172-G174 PolarHBondContact O-N 2.82Å; F172-G174 VanDerWaalsContact O-N 3.15Å; G174-K176 VanDerWaalsContact C-N 3.25Å; G174-K176 PolarHBondContact O-N 2.96Å; G174-L215 PolarHBondContact N-O 2.94Å
175	Y	97.1	Very high	95	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.			trans	-78.5	75.8	172.4	-166.2	179.1	0	0	0	110.4	F145 A148 R149 L153 F172 R173 R177 L178	F145-Y175 AromaticContact CE2-CD1 3.77Å; F145-Y175 HydrophobicContact CE2-CD1 3.77Å; F145-Y175 HydrophobicContact CE2-CE1 4.01Å; F145-Y175 AromaticContact CZ-CD1 3.7Å; F145-Y175 HydrophobicContact CZ-CD1 3.7Å; F145-Y175 HydrophobicContact CZ-CE1 4.28Å; A148-Y175 PolarHBondContact O-OH 3.06Å; R149-Y175 VanDerWaalsContact CA-CZ 3.46Å; R149-Y175 HydrophobicContact CB-CD1 3.71Å; R149-Y175 HydrophobicContact CB-CE1 3.63Å; R149-Y175 HydrophobicContact CB-CE2 4.48Å; R149-Y175 HydrophobicContact CB-CG 4.16Å; R149-Y175 HydrophobicContact CG-CD1 3.82Å; R149-Y175 HydrophobicContact CG-CD2 4.21Å; R149-Y175 HydrophobicContact CG-CE1 4.22Å; R149-Y175 HydrophobicContact CG-CG 3.8Å; R149-Y175 PolarHBondContact N-OH 2.88Å; L153-Y175 WeakPolarHBondContact O-CE2 3.49Å; L153-Y175 VanDerWaalsContact O-CZ 3.27Å; L153-Y175 PolarHBondContact O-OH 3.23Å; F172-Y175 WeakPolarHBondContact O-CB 3.35Å; F172-Y175 PolarHBondContact O-N 2.8Å; F172-Y175 VanDerWaalsContact O-N 3.09Å; R173-Y175 VanDerWaalsContact C-N 3.3Å; R173-Y175 PolarHBondContact O-N 3.04Å; Y175-R177 HydrophobicContact CD2-CB 4.34Å; Y175-R177 HydrophobicContact CE2-CB 4.05Å; Y175-R177 PolarHBondContact O-N 3.29Å; Y175-L178 HydrophobicContact CD1-CB 3.99Å; Y175-L178 HydrophobicContact CD1-CD2 4.14Å; Y175-L178 HydrophobicContact CD2-CB 4.41Å; Y175-L178 HydrophobicContact CG-CB 3.9Å; Y175-L178 WeakPolarHBondContact O-CB 3.44Å; Y175-L178 PolarHBondContact O-N 3.25Å
176	K	95.5	Very high	95.1	Very high	119 Å²	119	46.2 Å²	46.2	52%	0.517	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.6	-172	-62.1	-177.7	-178	177.6	0	115.5	G174 N217 Y266	G174-K176 VanDerWaalsContact C-N 3.25Å; G174-K176 PolarHBondContact O-N 2.96Å; K176-N217 HydrophobicContact CG-CB 4.43Å; K176-Y266 PolarHBondContact O-OH 2.72Å
177	R	97.3	Very high	95.5	Very high	83 Å²	83	44.1 Å²	44.1	31%	0.313	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	8.5	174.4	-52.6	-171.4	165.2	-170.7	-7	113.5	Q152 P154 M155 Y175 Y266	Q152-R177 WeakPolarHBondContact O-CD 3.5Å; Q152-R177 PolarHBondContact O-NH1 3.16Å; P154-R177 WeakPolarHBondContact CA-O 3.23Å; M155-R177 PolarHBondContact N-O 2.59Å; Y175-R177 HydrophobicContact CD2-CB 4.34Å; Y175-R177 HydrophobicContact CE2-CB 4.05Å; Y175-R177 PolarHBondContact O-N 3.29Å; R177-Y266 WeakPolarHBondContact CA-OH 3.14Å; R177-Y266 HydrophobicContact CB-CE2 4.14Å; R177-Y266 HydrophobicContact CG-CE1 4.13Å; R177-Y266 HydrophobicContact CG-CE2 4.2Å; R177-Y266 WeakPolarHBondContact CG-OH 3.45Å
178	L	98.3	Very high	96	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.6	177.5	-178.7	62.1	0	0	0	110.8	F145 M155 I157 F172 Y175 L180 V218 T219	F145-L178 HydrophobicContact CE2-CD1 4.45Å; F145-L178 HydrophobicContact CE2-CD2 3.91Å; F145-L178 HydrophobicContact CZ-CD2 4.23Å; M155-L178 HydrophobicContact CB-CD1 3.97Å; M155-L178 HydrophobicContact CG-CD1 3.98Å; M155-L178 CarbonylContact O-C 3.55Å; M155-L178 WeakPolarHBondContact O-CA 3.35Å; M155-L178 HydrophobicContact SD-CD1 4.18Å; I157-L178 HydrophobicContact CD1-CD1 3.65Å; I157-L178 HydrophobicContact CD1-CD2 4.45Å; I157-L178 HydrophobicContact CG1-CD1 3.72Å; F172-L178 HydrophobicContact CB-CD2 4.06Å; F172-L178 HydrophobicContact CD1-CD2 3.55Å; F172-L178 HydrophobicContact CE1-CD2 4.26Å; F172-L178 HydrophobicContact CG-CD2 4.06Å; Y175-L178 HydrophobicContact CD1-CB 3.99Å; Y175-L178 HydrophobicContact CD1-CD2 4.14Å; Y175-L178 HydrophobicContact CD2-CB 4.41Å; Y175-L178 HydrophobicContact CG-CB 3.9Å; Y175-L178 WeakPolarHBondContact O-CB 3.44Å; Y175-L178 PolarHBondContact O-N 3.25Å; L178-L180 HydrophobicContact CD1-CD2 4.07Å; L178-L180 HydrophobicContact CD2-CD2 3.79Å; L178-L180 HydrophobicContact CD2-CG 4.38Å; L178-L180 HydrophobicContact CG-CD2 3.83Å; L178-L180 HydrophobicContact CG-CG 4.37Å; L178-V218 HydrophobicContact CB-CG1 4.18Å; L178-V218 HydrophobicContact CD2-CG1 4.04Å; L178-V218 HydrophobicContact CD2-CG2 4.49Å; L178-V218 HydrophobicContact CG-CG1 4.08Å; L178-T219 PolarHBondContact O-N 2.96Å; L178-T219 VanDerWaalsContact O-N 3.14Å
179	V	98.8	Very high	96.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.8	167.3	-169.4	0	0	0	0	109.7	M155 V156 I157 T181 T219 V221 M258 L262 T283 A287	M155-V179 PolarHBondContact O-N 2.86Å; V156-V179 CarbonylContact C-O 3.53Å; V156-V179 WeakPolarHBondContact CA-O 3.33Å; I157-V179 PolarHBondContact N-O 2.91Å; V179-T181 HydrophobicContact CG1-CG2 4.27Å; V179-T219 CarbonylContact C-O 3.53Å; V179-T219 WeakPolarHBondContact CA-O 3.37Å; V179-T219 HydrophobicContact CG1-CG2 4.17Å; V179-T219 HydrophobicContact CG2-CG2 4.43Å; V179-V221 HydrophobicContact CG1-CG2 3.53Å; V179-M258 HydrophobicContact CB-SD 3.89Å; V179-M258 HydrophobicContact CG1-CE 4.49Å; V179-M258 HydrophobicContact CG1-SD 3.49Å; V179-M258 WeakPolarHBondContact CG1-SD 3.14Å; V179-M258 HydrophobicContact CG2-SD 4.27Å; V179-L262 HydrophobicContact CG2-CD1 4.31Å; V179-L262 HydrophobicContact CG2-CD2 4.05Å; V179-T283 HydrophobicContact CG2-CG2 3.78Å; V179-A287 HydrophobicContact CG1-CB 4.45Å
180	L	98.8	Very high	96.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.2	171.4	-54.4	-176.4	0	0	0	108.9	I157 L162 F172 L178 P182 L190 L215 V218 T219 I220 V221	I157-L180 HydrophobicContact CB-CD2 3.81Å; I157-L180 HydrophobicContact CD1-CD2 4.14Å; I157-L180 HydrophobicContact CG1-CD2 4.32Å; L162-L180 HydrophobicContact CD2-CB 4.03Å; L162-L180 HydrophobicContact CD2-CD2 3.86Å; L162-L180 HydrophobicContact CD2-CG 4.36Å; F172-L180 HydrophobicContact CD1-CD2 4.33Å; F172-L180 HydrophobicContact CD2-CD1 3.68Å; F172-L180 HydrophobicContact CE1-CD2 4.08Å; F172-L180 HydrophobicContact CE2-CD1 3.82Å; F172-L180 HydrophobicContact CE2-CD2 4.33Å; F172-L180 HydrophobicContact CG-CD1 4.11Å; F172-L180 HydrophobicContact CZ-CD1 4.35Å; F172-L180 HydrophobicContact CZ-CD2 4.02Å; L178-L180 HydrophobicContact CD1-CD2 4.07Å; L178-L180 HydrophobicContact CD2-CD2 3.79Å; L178-L180 HydrophobicContact CD2-CG 4.38Å; L178-L180 HydrophobicContact CG-CD2 3.83Å; L178-L180 HydrophobicContact CG-CG 4.37Å; L180-P182 WeakPolarHBondContact O-CD 3.16Å; L180-L190 HydrophobicContact CD1-CD2 3.75Å; L180-L215 HydrophobicContact CD1-CD1 4.09Å; L180-V218 HydrophobicContact CD1-CG1 4.09Å; L180-V218 HydrophobicContact CG-CG1 3.92Å; L180-T219 PolarHBondContact N-O 2.9Å; L180-I220 HydrophobicContact CB-CD1 3.88Å; L180-I220 HydrophobicContact CD1-CD1 3.75Å; L180-I220 HydrophobicContact CG-CD1 4.07Å; L180-V221 PolarHBondContact O-N 3.07Å
181	T	98.4	Very high	96.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.198	C	C	.	.			trans	-118.1	49.2	-174.1	59.2	0	0	0	0	114.3	V156 I157 D158 V179 V221 K223 M258	V156-T181 HydrophobicContact CG1-CG2 3.75Å; I157-T181 PolarHBondContact O-N 3.43Å; I157-T181 PolarHBondContact O-OG1 3.31Å; D158-T181 WeakPolarHBondContact CA-OG1 3.28Å; D158-T181 WeakPolarHBondContact CB-OG1 3.24Å; D158-T181 PolarHBondContact OD1-OG1 3.26Å; V179-T181 HydrophobicContact CG1-CG2 4.27Å; T181-V221 CarbonylContact C-O 3.58Å; T181-V221 WeakPolarHBondContact CA-O 3.34Å; T181-V221 HydrophobicContact CG2-CB 4.12Å; T181-V221 HydrophobicContact CG2-CG2 4.42Å; T181-K223 WeakPolarHBondContact O-CD 3.09Å; T181-K223 WeakPolarHBondContact O-CE 3.4Å; T181-K223 PolarHBondContact O-NZ 2.91Å; T181-M258 HydrophobicContact CG2-CE 3.81Å; T181-M258 HydrophobicContact CG2-SD 4.01Å
182	P	97.7	Very high	96.6	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.207	C	C	.	.			trans	-65.1	139.9	-173.9	29.4	-36.5	0	0	0	112.8	L162 L180 E186 F187 I220 V221 R222 K223	L162-P182 HydrophobicContact CD1-CB 4.01Å; L180-P182 WeakPolarHBondContact O-CD 3.16Å; P182-E186 WeakPolarHBondContact CA-OE2 3.21Å; P182-E186 HydrophobicContact CB-CB 3.67Å; P182-F187 HydrophobicContact CB-CB 3.96Å; P182-F187 HydrophobicContact CG-CB 4.08Å; P182-F187 HydrophobicContact CG-CD2 4.14Å; P182-I220 HydrophobicContact CG-CG2 3.99Å; P182-V221 VanDerWaalsContact CD-O 3.31Å; P182-V221 WeakPolarHBondContact CD-O 3.14Å; P182-R222 WeakPolarHBondContact O-CA 3.46Å; P182-K223 PolarHBondContact O-N 3.38Å
183	N	95.2	Very high	96.6	Very high	56 Å²	56	45.5 Å²	45.5	30%	0.299	23%	0.228	S	C	.	.			trans	-72.9	-178.1	160.9	71	47.9	0	0	0	111.4	V185 E186 F187	N183-V185 VanDerWaalsContact C-N 3.31Å; N183-V185 PolarHBondContact O-N 3.12Å; N183-V185 WeakPolarHBondContact OD1-CA 3.46Å; N183-V185 WeakPolarHBondContact OD1-CB 3.39Å; N183-V185 PolarHBondContact OD1-N 2.72Å; N183-E186 VanDerWaalsContact CG-CD 3.48Å; N183-E186 VanDerWaalsContact CG-OE2 3.23Å; N183-E186 PolarHBondContact N-OE2 2.89Å; N183-E186 PolarHBondContact ND2-OE1 3.23Å; N183-E186 PolarHBondContact ND2-OE2 3.38Å; N183-E186 PolarHBondContact O-N 2.61Å; N183-E186 PolarHBondContact OD1-N 3.09Å; N183-F187 WeakPolarHBondContact O-CB 3.47Å; N183-F187 PolarHBondContact O-N 3.38Å
184	A	95	Very high	96.5	Very high	46 Å²	46	42.6 Å²	42.6	38%	0.38	22%	0.219	S	C	.	.	H	α-helix	trans	-55.6	-41.4	-178.8	0	0	0	0	0	114.3	K188	A184-K188 PolarHBondContact O-N 3.31Å
185	V	94.4	Very high	96.6	Very high	85 Å²	85	43.1 Å²	43.1	52%	0.515	22%	0.215	S	C	.	.	H	α-helix	trans	-75.8	-46.9	-177.5	177.8	0	0	0	0	110.4	N183 F187 K188 R189	N183-V185 VanDerWaalsContact C-N 3.31Å; N183-V185 PolarHBondContact O-N 3.12Å; N183-V185 WeakPolarHBondContact OD1-CA 3.46Å; N183-V185 WeakPolarHBondContact OD1-CB 3.39Å; N183-V185 PolarHBondContact OD1-N 2.72Å; V185-F187 VanDerWaalsContact C-N 3.28Å; V185-F187 PolarHBondContact O-N 3.02Å; V185-K188 PolarHBondContact O-N 2.99Å; V185-R189 WeakPolarHBondContact O-CG 3.36Å; V185-R189 PolarHBondContact O-N 3.35Å; V185-R189 VanDerWaalsContact O-N 3.11Å
186	E	95.7	Very high	96.5	Very high	44 Å²	44	46.4 Å²	46.4	21%	0.206	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-39.6	176.2	-71.2	158	-176.8	0	0	111.3	L162 P182 N183 R189 L190	L162-E186 HydrophobicContact CD1-CB 4.39Å; P182-E186 WeakPolarHBondContact CA-OE2 3.21Å; P182-E186 HydrophobicContact CB-CB 3.67Å; N183-E186 VanDerWaalsContact CG-CD 3.48Å; N183-E186 VanDerWaalsContact CG-OE2 3.23Å; N183-E186 PolarHBondContact N-OE2 2.89Å; N183-E186 PolarHBondContact ND2-OE1 3.23Å; N183-E186 PolarHBondContact ND2-OE2 3.38Å; N183-E186 PolarHBondContact O-N 2.61Å; N183-E186 PolarHBondContact OD1-N 3.09Å; E186-R189 PolarHBondContact O-N 2.93Å; E186-L190 WeakPolarHBondContact O-CB 3.49Å; E186-L190 PolarHBondContact O-N 2.98Å
187	F	96.7	Very high	96.5	Very high	6 Å²	6	47.8 Å²	47.8	3%	0.026	25%	0.25	C	S	.	.	H	α-helix	trans	-64	-47.1	179	175.6	-98.4	0	0	0	110.9	P182 N183 V185 R189 L190 Y191 P199 L204 A207 V208 L211 I220 R222	P182-F187 HydrophobicContact CB-CB 3.96Å; P182-F187 HydrophobicContact CG-CB 4.08Å; P182-F187 HydrophobicContact CG-CD2 4.14Å; N183-F187 WeakPolarHBondContact O-CB 3.47Å; N183-F187 PolarHBondContact O-N 3.38Å; V185-F187 VanDerWaalsContact C-N 3.28Å; V185-F187 PolarHBondContact O-N 3.02Å; F187-R189 VanDerWaalsContact C-N 3.32Å; F187-R189 PolarHBondContact O-N 3.41Å; F187-L190 PolarHBondContact O-N 3.24Å; F187-Y191 HydrophobicContact CE1-CD2 4.17Å; F187-Y191 AromaticContact CZ-CD2 3.81Å; F187-Y191 HydrophobicContact CZ-CD2 3.81Å; F187-Y191 WeakPolarHBondContact O-CB 3.48Å; F187-Y191 PolarHBondContact O-N 3.05Å; F187-P199 HydrophobicContact CE1-CB 4.12Å; F187-P199 HydrophobicContact CE1-CG 4.27Å; F187-L204 HydrophobicContact CE1-CD1 4.36Å; F187-A207 HydrophobicContact CE1-CB 4.29Å; F187-A207 HydrophobicContact CZ-CB 4.1Å; F187-V208 HydrophobicContact CD2-CG2 4.48Å; F187-V208 HydrophobicContact CE2-CB 4.32Å; F187-V208 HydrophobicContact CE2-CG2 3.71Å; F187-V208 HydrophobicContact CZ-CB 4.44Å; F187-V208 HydrophobicContact CZ-CG2 3.74Å; F187-L211 HydrophobicContact CD2-CD2 3.87Å; F187-L211 HydrophobicContact CE2-CB 4.32Å; F187-L211 HydrophobicContact CE2-CD2 3.57Å; F187-L211 HydrophobicContact CZ-CD2 4.44Å; F187-I220 HydrophobicContact CD2-CG2 4.24Å; F187-I220 HydrophobicContact CE2-CG2 4.26Å; F187-R222 HydrophobicContact CB-CG 3.96Å; F187-R222 HydrophobicContact CD1-CG 4.15Å; F187-R222 HydrophobicContact CD2-CB 4.27Å; F187-R222 HydrophobicContact CD2-CG 3.86Å; F187-R222 HydrophobicContact CE2-CG 4.43Å; F187-R222 HydrophobicContact CG-CG 3.7Å
188	K	96.2	Very high	96.4	Very high	107 Å²	107	46.3 Å²	46.3	47%	0.465	26%	0.256	S	S	.	.	H	α-helix	trans	-58.4	-45.8	177	-178.6	174.9	176	176.7	0	111.2	A184 V185 Y191 E192	A184-K188 PolarHBondContact O-N 3.31Å; V185-K188 PolarHBondContact O-N 2.99Å; K188-Y191 PolarHBondContact O-N 3.49Å; K188-E192 WeakPolarHBondContact CE-OE1 3.15Å; K188-E192 WeakPolarHBondContact CG-OE1 3.2Å; K188-E192 IonicContact NZ-OE1 3.01Å; K188-E192 WeakPolarHBondContact O-CB 3.37Å; K188-E192 WeakPolarHBondContact O-CG 3.47Å; K188-E192 PolarHBondContact O-N 3.47Å
189	R	95.5	Very high	96.2	Very high	159 Å²	159	47.8 Å²	47.8	60%	0.6	27%	0.265	S	S	*	.	H	α-helix	trans	-62	-48.6	177.9	-70.7	175.7	-179.6	178.8	-0.6	112.2	V185 E186 F187 Y191 E192 A193	V185-R189 WeakPolarHBondContact O-CG 3.36Å; V185-R189 PolarHBondContact O-N 3.35Å; V185-R189 VanDerWaalsContact O-N 3.11Å; E186-R189 PolarHBondContact O-N 2.93Å; F187-R189 VanDerWaalsContact C-N 3.32Å; F187-R189 PolarHBondContact O-N 3.41Å; R189-Y191 VanDerWaalsContact C-N 3.32Å; R189-Y191 PolarHBondContact O-N 3.37Å; R189-E192 PolarHBondContact O-N 2.87Å; R189-A193 VanDerWaalsContact O-CB 3.27Å; R189-A193 WeakPolarHBondContact O-CB 3.49Å; R189-A193 PolarHBondContact O-N 3.22Å
190	L	96.7	Very high	95.8	Very high	17 Å²	17	54.1 Å²	54.1	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-63.9	-40.2	179.2	-178.5	61.3	0	0	0	111.3	P169 F172 L180 E186 F187 A193 T194 L211	P169-L190 HydrophobicContact CB-CD1 3.69Å; F172-L190 HydrophobicContact CD2-CD1 4.42Å; F172-L190 HydrophobicContact CE2-CD1 4.15Å; L180-L190 HydrophobicContact CD1-CD2 3.75Å; E186-L190 WeakPolarHBondContact O-CB 3.49Å; E186-L190 PolarHBondContact O-N 2.98Å; F187-L190 PolarHBondContact O-N 3.24Å; L190-A193 PolarHBondContact O-N 3.26Å; L190-T194 VanDerWaalsContact O-CB 3.27Å; L190-T194 WeakPolarHBondContact O-CB 3.43Å; L190-T194 PolarHBondContact O-N 3.41Å; L190-T194 PolarHBondContact O-OG1 3.23Å; L190-L211 HydrophobicContact CD2-CD2 3.98Å; L190-L211 HydrophobicContact CG-CD1 4.47Å; L190-L211 HydrophobicContact CG-CD2 4.04Å
191	Y	97.2	Very high	95.3	Very high	1 Å²	1	63.2 Å²	63.2	0%	0.004	34%	0.337	C	S	.	.	H	α-helix	trans	-62.9	-49.1	177.2	-171.5	-74.6	0	0	0	111.4	F187 K188 R189 T194 I195 R197 P199 A207 Q210 L211	F187-Y191 HydrophobicContact CE1-CD2 4.17Å; F187-Y191 AromaticContact CZ-CD2 3.81Å; F187-Y191 HydrophobicContact CZ-CD2 3.81Å; F187-Y191 WeakPolarHBondContact O-CB 3.48Å; F187-Y191 PolarHBondContact O-N 3.05Å; K188-Y191 PolarHBondContact O-N 3.49Å; R189-Y191 VanDerWaalsContact C-N 3.32Å; R189-Y191 PolarHBondContact O-N 3.37Å; Y191-T194 PolarHBondContact O-N 2.7Å; Y191-I195 HydrophobicContact CD1-CB 4.43Å; Y191-I195 HydrophobicContact CD1-CD1 4.02Å; Y191-I195 HydrophobicContact CD2-CD1 3.7Å; Y191-I195 HydrophobicContact CE1-CB 4.2Å; Y191-I195 HydrophobicContact CE1-CD1 3.73Å; Y191-I195 HydrophobicContact CE1-CG2 4.32Å; Y191-I195 HydrophobicContact CE2-CD1 3.39Å; Y191-I195 HydrophobicContact CG-CD1 4Å; Y191-I195 VanDerWaalsContact CZ-CD1 3.41Å; Y191-I195 WeakPolarHBondContact O-CB 3.26Å; Y191-I195 PolarHBondContact O-N 2.84Å; Y191-R197 WeakPolarHBondContact CD1-O 3.45Å; Y191-R197 HydrophobicContact CE1-CG 4.48Å; Y191-R197 VanDerWaalsContact CE1-O 3.29Å; Y191-R197 WeakPolarHBondContact CE1-O 3.33Å; Y191-P199 HydrophobicContact CD1-CB 3.96Å; Y191-P199 HydrophobicContact CD1-CG 4.33Å; Y191-P199 HydrophobicContact CD2-CB 4.01Å; Y191-P199 VanDerWaalsContact CE1-CA 3.42Å; Y191-P199 HydrophobicContact CE1-CB 3.96Å; Y191-P199 HydrophobicContact CE2-CB 4Å; Y191-P199 HydrophobicContact CG-CB 4Å; Y191-P199 HydrophobicContact CG-CG 4.37Å; Y191-A207 HydrophobicContact CE2-CB 3.99Å; Y191-A207 WeakPolarHBondContact CE2-O 3.45Å; Y191-Q210 PolarHBondContact OH-OE1 3.45Å; Y191-L211 HydrophobicContact CD2-CB 4.04Å
192	E	95.9	Very high	94.9	Very high	72 Å²	72	67.6 Å²	67.6	34%	0.336	38%	0.382	S	S	.	.	H	α-helix	trans	-62.7	-43.5	176.9	-74.8	169.6	179.9	0	0	111.8	K188 R189 T194 G196	K188-E192 WeakPolarHBondContact CE-OE1 3.15Å; K188-E192 WeakPolarHBondContact CG-OE1 3.2Å; K188-E192 IonicContact NZ-OE1 3.01Å; K188-E192 WeakPolarHBondContact O-CB 3.37Å; K188-E192 WeakPolarHBondContact O-CG 3.47Å; K188-E192 PolarHBondContact O-N 3.47Å; R189-E192 PolarHBondContact O-N 2.87Å; E192-T194 VanDerWaalsContact C-N 3.28Å; E192-T194 PolarHBondContact O-N 3.35Å; E192-G196 VanDerWaalsContact O-CA 3.23Å; E192-G196 WeakPolarHBondContact O-CA 3.22Å; E192-G196 PolarHBondContact O-N 3.44Å
193	A	95.3	Very high	94.8	Very high	54 Å²	54	71.1 Å²	71.1	45%	0.446	40%	0.401	S	S	.	.	H	α-helix	trans	-65.6	-29.8	178.3	0	0	0	0	0	113.1	P169 R189 L190	P169-A193 HydrophobicContact CG-CB 4.04Å; R189-A193 VanDerWaalsContact O-CB 3.27Å; R189-A193 WeakPolarHBondContact O-CB 3.49Å; R189-A193 PolarHBondContact O-N 3.22Å; L190-A193 PolarHBondContact O-N 3.26Å
194	T	96.3	Very high	94.8	Very high	16 Å²	16	71.2 Å²	71.2	10%	0.098	40%	0.401	C	S	.	.	H	α-helix	trans	-90	-42	-177.6	-53.2	0	0	0	0	112.6	L190 Y191 E192 L211 E214 L215	L190-T194 VanDerWaalsContact O-CB 3.27Å; L190-T194 WeakPolarHBondContact O-CB 3.43Å; L190-T194 PolarHBondContact O-N 3.41Å; L190-T194 PolarHBondContact O-OG1 3.23Å; Y191-T194 PolarHBondContact O-N 2.7Å; E192-T194 VanDerWaalsContact C-N 3.28Å; E192-T194 PolarHBondContact O-N 3.35Å; T194-L211 HydrophobicContact CG2-CD1 3.92Å; T194-E214 HydrophobicContact CG2-CB 4.12Å; T194-E214 HydrophobicContact CG2-CG 3.64Å; T194-L215 HydrophobicContact CG2-CD2 3.59Å; T194-L215 HydrophobicContact CG2-CG 4.01Å
195	I	95.8	Very high	94.8	Very high	41 Å²	41	71.3 Å²	71.3	21%	0.21	40%	0.396	C	S	.	.	H	α-helix	trans	-105.4	-17.9	-169.9	-60.9	164	0	0	0	111.8	Y191 R197 Q210 L211 E214	Y191-I195 HydrophobicContact CD1-CB 4.43Å; Y191-I195 HydrophobicContact CD1-CD1 4.02Å; Y191-I195 HydrophobicContact CD2-CD1 3.7Å; Y191-I195 HydrophobicContact CE1-CB 4.2Å; Y191-I195 HydrophobicContact CE1-CD1 3.73Å; Y191-I195 HydrophobicContact CE1-CG2 4.32Å; Y191-I195 HydrophobicContact CE2-CD1 3.39Å; Y191-I195 HydrophobicContact CG-CD1 4Å; Y191-I195 VanDerWaalsContact CZ-CD1 3.41Å; Y191-I195 WeakPolarHBondContact O-CB 3.26Å; Y191-I195 PolarHBondContact O-N 2.84Å; I195-R197 HydrophobicContact CG2-CG 4.11Å; I195-Q210 HydrophobicContact CD1-CG 3.99Å; I195-L211 HydrophobicContact CD1-CD1 4.35Å; I195-E214 HydrophobicContact CG1-CB 4.19Å; I195-E214 HydrophobicContact CG1-CG 4.02Å
196	G	95.1	Very high	95	Very high	68 Å²	68	68.1 Å²	68.1	70%	0.701	38%	0.38	S	S	*	.	S	Bend	trans	81.6	11.1	178.4	0	0	0	0	0	115.1	E192	E192-G196 VanDerWaalsContact O-CA 3.23Å; E192-G196 WeakPolarHBondContact O-CA 3.22Å; E192-G196 PolarHBondContact O-N 3.44Å
197	R	95.8	Very high	95.1	Very high	149 Å²	149	66.2 Å²	66.2	56%	0.562	37%	0.371	S	S	*	.	S	Bend	trans	-149.8	165.2	174.3	66.9	-179	-176.1	170.2	6.9	111.2	Y191 I195	Y191-R197 WeakPolarHBondContact CD1-O 3.45Å; Y191-R197 HydrophobicContact CE1-CG 4.48Å; Y191-R197 VanDerWaalsContact CE1-O 3.29Å; Y191-R197 WeakPolarHBondContact CE1-O 3.33Å; I195-R197 HydrophobicContact CG2-CG 4.11Å
198	A	94.9	Very high	95.2	Very high	52 Å²	52	65.9 Å²	65.9	43%	0.43	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-67.8	151.7	174.5	0	0	0	0	0	112.2
199	P	95.1	Very high	95.3	Very high	30 Å²	30	63.9 Å²	63.9	20%	0.195	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-65.1	146	172.5	27.5	-33.7	0	0	0	111.2	F187 Y191 A207	F187-P199 HydrophobicContact CE1-CB 4.12Å; F187-P199 HydrophobicContact CE1-CG 4.27Å; Y191-P199 HydrophobicContact CD1-CB 3.96Å; Y191-P199 HydrophobicContact CD1-CG 4.33Å; Y191-P199 HydrophobicContact CD2-CB 4.01Å; Y191-P199 VanDerWaalsContact CE1-CA 3.42Å; Y191-P199 HydrophobicContact CE1-CB 3.96Å; Y191-P199 HydrophobicContact CE2-CB 4Å; Y191-P199 HydrophobicContact CG-CB 4Å; Y191-P199 HydrophobicContact CG-CG 4.37Å; P199-A207 HydrophobicContact CB-CB 3.92Å
200	E	90.9	Very high	95.4	Very high	134 Å²	134	59.2 Å²	59.2	63%	0.626	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-64.8	133.1	178.2	-170.6	177.3	-166.3	0	0	111.1
201	E	88.6	Confident	95.5	Very high	190 Å²	190	58.4 Å²	58.4	89%	0.888	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	141.7	178	-64	-172.9	173.4	0	0	111	N203	E201-N203 VanDerWaalsContact C-N 3.26Å; E201-N203 PolarHBondContact O-N 2.94Å
202	G	89.9	Confident	95.5	Very high	92 Å²	92	58.4 Å²	58.4	95%	0.948	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-15.7	178.2	0	0	0	0	0	116
203	N	94.1	Very high	95.7	Very high	74 Å²	74	59.1 Å²	59.1	40%	0.396	35%	0.347	S	S	.	.			trans	-116.6	60.9	178.7	-171.8	15.9	0	0	0	112.9	E201 D205 G206 A207	E201-N203 VanDerWaalsContact C-N 3.26Å; E201-N203 PolarHBondContact O-N 2.94Å; N203-D205 VanDerWaalsContact C-N 3.34Å; N203-D205 PolarHBondContact O-N 3.39Å; N203-G206 PolarHBondContact O-N 2.84Å; N203-G206 PolarHBondContact OD1-N 3.3Å; N203-G206 VanDerWaalsContact OD1-N 3.11Å; N203-A207 PolarHBondContact O-N 2.73Å
204	L	95.4	Very high	95.8	Very high	59 Å²	59	59.5 Å²	59.5	31%	0.309	34%	0.34	S	S	.	.	H	α-helix	trans	-59.5	-42.5	-177.6	-177.6	61.3	0	0	0	112.6	F187 G206 A207 V208 R222 V228	F187-L204 HydrophobicContact CE1-CD1 4.36Å; L204-G206 PolarHBondContact O-N 3.47Å; L204-A207 PolarHBondContact O-N 3.28Å; L204-V208 HydrophobicContact CD1-CG2 4.02Å; L204-V208 HydrophobicContact CG-CG2 4.29Å; L204-V208 VanDerWaalsContact O-CG2 3.27Å; L204-V208 WeakPolarHBondContact O-CG2 3.27Å; L204-V208 PolarHBondContact O-N 3.34Å; L204-R222 HydrophobicContact CD1-CG 4.18Å; L204-V228 HydrophobicContact CD2-CG2 3.72Å; L204-V228 HydrophobicContact CG-CG2 4.06Å
205	D	96.1	Very high	95.8	Very high	48 Å²	48	58.8 Å²	58.8	26%	0.257	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-44.9	179.6	-71.4	20.4	0	0	0	111.5	N203 V208 M209 V228 T235 Q237	N203-D205 VanDerWaalsContact C-N 3.34Å; N203-D205 PolarHBondContact O-N 3.39Å; D205-V208 PolarHBondContact O-N 2.89Å; D205-M209 WeakPolarHBondContact O-CB 3.25Å; D205-M209 PolarHBondContact O-N 3.22Å; D205-V228 WeakPolarHBondContact OD1-CG1 3.31Å; D205-T235 HydrophobicContact CB-CG2 4.15Å; D205-Q237 PolarHBondContact OD1-NE2 3.32Å; D205-Q237 PolarHBondContact OD2-NE2 3.27Å
206	G	97.5	Very high	95.9	Very high	18 Å²	18	62.1 Å²	62.1	19%	0.186	35%	0.348	C	S	.	.	H	α-helix	trans	-63.2	-42.4	174.9	0	0	0	0	0	112.5	N203 L204 M209 Q210	N203-G206 PolarHBondContact O-N 2.84Å; N203-G206 PolarHBondContact OD1-N 3.3Å; N203-G206 VanDerWaalsContact OD1-N 3.11Å; L204-G206 PolarHBondContact O-N 3.47Å; G206-M209 PolarHBondContact O-N 2.84Å; G206-Q210 VanDerWaalsContact O-CB 3.32Å; G206-Q210 WeakPolarHBondContact O-CB 3.34Å; G206-Q210 PolarHBondContact O-N 3.05Å
207	A	98.2	Very high	95.8	Very high	3 Å²	3	61.5 Å²	61.5	3%	0.025	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-42	178	0	0	0	0	0	112.6	F187 Y191 P199 N203 L204 Q210 L211	F187-A207 HydrophobicContact CE1-CB 4.29Å; F187-A207 HydrophobicContact CZ-CB 4.1Å; Y191-A207 HydrophobicContact CE2-CB 3.99Å; Y191-A207 WeakPolarHBondContact CE2-O 3.45Å; P199-A207 HydrophobicContact CB-CB 3.92Å; N203-A207 PolarHBondContact O-N 2.73Å; L204-A207 PolarHBondContact O-N 3.28Å; A207-Q210 PolarHBondContact O-N 2.66Å; A207-L211 PolarHBondContact O-N 2.87Å
208	V	98.5	Very high	95.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-41.7	177.9	177.4	0	0	0	0	110.6	F187 L204 D205 L211 A212 I220 R222 V228	F187-V208 HydrophobicContact CD2-CG2 4.48Å; F187-V208 HydrophobicContact CE2-CB 4.32Å; F187-V208 HydrophobicContact CE2-CG2 3.71Å; F187-V208 HydrophobicContact CZ-CB 4.44Å; F187-V208 HydrophobicContact CZ-CG2 3.74Å; L204-V208 HydrophobicContact CD1-CG2 4.02Å; L204-V208 HydrophobicContact CG-CG2 4.29Å; L204-V208 VanDerWaalsContact O-CG2 3.27Å; L204-V208 WeakPolarHBondContact O-CG2 3.27Å; L204-V208 PolarHBondContact O-N 3.34Å; D205-V208 PolarHBondContact O-N 2.89Å; V208-L211 PolarHBondContact O-N 3.46Å; V208-A212 PolarHBondContact O-N 3.38Å; V208-A212 VanDerWaalsContact O-N 3.13Å; V208-I220 HydrophobicContact CG1-CB 3.97Å; V208-I220 HydrophobicContact CG1-CG2 3.97Å; V208-R222 HydrophobicContact CG1-CB 4.49Å; V208-R222 HydrophobicContact CG2-CB 3.58Å; V208-R222 HydrophobicContact CG2-CG 4.05Å; V208-V228 HydrophobicContact CB-CG1 3.96Å; V208-V228 HydrophobicContact CG1-CG1 4.17Å; V208-V228 HydrophobicContact CG2-CB 4.22Å; V208-V228 HydrophobicContact CG2-CG1 3.93Å
209	M	98.1	Very high	96.1	Very high	64 Å²	64	51.9 Å²	51.9	32%	0.315	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-43.5	174.3	-171.5	179	77.4	0	0	112.2	D205 G206 L211 A212 Q213 S230	D205-M209 WeakPolarHBondContact O-CB 3.25Å; D205-M209 PolarHBondContact O-N 3.22Å; G206-M209 PolarHBondContact O-N 2.84Å; M209-L211 PolarHBondContact O-N 3.35Å; M209-A212 PolarHBondContact O-N 3.31Å; M209-Q213 WeakPolarHBondContact O-CG 3.28Å; M209-Q213 PolarHBondContact O-N 2.98Å; M209-S230 WeakPolarHBondContact CA-OG 3.36Å
210	Q	98.3	Very high	96.3	Very high	62 Å²	62	50.5 Å²	50.5	29%	0.29	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-44.5	178.7	-177.8	169.7	19.3	0	0	111.7	Y191 I195 G206 A207 A212 Q213 E214	Y191-Q210 PolarHBondContact OH-OE1 3.45Å; I195-Q210 HydrophobicContact CD1-CG 3.99Å; G206-Q210 VanDerWaalsContact O-CB 3.32Å; G206-Q210 WeakPolarHBondContact O-CB 3.34Å; G206-Q210 PolarHBondContact O-N 3.05Å; A207-Q210 PolarHBondContact O-N 2.66Å; Q210-A212 VanDerWaalsContact C-N 3.35Å; Q210-A212 PolarHBondContact O-N 2.99Å; Q210-Q213 PolarHBondContact O-N 2.68Å; Q210-E214 WeakPolarHBondContact O-CB 3.37Å; Q210-E214 PolarHBondContact O-N 3.37Å
211	L	98.4	Very high	96.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.8	-43.8	176.5	-178.4	57.8	0	0	0	111.8	F187 L190 Y191 T194 I195 A207 V208 M209 Q213 E214 L215 I220	F187-L211 HydrophobicContact CD2-CD2 3.87Å; F187-L211 HydrophobicContact CE2-CB 4.32Å; F187-L211 HydrophobicContact CE2-CD2 3.57Å; F187-L211 HydrophobicContact CZ-CD2 4.44Å; L190-L211 HydrophobicContact CD2-CD2 3.98Å; L190-L211 HydrophobicContact CG-CD1 4.47Å; L190-L211 HydrophobicContact CG-CD2 4.04Å; Y191-L211 HydrophobicContact CD2-CB 4.04Å; T194-L211 HydrophobicContact CG2-CD1 3.92Å; I195-L211 HydrophobicContact CD1-CD1 4.35Å; A207-L211 PolarHBondContact O-N 2.87Å; V208-L211 PolarHBondContact O-N 3.46Å; M209-L211 PolarHBondContact O-N 3.35Å; L211-Q213 VanDerWaalsContact C-N 3.34Å; L211-Q213 PolarHBondContact O-N 3.27Å; L211-E214 PolarHBondContact O-N 2.74Å; L211-L215 HydrophobicContact CD1-CD1 4.02Å; L211-L215 HydrophobicContact CD1-CG 4.22Å; L211-L215 HydrophobicContact CG-CD1 4.16Å; L211-L215 WeakPolarHBondContact O-CB 3.49Å; L211-L215 WeakPolarHBondContact O-CG 3.3Å; L211-L215 PolarHBondContact O-N 3.04Å; L211-I220 HydrophobicContact CD2-CD1 4.46Å; L211-I220 HydrophobicContact CD2-CG1 4.43Å; L211-I220 HydrophobicContact CD2-CG2 4.42Å; L211-I220 HydrophobicContact CG-CD1 4.47Å; L211-I220 HydrophobicContact CG-CG1 4.33Å
212	A	98.4	Very high	97.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61	-41.7	176.7	0	0	0	0	0	112.1	V208 M209 Q210 L215 K216 N217 V218 I220 G232	V208-A212 PolarHBondContact O-N 3.38Å; V208-A212 VanDerWaalsContact O-N 3.13Å; M209-A212 PolarHBondContact O-N 3.31Å; Q210-A212 VanDerWaalsContact C-N 3.35Å; Q210-A212 PolarHBondContact O-N 2.99Å; A212-L215 CarbonylContact O-C 3.34Å; A212-L215 PolarHBondContact O-N 3.35Å; A212-K216 PolarHBondContact O-N 2.75Å; A212-N217 WeakPolarHBondContact O-CA 3.33Å; A212-N217 PolarHBondContact O-N 3.46Å; A212-V218 VanDerWaalsContact CB-O 3.25Å; A212-V218 WeakPolarHBondContact CB-O 3.11Å; A212-I220 HydrophobicContact CB-CG1 3.95Å; A212-G232 VanDerWaalsContact CB-N 3.29Å
213	Q	98.1	Very high	97.3	Very high	88 Å²	88	35 Å²	35	41%	0.411	17%	0.172	S	C	.	.	H	α-helix	trans	-64.2	-43.4	175.4	-73.5	175.1	-18.1	0	0	112.4	M209 Q210 L211 L215 K216 G232	M209-Q213 WeakPolarHBondContact O-CG 3.28Å; M209-Q213 PolarHBondContact O-N 2.98Å; Q210-Q213 PolarHBondContact O-N 2.68Å; L211-Q213 VanDerWaalsContact C-N 3.34Å; L211-Q213 PolarHBondContact O-N 3.27Å; Q213-L215 VanDerWaalsContact C-N 3.3Å; Q213-L215 PolarHBondContact O-N 2.93Å; Q213-K216 WeakPolarHBondContact O-CA 3.42Å; Q213-K216 PolarHBondContact O-N 3.44Å; Q213-G232 WeakPolarHBondContact CG-O 3.38Å; Q213-G232 PolarHBondContact NE2-O 3.3Å
214	E	97.9	Very high	97.3	Very high	62 Å²	62	32.6 Å²	32.6	29%	0.29	17%	0.165	S	C	.	.	H	α-helix	trans	-66.2	-35.8	179.9	-169.3	52.8	-130.2	0	0	111.7	R173 T194 I195 Q210 L211 K216	R173-E214 IonicContact CZ-OE1 3.27Å; R173-E214 PolarHBondContact NE-O 2.65Å; R173-E214 IonicContact NH2-OE1 2.68Å; R173-E214 PolarHBondContact NH2-OE1 3.16Å; T194-E214 HydrophobicContact CG2-CB 4.12Å; T194-E214 HydrophobicContact CG2-CG 3.64Å; I195-E214 HydrophobicContact CG1-CB 4.19Å; I195-E214 HydrophobicContact CG1-CG 4.02Å; Q210-E214 WeakPolarHBondContact O-CB 3.37Å; Q210-E214 PolarHBondContact O-N 3.37Å; L211-E214 PolarHBondContact O-N 2.74Å; E214-K216 PolarHBondContact O-N 3.12Å; E214-K216 VanDerWaalsContact O-N 3.16Å
215	L	97.7	Very high	96.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	15	170.5	-63.6	177.2	0	0	0	113.4	F172 R173 G174 L180 T194 L211 A212 Q213 V218 I220	F172-L215 HydrophobicContact CB-CD2 4.3Å; R173-L215 WeakPolarHBondContact CA-O 3.35Å; R173-L215 HydrophobicContact CG-CD2 4.16Å; G174-L215 PolarHBondContact N-O 2.94Å; L180-L215 HydrophobicContact CD1-CD1 4.09Å; T194-L215 HydrophobicContact CG2-CD2 3.59Å; T194-L215 HydrophobicContact CG2-CG 4.01Å; L211-L215 HydrophobicContact CD1-CD1 4.02Å; L211-L215 HydrophobicContact CD1-CG 4.22Å; L211-L215 HydrophobicContact CG-CD1 4.16Å; L211-L215 WeakPolarHBondContact O-CB 3.49Å; L211-L215 WeakPolarHBondContact O-CG 3.3Å; L211-L215 PolarHBondContact O-N 3.04Å; A212-L215 CarbonylContact O-C 3.34Å; A212-L215 PolarHBondContact O-N 3.35Å; Q213-L215 VanDerWaalsContact C-N 3.3Å; Q213-L215 PolarHBondContact O-N 2.93Å; L215-V218 HydrophobicContact CB-CB 3.94Å; L215-V218 HydrophobicContact CB-CG2 4.1Å; L215-V218 WeakPolarHBondContact O-CG2 3.35Å; L215-I220 HydrophobicContact CD1-CD1 4.07Å
216	K	96.8	Very high	96.7	Very high	111 Å²	111	40.7 Å²	40.7	48%	0.483	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	52	177.8	-49.4	-57.1	-179.1	-160.4	0	113.2	R173 A212 Q213 E214	R173-K216 HydrophobicContact CB-CG 4.38Å; A212-K216 PolarHBondContact O-N 2.75Å; Q213-K216 WeakPolarHBondContact O-CA 3.42Å; Q213-K216 PolarHBondContact O-N 3.44Å; E214-K216 PolarHBondContact O-N 3.12Å; E214-K216 VanDerWaalsContact O-N 3.16Å
217	N	94.1	Very high	96.6	Very high	55 Å²	55	40.5 Å²	40.5	29%	0.294	19%	0.188	S	C	.	.	S	Bend	trans	69.6	39.4	175.2	-51.5	-15.2	0	0	0	113.9	K176 A212 D231	K176-N217 HydrophobicContact CG-CB 4.43Å; A212-N217 WeakPolarHBondContact O-CA 3.33Å; A212-N217 PolarHBondContact O-N 3.46Å; N217-D231 VanDerWaalsContact CA-O 3.3Å; N217-D231 WeakPolarHBondContact CA-O 3.47Å; N217-D231 VanDerWaalsContact CB-O 3.31Å; N217-D231 WeakPolarHBondContact CB-O 3.44Å
218	V	97.2	Very high	96.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.187	C	C	.	.			trans	-75.7	140	161.5	169.6	0	0	0	0	108.4	F172 L178 L180 A212 L215 I220	F172-V218 HydrophobicContact CB-CG2 4.41Å; F172-V218 WeakPolarHBondContact O-CG2 3.35Å; L178-V218 HydrophobicContact CB-CG1 4.18Å; L178-V218 HydrophobicContact CD2-CG1 4.04Å; L178-V218 HydrophobicContact CD2-CG2 4.49Å; L178-V218 HydrophobicContact CG-CG1 4.08Å; L180-V218 HydrophobicContact CD1-CG1 4.09Å; L180-V218 HydrophobicContact CG-CG1 3.92Å; A212-V218 VanDerWaalsContact CB-O 3.25Å; A212-V218 WeakPolarHBondContact CB-O 3.11Å; L215-V218 HydrophobicContact CB-CB 3.94Å; L215-V218 HydrophobicContact CB-CG2 4.1Å; L215-V218 WeakPolarHBondContact O-CG2 3.35Å; V218-I220 HydrophobicContact CG1-CD1 4.19Å
219	T	98.6	Very high	96.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.4	-180	-58.4	0	0	0	0	111.2	L178 V179 L180 I229 S230 T283	L178-T219 PolarHBondContact O-N 2.96Å; L178-T219 VanDerWaalsContact O-N 3.14Å; V179-T219 CarbonylContact C-O 3.53Å; V179-T219 WeakPolarHBondContact CA-O 3.37Å; V179-T219 HydrophobicContact CG1-CG2 4.17Å; V179-T219 HydrophobicContact CG2-CG2 4.43Å; L180-T219 PolarHBondContact N-O 2.9Å; T219-I229 HydrophobicContact CG2-CG2 4.16Å; T219-S230 CarbonylContact C-O 3.46Å; T219-S230 VanDerWaalsContact CA-O 3.32Å; T219-S230 WeakPolarHBondContact CA-O 3.45Å; T219-T283 WeakPolarHBondContact OG1-CB 3.34Å; T219-T283 PolarHBondContact OG1-OG1 3.4Å
220	I	98.8	Very high	96.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.3	179.4	-51.9	-58.7	0	0	0	109.2	L180 P182 F187 V208 L211 A212 L215 V218 I229 S230	L180-I220 HydrophobicContact CB-CD1 3.88Å; L180-I220 HydrophobicContact CD1-CD1 3.75Å; L180-I220 HydrophobicContact CG-CD1 4.07Å; P182-I220 HydrophobicContact CG-CG2 3.99Å; F187-I220 HydrophobicContact CD2-CG2 4.24Å; F187-I220 HydrophobicContact CE2-CG2 4.26Å; V208-I220 HydrophobicContact CG1-CB 3.97Å; V208-I220 HydrophobicContact CG1-CG2 3.97Å; L211-I220 HydrophobicContact CD2-CD1 4.46Å; L211-I220 HydrophobicContact CD2-CG1 4.43Å; L211-I220 HydrophobicContact CD2-CG2 4.42Å; L211-I220 HydrophobicContact CG-CD1 4.47Å; L211-I220 HydrophobicContact CG-CG1 4.33Å; A212-I220 HydrophobicContact CB-CG1 3.95Å; L215-I220 HydrophobicContact CD1-CD1 4.07Å; V218-I220 HydrophobicContact CG1-CD1 4.19Å; I220-I229 CarbonylContact O-C 3.53Å; I220-I229 VanDerWaalsContact O-CA 3.29Å; I220-I229 WeakPolarHBondContact O-CA 3.38Å; I220-S230 PolarHBondContact N-O 3.38Å; I220-S230 PolarHBondContact O-N 2.97Å
221	V	98.8	Very high	96.5	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	94.7	172	-179.3	0	0	0	0	108	V179 L180 T181 P182 K223 I229 M258 A287	V179-V221 HydrophobicContact CG1-CG2 3.53Å; L180-V221 PolarHBondContact O-N 3.07Å; T181-V221 CarbonylContact C-O 3.58Å; T181-V221 WeakPolarHBondContact CA-O 3.34Å; T181-V221 HydrophobicContact CG2-CB 4.12Å; T181-V221 HydrophobicContact CG2-CG2 4.42Å; P182-V221 VanDerWaalsContact CD-O 3.31Å; P182-V221 WeakPolarHBondContact CD-O 3.14Å; V221-K223 HydrophobicContact CG1-CG 4.36Å; V221-K223 PolarHBondContact O-N 2.89Å; V221-I229 HydrophobicContact CG1-CG1 4.3Å; V221-I229 HydrophobicContact CG2-CG1 4.35Å; V221-I229 HydrophobicContact CG2-CG2 4.1Å; V221-M258 HydrophobicContact CG2-CE 4.14Å; V221-A287 HydrophobicContact CG2-CB 3.48Å; V221-A287 VanDerWaalsContact CG2-CB 3.48Å
222	R	98	Very high	96.4	Very high	49 Å²	49	35.2 Å²	35.2	19%	0.185	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	101.8	174.4	-165.1	-68.7	-171.2	176.6	6.2	108.5	P182 F187 L204 V208 V228	P182-R222 WeakPolarHBondContact O-CA 3.46Å; F187-R222 HydrophobicContact CB-CG 3.96Å; F187-R222 HydrophobicContact CD1-CG 4.15Å; F187-R222 HydrophobicContact CD2-CB 4.27Å; F187-R222 HydrophobicContact CD2-CG 3.86Å; F187-R222 HydrophobicContact CE2-CG 4.43Å; F187-R222 HydrophobicContact CG-CG 3.7Å; L204-R222 HydrophobicContact CD1-CG 4.18Å; V208-R222 HydrophobicContact CG1-CB 4.49Å; V208-R222 HydrophobicContact CG2-CB 3.58Å; V208-R222 HydrophobicContact CG2-CG 4.05Å; R222-V228 HydrophobicContact CB-CB 4.49Å; R222-V228 PolarHBondContact N-O 3.4Å; R222-V228 PolarHBondContact O-N 2.9Å; R222-V228 VanDerWaalsContact O-N 3.08Å
223	K	95.4	Very high	96.2	Very high	41 Å²	41	40.2 Å²	40.2	18%	0.178	19%	0.193	C	C	.	.			trans	-67.3	139.8	-179.5	-58.2	-176.5	-59.6	-147.8	0	111.7	D158 T181 P182 V221 D227 L254	D158-K223 IonicContact OD1-NZ 3.86Å; D158-K223 PolarHBondContact OD1-NZ 3.34Å; D158-K223 IonicContact OD2-NZ 2.66Å; D158-K223 PolarHBondContact OD2-NZ 2.99Å; T181-K223 WeakPolarHBondContact O-CD 3.09Å; T181-K223 WeakPolarHBondContact O-CE 3.4Å; T181-K223 PolarHBondContact O-NZ 2.91Å; P182-K223 PolarHBondContact O-N 3.38Å; V221-K223 HydrophobicContact CG1-CG 4.36Å; V221-K223 PolarHBondContact O-N 2.89Å; K223-D227 VanDerWaalsContact CA-OD1 3.26Å; K223-D227 WeakPolarHBondContact CA-OD1 3.34Å; K223-L254 HydrophobicContact CD-CD2 3.71Å; K223-L254 HydrophobicContact CG-CD2 4.24Å
224	G	92.4	Very high	96	Very high	24 Å²	24	37.8 Å²	37.8	25%	0.247	19%	0.186	C	C	.	.	S	Bend	trans	-174.4	-161.4	-176.5	0	0	0	0	0	115.9	R226 D227	G224-R226 VanDerWaalsContact C-N 3.31Å; G224-D227 PolarHBondContact N-OD1 3.1Å
225	F	88.7	Confident	95.9	Very high	165 Å²	165	36.7 Å²	36.7	72%	0.724	18%	0.184	S	C	*	.	S	Bend	trans	-61.4	-45.6	170.5	176.6	-102.8	0	0	0	110.5	R295	F225-R295 PolarHBondContact O-NH1 2.88Å; F225-R295 PolarHBondContact O-NH2 2.84Å
226	R	90.9	Very high	95.8	Very high	113 Å²	113	36.8 Å²	36.8	43%	0.426	18%	0.184	S	C	.	.	S	Bend	trans	-110.4	139.3	157.8	-63.9	177.5	-175.5	171.6	2.7	107.2	G224 D239	G224-R226 VanDerWaalsContact C-N 3.31Å; R226-D239 HydrophobicContact CG-CB 4.4Å
227	D	95.9	Very high	95.8	Very high	13 Å²	13	32.7 Å²	32.7	7%	0.07	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	127.9	175.1	-54.2	-55.3	0	0	0	107.8	K223 G224 Q237 C238 C291 R295	K223-D227 VanDerWaalsContact CA-OD1 3.26Å; K223-D227 WeakPolarHBondContact CA-OD1 3.34Å; G224-D227 PolarHBondContact N-OD1 3.1Å; D227-Q237 WeakPolarHBondContact O-CA 3.33Å; D227-C238 HydrophobicContact CB-CB 4.23Å; D227-C238 PolarHBondContact N-O 2.97Å; D227-C238 PolarHBondContact O-N 3.34Å; D227-C291 HydrophobicContact CB-CB 4.4Å; D227-R295 WeakPolarHBondContact OD2-CD 3.27Å; D227-R295 IonicContact OD2-CZ 2.75Å; D227-R295 IonicContact OD2-NE 3.82Å; D227-R295 IonicContact OD2-NH1 3.76Å; D227-R295 PolarHBondContact OD2-NH1 2.94Å
228	V	97.9	Very high	95.8	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.012	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	124.7	179.1	-178.4	0	0	0	0	107.9	L204 D205 V208 R222 T235 Q237	L204-V228 HydrophobicContact CD2-CG2 3.72Å; L204-V228 HydrophobicContact CG-CG2 4.06Å; D205-V228 WeakPolarHBondContact OD1-CG1 3.31Å; V208-V228 HydrophobicContact CB-CG1 3.96Å; V208-V228 HydrophobicContact CG1-CG1 4.17Å; V208-V228 HydrophobicContact CG2-CB 4.22Å; V208-V228 HydrophobicContact CG2-CG1 3.93Å; R222-V228 HydrophobicContact CB-CB 4.49Å; R222-V228 PolarHBondContact N-O 3.4Å; R222-V228 PolarHBondContact O-N 2.9Å; R222-V228 VanDerWaalsContact O-N 3.08Å; V228-T235 HydrophobicContact CG1-CG2 3.89Å; V228-Q237 HydrophobicContact CG2-CG 4.4Å
229	I	98.5	Very high	95.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.2	-171	-51.2	172.5	0	0	0	107.8	T219 I220 V221 T235 L236 L284 A287 F288 C291	T219-I229 HydrophobicContact CG2-CG2 4.16Å; I220-I229 CarbonylContact O-C 3.53Å; I220-I229 VanDerWaalsContact O-CA 3.29Å; I220-I229 WeakPolarHBondContact O-CA 3.38Å; V221-I229 HydrophobicContact CG1-CG1 4.3Å; V221-I229 HydrophobicContact CG2-CG1 4.35Å; V221-I229 HydrophobicContact CG2-CG2 4.1Å; I229-T235 CarbonylContact O-C 3.56Å; I229-T235 VanDerWaalsContact O-CA 3.27Å; I229-T235 WeakPolarHBondContact O-CA 3.43Å; I229-L236 PolarHBondContact N-O 3.33Å; I229-L236 PolarHBondContact O-N 2.87Å; I229-L284 HydrophobicContact CB-CD1 4.45Å; I229-L284 HydrophobicContact CG2-CD1 3.71Å; I229-L284 HydrophobicContact CG2-CG 4.31Å; I229-A287 HydrophobicContact CD1-CB 4.1Å; I229-A287 HydrophobicContact CG2-CB 3.62Å; I229-F288 VanDerWaalsContact CD1-CA 3.5Å; I229-F288 HydrophobicContact CD1-CB 4.05Å; I229-F288 HydrophobicContact CD1-CD2 4.43Å; I229-C291 HydrophobicContact CD1-CB 4.39Å
230	S	98.2	Very high	94.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	142.4	174.4	-167.4	0	0	0	0	112.2	M209 T219 I220 G232 S234 T235	M209-S230 WeakPolarHBondContact CA-OG 3.36Å; T219-S230 CarbonylContact C-O 3.46Å; T219-S230 VanDerWaalsContact CA-O 3.32Å; T219-S230 WeakPolarHBondContact CA-O 3.45Å; I220-S230 PolarHBondContact N-O 3.38Å; I220-S230 PolarHBondContact O-N 2.97Å; S230-G232 PolarHBondContact OG-N 3.46Å; S230-S234 WeakPolarHBondContact CA-O 3.07Å; S230-S234 PolarHBondContact OG-O 2.83Å; S230-S234 VanDerWaalsContact OG-O 3.07Å; S230-T235 WeakPolarHBondContact CB-OG1 3.32Å; S230-T235 PolarHBondContact OG-OG1 2.99Å
231	D	96.8	Very high	94.4	Very high	13 Å²	13	35.2 Å²	35.2	7%	0.07	18%	0.184	C	C	.	.			trans	-104.2	11	170.2	64.9	5.3	0	0	0	112.5	N217 V233 S234 S281 L284	N217-D231 VanDerWaalsContact CA-O 3.3Å; N217-D231 WeakPolarHBondContact CA-O 3.47Å; N217-D231 VanDerWaalsContact CB-O 3.31Å; N217-D231 WeakPolarHBondContact CB-O 3.44Å; D231-V233 VanDerWaalsContact C-N 3.25Å; D231-V233 PolarHBondContact O-N 3.29Å; D231-V233 PolarHBondContact OD1-N 2.93Å; D231-S234 PolarHBondContact N-O 3.06Å; D231-S234 PolarHBondContact OD1-N 2.84Å; D231-S281 VanDerWaalsContact OD2-CB 3.23Å; D231-S281 WeakPolarHBondContact OD2-CB 3.01Å; D231-S281 PolarHBondContact OD2-OG 2.83Å; D231-L284 HydrophobicContact CB-CD1 4.12Å
232	G	95.7	Very high	94	Very high	3 Å²	3	37.5 Å²	37.5	3%	0.031	20%	0.196	C	C	.	.	S	Bend	trans	84	-7.4	-178	0	0	0	0	0	114.2	A212 Q213 S230	A212-G232 VanDerWaalsContact CB-N 3.29Å; Q213-G232 WeakPolarHBondContact CG-O 3.38Å; Q213-G232 PolarHBondContact NE2-O 3.3Å; S230-G232 PolarHBondContact OG-N 3.46Å
233	V	93.8	Very high	93.7	Very high	106 Å²	106	35.5 Å²	35.5	64%	0.642	19%	0.19	S	C	*	.	S	Bend	trans	-114.4	-45.7	174.9	-178.8	0	0	0	0	110.4	D231	D231-V233 VanDerWaalsContact C-N 3.25Å; D231-V233 PolarHBondContact O-N 3.29Å; D231-V233 PolarHBondContact OD1-N 2.93Å
234	S	94.4	Very high	93.5	Very high	36 Å²	36	37.9 Å²	37.9	25%	0.252	21%	0.21	S	C	.	.			trans	-122.4	147.6	178.8	-72.5	0	0	0	0	110.7	S230 D231	S230-S234 WeakPolarHBondContact CA-O 3.07Å; S230-S234 PolarHBondContact OG-O 2.83Å; S230-S234 VanDerWaalsContact OG-O 3.07Å; D231-S234 PolarHBondContact N-O 3.06Å; D231-S234 PolarHBondContact OD1-N 2.84Å
235	T	95.7	Very high	93.5	Very high	40 Å²	40	40.2 Å²	40.2	25%	0.245	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.8	174.7	-59.8	0	0	0	0	110.1	D205 V228 I229 S230	D205-T235 HydrophobicContact CB-CG2 4.15Å; V228-T235 HydrophobicContact CG1-CG2 3.89Å; I229-T235 CarbonylContact O-C 3.56Å; I229-T235 VanDerWaalsContact O-CA 3.27Å; I229-T235 WeakPolarHBondContact O-CA 3.43Å; S230-T235 WeakPolarHBondContact CB-OG1 3.32Å; S230-T235 PolarHBondContact OG-OG1 2.99Å
236	L	96.1	Very high	93.5	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	144.5	175.6	-68.7	177.4	0	0	0	110	A30 I229 Y280 L284 F288	A30-L236 HydrophobicContact CB-CD1 3.61Å; A30-L236 HydrophobicContact CB-CD2 4.34Å; I229-L236 PolarHBondContact N-O 3.33Å; I229-L236 PolarHBondContact O-N 2.87Å; L236-Y280 HydrophobicContact CD1-CD1 4.36Å; L236-Y280 HydrophobicContact CD1-CE1 4.37Å; L236-Y280 HydrophobicContact CD1-CG 4.46Å; L236-Y280 HydrophobicContact CD2-CE1 3.92Å; L236-Y280 HydrophobicContact CD2-CE2 4.42Å; L236-Y280 HydrophobicContact CG-CE1 4.24Å; L236-L284 HydrophobicContact CD1-CD2 3.68Å; L236-L284 HydrophobicContact CD1-CG 3.98Å; L236-L284 HydrophobicContact CG-CD2 3.89Å; L236-L284 HydrophobicContact CG-CG 4.37Å; L236-F288 HydrophobicContact CB-CD2 4.26Å; L236-F288 HydrophobicContact CD1-CB 4.15Å; L236-F288 HydrophobicContact CD1-CD2 4.2Å; L236-F288 HydrophobicContact CD1-CG 4.16Å
237	Q	95.7	Very high	93.4	Very high	26 Å²	26	34.1 Å²	34.1	12%	0.121	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.9	167.9	-65.8	-170.1	-17.6	0	0	108.8	S27 D205 D227 V228	S27-Q237 PolarHBondContact OG-O 3.08Å; D205-Q237 PolarHBondContact OD1-NE2 3.32Å; D205-Q237 PolarHBondContact OD2-NE2 3.27Å; D227-Q237 WeakPolarHBondContact O-CA 3.33Å; V228-Q237 HydrophobicContact CG2-CG 4.4Å
238	C	94.2	Very high	93.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	106.2	168.1	-172.5	0	0	0	0	108.9	D227 F288 C291 S292 R295	D227-C238 HydrophobicContact CB-CB 4.23Å; D227-C238 PolarHBondContact N-O 2.97Å; D227-C238 PolarHBondContact O-N 3.34Å; C238-F288 HydrophobicContact CB-CD2 4.27Å; C238-F288 HydrophobicContact CB-CE2 4.3Å; C238-C291 HydrophobicContact CB-CB 3.85Å; C238-S292 PolarHBondContact SG-N 3.23Å; C238-S292 PolarHBondContact SG-OG 3.02Å; C238-S292 VanDerWaalsContact SG-OG 3.37Å; C238-R295 VanDerWaalsContact SG-CD 3.58Å
239	D	86.4	Confident	92.9	Very high	37 Å²	37	37.4 Å²	37.4	20%	0.198	22%	0.223	C	C	.	.			trans	-112.8	13.8	-178.4	60.8	-9.4	0	0	0	113.2	R226	R226-D239 HydrophobicContact CG-CB 4.4Å
240	V	90.3	Very high	92.7	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	23%	0.229	C	C	.	.			trans	-47.1	132.7	170.6	178.3	0	0	0	0	109.3	F19 N242 R295 E296	F19-V240 HydrophobicContact CE1-CG1 4.41Å; F19-V240 HydrophobicContact CE1-CG2 3.87Å; F19-V240 HydrophobicContact CZ-CG1 3.91Å; F19-V240 HydrophobicContact CZ-CG2 4.16Å; V240-N242 PolarHBondContact O-N 3.29Å; V240-R295 HydrophobicContact CB-CB 4.28Å; V240-R295 HydrophobicContact CG1-CB 4.26Å; V240-R295 VanDerWaalsContact O-CZ 3.28Å; V240-R295 PolarHBondContact O-NE 3.17Å; V240-R295 PolarHBondContact O-NH2 3.13Å; V240-E296 HydrophobicContact CG1-CB 4.33Å
241	P	88.4	Confident	92.6	Very high	69 Å²	69	39.8 Å²	39.8	45%	0.448	24%	0.239	S	C	.	.			trans	-54.4	136.6	178.6	-26.6	35.2	0	0	0	111.4
242	N	90.8	Very high	92.7	Very high	48 Å²	48	40 Å²	40	26%	0.257	24%	0.241	S	C	.	.			trans	-124.1	-176.8	-177.3	-167.1	4.4	0	0	0	108.9	V240 R295 N298	V240-N242 PolarHBondContact O-N 3.29Å; N242-R295 HydrophobicContact CB-CB 4.16Å; N242-R295 HydrophobicContact CB-CG 4.28Å; N242-N298 WeakPolarHBondContact OD1-CB 3.34Å; N242-N298 PolarHBondContact OD1-ND2 3.49Å
243	S	91.5	Very high	92.8	Very high	8 Å²	8	39.9 Å²	39.9	6%	0.056	24%	0.239	C	C	.	.			trans	-104.8	159.9	173.4	92.8	0	0	0	0	112.6	R245 R246 N298 Y302	S243-R245 PolarHBondContact O-N 2.64Å; S243-R245 WeakPolarHBondContact OG-CB 3.48Å; S243-R245 PolarHBondContact OG-N 2.87Å; S243-R246 PolarHBondContact O-NH1 3.29Å; S243-N298 PolarHBondContact OG-ND2 3.35Å; S243-N298 PolarHBondContact OG-OD1 3.17Å; S243-Y302 VanDerWaalsContact CB-CG 3.49Å
244	P	91	Very high	93.1	Very high	91 Å²	91	35.3 Å²	35.3	59%	0.591	21%	0.211	S	C	*	.	S	Bend	trans	-74.4	-7.8	169.6	32.2	-35.3	0	0	0	112.7	Y302	P244-Y302 HydrophobicContact CG-CE1 3.91Å; P244-Y302 HydrophobicContact CG-CE2 3.92Å; P244-Y302 VanDerWaalsContact CG-CZ 3.5Å; P244-Y302 WeakPolarHBondContact CG-OH 3.35Å
245	R	92.1	Very high	93.3	Very high	72 Å²	72	33.6 Å²	33.6	27%	0.272	20%	0.199	S	C	.	.			trans	-72.4	134.1	-179	-175.3	74.2	178.4	85.6	5.4	111.1	S243 Q250 Y302 R307 T309	S243-R245 PolarHBondContact O-N 2.64Å; S243-R245 WeakPolarHBondContact OG-CB 3.48Å; S243-R245 PolarHBondContact OG-N 2.87Å; R245-Q250 PolarHBondContact O-NE2 3.09Å; R245-Y302 HydrophobicContact CB-CD2 3.81Å; R245-Y302 HydrophobicContact CB-CE2 4.2Å; R245-R307 PolarHBondContact NE-O 3.06Å; R245-R307 VanDerWaalsContact NE-O 3.14Å; R245-T309 HydrophobicContact CG-CG2 4.44Å; R245-T309 PolarHBondContact NE-O 3.29Å; R245-T309 PolarHBondContact NH2-O 2.8Å
246	R	89	Confident	93.4	Very high	134 Å²	134	31.7 Å²	31.7	51%	0.506	19%	0.188	S	C	.	.			trans	-122.2	82.1	171.8	-61.4	-65.4	176.4	-89.4	-1.1	110.5	S243	S243-R246 PolarHBondContact O-NH1 3.29Å
247	C	88.6	Confident	93.6	Very high	16 Å²	16	31.7 Å²	31.7	11%	0.108	19%	0.187	C	C	.	.			trans	-90.4	152.3	172.2	57.7	0	0	0	0	110.4	Q250 T311	C247-Q250 VanDerWaalsContact N-NE2 3.1Å; C247-Q250 WeakPolarHBondContact O-CG 3.32Å; C247-Q250 PolarHBondContact SG-NE2 3.34Å; C247-T311 PolarHBondContact SG-OG1 2.8Å
248	G	90.1	Very high	93.7	Very high	72 Å²	72	30.4 Å²	30.4	74%	0.742	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	137.7	171.2	0	0	0	0	0	110.5	T311	G248-T311 PolarHBondContact O-OG1 3.3Å
249	G	93.2	Very high	93.9	Very high	12 Å²	12	30.4 Å²	30.4	12%	0.124	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.5	-8.7	-179.2	0	0	0	0	0	116.2	G251 D252 L253 T311	G249-G251 VanDerWaalsContact C-N 3.34Å; G249-G251 PolarHBondContact O-N 2.84Å; G249-D252 WeakPolarHBondContact CA-OD2 3.34Å; G249-D252 WeakPolarHBondContact O-CB 3.22Å; G249-D252 PolarHBondContact O-N 3.49Å; G249-D252 VanDerWaalsContact O-N 3.16Å; G249-L253 PolarHBondContact O-N 3.33Å; G249-T311 WeakPolarHBondContact CA-OG1 3.18Å; G249-T311 WeakPolarHBondContact O-CG2 3.4Å
250	Q	95.5	Very high	94.5	Very high	29 Å²	29	28.7 Å²	28.7	14%	0.136	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-37.8	178.9	-63.2	-175.7	11.6	0	0	112.7	R245 C247 D252 L253 L254 M314	R245-Q250 PolarHBondContact O-NE2 3.09Å; C247-Q250 VanDerWaalsContact N-NE2 3.1Å; C247-Q250 WeakPolarHBondContact O-CG 3.32Å; C247-Q250 PolarHBondContact SG-NE2 3.34Å; Q250-D252 VanDerWaalsContact C-N 3.32Å; Q250-L253 PolarHBondContact O-N 3.05Å; Q250-L254 PolarHBondContact O-N 3.36Å; Q250-L254 VanDerWaalsContact O-N 3.12Å; Q250-M314 HydrophobicContact CB-CE 4.27Å; Q250-M314 HydrophobicContact CG-CE 3.76Å; Q250-M314 HydrophobicContact CG-SD 3.66Å
251	G	96.2	Very high	94.9	Very high	21 Å²	21	28.7 Å²	28.7	22%	0.216	17%	0.172	C	C	.	.	H	α-helix	trans	-66.4	-35.2	173.5	0	0	0	0	0	112.3	G249 L254 T255	G249-G251 VanDerWaalsContact C-N 3.34Å; G249-G251 PolarHBondContact O-N 2.84Å; G251-L254 WeakPolarHBondContact O-CB 3.5Å; G251-L254 PolarHBondContact O-N 3.17Å; G251-T255 WeakPolarHBondContact O-CG2 3.33Å; G251-T255 PolarHBondContact O-N 2.82Å; G251-T255 PolarHBondContact O-OG1 3.39Å
252	D	98.4	Very high	95.4	Very high	19 Å²	19	25.4 Å²	25.4	10%	0.102	15%	0.151	C	C	.	.	H	α-helix	trans	-66	-44.2	177	-55.3	-44.1	0	0	0	110.7	A65 F68 S69 G249 Q250 L254 T255 G256	A65-D252 WeakPolarHBondContact CA-OD2 3.42Å; A65-D252 WeakPolarHBondContact CB-OD2 3.35Å; F68-D252 HydrophobicContact CB-CB 3.59Å; S69-D252 WeakPolarHBondContact CA-O 3.43Å; S69-D252 WeakPolarHBondContact CB-O 3.45Å; S69-D252 PolarHBondContact OG-O 3.21Å; G249-D252 WeakPolarHBondContact CA-OD2 3.34Å; G249-D252 WeakPolarHBondContact O-CB 3.22Å; G249-D252 PolarHBondContact O-N 3.49Å; G249-D252 VanDerWaalsContact O-N 3.16Å; Q250-D252 VanDerWaalsContact C-N 3.32Å; D252-L254 VanDerWaalsContact C-N 3.33Å; D252-L254 PolarHBondContact O-N 3.44Å; D252-T255 PolarHBondContact O-N 3.03Å; D252-T255 PolarHBondContact O-OG1 2.88Å; D252-G256 PolarHBondContact O-N 3.2Å
253	L	98.5	Very high	95.7	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56.3	-48.7	172.2	-168.9	169.2	0	0	0	111.2	S72 G249 Q250 T255 G256 A257 T294 C297 M314 I315 I318	S72-L253 WeakPolarHBondContact OG-CA 3.38Å; G249-L253 PolarHBondContact O-N 3.33Å; Q250-L253 PolarHBondContact O-N 3.05Å; L253-T255 PolarHBondContact O-N 2.93Å; L253-G256 PolarHBondContact O-N 3.24Å; L253-A257 WeakPolarHBondContact O-CB 3.36Å; L253-A257 PolarHBondContact O-N 2.96Å; L253-T294 HydrophobicContact CD2-CG2 4.11Å; L253-T294 WeakPolarHBondContact CD2-OG1 3.33Å; L253-C297 HydrophobicContact CD1-CB 4.35Å; L253-M314 HydrophobicContact CD1-CB 3.8Å; L253-M314 HydrophobicContact CD1-CE 3.99Å; L253-I315 HydrophobicContact CD1-CG1 3.97Å; L253-I315 HydrophobicContact CG-CG1 4.34Å; L253-I318 HydrophobicContact CD1-CD1 4.49Å; L253-I318 HydrophobicContact CG-CD1 4.37Å
254	L	98.7	Very high	95.9	Very high	10 Å²	10	24.1 Å²	24.1	5%	0.052	14%	0.142	C	C	.	.	H	α-helix	trans	-55.8	-49.5	178.6	173.1	63.9	0	0	0	112.1	K223 Q250 G251 D252 M258 A290 T294	K223-L254 HydrophobicContact CD-CD2 3.71Å; K223-L254 HydrophobicContact CG-CD2 4.24Å; Q250-L254 PolarHBondContact O-N 3.36Å; Q250-L254 VanDerWaalsContact O-N 3.12Å; G251-L254 WeakPolarHBondContact O-CB 3.5Å; G251-L254 PolarHBondContact O-N 3.17Å; D252-L254 VanDerWaalsContact C-N 3.33Å; D252-L254 PolarHBondContact O-N 3.44Å; L254-M258 HydrophobicContact CD1-CE 3.73Å; L254-M258 HydrophobicContact CD2-CE 4.35Å; L254-M258 HydrophobicContact CG-CE 3.89Å; L254-M258 WeakPolarHBondContact O-CB 3.45Å; L254-M258 PolarHBondContact O-N 2.68Å; L254-A290 VanDerWaalsContact CD1-C 3.48Å; L254-A290 HydrophobicContact CD1-CB 3.79Å; L254-T294 WeakPolarHBondContact CA-OG1 3.24Å; L254-T294 HydrophobicContact CB-CG2 4.24Å
255	T	98.8	Very high	96.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67.1	-40	-176.8	54.9	0	0	0	0	112.2	S69 V126 V156 D158 G251 D252 L253 M258 A259	S69-T255 PolarHBondContact OG-OG1 3.26Å; V126-T255 HydrophobicContact CG1-CG2 4.18Å; V126-T255 WeakPolarHBondContact CG2-O 3.28Å; V156-T255 HydrophobicContact CG1-CG2 3.94Å; D158-T255 HydrophobicContact CB-CG2 3.43Å; D158-T255 VanDerWaalsContact CB-CG2 3.43Å; D158-T255 WeakPolarHBondContact OD2-CG2 3.48Å; G251-T255 WeakPolarHBondContact O-CG2 3.33Å; G251-T255 PolarHBondContact O-N 2.82Å; G251-T255 PolarHBondContact O-OG1 3.39Å; D252-T255 PolarHBondContact O-N 3.03Å; D252-T255 PolarHBondContact O-OG1 2.88Å; L253-T255 PolarHBondContact O-N 2.93Å; T255-M258 PolarHBondContact O-N 3.27Å; T255-A259 WeakPolarHBondContact O-CB 3.42Å; T255-A259 PolarHBondContact O-N 3.11Å
256	G	98.8	Very high	96.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.2	-53.1	175.2	0	0	0	0	0	112.3	S69 A73 D252 L253 M258 A259 T260	S69-G256 WeakPolarHBondContact O-CA 3.46Å; S69-G256 PolarHBondContact OG-N 3.4Å; A73-G256 WeakPolarHBondContact CA-O 3.27Å; A73-G256 WeakPolarHBondContact CB-O 3.33Å; D252-G256 PolarHBondContact O-N 3.2Å; L253-G256 PolarHBondContact O-N 3.24Å; G256-M258 VanDerWaalsContact C-N 3.31Å; G256-M258 PolarHBondContact O-N 3.41Å; G256-A259 PolarHBondContact O-N 3.31Å; G256-T260 PolarHBondContact O-N 3.23Å; G256-T260 PolarHBondContact O-OG1 3.25Å
257	A	98.9	Very high	96.4	Very high	0 Å²	0	16 Å²	16	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59.8	-42.4	176.1	0	0	0	0	0	111.9	T76 L253 A259 T260 F261 A290 L293	T76-A257 HydrophobicContact CG2-CB 4.32Å; T76-A257 WeakPolarHBondContact OG1-CB 3.3Å; L253-A257 WeakPolarHBondContact O-CB 3.36Å; L253-A257 PolarHBondContact O-N 2.96Å; A257-A259 PolarHBondContact O-N 3.17Å; A257-T260 WeakPolarHBondContact O-CB 3.39Å; A257-T260 PolarHBondContact O-N 3.04Å; A257-F261 WeakPolarHBondContact O-CD2 3.39Å; A257-F261 PolarHBondContact O-N 3.47Å; A257-A290 HydrophobicContact CB-CB 4.21Å; A257-L293 HydrophobicContact CB-CD2 4.01Å
258	M	98.8	Very high	96.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.3	-40.8	179.9	-169.5	-179.6	-58.1	0	0	112.4	V156 V179 T181 V221 L254 T255 G256 T260 F261 L262 A287 A290	V156-M258 HydrophobicContact CG1-SD 3.84Å; V156-M258 HydrophobicContact CG2-CB 4.12Å; V156-M258 HydrophobicContact CG2-CG 3.86Å; V156-M258 HydrophobicContact CG2-SD 3.85Å; V179-M258 HydrophobicContact CB-SD 3.89Å; V179-M258 HydrophobicContact CG1-CE 4.49Å; V179-M258 HydrophobicContact CG1-SD 3.49Å; V179-M258 WeakPolarHBondContact CG1-SD 3.14Å; V179-M258 HydrophobicContact CG2-SD 4.27Å; T181-M258 HydrophobicContact CG2-CE 3.81Å; T181-M258 HydrophobicContact CG2-SD 4.01Å; V221-M258 HydrophobicContact CG2-CE 4.14Å; L254-M258 HydrophobicContact CD1-CE 3.73Å; L254-M258 HydrophobicContact CD2-CE 4.35Å; L254-M258 HydrophobicContact CG-CE 3.89Å; L254-M258 WeakPolarHBondContact O-CB 3.45Å; L254-M258 PolarHBondContact O-N 2.68Å; T255-M258 PolarHBondContact O-N 3.27Å; G256-M258 VanDerWaalsContact C-N 3.31Å; G256-M258 PolarHBondContact O-N 3.41Å; M258-T260 VanDerWaalsContact C-N 3.32Å; M258-T260 PolarHBondContact O-N 2.98Å; M258-F261 PolarHBondContact O-N 3.2Å; M258-L262 WeakPolarHBondContact O-CG 3.34Å; M258-L262 PolarHBondContact O-N 3.09Å; M258-A287 HydrophobicContact CE-CB 4.28Å; M258-A287 HydrophobicContact SD-CB 4.39Å; M258-A290 VanDerWaalsContact CA-CB 3.48Å; M258-A290 HydrophobicContact CB-CB 3.55Å; M258-A290 HydrophobicContact CE-CB 4.28Å; M258-A290 HydrophobicContact CG-CB 4.12Å
259	A	98.8	Very high	96.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.1	-36.9	175.5	0	0	0	0	0	112.4	V53 S124 V126 V156 T255 G256 A257 L262 H263	V53-A259 HydrophobicContact CG1-CB 3.55Å; V53-A259 HydrophobicContact CG2-CB 4.25Å; S124-A259 WeakPolarHBondContact CB-O 3.4Å; S124-A259 PolarHBondContact OG-O 3.05Å; V126-A259 HydrophobicContact CG2-CB 3.58Å; V156-A259 HydrophobicContact CG2-CB 4.46Å; T255-A259 WeakPolarHBondContact O-CB 3.42Å; T255-A259 PolarHBondContact O-N 3.11Å; G256-A259 PolarHBondContact O-N 3.31Å; A257-A259 PolarHBondContact O-N 3.17Å; A259-L262 PolarHBondContact O-N 3.15Å; A259-H263 PolarHBondContact O-N 2.95Å
260	T	98.8	Very high	95.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.1	-49.1	172	-58.8	0	0	0	0	111.3	A73 T76 A78 G256 A257 M258 L262 H263 W264	A73-T260 WeakPolarHBondContact CA-OG1 3.46Å; A73-T260 PolarHBondContact O-OG1 2.85Å; T76-T260 HydrophobicContact CG2-CG2 3.99Å; A78-T260 HydrophobicContact CB-CG2 4.1Å; G256-T260 PolarHBondContact O-N 3.23Å; G256-T260 PolarHBondContact O-OG1 3.25Å; A257-T260 WeakPolarHBondContact O-CB 3.39Å; A257-T260 PolarHBondContact O-N 3.04Å; M258-T260 VanDerWaalsContact C-N 3.32Å; M258-T260 PolarHBondContact O-N 2.98Å; T260-L262 VanDerWaalsContact C-N 3.3Å; T260-L262 PolarHBondContact O-N 3.39Å; T260-H263 WeakPolarHBondContact O-CB 3.34Å; T260-H263 PolarHBondContact O-N 2.76Å; T260-W264 HydrophobicContact CG2-CD2 4.07Å; T260-W264 HydrophobicContact CG2-CE3 4.45Å; T260-W264 HydrophobicContact CG2-CH2 3.92Å; T260-W264 HydrophobicContact CG2-CZ2 3.46Å; T260-W264 VanDerWaalsContact CG2-CZ2 3.46Å; T260-W264 HydrophobicContact CG2-CZ3 4.37Å; T260-W264 PolarHBondContact O-N 3.43Å
261	F	98.7	Very high	93.3	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.009	14%	0.139	C	C	.	.	H	α-helix	trans	-63.6	-32.6	177.4	-77.8	-67.9	0	0	0	113.4	V34 I38 T76 A257 M258 H263 W264 T265 S286 A289 A290 L293 F322 F326	V34-F261 HydrophobicContact CG1-CE1 4.2Å; I38-F261 HydrophobicContact CD1-CE1 4.24Å; I38-F261 HydrophobicContact CG1-CE1 4.09Å; T76-F261 HydrophobicContact CG2-CD2 4.44Å; T76-F261 HydrophobicContact CG2-CE2 3.95Å; T76-F261 HydrophobicContact CG2-CZ 4.33Å; A257-F261 WeakPolarHBondContact O-CD2 3.39Å; A257-F261 PolarHBondContact O-N 3.47Å; M258-F261 PolarHBondContact O-N 3.2Å; F261-H263 VanDerWaalsContact C-N 3.3Å; F261-H263 PolarHBondContact O-N 3.01Å; F261-W264 AromaticContact CD1-CE3 3.57Å; F261-W264 HydrophobicContact CD1-CE3 3.57Å; F261-W264 AromaticContact CD1-CZ3 3.98Å; F261-W264 HydrophobicContact CD1-CZ3 3.98Å; F261-W264 AromaticContact CE1-CE3 3.67Å; F261-W264 HydrophobicContact CE1-CE3 3.67Å; F261-W264 AromaticContact CE1-CZ3 3.62Å; F261-W264 HydrophobicContact CE1-CZ3 3.62Å; F261-W264 HydrophobicContact CG-CE3 4.4Å; F261-W264 HydrophobicContact CZ-CZ3 4.15Å; F261-W264 PolarHBondContact O-N 3.19Å; F261-T265 WeakPolarHBondContact O-CB 3.48Å; F261-T265 WeakPolarHBondContact O-CG2 3.45Å; F261-T265 PolarHBondContact O-N 3.27Å; F261-T265 PolarHBondContact O-OG1 3.41Å; F261-S286 PolarHBondContact O-OG 2.81Å; F261-S286 VanDerWaalsContact O-OG 3.05Å; F261-A289 HydrophobicContact CB-CB 4.47Å; F261-A289 HydrophobicContact CD1-CB 3.67Å; F261-A289 HydrophobicContact CD2-CB 3.76Å; F261-A289 HydrophobicContact CE1-CB 3.73Å; F261-A289 HydrophobicContact CE2-CB 3.82Å; F261-A289 HydrophobicContact CG-CB 3.71Å; F261-A289 HydrophobicContact CZ-CB 3.82Å; F261-A290 HydrophobicContact CD2-CB 4.15Å; F261-L293 HydrophobicContact CE2-CD2 4.04Å; F261-F322 HydrophobicContact CE1-CE2 4.38Å; F261-F322 AromaticContact CZ-CE2 3.89Å; F261-F322 HydrophobicContact CZ-CE2 3.89Å; F261-F326 HydrophobicContact CE1-CE2 4.45Å; F261-F326 HydrophobicContact CE1-CZ 4.44Å; F261-F326 HydrophobicContact CE2-CE2 4.47Å; F261-F326 HydrophobicContact CZ-CD2 4.37Å; F261-F326 AromaticContact CZ-CE2 3.65Å; F261-F326 HydrophobicContact CZ-CE2 3.65Å; F261-F326 AromaticContact CZ-CZ 3.8Å; F261-F326 HydrophobicContact CZ-CZ 3.8Å
262	L	98.3	Very high	91	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.3	-44.8	174.1	-80.7	173.2	0	0	0	111	P154 V156 V179 M258 A259 T260 T265 Y266 T283 S286	P154-L262 HydrophobicContact CB-CB 3.99Å; P154-L262 HydrophobicContact CB-CD1 4.24Å; V156-L262 HydrophobicContact CG2-CD1 3.51Å; V179-L262 HydrophobicContact CG2-CD1 4.31Å; V179-L262 HydrophobicContact CG2-CD2 4.05Å; M258-L262 WeakPolarHBondContact O-CG 3.34Å; M258-L262 PolarHBondContact O-N 3.09Å; A259-L262 PolarHBondContact O-N 3.15Å; T260-L262 VanDerWaalsContact C-N 3.3Å; T260-L262 PolarHBondContact O-N 3.39Å; L262-T265 PolarHBondContact O-OG1 3.02Å; L262-Y266 HydrophobicContact CD2-CD2 4.48Å; L262-Y266 HydrophobicContact CD2-CE2 4Å; L262-Y266 WeakPolarHBondContact O-CB 3.43Å; L262-Y266 WeakPolarHBondContact O-CD2 3.2Å; L262-Y266 PolarHBondContact O-N 2.52Å; L262-T283 HydrophobicContact CD2-CG2 3.73Å; L262-S286 VanDerWaalsContact CA-OG 3.26Å; L262-S286 WeakPolarHBondContact CA-OG 3.29Å; L262-S286 PolarHBondContact N-OG 2.98Å
263	H	96.8	Very high	88.2	Confident	17 Å²	17	34.1 Å²	34.1	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-54.4	174.1	174.5	52.7	0	0	0	110.9	S49 G51 H123 A259 T260 F261 T265 Y266 D267	S49-H263 PolarHBondContact O-NE2 3.33Å; G51-H263 WeakPolarHBondContact CA-CD2 3.22Å; G51-H263 PolarHBondContact N-CD2 2.78Å; H123-H263 HydrophobicContact CB-CB 4.03Å; H123-H263 VanDerWaalsContact CB-ND1 3.34Å; H123-H263 WeakPolarHBondContact CB-ND1 3.41Å; H123-H263 AromaticContact CE1-CE1 3.59Å; H123-H263 AromaticContact CE1-NE2 3.85Å; H123-H263 AromaticContact CG-CE1 3.67Å; H123-H263 AromaticContact CG-ND1 3.42Å; H123-H263 AromaticContact ND1-CD2 3.77Å; H123-H263 AromaticContact ND1-CE1 3.22Å; H123-H263 PolarHBondContact ND1-CE1 3.43Å; H123-H263 AromaticContact ND1-CG 3.73Å; H123-H263 AromaticContact ND1-ND1 3.36Å; H123-H263 PolarHBondContact ND1-ND1 3.24Å; H123-H263 AromaticContact ND1-NE2 3.44Å; H123-H263 PolarHBondContact ND1-NE2 3.2Å; A259-H263 PolarHBondContact O-N 2.95Å; T260-H263 WeakPolarHBondContact O-CB 3.34Å; T260-H263 PolarHBondContact O-N 2.76Å; F261-H263 VanDerWaalsContact C-N 3.3Å; F261-H263 PolarHBondContact O-N 3.01Å; H263-T265 PolarHBondContact O-N 3.02Å; H263-Y266 PolarHBondContact O-N 3.18Å; H263-D267 VanDerWaalsContact O-CB 3.27Å; H263-D267 WeakPolarHBondContact O-CB 3.46Å; H263-D267 PolarHBondContact O-N 3.03Å
264	W	96.9	Very high	85.5	Confident	11 Å²	11	42.9 Å²	42.9	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-42.9	-175.7	-63.4	-13.8	0	0	0	114.3	I38 P39 S50 T76 T260 F261 R268 F322	I38-W264 HydrophobicContact CB-CE3 4.5Å; I38-W264 HydrophobicContact CG1-CE3 4Å; I38-W264 HydrophobicContact CG1-CZ3 4.04Å; I38-W264 HydrophobicContact CG2-CZ3 4.2Å; P39-W264 HydrophobicContact CG-CD2 4.04Å; P39-W264 HydrophobicContact CG-CG 4.11Å; P39-W264 HydrophobicContact CG-CZ2 4.16Å; S50-W264 PolarHBondContact O-NE1 3.43Å; T76-W264 HydrophobicContact CG2-CH2 4.3Å; T76-W264 HydrophobicContact CG2-CZ3 4.46Å; T76-W264 VanDerWaalsContact O-CH2 3.28Å; T76-W264 WeakPolarHBondContact O-CH2 3.5Å; T260-W264 HydrophobicContact CG2-CD2 4.07Å; T260-W264 HydrophobicContact CG2-CE3 4.45Å; T260-W264 HydrophobicContact CG2-CH2 3.92Å; T260-W264 HydrophobicContact CG2-CZ2 3.46Å; T260-W264 VanDerWaalsContact CG2-CZ2 3.46Å; T260-W264 HydrophobicContact CG2-CZ3 4.37Å; T260-W264 PolarHBondContact O-N 3.43Å; F261-W264 AromaticContact CD1-CE3 3.57Å; F261-W264 HydrophobicContact CD1-CE3 3.57Å; F261-W264 AromaticContact CD1-CZ3 3.98Å; F261-W264 HydrophobicContact CD1-CZ3 3.98Å; F261-W264 AromaticContact CE1-CE3 3.67Å; F261-W264 HydrophobicContact CE1-CE3 3.67Å; F261-W264 AromaticContact CE1-CZ3 3.62Å; F261-W264 HydrophobicContact CE1-CZ3 3.62Å; F261-W264 HydrophobicContact CG-CE3 4.4Å; F261-W264 HydrophobicContact CZ-CZ3 4.15Å; F261-W264 PolarHBondContact O-N 3.19Å; W264-R268 WeakPolarHBondContact O-CB 3.13Å; W264-R268 PolarHBondContact O-N 3.26Å; W264-F322 AromaticContact CH2-CE2 3.95Å; W264-F322 HydrophobicContact CH2-CE2 3.95Å; W264-F322 AromaticContact CH2-CZ 3.97Å; W264-F322 HydrophobicContact CH2-CZ 3.97Å; W264-F322 AromaticContact CZ3-CE2 3.73Å; W264-F322 HydrophobicContact CZ3-CE2 3.73Å; W264-F322 AromaticContact CZ3-CZ 3.75Å; W264-F322 HydrophobicContact CZ3-CZ 3.75Å
265	T	95.8	Very high	82.9	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-71.9	-37.9	179.1	58.5	0	0	0	0	111.7	C37 F261 L262 H263 L269 A282 L285 S286	C37-T265 HydrophobicContact CB-CG2 3.97Å; F261-T265 WeakPolarHBondContact O-CB 3.48Å; F261-T265 WeakPolarHBondContact O-CG2 3.45Å; F261-T265 PolarHBondContact O-N 3.27Å; F261-T265 PolarHBondContact O-OG1 3.41Å; L262-T265 PolarHBondContact O-OG1 3.02Å; H263-T265 PolarHBondContact O-N 3.02Å; T265-L269 WeakPolarHBondContact O-CB 3.42Å; T265-L269 WeakPolarHBondContact O-CG 3.18Å; T265-L269 PolarHBondContact O-N 3.41Å; T265-A282 PolarHBondContact OG1-O 2.63Å; T265-A282 VanDerWaalsContact OG1-O 3.12Å; T265-L285 HydrophobicContact CG2-CB 4.07Å; T265-S286 WeakPolarHBondContact CG2-OG 3.48Å; T265-S286 PolarHBondContact OG1-OG 2.91Å
266	Y	94.4	Very high	80.3	Confident	36 Å²	36	51.4 Å²	51.4	14%	0.141	29%	0.286	C	S	.	.	H	α-helix	trans	-66.5	-48.6	174.7	-85.9	-61.1	0	0	0	111.3	P154 K176 R177 L262 H263 R268 L269 S270 A282 T283	P154-Y266 HydrophobicContact CB-CD2 3.92Å; P154-Y266 HydrophobicContact CB-CE2 3.98Å; P154-Y266 HydrophobicContact CG-CD2 3.49Å; P154-Y266 VanDerWaalsContact CG-CD2 3.49Å; P154-Y266 HydrophobicContact CG-CE2 3.85Å; P154-Y266 HydrophobicContact CG-CG 4.31Å; K176-Y266 PolarHBondContact O-OH 2.72Å; R177-Y266 WeakPolarHBondContact CA-OH 3.14Å; R177-Y266 HydrophobicContact CB-CE2 4.14Å; R177-Y266 HydrophobicContact CG-CE1 4.13Å; R177-Y266 HydrophobicContact CG-CE2 4.2Å; R177-Y266 WeakPolarHBondContact CG-OH 3.45Å; L262-Y266 HydrophobicContact CD2-CD2 4.48Å; L262-Y266 HydrophobicContact CD2-CE2 4Å; L262-Y266 WeakPolarHBondContact O-CB 3.43Å; L262-Y266 WeakPolarHBondContact O-CD2 3.2Å; L262-Y266 PolarHBondContact O-N 2.52Å; H263-Y266 PolarHBondContact O-N 3.18Å; Y266-R268 VanDerWaalsContact C-N 3.27Å; Y266-R268 PolarHBondContact O-N 2.88Å; Y266-L269 PolarHBondContact O-N 3Å; Y266-S270 VanDerWaalsContact O-CB 3.24Å; Y266-S270 WeakPolarHBondContact O-CB 3.39Å; Y266-S270 PolarHBondContact O-N 2.76Å; Y266-S270 PolarHBondContact O-OG 3.13Å; Y266-A282 HydrophobicContact CD1-CB 3.72Å; Y266-A282 HydrophobicContact CD2-CB 4.22Å; Y266-A282 HydrophobicContact CE1-CB 3.57Å; Y266-A282 HydrophobicContact CE2-CB 4.1Å; Y266-A282 HydrophobicContact CG-CB 4.02Å; Y266-T283 HydrophobicContact CE2-CG2 4.26Å; Y266-T283 WeakPolarHBondContact OH-CG2 3.5Å
267	D	91.9	Very high	77.9	Confident	89 Å²	89	61.3 Å²	61.3	48%	0.476	33%	0.332	S	S	.	.	H	α-helix	trans	-52.1	-47.5	176.3	-170.8	73.6	0	0	0	110.9	H263	H263-D267 VanDerWaalsContact O-CB 3.27Å; H263-D267 WeakPolarHBondContact O-CB 3.46Å; H263-D267 PolarHBondContact O-N 3.03Å
268	R	90.2	Very high	75.9	Confident	110 Å²	110	67.9 Å²	67.9	42%	0.415	37%	0.367	S	S	.	.	H	α-helix	trans	-74	-37.5	-178.8	-169.2	61.3	165	157.2	-3.3	115.1	Q36 C37 W264 Y266	Q36-R268 PolarHBondContact O-NE 3.41Å; C37-R268 HydrophobicContact CB-CB 4.1Å; C37-R268 HydrophobicContact CB-CG 4.38Å; W264-R268 WeakPolarHBondContact O-CB 3.13Å; W264-R268 PolarHBondContact O-N 3.26Å; Y266-R268 VanDerWaalsContact C-N 3.27Å; Y266-R268 PolarHBondContact O-N 2.88Å
269	L	87	Confident	75	Confident	37 Å²	37	70 Å²	70	19%	0.194	38%	0.381	C	S	.	.	H	α-helix	trans	-93.3	-26.7	-171.9	-62.4	175.1	0	0	0	113	T265 Y266 D271 K272 A282 L285	T265-L269 WeakPolarHBondContact O-CB 3.42Å; T265-L269 WeakPolarHBondContact O-CG 3.18Å; T265-L269 PolarHBondContact O-N 3.41Å; Y266-L269 PolarHBondContact O-N 3Å; L269-D271 PolarHBondContact O-N 2.83Å; L269-K272 CarbonylContact O-C 3.54Å; L269-K272 PolarHBondContact O-N 3.36Å; L269-A282 HydrophobicContact CD1-CB 4.04Å; L269-L285 HydrophobicContact CD1-CD1 3.8Å
270	S	70.6	Confident	74.7	Confident	76 Å²	76	71.5 Å²	71.5	53%	0.531	39%	0.388	S	S	.	.	H	α-helix	trans	-63.1	-31.3	172.4	59.8	0	0	0	0	111.8	Y266 K272	Y266-S270 VanDerWaalsContact O-CB 3.24Å; Y266-S270 WeakPolarHBondContact O-CB 3.39Å; Y266-S270 PolarHBondContact O-N 2.76Å; Y266-S270 PolarHBondContact O-OG 3.13Å; S270-K272 PolarHBondContact O-N 3.35Å
271	D	53.3	Low	74.4	Confident	123 Å²	123	73.3 Å²	73.3	66%	0.658	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-22.1	174.3	-76.8	-5.8	0	0	0	113.1	L269	L269-D271 PolarHBondContact O-N 2.83Å
272	K	48.6	Very low	74.3	Confident	101 Å²	101	73.6 Å²	73.6	44%	0.439	40%	0.403	S	S	.	.			trans	-105.2	83.6	-178.3	-66	-175.8	-178.7	179.1	0	109.4	L269 S270 K274	L269-K272 CarbonylContact O-C 3.54Å; L269-K272 PolarHBondContact O-N 3.36Å; S270-K272 PolarHBondContact O-N 3.35Å; K272-K274 PolarHBondContact O-N 2.91Å
273	A	40.1	Very low	74.3	Confident	103 Å²	103	73.7 Å²	73.7	85%	0.851	40%	0.403	S	S	*	.			trans	-61	22.1	170.2	0	0	0	0	0	115.1
274	K	42	Very low	74.3	Confident	184 Å²	184	72.9 Å²	72.9	80%	0.8	40%	0.399	S	S	*	.			trans	-131.4	80.2	-175.9	-65.9	-175	-179.5	180	0	109.4	K272 T276	K272-K274 PolarHBondContact O-N 2.91Å; K274-T276 VanDerWaalsContact C-N 3.33Å; K274-T276 PolarHBondContact O-N 2.77Å
275	A	43.6	Very low	74.3	Confident	89 Å²	89	72.3 Å²	72.3	74%	0.736	40%	0.397	S	S	*	.			trans	-58.5	99.7	158.8	0	0	0	0	0	107.6
276	T	43.8	Very low	74.4	Confident	101 Å²	101	72.3 Å²	72.3	62%	0.62	40%	0.397	S	S	*	.			trans	-67	152.8	159.1	47.4	0	0	0	0	107.8	K274 N278 S279	K274-T276 VanDerWaalsContact C-N 3.33Å; K274-T276 PolarHBondContact O-N 2.77Å; T276-N278 PolarHBondContact O-N 3.16Å; T276-S279 VanDerWaalsContact O-CB 3.28Å; T276-S279 WeakPolarHBondContact O-CB 3.19Å; T276-S279 PolarHBondContact O-N 3.03Å
277	E	49.6	Very low	74.6	Confident	207 Å²	207	70.6 Å²	70.6	97%	0.967	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-13.7	-177.8	-76.7	178.2	145.9	0	0	114.6
278	N	56.5	Low	74.9	Confident	138 Å²	138	66.4 Å²	66.4	74%	0.738	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	22.9	176.5	-74.5	-32	0	0	0	113.9	T276	T276-N278 PolarHBondContact O-N 3.16Å
279	S	79.6	Confident	75.3	Confident	44 Å²	44	61.1 Å²	61.1	31%	0.308	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-90.9	116.6	-178.4	-169.2	0	0	0	0	112.1	T276	T276-S279 VanDerWaalsContact O-CB 3.28Å; T276-S279 WeakPolarHBondContact O-CB 3.19Å; T276-S279 PolarHBondContact O-N 3.03Å
280	Y	91.7	Very high	75.9	Confident	33 Å²	33	59.4 Å²	59.4	13%	0.129	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-69.5	150.5	163.7	-62.8	-57.1	0	0	0	111	S26 A30 M33 L236 L284 L285	S26-Y280 WeakPolarHBondContact CA-OH 3.38Å; S26-Y280 WeakPolarHBondContact CB-OH 3.33Å; S26-Y280 PolarHBondContact O-OH 2.84Å; A30-Y280 HydrophobicContact CB-CD2 3.94Å; A30-Y280 HydrophobicContact CB-CE2 3.76Å; M33-Y280 HydrophobicContact SD-CD2 3.71Å; M33-Y280 HydrophobicContact SD-CE2 4.46Å; M33-Y280 HydrophobicContact SD-CG 4.49Å; L236-Y280 HydrophobicContact CD1-CD1 4.36Å; L236-Y280 HydrophobicContact CD1-CE1 4.37Å; L236-Y280 HydrophobicContact CD1-CG 4.46Å; L236-Y280 HydrophobicContact CD2-CE1 3.92Å; L236-Y280 HydrophobicContact CD2-CE2 4.42Å; L236-Y280 HydrophobicContact CG-CE1 4.24Å; Y280-L284 HydrophobicContact CD1-CD2 3.35Å; Y280-L284 HydrophobicContact CE1-CD2 4.15Å; Y280-L284 HydrophobicContact CG-CD2 3.89Å; Y280-L285 HydrophobicContact CD2-CD2 3.92Å; Y280-L285 HydrophobicContact CG-CD2 4.23Å
281	S	93.6	Very high	77.2	Confident	37 Å²	37	55.8 Å²	55.8	26%	0.259	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-70.8	158.2	174.6	65.1	0	0	0	0	112	D231 T283 L284 L285	D231-S281 VanDerWaalsContact OD2-CB 3.23Å; D231-S281 WeakPolarHBondContact OD2-CB 3.01Å; D231-S281 PolarHBondContact OD2-OG 2.83Å; S281-T283 VanDerWaalsContact C-N 3.31Å; S281-T283 PolarHBondContact O-N 3.17Å; S281-T283 PolarHBondContact OG-OG1 3.34Å; S281-L284 PolarHBondContact O-N 2.96Å; S281-L284 VanDerWaalsContact OG-CB 3.26Å; S281-L284 WeakPolarHBondContact OG-CB 3.44Å; S281-L284 PolarHBondContact OG-N 3.06Å; S281-L285 WeakPolarHBondContact O-CG 3.46Å; S281-L285 PolarHBondContact O-N 3.35Å
282	A	95.6	Very high	79.3	Confident	8 Å²	8	50 Å²	50	7%	0.066	28%	0.283	C	S	.	.	H	α-helix	trans	-58.1	-41.6	178	0	0	0	0	0	112.4	T265 Y266 L269 S286	T265-A282 PolarHBondContact OG1-O 2.63Å; T265-A282 VanDerWaalsContact OG1-O 3.12Å; Y266-A282 HydrophobicContact CD1-CB 3.72Å; Y266-A282 HydrophobicContact CD2-CB 4.22Å; Y266-A282 HydrophobicContact CE1-CB 3.57Å; Y266-A282 HydrophobicContact CE2-CB 4.1Å; Y266-A282 HydrophobicContact CG-CB 4.02Å; L269-A282 HydrophobicContact CD1-CB 4.04Å; A282-S286 VanDerWaalsContact O-CB 3.28Å; A282-S286 WeakPolarHBondContact O-CB 3.16Å; A282-S286 PolarHBondContact O-N 2.89Å; A282-S286 PolarHBondContact O-OG 3.03Å
283	T	97.9	Very high	81.7	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-42.8	176	43.8	0	0	0	0	112.4	V179 T219 L262 Y266 S281 S286 A287	V179-T283 HydrophobicContact CG2-CG2 3.78Å; T219-T283 WeakPolarHBondContact OG1-CB 3.34Å; T219-T283 PolarHBondContact OG1-OG1 3.4Å; L262-T283 HydrophobicContact CD2-CG2 3.73Å; Y266-T283 HydrophobicContact CE2-CG2 4.26Å; Y266-T283 WeakPolarHBondContact OH-CG2 3.5Å; S281-T283 VanDerWaalsContact C-N 3.31Å; S281-T283 PolarHBondContact O-N 3.17Å; S281-T283 PolarHBondContact OG-OG1 3.34Å; T283-S286 PolarHBondContact O-N 3.25Å; T283-A287 VanDerWaalsContact O-CB 3.27Å; T283-A287 WeakPolarHBondContact O-CB 3.25Å; T283-A287 PolarHBondContact O-N 2.81Å
284	L	97	Very high	84.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-44.7	177.8	-162.7	86.4	0	0	0	111.3	I229 D231 L236 Y280 S281 F288	I229-L284 HydrophobicContact CB-CD1 4.45Å; I229-L284 HydrophobicContact CG2-CD1 3.71Å; I229-L284 HydrophobicContact CG2-CG 4.31Å; D231-L284 HydrophobicContact CB-CD1 4.12Å; L236-L284 HydrophobicContact CD1-CD2 3.68Å; L236-L284 HydrophobicContact CD1-CG 3.98Å; L236-L284 HydrophobicContact CG-CD2 3.89Å; L236-L284 HydrophobicContact CG-CG 4.37Å; Y280-L284 HydrophobicContact CD1-CD2 3.35Å; Y280-L284 HydrophobicContact CE1-CD2 4.15Å; Y280-L284 HydrophobicContact CG-CD2 3.89Å; S281-L284 PolarHBondContact O-N 2.96Å; S281-L284 VanDerWaalsContact OG-CB 3.26Å; S281-L284 WeakPolarHBondContact OG-CB 3.44Å; S281-L284 PolarHBondContact OG-N 3.06Å; L284-F288 WeakPolarHBondContact O-CB 2.96Å; L284-F288 PolarHBondContact O-N 3.17Å
285	L	96.9	Very high	87.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.6	-42.9	176.4	-70.7	171.9	0	0	0	112.2	A30 M33 V34 T265 L269 Y280 S281 F288 A289	A30-L285 HydrophobicContact CB-CD2 4.13Å; M33-L285 HydrophobicContact CB-CD1 3.99Å; M33-L285 HydrophobicContact CB-CD2 3.81Å; M33-L285 HydrophobicContact CE-CD1 3.97Å; M33-L285 HydrophobicContact SD-CD2 4.49Å; V34-L285 HydrophobicContact CG2-CB 4.18Å; V34-L285 HydrophobicContact CG2-CD2 4.08Å; T265-L285 HydrophobicContact CG2-CB 4.07Å; L269-L285 HydrophobicContact CD1-CD1 3.8Å; Y280-L285 HydrophobicContact CD2-CD2 3.92Å; Y280-L285 HydrophobicContact CG-CD2 4.23Å; S281-L285 WeakPolarHBondContact O-CG 3.46Å; S281-L285 PolarHBondContact O-N 3.35Å; L285-F288 PolarHBondContact O-N 3.3Å; L285-A289 WeakPolarHBondContact O-CB 3.44Å; L285-A289 PolarHBondContact O-N 3.36Å
286	S	98.4	Very high	89.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.5	-46.4	177.6	-62.9	0	0	0	0	111.9	F261 L262 T265 A282 T283 F288 A289 A290	F261-S286 PolarHBondContact O-OG 2.81Å; F261-S286 VanDerWaalsContact O-OG 3.05Å; L262-S286 VanDerWaalsContact CA-OG 3.26Å; L262-S286 WeakPolarHBondContact CA-OG 3.29Å; L262-S286 PolarHBondContact N-OG 2.98Å; T265-S286 WeakPolarHBondContact CG2-OG 3.48Å; T265-S286 PolarHBondContact OG1-OG 2.91Å; A282-S286 VanDerWaalsContact O-CB 3.28Å; A282-S286 WeakPolarHBondContact O-CB 3.16Å; A282-S286 PolarHBondContact O-N 2.89Å; A282-S286 PolarHBondContact O-OG 3.03Å; T283-S286 PolarHBondContact O-N 3.25Å; S286-F288 VanDerWaalsContact C-N 3.34Å; S286-F288 PolarHBondContact O-N 3.09Å; S286-A289 PolarHBondContact O-N 3.49Å; S286-A290 WeakPolarHBondContact O-CB 3.4Å; S286-A290 PolarHBondContact O-N 3.36Å
287	A	98.7	Very high	92.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.1	-44	176.9	0	0	0	0	0	111.3	V179 V221 I229 M258 T283 A290 C291	V179-A287 HydrophobicContact CG1-CB 4.45Å; V221-A287 HydrophobicContact CG2-CB 3.48Å; V221-A287 VanDerWaalsContact CG2-CB 3.48Å; I229-A287 HydrophobicContact CD1-CB 4.1Å; I229-A287 HydrophobicContact CG2-CB 3.62Å; M258-A287 HydrophobicContact CE-CB 4.28Å; M258-A287 HydrophobicContact SD-CB 4.39Å; T283-A287 VanDerWaalsContact O-CB 3.27Å; T283-A287 WeakPolarHBondContact O-CB 3.25Å; T283-A287 PolarHBondContact O-N 2.81Å; A287-A290 PolarHBondContact O-N 2.81Å; A287-C291 WeakPolarHBondContact O-CB 3.31Å; A287-C291 PolarHBondContact O-N 3.18Å; A287-C291 PolarHBondContact O-SG 3.17Å
288	F	98.2	Very high	94.6	Very high	1 Å²	1	14 Å²	14	0%	0.004	8%	0.079	C	C	.	.	H	α-helix	trans	-63.6	-43.4	178.6	-179.6	-99.9	0	0	0	112.1	A30 M31 V34 I229 L236 C238 L284 L285 S286 S292	A30-F288 HydrophobicContact CB-CD1 3.81Å; A30-F288 HydrophobicContact CB-CE1 3.9Å; A30-F288 HydrophobicContact CB-CG 4.29Å; A30-F288 HydrophobicContact CB-CZ 4.43Å; M31-F288 HydrophobicContact CB-CE1 4.2Å; M31-F288 HydrophobicContact CE-CE1 4.03Å; V34-F288 HydrophobicContact CG2-CD1 4.4Å; I229-F288 VanDerWaalsContact CD1-CA 3.5Å; I229-F288 HydrophobicContact CD1-CB 4.05Å; I229-F288 HydrophobicContact CD1-CD2 4.43Å; L236-F288 HydrophobicContact CB-CD2 4.26Å; L236-F288 HydrophobicContact CD1-CB 4.15Å; L236-F288 HydrophobicContact CD1-CD2 4.2Å; L236-F288 HydrophobicContact CD1-CG 4.16Å; C238-F288 HydrophobicContact CB-CD2 4.27Å; C238-F288 HydrophobicContact CB-CE2 4.3Å; L284-F288 WeakPolarHBondContact O-CB 2.96Å; L284-F288 PolarHBondContact O-N 3.17Å; L285-F288 PolarHBondContact O-N 3.3Å; S286-F288 VanDerWaalsContact C-N 3.34Å; S286-F288 PolarHBondContact O-N 3.09Å; F288-S292 WeakPolarHBondContact O-CB 3.48Å; F288-S292 PolarHBondContact O-N 3.37Å; F288-S292 PolarHBondContact O-OG 3.22Å
289	A	98.6	Very high	96.5	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-60.8	-49.7	176.3	0	0	0	0	0	111.7	V34 F261 L285 S286 S292 L293 F326	V34-A289 HydrophobicContact CB-CB 4.39Å; V34-A289 HydrophobicContact CG1-CB 3.53Å; V34-A289 HydrophobicContact CG2-CB 3.88Å; F261-A289 HydrophobicContact CB-CB 4.47Å; F261-A289 HydrophobicContact CD1-CB 3.67Å; F261-A289 HydrophobicContact CD2-CB 3.76Å; F261-A289 HydrophobicContact CE1-CB 3.73Å; F261-A289 HydrophobicContact CE2-CB 3.82Å; F261-A289 HydrophobicContact CG-CB 3.71Å; F261-A289 HydrophobicContact CZ-CB 3.82Å; L285-A289 WeakPolarHBondContact O-CB 3.44Å; L285-A289 PolarHBondContact O-N 3.36Å; S286-A289 PolarHBondContact O-N 3.49Å; A289-S292 WeakPolarHBondContact O-CB 3.47Å; A289-S292 PolarHBondContact O-N 3.23Å; A289-L293 WeakPolarHBondContact O-CB 3.27Å; A289-L293 PolarHBondContact O-N 2.94Å; A289-F326 HydrophobicContact CB-CE1 4.46Å; A289-F326 HydrophobicContact CB-CZ 4.27Å
290	A	98.8	Very high	97.4	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-67.3	-38.9	-178.2	0	0	0	0	0	112.9	L254 A257 M258 F261 S286 A287 T294	L254-A290 VanDerWaalsContact CD1-C 3.48Å; L254-A290 HydrophobicContact CD1-CB 3.79Å; A257-A290 HydrophobicContact CB-CB 4.21Å; M258-A290 VanDerWaalsContact CA-CB 3.48Å; M258-A290 HydrophobicContact CB-CB 3.55Å; M258-A290 HydrophobicContact CE-CB 4.28Å; M258-A290 HydrophobicContact CG-CB 4.12Å; F261-A290 HydrophobicContact CD2-CB 4.15Å; S286-A290 WeakPolarHBondContact O-CB 3.4Å; S286-A290 PolarHBondContact O-N 3.36Å; A287-A290 PolarHBondContact O-N 2.81Å; A290-T294 WeakPolarHBondContact O-CB 3.36Å; A290-T294 PolarHBondContact O-N 3.24Å; A290-T294 PolarHBondContact O-OG1 3.5Å
291	C	98.5	Very high	97.7	Very high	1 Å²	1	6.1 Å²	6.1	1%	0.007	3%	0.033	C	C	.	.	H	α-helix	trans	-62	-46	172.5	-67.5	0	0	0	0	110.7	D227 I229 C238 A287 L293 T294 R295	D227-C291 HydrophobicContact CB-CB 4.4Å; I229-C291 HydrophobicContact CD1-CB 4.39Å; C238-C291 HydrophobicContact CB-CB 3.85Å; A287-C291 WeakPolarHBondContact O-CB 3.31Å; A287-C291 PolarHBondContact O-N 3.18Å; A287-C291 PolarHBondContact O-SG 3.17Å; C291-L293 PolarHBondContact O-N 3.06Å; C291-T294 PolarHBondContact O-N 2.82Å; C291-R295 WeakPolarHBondContact O-CB 3.34Å; C291-R295 WeakPolarHBondContact O-CD 3.32Å; C291-R295 WeakPolarHBondContact O-CG 3.22Å; C291-R295 PolarHBondContact O-N 3.04Å
292	S	98.2	Very high	98	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-60	-48.3	178.8	-58.6	0	0	0	0	111.4	C238 F288 A289 R295 E296	C238-S292 PolarHBondContact SG-N 3.23Å; C238-S292 PolarHBondContact SG-OG 3.02Å; C238-S292 VanDerWaalsContact SG-OG 3.37Å; F288-S292 WeakPolarHBondContact O-CB 3.48Å; F288-S292 PolarHBondContact O-N 3.37Å; F288-S292 PolarHBondContact O-OG 3.22Å; A289-S292 WeakPolarHBondContact O-CB 3.47Å; A289-S292 PolarHBondContact O-N 3.23Å; S292-R295 PolarHBondContact O-N 2.94Å; S292-E296 WeakPolarHBondContact O-CB 3.41Å; S292-E296 PolarHBondContact O-N 3.17Å
293	L	98.6	Very high	98.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.6	-49.3	178.3	-178	64.1	0	0	0	111.7	T76 A257 F261 A289 C291 R295 E296 C297 I318 A321 F322 L325 F326	T76-L293 HydrophobicContact CG2-CD2 3.97Å; A257-L293 HydrophobicContact CB-CD2 4.01Å; F261-L293 HydrophobicContact CE2-CD2 4.04Å; A289-L293 WeakPolarHBondContact O-CB 3.27Å; A289-L293 PolarHBondContact O-N 2.94Å; C291-L293 PolarHBondContact O-N 3.06Å; L293-R295 VanDerWaalsContact C-N 3.32Å; L293-R295 PolarHBondContact O-N 3.06Å; L293-E296 PolarHBondContact O-N 3.46Å; L293-C297 WeakPolarHBondContact O-CB 3.47Å; L293-C297 PolarHBondContact O-N 3.34Å; L293-C297 PolarHBondContact O-SG 3.27Å; L293-I318 HydrophobicContact CD2-CG2 4.41Å; L293-A321 HydrophobicContact CD1-CB 3.71Å; L293-F322 HydrophobicContact CD1-CB 4.07Å; L293-F322 HydrophobicContact CD1-CD2 4.36Å; L293-F322 HydrophobicContact CD2-CD2 4.36Å; L293-L325 VanDerWaalsContact CA-CD1 3.48Å; L293-L325 HydrophobicContact CB-CD1 4.25Å; L293-L325 HydrophobicContact CD1-CD1 4.29Å; L293-F326 HydrophobicContact CB-CE2 4.29Å; L293-F326 HydrophobicContact CB-CZ 4.46Å; L293-F326 HydrophobicContact CD1-CE2 4.24Å
294	T	98.3	Very high	98.1	Very high	14 Å²	14	19.3 Å²	19.3	9%	0.086	9%	0.085	C	C	.	.	H	α-helix	trans	-60.9	-42.3	-178.2	-56.4	0	0	0	0	111.7	L253 L254 A290 C291 C297 N298 M314	L253-T294 HydrophobicContact CD2-CG2 4.11Å; L253-T294 WeakPolarHBondContact CD2-OG1 3.33Å; L254-T294 WeakPolarHBondContact CA-OG1 3.24Å; L254-T294 HydrophobicContact CB-CG2 4.24Å; A290-T294 WeakPolarHBondContact O-CB 3.36Å; A290-T294 PolarHBondContact O-N 3.24Å; A290-T294 PolarHBondContact O-OG1 3.5Å; C291-T294 PolarHBondContact O-N 2.82Å; T294-C297 PolarHBondContact O-N 3.15Å; T294-N298 WeakPolarHBondContact O-CB 3.36Å; T294-N298 PolarHBondContact O-N 3.01Å; T294-M314 HydrophobicContact CG2-CE 4.27Å
295	R	97.4	Very high	98.1	Very high	12 Å²	12	23.2 Å²	23.2	5%	0.045	10%	0.102	C	C	.	.	H	α-helix	trans	-67.4	-42.6	179.9	-67.4	168.4	75.8	83.6	5.5	111.6	F225 D227 C238 V240 N242 C291 S292 L293 N298 R299	F225-R295 PolarHBondContact O-NH1 2.88Å; F225-R295 PolarHBondContact O-NH2 2.84Å; D227-R295 WeakPolarHBondContact OD2-CD 3.27Å; D227-R295 IonicContact OD2-CZ 2.75Å; D227-R295 IonicContact OD2-NE 3.82Å; D227-R295 IonicContact OD2-NH1 3.76Å; D227-R295 PolarHBondContact OD2-NH1 2.94Å; C238-R295 VanDerWaalsContact SG-CD 3.58Å; V240-R295 HydrophobicContact CB-CB 4.28Å; V240-R295 HydrophobicContact CG1-CB 4.26Å; V240-R295 VanDerWaalsContact O-CZ 3.28Å; V240-R295 PolarHBondContact O-NE 3.17Å; V240-R295 PolarHBondContact O-NH2 3.13Å; N242-R295 HydrophobicContact CB-CB 4.16Å; N242-R295 HydrophobicContact CB-CG 4.28Å; C291-R295 WeakPolarHBondContact O-CB 3.34Å; C291-R295 WeakPolarHBondContact O-CD 3.32Å; C291-R295 WeakPolarHBondContact O-CG 3.22Å; C291-R295 PolarHBondContact O-N 3.04Å; S292-R295 PolarHBondContact O-N 2.94Å; L293-R295 VanDerWaalsContact C-N 3.32Å; L293-R295 PolarHBondContact O-N 3.06Å; R295-N298 PolarHBondContact O-N 3.18Å; R295-R299 WeakPolarHBondContact O-CB 3.49Å; R295-R299 PolarHBondContact O-N 2.74Å
296	E	97.8	Very high	98.1	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.009	12%	0.121	C	C	.	.	H	α-helix	trans	-66.3	-41.5	176.4	-179.2	64	-178.6	0	0	111.7	V240 S292 L293 N298 R299 L300 A321 N324 L325	V240-E296 HydrophobicContact CG1-CB 4.33Å; S292-E296 WeakPolarHBondContact O-CB 3.41Å; S292-E296 PolarHBondContact O-N 3.17Å; L293-E296 PolarHBondContact O-N 3.46Å; E296-N298 VanDerWaalsContact C-N 3.31Å; E296-N298 PolarHBondContact O-N 2.85Å; E296-R299 PolarHBondContact O-N 2.98Å; E296-R299 IonicContact OE1-CZ 3.56Å; E296-R299 IonicContact OE1-NE 3.62Å; E296-R299 IonicContact OE1-NH2 2.7Å; E296-R299 PolarHBondContact OE1-NH2 2.93Å; E296-R299 IonicContact OE2-CZ 3.49Å; E296-R299 IonicContact OE2-NE 2.74Å; E296-R299 PolarHBondContact OE2-NE 3.41Å; E296-R299 IonicContact OE2-NH2 3.4Å; E296-R299 PolarHBondContact OE2-NH2 3.18Å; E296-L300 HydrophobicContact CG-CD1 4.11Å; E296-L300 HydrophobicContact CG-CG 4.45Å; E296-L300 WeakPolarHBondContact O-CB 3.43Å; E296-L300 WeakPolarHBondContact O-CG 3.36Å; E296-L300 PolarHBondContact O-N 3.41Å; E296-A321 HydrophobicContact CB-CB 3.92Å; E296-A321 HydrophobicContact CG-CB 3.55Å; E296-N324 PolarHBondContact OE1-ND2 3.2Å; E296-L325 HydrophobicContact CB-CD1 3.89Å; E296-L325 HydrophobicContact CB-CG 4.37Å; E296-L325 HydrophobicContact CG-CD1 4.3Å; E296-L325 HydrophobicContact CG-CG 4.36Å
297	C	98.3	Very high	98	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-56.7	-46	172.7	-67.7	0	0	0	0	111.4	L253 L293 T294 L300 A301 M314 E317 A321	L253-C297 HydrophobicContact CD1-CB 4.35Å; L293-C297 WeakPolarHBondContact O-CB 3.47Å; L293-C297 PolarHBondContact O-N 3.34Å; L293-C297 PolarHBondContact O-SG 3.27Å; T294-C297 PolarHBondContact O-N 3.15Å; C297-L300 PolarHBondContact O-N 2.89Å; C297-A301 VanDerWaalsContact O-CB 3.29Å; C297-A301 WeakPolarHBondContact O-CB 3.34Å; C297-A301 PolarHBondContact O-N 3.34Å; C297-M314 HydrophobicContact CB-CB 4.35Å; C297-E317 HydrophobicContact CB-CB 4.39Å; C297-A321 HydrophobicContact CB-CB 4.48Å; C297-A321 WeakPolarHBondContact SG-CB 3.18Å
298	N	97.6	Very high	97.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-65.3	-40.4	178.5	-167.1	13.3	0	0	0	112	N242 S243 T294 R295 E296 Y302 M314	N242-N298 WeakPolarHBondContact OD1-CB 3.34Å; N242-N298 PolarHBondContact OD1-ND2 3.49Å; S243-N298 PolarHBondContact OG-ND2 3.35Å; S243-N298 PolarHBondContact OG-OD1 3.17Å; T294-N298 WeakPolarHBondContact O-CB 3.36Å; T294-N298 PolarHBondContact O-N 3.01Å; R295-N298 PolarHBondContact O-N 3.18Å; E296-N298 VanDerWaalsContact C-N 3.31Å; E296-N298 PolarHBondContact O-N 2.85Å; N298-Y302 WeakPolarHBondContact O-CB 3.41Å; N298-Y302 PolarHBondContact O-N 3.27Å; N298-M314 HydrophobicContact CB-CE 3.61Å; N298-M314 HydrophobicContact CB-CG 4.47Å; N298-M314 HydrophobicContact CB-SD 3.95Å
299	R	97.7	Very high	97.9	Very high	36 Å²	36	40.4 Å²	40.4	14%	0.136	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-50.5	176.2	-170.9	-168.7	71.7	71	-1.2	111.2	R295 E296 Y302 Q303	R295-R299 WeakPolarHBondContact O-CB 3.49Å; R295-R299 PolarHBondContact O-N 2.74Å; E296-R299 PolarHBondContact O-N 2.98Å; E296-R299 IonicContact OE1-CZ 3.56Å; E296-R299 IonicContact OE1-NE 3.62Å; E296-R299 IonicContact OE1-NH2 2.7Å; E296-R299 PolarHBondContact OE1-NH2 2.93Å; E296-R299 IonicContact OE2-CZ 3.49Å; E296-R299 IonicContact OE2-NE 2.74Å; E296-R299 PolarHBondContact OE2-NE 3.41Å; E296-R299 IonicContact OE2-NH2 3.4Å; E296-R299 PolarHBondContact OE2-NH2 3.18Å; R299-Y302 PolarHBondContact O-N 2.86Å; R299-Q303 WeakPolarHBondContact O-CG 3.48Å; R299-Q303 PolarHBondContact O-N 3.28Å
300	L	98.5	Very high	97.9	Very high	14 Å²	14	43.2 Å²	43.2	7%	0.073	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-45.6	179.9	-70	173.6	0	0	0	111.7	E296 C297 Y302 Q303 K304 E317 C320 A321	E296-L300 HydrophobicContact CG-CD1 4.11Å; E296-L300 HydrophobicContact CG-CG 4.45Å; E296-L300 WeakPolarHBondContact O-CB 3.43Å; E296-L300 WeakPolarHBondContact O-CG 3.36Å; E296-L300 PolarHBondContact O-N 3.41Å; C297-L300 PolarHBondContact O-N 2.89Å; L300-Y302 VanDerWaalsContact C-N 3.34Å; L300-Y302 PolarHBondContact O-N 2.91Å; L300-Q303 PolarHBondContact O-N 2.94Å; L300-K304 PolarHBondContact O-N 3.02Å; L300-E317 HydrophobicContact CB-CB 4.02Å; L300-E317 HydrophobicContact CB-CG 3.84Å; L300-E317 HydrophobicContact CD1-CB 4.32Å; L300-C320 HydrophobicContact CD1-CB 4.04Å; L300-A321 HydrophobicContact CD1-CB 3.99Å
301	A	98.3	Very high	97.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-36.8	178.6	0	0	0	0	0	111.8	C297 K304 F305 T309 D313 M314 E317	C297-A301 VanDerWaalsContact O-CB 3.29Å; C297-A301 WeakPolarHBondContact O-CB 3.34Å; C297-A301 PolarHBondContact O-N 3.34Å; A301-K304 PolarHBondContact O-N 3.29Å; A301-F305 VanDerWaalsContact O-CD2 3.31Å; A301-F305 WeakPolarHBondContact O-CD2 3.3Å; A301-F305 PolarHBondContact O-N 2.81Å; A301-T309 HydrophobicContact CB-CG2 3.73Å; A301-T309 PolarHBondContact O-OG1 3Å; A301-T309 VanDerWaalsContact O-OG1 3.11Å; A301-D313 HydrophobicContact CB-CB 4.14Å; A301-M314 HydrophobicContact CB-CB 4.5Å; A301-M314 HydrophobicContact CB-CG 3.9Å; A301-E317 HydrophobicContact CB-CG 3.91Å
302	Y	98.2	Very high	97.8	Very high	69 Å²	69	45.7 Å²	45.7	27%	0.271	22%	0.224	S	C	.	.	H	α-helix	trans	-67.7	-34.2	175.8	-175	-99.3	0	0	0	113.4	S243 P244 R245 N298 R299 L300 K304 S306 T309	S243-Y302 VanDerWaalsContact CB-CG 3.49Å; P244-Y302 HydrophobicContact CG-CE1 3.91Å; P244-Y302 HydrophobicContact CG-CE2 3.92Å; P244-Y302 VanDerWaalsContact CG-CZ 3.5Å; P244-Y302 WeakPolarHBondContact CG-OH 3.35Å; R245-Y302 HydrophobicContact CB-CD2 3.81Å; R245-Y302 HydrophobicContact CB-CE2 4.2Å; N298-Y302 WeakPolarHBondContact O-CB 3.41Å; N298-Y302 PolarHBondContact O-N 3.27Å; R299-Y302 PolarHBondContact O-N 2.86Å; L300-Y302 VanDerWaalsContact C-N 3.34Å; L300-Y302 PolarHBondContact O-N 2.91Å; Y302-K304 PolarHBondContact O-N 3.31Å; Y302-S306 WeakPolarHBondContact CD2-O 3.28Å; Y302-S306 VanDerWaalsContact CE2-C 3.43Å; Y302-S306 WeakPolarHBondContact CE2-O 3.29Å; Y302-S306 WeakPolarHBondContact O-CA 3.41Å; Y302-S306 PolarHBondContact O-N 3.37Å; Y302-T309 VanDerWaalsContact CA-OG1 3.29Å; Y302-T309 WeakPolarHBondContact CA-OG1 3.43Å
303	Q	97.9	Very high	97.8	Very high	132 Å²	132	46.4 Å²	46.4	62%	0.617	23%	0.228	S	C	*	.	H	α-helix	trans	-62.5	-31.5	173.7	-75.1	179.8	-31.3	0	0	112.3	R299 L300	R299-Q303 WeakPolarHBondContact O-CG 3.48Å; R299-Q303 PolarHBondContact O-N 3.28Å; L300-Q303 PolarHBondContact O-N 2.94Å
304	K	98.2	Very high	97.8	Very high	123 Å²	123	46.4 Å²	46.4	54%	0.535	23%	0.228	S	C	.	.	H	α-helix	trans	-86	-41.3	-179.4	-62.7	178	-168.9	177.8	0	113.1	L300 A301 Y302 E317	L300-K304 PolarHBondContact O-N 3.02Å; A301-K304 PolarHBondContact O-N 3.29Å; Y302-K304 PolarHBondContact O-N 3.31Å; K304-E317 WeakPolarHBondContact CD-OE1 3.37Å; K304-E317 WeakPolarHBondContact CE-OE1 3.47Å; K304-E317 IonicContact NZ-OE1 2.69Å; K304-E317 PolarHBondContact NZ-OE1 3.46Å; K304-E317 IonicContact NZ-OE2 2.65Å; K304-E317 PolarHBondContact NZ-OE2 3.49Å
305	F	97.6	Very high	97.8	Very high	83 Å²	83	46.4 Å²	46.4	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-118.8	-10.1	-168.6	-55.2	-74.2	0	0	0	114.3	A301 R307 S308 T309 D313	A301-F305 VanDerWaalsContact O-CD2 3.31Å; A301-F305 WeakPolarHBondContact O-CD2 3.3Å; A301-F305 PolarHBondContact O-N 2.81Å; F305-R307 PolarHBondContact O-N 3.5Å; F305-S308 WeakPolarHBondContact O-CA 3.28Å; F305-S308 WeakPolarHBondContact O-CB 3.34Å; F305-S308 PolarHBondContact O-N 3Å; F305-T309 WeakPolarHBondContact CB-OG1 3.47Å; F305-D313 HydrophobicContact CD2-CB 3.73Å; F305-D313 HydrophobicContact CE2-CB 3.8Å
306	S	96	Very high	97.8	Very high	55 Å²	55	54.5 Å²	54.5	39%	0.385	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	49.2	-119.8	177.9	-172.5	0	0	0	0	112.5	Y302 S308 T309	Y302-S306 WeakPolarHBondContact CD2-O 3.28Å; Y302-S306 VanDerWaalsContact CE2-C 3.43Å; Y302-S306 WeakPolarHBondContact CE2-O 3.29Å; Y302-S306 WeakPolarHBondContact O-CA 3.41Å; Y302-S306 PolarHBondContact O-N 3.37Å; S306-S308 PolarHBondContact O-N 3.33Å; S306-T309 WeakPolarHBondContact O-CB 3.42Å; S306-T309 PolarHBondContact O-N 2.82Å; S306-T309 PolarHBondContact O-OG1 3.21Å
307	R	96.5	Very high	97.9	Very high	217 Å²	217	55 Å²	55	82%	0.819	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-59.3	-29	177.8	-72	-179.1	168.7	175.5	-3.4	113.1	R245 F305 T309	R245-R307 PolarHBondContact NE-O 3.06Å; R245-R307 VanDerWaalsContact NE-O 3.14Å; F305-R307 PolarHBondContact O-N 3.5Å; R307-T309 VanDerWaalsContact C-N 3.31Å; R307-T309 PolarHBondContact O-N 2.9Å
308	S	97.1	Very high	97.9	Very high	90 Å²	90	55.2 Å²	55.2	63%	0.629	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-83.6	-2.2	-177.1	-56.7	0	0	0	0	113.8	F305 S306 T310	F305-S308 WeakPolarHBondContact O-CA 3.28Å; F305-S308 WeakPolarHBondContact O-CB 3.34Å; F305-S308 PolarHBondContact O-N 3Å; S306-S308 PolarHBondContact O-N 3.33Å; S308-T310 PolarHBondContact O-N 2.57Å
309	T	97.6	Very high	97.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.289	C	S	.	.			trans	-56.4	131.3	178.2	-60.4	0	0	0	0	111.9	R245 A301 Y302 F305 S306 R307 M314	R245-T309 HydrophobicContact CG-CG2 4.44Å; R245-T309 PolarHBondContact NE-O 3.29Å; R245-T309 PolarHBondContact NH2-O 2.8Å; A301-T309 HydrophobicContact CB-CG2 3.73Å; A301-T309 PolarHBondContact O-OG1 3Å; A301-T309 VanDerWaalsContact O-OG1 3.11Å; Y302-T309 VanDerWaalsContact CA-OG1 3.29Å; Y302-T309 WeakPolarHBondContact CA-OG1 3.43Å; F305-T309 WeakPolarHBondContact CB-OG1 3.47Å; S306-T309 WeakPolarHBondContact O-CB 3.42Å; S306-T309 PolarHBondContact O-N 2.82Å; S306-T309 PolarHBondContact O-OG1 3.21Å; R307-T309 VanDerWaalsContact C-N 3.31Å; R307-T309 PolarHBondContact O-N 2.9Å; T309-M314 HydrophobicContact CG2-CG 4.16Å
310	T	97.9	Very high	97.9	Very high	58 Å²	58	60.9 Å²	60.9	36%	0.356	29%	0.292	S	S	.	.			trans	-118.2	169.7	174	69.8	0	0	0	0	111.3	S308 S312 D313 M314	S308-T310 PolarHBondContact O-N 2.57Å; T310-S312 VanDerWaalsContact C-N 3.29Å; T310-S312 PolarHBondContact O-N 2.95Å; T310-D313 WeakPolarHBondContact CB-OD2 3.16Å; T310-D313 PolarHBondContact N-OD2 3.25Å; T310-D313 WeakPolarHBondContact O-CB 3.21Å; T310-D313 PolarHBondContact O-N 3.09Å; T310-D313 VanDerWaalsContact OG1-CG 3.25Å; T310-D313 PolarHBondContact OG1-N 2.76Å; T310-D313 PolarHBondContact OG1-OD2 2.92Å; T310-M314 PolarHBondContact O-N 3.22Å; T310-M314 VanDerWaalsContact O-N 3.11Å
311	T	97.5	Very high	97.9	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-65.3	-33.6	175.6	-61.2	0	0	0	0	112.1	F68 C247 G248 G249 D313 M314 I315	F68-T311 HydrophobicContact CB-CG2 4.34Å; F68-T311 HydrophobicContact CD1-CG2 3.88Å; F68-T311 HydrophobicContact CD2-CG2 4.09Å; F68-T311 HydrophobicContact CE1-CG2 4.13Å; F68-T311 HydrophobicContact CE2-CG2 4.34Å; F68-T311 HydrophobicContact CG-CG2 3.86Å; F68-T311 HydrophobicContact CZ-CG2 4.36Å; C247-T311 PolarHBondContact SG-OG1 2.8Å; G248-T311 PolarHBondContact O-OG1 3.3Å; G249-T311 WeakPolarHBondContact CA-OG1 3.18Å; G249-T311 WeakPolarHBondContact O-CG2 3.4Å; T311-D313 VanDerWaalsContact C-N 3.27Å; T311-D313 PolarHBondContact O-N 3.24Å; T311-M314 WeakPolarHBondContact O-CB 3.41Å; T311-M314 PolarHBondContact O-N 3.23Å; T311-M314 VanDerWaalsContact O-N 3.16Å; T311-I315 HydrophobicContact CG2-CD1 3.99Å; T311-I315 HydrophobicContact CG2-CG1 4.43Å; T311-I315 WeakPolarHBondContact O-CG1 3.39Å; T311-I315 PolarHBondContact O-N 2.94Å
312	S	98.1	Very high	97.9	Very high	51 Å²	51	61.2 Å²	61.2	36%	0.357	29%	0.293	S	S	.	.	H	α-helix	trans	-61.8	-36.9	172.9	-57.8	0	0	0	0	112.1	T310 I315 R316	T310-S312 VanDerWaalsContact C-N 3.29Å; T310-S312 PolarHBondContact O-N 2.95Å; S312-I315 PolarHBondContact O-N 3.1Å; S312-R316 WeakPolarHBondContact O-CG 3.08Å; S312-R316 PolarHBondContact O-N 2.96Å
313	D	98.4	Very high	97.9	Very high	15 Å²	15	59.7 Å²	59.7	8%	0.08	29%	0.292	C	S	.	.	H	α-helix	trans	-66.9	-42.1	174.1	-55	-48.5	0	0	0	110.9	A301 F305 T310 T311 I315 R316 E317	A301-D313 HydrophobicContact CB-CB 4.14Å; F305-D313 HydrophobicContact CD2-CB 3.73Å; F305-D313 HydrophobicContact CE2-CB 3.8Å; T310-D313 WeakPolarHBondContact CB-OD2 3.16Å; T310-D313 PolarHBondContact N-OD2 3.25Å; T310-D313 WeakPolarHBondContact O-CB 3.21Å; T310-D313 PolarHBondContact O-N 3.09Å; T310-D313 VanDerWaalsContact OG1-CG 3.25Å; T310-D313 PolarHBondContact OG1-N 2.76Å; T310-D313 PolarHBondContact OG1-OD2 2.92Å; T311-D313 VanDerWaalsContact C-N 3.27Å; T311-D313 PolarHBondContact O-N 3.24Å; D313-I315 PolarHBondContact O-N 2.92Å; D313-R316 WeakPolarHBondContact O-CB 3.41Å; D313-R316 PolarHBondContact O-N 3.09Å; D313-R316 IonicContact OD1-NH1 3.47Å; D313-E317 PolarHBondContact O-N 3.4Å
314	M	98.5	Very high	97.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-42.8	175.4	-65.9	176.7	46.6	0	0	112.5	Q250 L253 T294 C297 N298 A301 T309 T310 T311 R316 E317	Q250-M314 HydrophobicContact CB-CE 4.27Å; Q250-M314 HydrophobicContact CG-CE 3.76Å; Q250-M314 HydrophobicContact CG-SD 3.66Å; L253-M314 HydrophobicContact CD1-CB 3.8Å; L253-M314 HydrophobicContact CD1-CE 3.99Å; T294-M314 HydrophobicContact CG2-CE 4.27Å; C297-M314 HydrophobicContact CB-CB 4.35Å; N298-M314 HydrophobicContact CB-CE 3.61Å; N298-M314 HydrophobicContact CB-CG 4.47Å; N298-M314 HydrophobicContact CB-SD 3.95Å; A301-M314 HydrophobicContact CB-CB 4.5Å; A301-M314 HydrophobicContact CB-CG 3.9Å; T309-M314 HydrophobicContact CG2-CG 4.16Å; T310-M314 PolarHBondContact O-N 3.22Å; T310-M314 VanDerWaalsContact O-N 3.11Å; T311-M314 WeakPolarHBondContact O-CB 3.41Å; T311-M314 PolarHBondContact O-N 3.23Å; T311-M314 VanDerWaalsContact O-N 3.16Å; M314-R316 VanDerWaalsContact C-N 3.25Å; M314-R316 PolarHBondContact O-N 3.02Å; M314-E317 WeakPolarHBondContact O-CB 3.42Å; M314-E317 PolarHBondContact O-N 3.39Å
315	I	98.6	Very high	97.8	Very high	14 Å²	14	48.6 Å²	48.6	7%	0.072	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-34.9	178.5	-71.8	165.6	0	0	0	111.2	F68 I71 K75 L253 T311 S312 D313 E317 I318	F68-I315 HydrophobicContact CB-CD1 4.45Å; F68-I315 HydrophobicContact CD1-CD1 3.43Å; F68-I315 VanDerWaalsContact CD1-CD1 3.43Å; F68-I315 HydrophobicContact CE1-CD1 4.07Å; F68-I315 HydrophobicContact CG-CD1 4.3Å; I71-I315 HydrophobicContact CG2-CD1 3.84Å; K75-I315 HydrophobicContact CG-CG2 4Å; L253-I315 HydrophobicContact CD1-CG1 3.97Å; L253-I315 HydrophobicContact CG-CG1 4.34Å; T311-I315 HydrophobicContact CG2-CD1 3.99Å; T311-I315 HydrophobicContact CG2-CG1 4.43Å; T311-I315 WeakPolarHBondContact O-CG1 3.39Å; T311-I315 PolarHBondContact O-N 2.94Å; S312-I315 PolarHBondContact O-N 3.1Å; D313-I315 PolarHBondContact O-N 2.92Å; I315-E317 PolarHBondContact O-N 3.15Å; I315-I318 HydrophobicContact CB-CD1 4.3Å; I315-I318 HydrophobicContact CG1-CD1 4.32Å; I315-I318 HydrophobicContact CG2-CD1 4.09Å; I315-I318 WeakPolarHBondContact O-CB 3.29Å; I315-I318 WeakPolarHBondContact O-CG1 3.48Å; I315-I318 PolarHBondContact O-N 3.07Å
316	R	98.4	Very high	97.7	Very high	182 Å²	182	45.2 Å²	45.2	69%	0.687	23%	0.228	S	C	*	.	H	α-helix	trans	-65.8	-22	174.8	-70.7	169.6	177.7	172.6	-3	113	S312 D313 M314	S312-R316 WeakPolarHBondContact O-CG 3.08Å; S312-R316 PolarHBondContact O-N 2.96Å; D313-R316 WeakPolarHBondContact O-CB 3.41Å; D313-R316 PolarHBondContact O-N 3.09Å; D313-R316 IonicContact OD1-NH1 3.47Å; M314-R316 VanDerWaalsContact C-N 3.25Å; M314-R316 PolarHBondContact O-N 3.02Å
317	E	98.5	Very high	97.4	Very high	13 Å²	13	48.6 Å²	48.6	6%	0.061	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-4.6	177	-56.6	-53.1	143.7	0	0	113.8	C297 L300 A301 K304 D313 M314 I315 Q319 C320 A321	C297-E317 HydrophobicContact CB-CB 4.39Å; L300-E317 HydrophobicContact CB-CB 4.02Å; L300-E317 HydrophobicContact CB-CG 3.84Å; L300-E317 HydrophobicContact CD1-CB 4.32Å; A301-E317 HydrophobicContact CB-CG 3.91Å; K304-E317 WeakPolarHBondContact CD-OE1 3.37Å; K304-E317 WeakPolarHBondContact CE-OE1 3.47Å; K304-E317 IonicContact NZ-OE1 2.69Å; K304-E317 PolarHBondContact NZ-OE1 3.46Å; K304-E317 IonicContact NZ-OE2 2.65Å; K304-E317 PolarHBondContact NZ-OE2 3.49Å; D313-E317 PolarHBondContact O-N 3.4Å; M314-E317 WeakPolarHBondContact O-CB 3.42Å; M314-E317 PolarHBondContact O-N 3.39Å; I315-E317 PolarHBondContact O-N 3.15Å; E317-Q319 VanDerWaalsContact C-N 3.32Å; E317-Q319 PolarHBondContact O-N 3.14Å; E317-C320 PolarHBondContact O-N 3.1Å; E317-C320 VanDerWaalsContact O-N 3.1Å; E317-A321 WeakPolarHBondContact O-CB 3.44Å; E317-A321 PolarHBondContact O-N 2.98Å
318	I	98.7	Very high	97.4	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.015	21%	0.213	C	C	.	.	H	α-helix	trans	-52.7	-48.7	-176	-73	170.9	0	0	0	111.4	K75 L253 L293 I315 C320 A321 F322	K75-I318 HydrophobicContact CB-CB 4.47Å; K75-I318 HydrophobicContact CB-CD1 3.69Å; K75-I318 HydrophobicContact CB-CG2 4.34Å; K75-I318 WeakPolarHBondContact O-CG2 3.02Å; L253-I318 HydrophobicContact CD1-CD1 4.49Å; L253-I318 HydrophobicContact CG-CD1 4.37Å; L293-I318 HydrophobicContact CD2-CG2 4.41Å; I315-I318 HydrophobicContact CB-CD1 4.3Å; I315-I318 HydrophobicContact CG1-CD1 4.32Å; I315-I318 HydrophobicContact CG2-CD1 4.09Å; I315-I318 WeakPolarHBondContact O-CB 3.29Å; I315-I318 WeakPolarHBondContact O-CG1 3.48Å; I315-I318 PolarHBondContact O-N 3.07Å; I318-C320 PolarHBondContact O-N 3.35Å; I318-A321 PolarHBondContact O-N 3.34Å; I318-F322 WeakPolarHBondContact O-CB 3.08Å; I318-F322 PolarHBondContact O-N 2.71Å
319	Q	98	Very high	97.4	Very high	126 Å²	126	37.5 Å²	37.5	59%	0.589	19%	0.191	S	C	*	.	H	α-helix	trans	-60.5	-46.6	179.3	177.7	59.5	42	0	0	112.5	E317 F322 S323	E317-Q319 VanDerWaalsContact C-N 3.32Å; E317-Q319 PolarHBondContact O-N 3.14Å; Q319-F322 PolarHBondContact O-N 3.42Å; Q319-S323 PolarHBondContact NE2-OG 2.92Å; Q319-S323 VanDerWaalsContact NE2-OG 3.15Å; Q319-S323 PolarHBondContact O-N 2.85Å; Q319-S323 PolarHBondContact O-OG 3.1Å
320	C	98.5	Very high	97.4	Very high	31 Å²	31	39.6 Å²	39.6	21%	0.209	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-41.6	-177.9	-175.1	0	0	0	0	111.1	L300 E317 I318 S323 N324	L300-C320 HydrophobicContact CD1-CB 4.04Å; E317-C320 PolarHBondContact O-N 3.1Å; E317-C320 VanDerWaalsContact O-N 3.1Å; I318-C320 PolarHBondContact O-N 3.35Å; C320-S323 PolarHBondContact O-N 3.36Å; C320-N324 WeakPolarHBondContact O-CB 3.17Å; C320-N324 PolarHBondContact O-N 3.41Å; C320-N324 PolarHBondContact O-OD1 3.17Å
321	A	98.5	Very high	97.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.4	-42.6	174.8	0	0	0	0	0	111.7	L293 E296 C297 L300 E317 I318 N324 L325	L293-A321 HydrophobicContact CD1-CB 3.71Å; E296-A321 HydrophobicContact CB-CB 3.92Å; E296-A321 HydrophobicContact CG-CB 3.55Å; C297-A321 HydrophobicContact CB-CB 4.48Å; C297-A321 WeakPolarHBondContact SG-CB 3.18Å; L300-A321 HydrophobicContact CD1-CB 3.99Å; E317-A321 WeakPolarHBondContact O-CB 3.44Å; E317-A321 PolarHBondContact O-N 2.98Å; I318-A321 PolarHBondContact O-N 3.34Å; A321-N324 PolarHBondContact O-N 3.06Å; A321-L325 WeakPolarHBondContact O-CB 3.35Å; A321-L325 WeakPolarHBondContact O-CD1 3.4Å; A321-L325 VanDerWaalsContact O-CG 3.23Å; A321-L325 WeakPolarHBondContact O-CG 3.34Å; A321-L325 PolarHBondContact O-N 3.42Å; A321-L325 VanDerWaalsContact O-N 3.08Å
322	F	98.2	Very high	97.4	Very high	21 Å²	21	40.8 Å²	40.8	9%	0.092	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-50	177.8	-164.3	-78.2	0	0	0	110.5	I38 T76 F261 W264 L293 I318 Q319 N324 L325 F326	I38-F322 HydrophobicContact CD1-CE1 4.13Å; I38-F322 HydrophobicContact CD1-CZ 3.71Å; I38-F322 HydrophobicContact CG1-CZ 4.17Å; I38-F322 HydrophobicContact CG2-CE1 4.17Å; I38-F322 HydrophobicContact CG2-CZ 3.8Å; T76-F322 HydrophobicContact CG2-CE2 4.3Å; F261-F322 HydrophobicContact CE1-CE2 4.38Å; F261-F322 AromaticContact CZ-CE2 3.89Å; F261-F322 HydrophobicContact CZ-CE2 3.89Å; W264-F322 AromaticContact CH2-CE2 3.95Å; W264-F322 HydrophobicContact CH2-CE2 3.95Å; W264-F322 AromaticContact CH2-CZ 3.97Å; W264-F322 HydrophobicContact CH2-CZ 3.97Å; W264-F322 AromaticContact CZ3-CE2 3.73Å; W264-F322 HydrophobicContact CZ3-CE2 3.73Å; W264-F322 AromaticContact CZ3-CZ 3.75Å; W264-F322 HydrophobicContact CZ3-CZ 3.75Å; L293-F322 HydrophobicContact CD1-CB 4.07Å; L293-F322 HydrophobicContact CD1-CD2 4.36Å; L293-F322 HydrophobicContact CD2-CD2 4.36Å; I318-F322 WeakPolarHBondContact O-CB 3.08Å; I318-F322 PolarHBondContact O-N 2.71Å; Q319-F322 PolarHBondContact O-N 3.42Å; F322-N324 PolarHBondContact O-N 2.85Å; F322-L325 PolarHBondContact O-N 3.06Å; F322-F326 HydrophobicContact CB-CD2 4.32Å; F322-F326 HydrophobicContact CD1-CB 4.2Å; F322-F326 AromaticContact CD1-CD2 3.83Å; F322-F326 HydrophobicContact CD1-CD2 3.83Å; F322-F326 AromaticContact CD2-CD2 3.61Å; F322-F326 HydrophobicContact CD2-CD2 3.61Å; F322-F326 AromaticContact CD2-CE2 3.88Å; F322-F326 HydrophobicContact CD2-CE2 3.88Å; F322-F326 HydrophobicContact CE1-CB 4.02Å; F322-F326 AromaticContact CE1-CD2 3.96Å; F322-F326 HydrophobicContact CE1-CD2 3.96Å; F322-F326 HydrophobicContact CE1-CG 4.43Å; F322-F326 AromaticContact CE2-CD2 3.76Å; F322-F326 HydrophobicContact CE2-CD2 3.76Å; F322-F326 HydrophobicContact CE2-CE2 4.1Å; F322-F326 AromaticContact CG-CD2 3.65Å; F322-F326 HydrophobicContact CG-CD2 3.65Å; F322-F326 HydrophobicContact CG-CE2 4.27Å; F322-F326 AromaticContact CZ-CD2 3.93Å; F322-F326 HydrophobicContact CZ-CD2 3.93Å; F322-F326 WeakPolarHBondContact O-CB 3.25Å; F322-F326 WeakPolarHBondContact O-CD2 3.47Å; F322-F326 PolarHBondContact O-N 3.45Å
323	S	97.3	Very high	97.4	Very high	36 Å²	36	40.1 Å²	40.1	25%	0.252	19%	0.193	S	C	.	.	H	α-helix	trans	-63	-41.3	177.1	-69.9	0	0	0	0	113	Q319 C320 L325 D327	Q319-S323 PolarHBondContact NE2-OG 2.92Å; Q319-S323 VanDerWaalsContact NE2-OG 3.15Å; Q319-S323 PolarHBondContact O-N 2.85Å; Q319-S323 PolarHBondContact O-OG 3.1Å; C320-S323 PolarHBondContact O-N 3.36Å; S323-L325 PolarHBondContact O-N 2.99Å; S323-D327 WeakPolarHBondContact CA-OD2 2.99Å; S323-D327 WeakPolarHBondContact CB-OD2 3.04Å; S323-D327 WeakPolarHBondContact O-CB 3.45Å; S323-D327 PolarHBondContact O-N 3.24Å; S323-D327 PolarHBondContact OG-OD2 3.11Å
324	N	96.8	Very high	97.3	Very high	17 Å²	17	41.9 Å²	41.9	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-32.9	177.2	-74.1	-5.5	0	0	0	113.3	V15 E296 C320 A321 F322	V15-N324 HydrophobicContact CG1-CB 4.1Å; E296-N324 PolarHBondContact OE1-ND2 3.2Å; C320-N324 WeakPolarHBondContact O-CB 3.17Å; C320-N324 PolarHBondContact O-N 3.41Å; C320-N324 PolarHBondContact O-OD1 3.17Å; A321-N324 PolarHBondContact O-N 3.06Å; F322-N324 PolarHBondContact O-N 2.85Å
325	L	96.6	Very high	97.2	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-91.4	-43.2	-174.5	-71.8	168.1	0	0	0	112.7	F19 M31 K35 L293 E296 A321 F322 S323	F19-L325 HydrophobicContact CE1-CD2 3.78Å; F19-L325 HydrophobicContact CE2-CD2 3.79Å; F19-L325 HydrophobicContact CZ-CD2 3.18Å; F19-L325 HydrophobicContact CZ-CG 4.46Å; M31-L325 HydrophobicContact CE-CD2 3.97Å; K35-L325 WeakPolarHBondContact CE-O 3.43Å; K35-L325 PolarHBondContact NZ-O 3.22Å; L293-L325 VanDerWaalsContact CA-CD1 3.48Å; L293-L325 HydrophobicContact CB-CD1 4.25Å; L293-L325 HydrophobicContact CD1-CD1 4.29Å; E296-L325 HydrophobicContact CB-CD1 3.89Å; E296-L325 HydrophobicContact CB-CG 4.37Å; E296-L325 HydrophobicContact CG-CD1 4.3Å; E296-L325 HydrophobicContact CG-CG 4.36Å; A321-L325 WeakPolarHBondContact O-CB 3.35Å; A321-L325 WeakPolarHBondContact O-CD1 3.4Å; A321-L325 VanDerWaalsContact O-CG 3.23Å; A321-L325 WeakPolarHBondContact O-CG 3.34Å; A321-L325 PolarHBondContact O-N 3.42Å; A321-L325 VanDerWaalsContact O-N 3.08Å; F322-L325 PolarHBondContact O-N 3.06Å; S323-L325 PolarHBondContact O-N 2.99Å
326	F	95.8	Very high	97.1	Very high	11 Å²	11	47.7 Å²	47.7	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-114.3	-25	-160.2	-53.9	-53.8	0	0	0	114.2	M31 V34 K35 I38 F261 A289 L293 F322	M31-F326 HydrophobicContact CE-CE1 4.23Å; M31-F326 HydrophobicContact SD-CD1 3.71Å; M31-F326 HydrophobicContact SD-CE1 3.57Å; M31-F326 VanDerWaalsContact SD-CE1 3.57Å; V34-F326 HydrophobicContact CG1-CD1 3.91Å; V34-F326 HydrophobicContact CG1-CE1 3.62Å; V34-F326 HydrophobicContact CG1-CZ 4.42Å; K35-F326 VanDerWaalsContact CD-O 3.31Å; K35-F326 WeakPolarHBondContact CD-O 3.29Å; K35-F326 VanDerWaalsContact CE-O 3.26Å; K35-F326 WeakPolarHBondContact CE-O 3.48Å; K35-F326 WeakPolarHBondContact CG-O 3.5Å; K35-F326 PolarHBondContact NZ-O 2.75Å; I38-F326 HydrophobicContact CD1-CB 3.45Å; I38-F326 VanDerWaalsContact CD1-CB 3.45Å; I38-F326 HydrophobicContact CD1-CD1 3.92Å; I38-F326 HydrophobicContact CD1-CD2 4.05Å; I38-F326 HydrophobicContact CD1-CG 3.53Å; F261-F326 HydrophobicContact CE1-CE2 4.45Å; F261-F326 HydrophobicContact CE1-CZ 4.44Å; F261-F326 HydrophobicContact CE2-CE2 4.47Å; F261-F326 HydrophobicContact CZ-CD2 4.37Å; F261-F326 AromaticContact CZ-CE2 3.65Å; F261-F326 HydrophobicContact CZ-CE2 3.65Å; F261-F326 AromaticContact CZ-CZ 3.8Å; F261-F326 HydrophobicContact CZ-CZ 3.8Å; A289-F326 HydrophobicContact CB-CE1 4.46Å; A289-F326 HydrophobicContact CB-CZ 4.27Å; L293-F326 HydrophobicContact CB-CE2 4.29Å; L293-F326 HydrophobicContact CB-CZ 4.46Å; L293-F326 HydrophobicContact CD1-CE2 4.24Å; F322-F326 HydrophobicContact CB-CD2 4.32Å; F322-F326 HydrophobicContact CD1-CB 4.2Å; F322-F326 AromaticContact CD1-CD2 3.83Å; F322-F326 HydrophobicContact CD1-CD2 3.83Å; F322-F326 AromaticContact CD2-CD2 3.61Å; F322-F326 HydrophobicContact CD2-CD2 3.61Å; F322-F326 AromaticContact CD2-CE2 3.88Å; F322-F326 HydrophobicContact CD2-CE2 3.88Å; F322-F326 HydrophobicContact CE1-CB 4.02Å; F322-F326 AromaticContact CE1-CD2 3.96Å; F322-F326 HydrophobicContact CE1-CD2 3.96Å; F322-F326 HydrophobicContact CE1-CG 4.43Å; F322-F326 AromaticContact CE2-CD2 3.76Å; F322-F326 HydrophobicContact CE2-CD2 3.76Å; F322-F326 HydrophobicContact CE2-CE2 4.1Å; F322-F326 AromaticContact CG-CD2 3.65Å; F322-F326 HydrophobicContact CG-CD2 3.65Å; F322-F326 HydrophobicContact CG-CE2 4.27Å; F322-F326 AromaticContact CZ-CD2 3.93Å; F322-F326 HydrophobicContact CZ-CD2 3.93Å; F322-F326 WeakPolarHBondContact O-CB 3.25Å; F322-F326 WeakPolarHBondContact O-CD2 3.47Å; F322-F326 PolarHBondContact O-N 3.45Å
327	D	89.6	Confident	97	Very high	126 Å²	126	35.5 Å²	35.5	67%	0.674	19%	0.188	S	C	*	.			trans	-78.1	0	169.7	-56.2	-25	0	0	0	110.2	K35 S323	K35-D327 PolarHBondContact NZ-O 2.81Å; K35-D327 PolarHBondContact NZ-OXT 2.73Å; S323-D327 WeakPolarHBondContact CA-OD2 2.99Å; S323-D327 WeakPolarHBondContact CB-OD2 3.04Å; S323-D327 WeakPolarHBondContact O-CB 3.45Å; S323-D327 PolarHBondContact O-N 3.24Å; S323-D327 PolarHBondContact OG-OD2 3.11Å

Retrieved 327 of 327 residues in 1170.7 ms (Link to these results)

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