A0A2R9AD99_PANPA Loading...

Transforming growth factor beta

Multifunctional protein that regulates various processes such as angiogenesis and heart development. Activation into mature form follows different steps: following cleavage of the proprotein in the Golgi apparatus, Latency-associated peptide (LAP) and Transforming growth factor beta-2 (TGF-beta-2) chains remain non-covalently linked rendering TGF-beta-2 inactive during storage in extracellular matrix. At the same time, LAP chain interacts with 'milieu molecules', such as LTBP1 and LRRC32/GARP, that control activation of TGF-beta-2 and maintain it in a latent state during storage in extracellular milieus. Once activated following release of LAP, TGF-beta-2 acts by binding to TGF-beta receptors (TGFBR1 and TGFBR2), which transduce signal. Precursor of the Latency-associated peptide (LAP) and Transforming growth factor beta-2 (TGF-beta-2) chains, which constitute the regulatory and active subunit of TGF-beta-2, respectively. Required to maintain the Transforming growth factor beta-2 (TGF-beta-2) chain in a latent state during storage in extracellular matrix. Associates non-covalently with TGF-beta-2 and regulates its activation via interaction with 'milieu molecules', such as LTBP1 and LRRC32/GARP, that control activation of TGF-beta-2.

AlphaFold DB , UniProt , Accession A0A2R9AD99, Species PANPA (Pan paniscus, Pygmy chimpanzee), Gene TGFB2, Length 442 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	58.5	Low	64.2	Low	204 Å²	204	118.1 Å²	118.1	100%	1.005	61%	0.613	S	S	*	*				0	-44.6	0	-66.8	-57.1	-167	0	0	113.1	Y3	M1-Y3 PolarHBondContact O-N 2.91Å
2	H	59.1	Low	63.8	Low	155 Å²	155	117.6 Å²	117.6	72%	0.718	61%	0.611	S	S	*	*	H	α-helix	trans	-66.3	-34.8	-177.3	-73.4	-73.2	0	0	0	115.9	V5 L6	H2-V5 PolarHBondContact O-N 3.09Å; H2-L6 PolarHBondContact O-N 3.48Å; H2-L6 VanDerWaalsContact O-N 3.14Å
3	Y	62.9	Low	63.3	Low	204 Å²	204	118.1 Å²	118.1	80%	0.8	61%	0.608	S	S	*	*	H	α-helix	trans	-70.1	-34.4	-179.4	-72.1	-77.5	0	0	0	114	M1 S7	M1-Y3 PolarHBondContact O-N 2.91Å; Y3-S7 PolarHBondContact O-N 3.34Å
4	C	65.7	Low	62.8	Low	93 Å²	93	117.6 Å²	117.6	63%	0.628	61%	0.606	S	S	*	*	H	α-helix	trans	-68.6	-39.3	176.5	-70.1	0	0	0	0	111.7	S7 A8	C4-S7 PolarHBondContact O-N 3.06Å; C4-S7 PolarHBondContact O-OG 3.47Å; C4-A8 WeakPolarHBondContact O-CB 3.18Å; C4-A8 PolarHBondContact O-N 3.48Å
5	V	68.9	Low	62.2	Low	81 Å²	81	114.5 Å²	114.5	49%	0.491	60%	0.595	S	S	.	*	H	α-helix	trans	-66.2	-42.5	178.1	178.8	0	0	0	0	110.6	H2 S7 A8 F9	H2-V5 PolarHBondContact O-N 3.09Å; V5-S7 PolarHBondContact O-N 3.14Å; V5-A8 PolarHBondContact O-N 2.92Å; V5-F9 HydrophobicContact CG1-CD2 3.82Å; V5-F9 HydrophobicContact CG1-CE2 3.92Å; V5-F9 WeakPolarHBondContact O-CD2 3.42Å; V5-F9 PolarHBondContact O-N 3.45Å
6	L	63.8	Low	61.7	Low	109 Å²	109	112.2 Å²	112.2	57%	0.571	59%	0.587	S	S	*	*	H	α-helix	trans	-61.6	-41.5	174.2	-91.1	151.8	0	0	0	112.4	H2 F9 L10	H2-L6 PolarHBondContact O-N 3.48Å; H2-L6 VanDerWaalsContact O-N 3.14Å; L6-F9 PolarHBondContact O-N 2.96Å; L6-L10 WeakPolarHBondContact O-CB 3.38Å; L6-L10 PolarHBondContact O-N 3.31Å
7	S	66.7	Low	61.2	Low	60 Å²	60	111.5 Å²	111.5	42%	0.42	59%	0.589	S	S	.	*	H	α-helix	trans	-66.9	-37.5	176.3	85.5	0	0	0	0	112.4	Y3 C4 V5 L10 I11	Y3-S7 PolarHBondContact O-N 3.34Å; C4-S7 PolarHBondContact O-N 3.06Å; C4-S7 PolarHBondContact O-OG 3.47Å; V5-S7 PolarHBondContact O-N 3.14Å; S7-L10 PolarHBondContact O-N 3.47Å; S7-I11 WeakPolarHBondContact O-CB 3.25Å; S7-I11 WeakPolarHBondContact O-CD1 3.33Å; S7-I11 WeakPolarHBondContact O-CG1 3.47Å; S7-I11 PolarHBondContact O-N 3.27Å
8	A	67.6	Low	60.5	Low	56 Å²	56	109.4 Å²	109.4	46%	0.463	59%	0.589	S	S	.	*	H	α-helix	trans	-67.2	-40.6	177.8	0	0	0	0	0	111.5	C4 V5 I11 L12	C4-A8 WeakPolarHBondContact O-CB 3.18Å; C4-A8 PolarHBondContact O-N 3.48Å; V5-A8 PolarHBondContact O-N 2.92Å; A8-I11 PolarHBondContact O-N 3.47Å; A8-L12 WeakPolarHBondContact O-CB 3.44Å; A8-L12 PolarHBondContact O-N 2.94Å
9	F	63.7	Low	59.8	Low	125 Å²	125	109.8 Å²	109.8	55%	0.548	59%	0.591	S	S	.	*	H	α-helix	trans	-66.2	-37.9	173.2	-92	-79.8	0	0	0	112.5	V5 L6 L12 H13	V5-F9 HydrophobicContact CG1-CD2 3.82Å; V5-F9 HydrophobicContact CG1-CE2 3.92Å; V5-F9 WeakPolarHBondContact O-CD2 3.42Å; V5-F9 PolarHBondContact O-N 3.45Å; L6-F9 PolarHBondContact O-N 2.96Å; F9-L12 PolarHBondContact O-N 3.27Å; F9-H13 WeakPolarHBondContact O-CB 3.46Å; F9-H13 PolarHBondContact O-CD2 2.99Å; F9-H13 PolarHBondContact O-N 2.97Å
10	L	64.3	Low	59	Low	109 Å²	109	108.8 Å²	108.8	57%	0.571	59%	0.592	S	S	*	*	H	α-helix	trans	-67.6	-39.6	177.6	-136.8	112.1	0	0	0	111.7	L6 S7 H13 L14	L6-L10 WeakPolarHBondContact O-CB 3.38Å; L6-L10 PolarHBondContact O-N 3.31Å; S7-L10 PolarHBondContact O-N 3.47Å; L10-H13 PolarHBondContact O-N 2.92Å; L10-L14 HydrophobicContact CD2-CD1 4.23Å; L10-L14 WeakPolarHBondContact O-CB 3.34Å; L10-L14 WeakPolarHBondContact O-CD1 3.34Å; L10-L14 WeakPolarHBondContact O-CG 3.24Å; L10-L14 PolarHBondContact O-N 2.88Å
11	I	65.1	Low	58.4	Low	103 Å²	103	109.5 Å²	109.5	53%	0.528	60%	0.595	S	S	.	*	H	α-helix	trans	-68.4	-39.7	175.4	-65.9	164.4	0	0	0	110.5	S7 A8 H13 L14 V15	S7-I11 WeakPolarHBondContact O-CB 3.25Å; S7-I11 WeakPolarHBondContact O-CD1 3.33Å; S7-I11 WeakPolarHBondContact O-CG1 3.47Å; S7-I11 PolarHBondContact O-N 3.27Å; A8-I11 PolarHBondContact O-N 3.47Å; I11-H13 VanDerWaalsContact C-N 3.33Å; I11-H13 PolarHBondContact O-N 3.33Å; I11-L14 PolarHBondContact O-N 2.74Å; I11-V15 HydrophobicContact CG2-CG2 4.4Å; I11-V15 WeakPolarHBondContact O-CB 3.49Å; I11-V15 VanDerWaalsContact O-CG2 3.25Å; I11-V15 WeakPolarHBondContact O-CG2 3.3Å; I11-V15 PolarHBondContact O-N 3.21Å
12	L	60	Low	57.9	Low	112 Å²	112	104.9 Å²	104.9	59%	0.586	58%	0.583	S	S	*	*	H	α-helix	trans	-67.1	-33.9	176	-156.5	75	0	0	0	112.1	A8 F9 T16	A8-L12 WeakPolarHBondContact O-CB 3.44Å; A8-L12 PolarHBondContact O-N 2.94Å; F9-L12 PolarHBondContact O-N 3.27Å; L12-T16 WeakPolarHBondContact O-CG2 3.33Å; L12-T16 PolarHBondContact O-N 3.47Å; L12-T16 PolarHBondContact O-OG1 3.38Å
13	H	56.6	Low	57.2	Low	124 Å²	124	104.5 Å²	104.5	57%	0.574	59%	0.591	S	S	*	*	H	α-helix	trans	-70	-39.5	171	-90.7	-67.8	0	0	0	112.7	F9 L10 I11 V15 T16 V17	F9-H13 WeakPolarHBondContact O-CB 3.46Å; F9-H13 PolarHBondContact O-CD2 2.99Å; F9-H13 PolarHBondContact O-N 2.97Å; L10-H13 PolarHBondContact O-N 2.92Å; I11-H13 VanDerWaalsContact C-N 3.33Å; I11-H13 PolarHBondContact O-N 3.33Å; H13-V15 VanDerWaalsContact C-N 3.34Å; H13-V15 PolarHBondContact O-N 3.48Å; H13-T16 WeakPolarHBondContact CA-OG1 3.48Å; H13-T16 PolarHBondContact O-N 3.42Å; H13-T16 PolarHBondContact O-OG1 2.98Å; H13-V17 VanDerWaalsContact O-CG2 3.28Å; H13-V17 WeakPolarHBondContact O-CG2 3.47Å; H13-V17 PolarHBondContact O-N 3.12Å
14	L	56	Low	56	Low	111 Å²	111	100.1 Å²	100.1	58%	0.581	59%	0.589	S	S	*	*	H	α-helix	trans	-66.3	-35.4	174.6	-83.6	155.7	0	0	0	112.2	L10 I11 A18	L10-L14 HydrophobicContact CD2-CD1 4.23Å; L10-L14 WeakPolarHBondContact O-CB 3.34Å; L10-L14 WeakPolarHBondContact O-CD1 3.34Å; L10-L14 WeakPolarHBondContact O-CG 3.24Å; L10-L14 PolarHBondContact O-N 2.88Å; I11-L14 PolarHBondContact O-N 2.74Å; L14-A18 WeakPolarHBondContact O-CB 3.42Å; L14-A18 PolarHBondContact O-N 2.92Å
15	V	55	Low	54.7	Low	72 Å²	72	101 Å²	101	44%	0.436	60%	0.596	S	S	.	*	H	α-helix	trans	-72.8	-35.3	176	172.6	0	0	0	0	111.8	I11 H13 A18 L19	I11-V15 HydrophobicContact CG2-CG2 4.4Å; I11-V15 WeakPolarHBondContact O-CB 3.49Å; I11-V15 VanDerWaalsContact O-CG2 3.25Å; I11-V15 WeakPolarHBondContact O-CG2 3.3Å; I11-V15 PolarHBondContact O-N 3.21Å; H13-V15 VanDerWaalsContact C-N 3.34Å; H13-V15 PolarHBondContact O-N 3.48Å; V15-A18 PolarHBondContact O-N 3.43Å; V15-L19 HydrophobicContact CG1-CD1 3.93Å; V15-L19 WeakPolarHBondContact O-CB 3.5Å; V15-L19 WeakPolarHBondContact O-CG 3.46Å; V15-L19 PolarHBondContact O-N 2.96Å
16	T	52.8	Low	53.5	Low	77 Å²	77	103.1 Å²	103.1	47%	0.472	61%	0.61	S	S	.	*	H	α-helix	trans	-72	-32.4	174.7	47.6	0	0	0	0	112.9	L12 H13 L19 S20	L12-T16 WeakPolarHBondContact O-CG2 3.33Å; L12-T16 PolarHBondContact O-N 3.47Å; L12-T16 PolarHBondContact O-OG1 3.38Å; H13-T16 WeakPolarHBondContact CA-OG1 3.48Å; H13-T16 PolarHBondContact O-N 3.42Å; H13-T16 PolarHBondContact O-OG1 2.98Å; T16-L19 PolarHBondContact O-N 3.35Å; T16-S20 PolarHBondContact O-N 2.91Å
17	V	53.4	Low	53	Low	101 Å²	101	105.8 Å²	105.8	61%	0.612	62%	0.624	S	S	*	*	H	α-helix	trans	-73.5	-30	171.3	176.1	0	0	0	0	111.9	H13 S20	H13-V17 VanDerWaalsContact O-CG2 3.28Å; H13-V17 WeakPolarHBondContact O-CG2 3.47Å; H13-V17 PolarHBondContact O-N 3.12Å; V17-S20 PolarHBondContact O-OG 3.05Å
18	A	49.9	Very low	53	Low	73 Å²	73	106 Å²	106	60%	0.603	62%	0.62	S	S	*	*	H	α-helix	trans	-76	-23.3	173.1	0	0	0	0	0	113.4	L14 V15	L14-A18 WeakPolarHBondContact O-CB 3.42Å; L14-A18 PolarHBondContact O-N 2.92Å; V15-A18 PolarHBondContact O-N 3.43Å
19	L	46.1	Very low	53.2	Low	117 Å²	117	107 Å²	107	61%	0.613	62%	0.617	S	S	*	*	S	Bend	trans	-86.5	-4.5	174.6	-75.8	164.2	0	0	0	113.8	V15 T16 L21	V15-L19 HydrophobicContact CG1-CD1 3.93Å; V15-L19 WeakPolarHBondContact O-CB 3.5Å; V15-L19 WeakPolarHBondContact O-CG 3.46Å; V15-L19 PolarHBondContact O-N 2.96Å; T16-L19 PolarHBondContact O-N 3.35Å; L19-L21 HydrophobicContact CD2-CD1 4.45Å; L19-L21 PolarHBondContact O-N 3.4Å
20	S	43.8	Very low	53.9	Low	89 Å²	89	106.4 Å²	106.4	62%	0.622	62%	0.619	S	S	*	*	S	Bend	trans	-73.2	69.3	154.8	47.8	0	0	0	0	109.7	T16 V17 S22	T16-S20 PolarHBondContact O-N 2.91Å; V17-S20 PolarHBondContact O-OG 3.05Å; S20-S22 PolarHBondContact O-N 2.98Å
21	L	47.8	Very low	54.8	Low	125 Å²	125	105.4 Å²	105.4	65%	0.654	61%	0.611	S	S	*	*			trans	-58.5	99.4	169.7	-81	141.3	0	0	0	109.4	L19 T23	L19-L21 HydrophobicContact CD2-CD1 4.45Å; L19-L21 PolarHBondContact O-N 3.4Å; L21-T23 PolarHBondContact O-N 3.38Å; L21-T23 VanDerWaalsContact O-N 3.13Å
22	S	46.4	Very low	55.5	Low	106 Å²	106	105 Å²	105	74%	0.741	61%	0.606	S	S	*	*			trans	36.6	66.5	137.5	66.9	0	0	0	0	117.2	S20	S20-S22 PolarHBondContact O-N 2.98Å
23	T	44.2	Very low	56.7	Low	147 Å²	147	101.8 Å²	101.8	90%	0.902	59%	0.588	S	S	*	*			trans	-100.6	49.1	161.7	55.6	0	0	0	0	110.6	L21	L21-T23 PolarHBondContact O-N 3.38Å; L21-T23 VanDerWaalsContact O-N 3.13Å
24	C	38.1	Very low	58.2	Low	112 Å²	112	104.3 Å²	104.3	76%	0.757	59%	0.593	S	S	*	*			trans	-123	107.3	-178	-155.9	0	0	0	0	111.4
25	S	39.6	Very low	59.8	Low	111 Å²	111	104.4 Å²	104.4	78%	0.776	59%	0.589	S	S	*	*			trans	80.4	34.6	153.1	74.7	0	0	0	0	121.6
26	T	43.2	Very low	61.4	Low	127 Å²	127	103.5 Å²	103.5	78%	0.779	58%	0.577	S	S	*	*			trans	-92.5	87.2	144.8	54.7	0	0	0	0	108.1	D28	T26-D28 WeakPolarHBondContact O-CA 3.49Å; T26-D28 PolarHBondContact O-N 3.02Å; T26-D28 VanDerWaalsContact O-N 3.12Å
27	L	52	Low	63.3	Low	164 Å²	164	101.3 Å²	101.3	86%	0.859	56%	0.562	S	S	*	*			trans	-57.4	118.2	164.2	-125.8	143.4	0	0	0	106.5	M29	L27-M29 PolarHBondContact O-N 2.95Å
28	D	67.7	Low	65.1	Low	64 Å²	64	103.1 Å²	103.1	34%	0.342	56%	0.564	S	S	.	*			trans	-80.5	90.4	-131	-171.6	-5.9	0	0	0	114	T26 D30 Q31 F32	T26-D28 WeakPolarHBondContact O-CA 3.49Å; T26-D28 PolarHBondContact O-N 3.02Å; T26-D28 VanDerWaalsContact O-N 3.12Å; D28-D30 PolarHBondContact O-N 3.02Å; D28-D30 WeakPolarHBondContact OD1-CB 3.36Å; D28-D30 PolarHBondContact OD1-N 3.01Å; D28-D30 VanDerWaalsContact OD1-N 3.15Å; D28-Q31 HydrophobicContact CB-CB 3.74Å; D28-Q31 WeakPolarHBondContact O-CB 3.43Å; D28-Q31 PolarHBondContact O-N 3Å; D28-Q31 VanDerWaalsContact O-N 3.11Å; D28-Q31 PolarHBondContact OD1-N 2.89Å; D28-Q31 VanDerWaalsContact OD2-CB 3.27Å; D28-Q31 WeakPolarHBondContact OD2-CB 3.37Å; D28-F32 VanDerWaalsContact O-CD2 3.32Å; D28-F32 WeakPolarHBondContact O-CD2 3.45Å; D28-F32 PolarHBondContact O-N 3.4Å
29	M	71.4	Confident	67.1	Low	79 Å²	79	102.2 Å²	102.2	39%	0.389	56%	0.557	S	S	.	*	H	α-helix	trans	-57.3	-34.2	174.6	-68.2	-65.6	-80.3	0	0	111.5	L27 Q31 F32 M33 R348 F373 A375	L27-M29 PolarHBondContact O-N 2.95Å; M29-Q31 VanDerWaalsContact C-N 3.34Å; M29-Q31 PolarHBondContact O-N 3.49Å; M29-F32 PolarHBondContact O-N 3.07Å; M29-M33 WeakPolarHBondContact O-CG 3.45Å; M29-M33 PolarHBondContact O-N 3.4Å; M29-R348 HydrophobicContact CE-CB 4.26Å; M29-R348 HydrophobicContact CE-CG 3.68Å; M29-F373 HydrophobicContact CE-CE2 4.05Å; M29-F373 HydrophobicContact CE-CZ 3.72Å; M29-A375 HydrophobicContact CE-CB 4.38Å; M29-A375 HydrophobicContact SD-CB 4.3Å
30	D	78.8	Confident	69.3	Low	111 Å²	111	96.6 Å²	96.6	59%	0.594	53%	0.527	S	S	*	.	H	α-helix	trans	-68	-34.3	177.8	-67	-30.4	0	0	0	111.8	D28 M33 R34	D28-D30 PolarHBondContact O-N 3.02Å; D28-D30 WeakPolarHBondContact OD1-CB 3.36Å; D28-D30 PolarHBondContact OD1-N 3.01Å; D28-D30 VanDerWaalsContact OD1-N 3.15Å; D30-M33 WeakPolarHBondContact O-CB 3.34Å; D30-M33 PolarHBondContact O-N 3.46Å; D30-R34 VanDerWaalsContact O-CG 3.31Å; D30-R34 WeakPolarHBondContact O-CG 3.28Å; D30-R34 PolarHBondContact O-N 2.86Å
31	Q	82.4	Confident	71.6	Confident	89 Å²	89	98 Å²	98	42%	0.416	52%	0.519	S	S	.	.	H	α-helix	trans	-65.1	-41.5	171.1	-177.7	-177.1	52.1	0	0	112.1	D28 M29 M33 R34 K35	D28-Q31 HydrophobicContact CB-CB 3.74Å; D28-Q31 WeakPolarHBondContact O-CB 3.43Å; D28-Q31 PolarHBondContact O-N 3Å; D28-Q31 VanDerWaalsContact O-N 3.11Å; D28-Q31 PolarHBondContact OD1-N 2.89Å; D28-Q31 VanDerWaalsContact OD2-CB 3.27Å; D28-Q31 WeakPolarHBondContact OD2-CB 3.37Å; M29-Q31 VanDerWaalsContact C-N 3.34Å; M29-Q31 PolarHBondContact O-N 3.49Å; Q31-M33 VanDerWaalsContact C-N 3.32Å; Q31-R34 PolarHBondContact O-N 3.31Å; Q31-K35 HydrophobicContact CG-CD 4.32Å; Q31-K35 WeakPolarHBondContact O-CB 3.32Å; Q31-K35 WeakPolarHBondContact O-CG 3.37Å; Q31-K35 PolarHBondContact O-N 3.45Å
32	F	80.8	Confident	73.7	Confident	93 Å²	93	94 Å²	94	41%	0.408	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-40.3	174.1	-78.8	-78.2	0	0	0	111.6	D28 M29 K35 R36 F373	D28-F32 VanDerWaalsContact O-CD2 3.32Å; D28-F32 WeakPolarHBondContact O-CD2 3.45Å; D28-F32 PolarHBondContact O-N 3.4Å; M29-F32 PolarHBondContact O-N 3.07Å; F32-K35 PolarHBondContact O-N 3.1Å; F32-R36 WeakPolarHBondContact O-CB 3.36Å; F32-R36 PolarHBondContact O-N 2.96Å; F32-F373 HydrophobicContact CB-CD2 4.33Å; F32-F373 HydrophobicContact CB-CE2 3.87Å
33	M	84.8	Confident	75.8	Confident	45 Å²	45	91.3 Å²	91.3	22%	0.222	48%	0.484	C	S	.	.	H	α-helix	trans	-60.2	-49.7	174.9	-67.5	-67.8	-107.4	0	0	111.6	M29 D30 Q31 R36 I37 L350 F373	M29-M33 WeakPolarHBondContact O-CG 3.45Å; M29-M33 PolarHBondContact O-N 3.4Å; D30-M33 WeakPolarHBondContact O-CB 3.34Å; D30-M33 PolarHBondContact O-N 3.46Å; Q31-M33 VanDerWaalsContact C-N 3.32Å; M33-R36 WeakPolarHBondContact O-CB 3.4Å; M33-R36 PolarHBondContact O-N 2.8Å; M33-I37 VanDerWaalsContact O-CG1 3.3Å; M33-I37 WeakPolarHBondContact O-CG1 3.38Å; M33-I37 PolarHBondContact O-N 3.3Å; M33-L350 HydrophobicContact CE-CB 3.7Å; M33-L350 HydrophobicContact CE-CD1 3.2Å; M33-L350 HydrophobicContact CE-CG 3.9Å; M33-L350 HydrophobicContact SD-CB 3.69Å; M33-L350 HydrophobicContact SD-CD1 3.51Å; M33-L350 VanDerWaalsContact SD-CD1 3.51Å; M33-L350 HydrophobicContact SD-CD2 3.77Å; M33-L350 HydrophobicContact SD-CG 3.8Å; M33-F373 HydrophobicContact CE-CE1 4.07Å; M33-F373 HydrophobicContact CG-CE1 4.2Å; M33-F373 HydrophobicContact CG-CZ 4.09Å; M33-F373 HydrophobicContact SD-CD1 3.66Å; M33-F373 HydrophobicContact SD-CE1 3.02Å; M33-F373 WeakPolarHBondContact SD-CE1 3.21Å; M33-F373 HydrophobicContact SD-CE2 4.49Å; M33-F373 HydrophobicContact SD-CZ 3.5Å; M33-F373 VanDerWaalsContact SD-CZ 3.5Å
34	R	87.8	Confident	78.1	Confident	177 Å²	177	84.3 Å²	84.3	67%	0.668	44%	0.441	S	S	*	.	H	α-helix	trans	-60.5	-47.9	178.2	-72.4	176.8	-169.3	-146.3	5.1	112	D30 Q31 R36 I37 E38	D30-R34 VanDerWaalsContact O-CG 3.31Å; D30-R34 WeakPolarHBondContact O-CG 3.28Å; D30-R34 PolarHBondContact O-N 2.86Å; Q31-R34 PolarHBondContact O-N 3.31Å; R34-R36 VanDerWaalsContact C-N 3.26Å; R34-R36 PolarHBondContact O-N 3.39Å; R34-I37 PolarHBondContact O-N 2.97Å; R34-I37 VanDerWaalsContact O-N 3.16Å; R34-E38 PolarHBondContact O-N 2.94Å
35	K	89.1	Confident	80.7	Confident	114 Å²	114	80.1 Å²	80.1	50%	0.496	41%	0.411	S	S	.	.	H	α-helix	trans	-57.6	-40.2	175.8	-75.5	177.1	179	174	0	111.8	Q31 F32 A39	Q31-K35 HydrophobicContact CG-CD 4.32Å; Q31-K35 WeakPolarHBondContact O-CB 3.32Å; Q31-K35 WeakPolarHBondContact O-CG 3.37Å; Q31-K35 PolarHBondContact O-N 3.45Å; F32-K35 PolarHBondContact O-N 3.1Å; K35-A39 VanDerWaalsContact O-CB 3.3Å; K35-A39 WeakPolarHBondContact O-CB 3.28Å; K35-A39 PolarHBondContact O-N 3.01Å
36	R	90.1	Very high	83.1	Confident	53 Å²	53	79.1 Å²	79.1	20%	0.2	40%	0.404	C	S	.	.	H	α-helix	trans	-67.3	-42	177.2	-177.6	62.2	173.9	176.1	10.8	111.9	F32 M33 R34 A39 I40 L350 N372 F373 M434	F32-R36 WeakPolarHBondContact O-CB 3.36Å; F32-R36 PolarHBondContact O-N 2.96Å; M33-R36 WeakPolarHBondContact O-CB 3.4Å; M33-R36 PolarHBondContact O-N 2.8Å; R34-R36 VanDerWaalsContact C-N 3.26Å; R34-R36 PolarHBondContact O-N 3.39Å; R36-A39 PolarHBondContact O-N 2.8Å; R36-I40 HydrophobicContact CG-CD1 3.9Å; R36-I40 WeakPolarHBondContact O-CB 3.42Å; R36-I40 VanDerWaalsContact O-CG1 3.3Å; R36-I40 WeakPolarHBondContact O-CG1 3.38Å; R36-I40 PolarHBondContact O-N 3.42Å; R36-L350 HydrophobicContact CB-CD2 3.98Å; R36-L350 HydrophobicContact CG-CD2 3.54Å; R36-N372 PolarHBondContact NE-O 3.16Å; R36-F373 HydrophobicContact CG-CB 4.18Å; R36-M434 PolarHBondContact NH2-O 2.91Å
37	I	91.4	Very high	85.3	Confident	31 Å²	31	76.3 Å²	76.3	16%	0.159	38%	0.381	C	S	.	.	H	α-helix	trans	-61.5	-46.2	176.7	-68	163.8	0	0	0	110.4	M33 R34 I40 R41 I352 D357 L358	M33-I37 VanDerWaalsContact O-CG1 3.3Å; M33-I37 WeakPolarHBondContact O-CG1 3.38Å; M33-I37 PolarHBondContact O-N 3.3Å; R34-I37 PolarHBondContact O-N 2.97Å; R34-I37 VanDerWaalsContact O-N 3.16Å; I37-I40 PolarHBondContact O-N 3.29Å; I37-R41 PolarHBondContact O-N 3.4Å; I37-I352 HydrophobicContact CG1-CD1 4.16Å; I37-I352 HydrophobicContact CG1-CG1 4.32Å; I37-D357 HydrophobicContact CD1-CB 4.49Å; I37-L358 HydrophobicContact CG2-CD2 3.79Å; I37-L358 HydrophobicContact CG2-CG 4.36Å
38	E	91.9	Very high	87.1	Confident	138 Å²	138	69.2 Å²	69.2	65%	0.645	34%	0.344	S	S	*	.	H	α-helix	trans	-63.9	-42	176.5	-72.1	177.6	-179.4	0	0	112.5	R34 I40 R41 G42	R34-E38 PolarHBondContact O-N 2.94Å; E38-I40 VanDerWaalsContact C-N 3.32Å; E38-I40 PolarHBondContact O-N 2.87Å; E38-R41 VanDerWaalsContact O-CB 3.27Å; E38-R41 WeakPolarHBondContact O-CB 3.46Å; E38-R41 PolarHBondContact O-N 3.41Å; E38-G42 PolarHBondContact O-N 3.5Å; E38-G42 VanDerWaalsContact O-N 3.1Å
39	A	91.6	Very high	88.1	Confident	54 Å²	54	75.4 Å²	75.4	45%	0.446	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-42.8	175	0	0	0	0	0	111.6	K35 R36 R41 G42 Q43	K35-A39 VanDerWaalsContact O-CB 3.3Å; K35-A39 WeakPolarHBondContact O-CB 3.28Å; K35-A39 PolarHBondContact O-N 3.01Å; R36-A39 PolarHBondContact O-N 2.8Å; A39-R41 VanDerWaalsContact C-N 3.32Å; A39-R41 PolarHBondContact O-N 2.94Å; A39-G42 PolarHBondContact O-N 3.39Å; A39-Q43 VanDerWaalsContact O-CB 3.24Å; A39-Q43 WeakPolarHBondContact O-CB 3.29Å; A39-Q43 PolarHBondContact O-N 3.28Å
40	I	92.2	Very high	88.8	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.4	-38.5	176.7	-76.4	167.5	0	0	0	111	R36 I37 E38 G42 Q43 I44 I352 Y369 A371 M434	R36-I40 HydrophobicContact CG-CD1 3.9Å; R36-I40 WeakPolarHBondContact O-CB 3.42Å; R36-I40 VanDerWaalsContact O-CG1 3.3Å; R36-I40 WeakPolarHBondContact O-CG1 3.38Å; R36-I40 PolarHBondContact O-N 3.42Å; I37-I40 PolarHBondContact O-N 3.29Å; E38-I40 VanDerWaalsContact C-N 3.32Å; E38-I40 PolarHBondContact O-N 2.87Å; I40-G42 PolarHBondContact O-N 3.47Å; I40-Q43 PolarHBondContact O-N 3.47Å; I40-I44 HydrophobicContact CG2-CD1 3.72Å; I40-I44 HydrophobicContact CG2-CG1 4.33Å; I40-I44 WeakPolarHBondContact O-CG1 3.08Å; I40-I44 PolarHBondContact O-N 2.94Å; I40-I352 HydrophobicContact CB-CD1 4.43Å; I40-I352 HydrophobicContact CD1-CD1 3.22Å; I40-I352 HydrophobicContact CG1-CD1 4.39Å; I40-I352 HydrophobicContact CG2-CD1 4.27Å; I40-Y369 VanDerWaalsContact CG2-OH 3.23Å; I40-Y369 WeakPolarHBondContact CG2-OH 3.36Å; I40-A371 HydrophobicContact CD1-CB 3.61Å; I40-M434 HydrophobicContact CG2-CE 4.06Å
41	R	92.6	Very high	89.2	Confident	118 Å²	118	75.2 Å²	75.2	45%	0.445	37%	0.373	S	S	.	.	H	α-helix	trans	-55.7	-52.7	174.2	-164.3	178.8	-142.6	177.8	5.4	111.3	I37 E38 A39 L45 L358 W360	I37-R41 PolarHBondContact O-N 3.4Å; E38-R41 VanDerWaalsContact O-CB 3.27Å; E38-R41 WeakPolarHBondContact O-CB 3.46Å; E38-R41 PolarHBondContact O-N 3.41Å; A39-R41 VanDerWaalsContact C-N 3.32Å; A39-R41 PolarHBondContact O-N 2.94Å; R41-L45 PolarHBondContact O-N 3.26Å; R41-L358 HydrophobicContact CB-CD2 3.67Å; R41-L358 HydrophobicContact CG-CD2 3.87Å; R41-L358 PolarHBondContact NH2-O 3.38Å; R41-W360 HydrophobicContact CB-CZ2 4.45Å; R41-W360 HydrophobicContact CG-CH2 3.9Å; R41-W360 HydrophobicContact CG-CZ2 3.42Å; R41-W360 VanDerWaalsContact CG-CZ2 3.42Å
42	G	91.9	Very high	89.5	Confident	42 Å²	42	74 Å²	74	43%	0.433	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-39.8	177.7	0	0	0	0	0	112.6	E38 A39 I40 S46	E38-G42 PolarHBondContact O-N 3.5Å; E38-G42 VanDerWaalsContact O-N 3.1Å; A39-G42 PolarHBondContact O-N 3.39Å; I40-G42 PolarHBondContact O-N 3.47Å; G42-S46 WeakPolarHBondContact O-CB 3.39Å; G42-S46 PolarHBondContact O-N 2.73Å
43	Q	91.2	Very high	89.9	Confident	48 Å²	48	71.7 Å²	71.7	22%	0.224	37%	0.369	C	S	.	.	H	α-helix	trans	-63.6	-43	-179.5	-174.9	175.7	0.8	0	0	112.4	A39 I40 K47 N433 M434	A39-Q43 VanDerWaalsContact O-CB 3.24Å; A39-Q43 WeakPolarHBondContact O-CB 3.29Å; A39-Q43 PolarHBondContact O-N 3.28Å; I40-Q43 PolarHBondContact O-N 3.47Å; Q43-K47 HydrophobicContact CG-CD 4.06Å; Q43-K47 WeakPolarHBondContact O-CB 2.92Å; Q43-K47 VanDerWaalsContact O-CG 3.25Å; Q43-K47 WeakPolarHBondContact O-CG 3.39Å; Q43-K47 PolarHBondContact O-N 2.98Å; Q43-N433 PolarHBondContact NE2-O 2.7Å; Q43-M434 VanDerWaalsContact CD-SD 3.57Å; Q43-M434 HydrophobicContact CG-SD 3.86Å; Q43-M434 PolarHBondContact NE2-SD 3.01Å
44	I	92	Very high	90.1	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.6	-51.5	179.2	-67.9	169.5	0	0	0	110.2	I40 S46 K47 L48 F354 W360 W362 I363 L431 M434	I40-I44 HydrophobicContact CG2-CD1 3.72Å; I40-I44 HydrophobicContact CG2-CG1 4.33Å; I40-I44 WeakPolarHBondContact O-CG1 3.08Å; I40-I44 PolarHBondContact O-N 2.94Å; I44-S46 VanDerWaalsContact C-N 3.34Å; I44-S46 PolarHBondContact O-N 2.89Å; I44-K47 PolarHBondContact O-N 3.27Å; I44-L48 HydrophobicContact CG2-CD1 3.76Å; I44-L48 HydrophobicContact CG2-CG 4.44Å; I44-L48 WeakPolarHBondContact O-CB 3.48Å; I44-L48 WeakPolarHBondContact O-CG 3.2Å; I44-L48 PolarHBondContact O-N 2.95Å; I44-F354 HydrophobicContact CD1-CE1 3.79Å; I44-W360 HydrophobicContact CB-CH2 3.98Å; I44-W360 HydrophobicContact CB-CZ3 3.93Å; I44-W360 HydrophobicContact CD1-CH2 4.42Å; I44-W360 HydrophobicContact CD1-CZ3 3.74Å; I44-W360 HydrophobicContact CG1-CZ3 4.43Å; I44-W360 HydrophobicContact CG2-CH2 4.07Å; I44-W360 HydrophobicContact CG2-CZ3 3.75Å; I44-W362 HydrophobicContact CG2-CH2 4.26Å; I44-I363 HydrophobicContact CG2-CD1 4.47Å; I44-L431 HydrophobicContact CB-CD1 4.42Å; I44-L431 HydrophobicContact CG1-CD1 3.94Å; I44-L431 HydrophobicContact CG2-CD1 4.11Å; I44-M434 HydrophobicContact CD1-CE 3.93Å; I44-M434 HydrophobicContact CG1-CE 3.5Å; I44-M434 HydrophobicContact CG1-SD 4.49Å
45	L	91.7	Very high	89.9	Confident	24 Å²	24	71.1 Å²	71.1	13%	0.126	38%	0.376	C	S	.	.	H	α-helix	trans	-59.6	-44.7	179.8	-69.3	177.7	0	0	0	111.6	R41 K47 L48 K49 L50 W360 W362	R41-L45 PolarHBondContact O-N 3.26Å; L45-K47 PolarHBondContact O-N 2.88Å; L45-L48 CarbonylContact O-C 3.56Å; L45-L48 PolarHBondContact O-N 3.17Å; L45-K49 PolarHBondContact O-N 3.29Å; L45-L50 CarbonylContact C-O 3.56Å; L45-L50 WeakPolarHBondContact CB-O 3.47Å; L45-L50 HydrophobicContact CD2-CB 4.08Å; L45-L50 PolarHBondContact O-N 2.98Å; L45-W360 HydrophobicContact CD1-CZ2 4.11Å; L45-W360 HydrophobicContact CD2-CH2 4.34Å; L45-W360 HydrophobicContact CD2-CZ2 4.19Å; L45-W360 HydrophobicContact CG-CH2 4.02Å; L45-W360 HydrophobicContact CG-CZ2 3.96Å; L45-W362 HydrophobicContact CD2-CZ2 4.36Å
46	S	91.3	Very high	89.6	Confident	90 Å²	90	71 Å²	71	63%	0.629	38%	0.38	S	S	*	.	H	α-helix	trans	-61.5	-44.3	177.3	178.9	0	0	0	0	112.7	G42 I44 K49	G42-S46 WeakPolarHBondContact O-CB 3.39Å; G42-S46 PolarHBondContact O-N 2.73Å; I44-S46 VanDerWaalsContact C-N 3.34Å; I44-S46 PolarHBondContact O-N 2.89Å; S46-K49 PolarHBondContact O-N 2.72Å; S46-K49 VanDerWaalsContact O-N 3.11Å
47	K	89.7	Confident	89.3	Confident	69 Å²	69	71.8 Å²	71.8	30%	0.3	38%	0.384	S	S	.	.	H	α-helix	trans	-67.2	-35.9	179.5	-76.9	176.7	-177.4	-75.8	0	112.9	Q43 I44 L45 K49 L431 S432 M434	Q43-K47 HydrophobicContact CG-CD 4.06Å; Q43-K47 WeakPolarHBondContact O-CB 2.92Å; Q43-K47 VanDerWaalsContact O-CG 3.25Å; Q43-K47 WeakPolarHBondContact O-CG 3.39Å; Q43-K47 PolarHBondContact O-N 2.98Å; I44-K47 PolarHBondContact O-N 3.27Å; L45-K47 PolarHBondContact O-N 2.88Å; K47-K49 PolarHBondContact O-N 2.82Å; K47-L431 HydrophobicContact CB-CD2 3.78Å; K47-L431 HydrophobicContact CD-CB 4.24Å; K47-L431 HydrophobicContact CD-CD2 4.27Å; K47-S432 WeakPolarHBondContact CE-O 3.29Å; K47-S432 PolarHBondContact NZ-O 3.05Å; K47-S432 PolarHBondContact NZ-OG 3.49Å; K47-M434 HydrophobicContact CD-SD 4.23Å
48	L	88.1	Confident	88.8	Confident	14 Å²	14	71.5 Å²	71.5	7%	0.073	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.3	174.7	-63	175.7	0	0	0	113	I44 L45 L50 W362 I418 Y420 E429 L431	I44-L48 HydrophobicContact CG2-CD1 3.76Å; I44-L48 HydrophobicContact CG2-CG 4.44Å; I44-L48 WeakPolarHBondContact O-CB 3.48Å; I44-L48 WeakPolarHBondContact O-CG 3.2Å; I44-L48 PolarHBondContact O-N 2.95Å; L45-L48 CarbonylContact O-C 3.56Å; L45-L48 PolarHBondContact O-N 3.17Å; L48-L50 HydrophobicContact CB-CD1 3.97Å; L48-L50 HydrophobicContact CB-CG 3.9Å; L48-L50 HydrophobicContact CD1-CD1 4.18Å; L48-L50 PolarHBondContact O-N 2.88Å; L48-W362 HydrophobicContact CD1-CH2 3.52Å; L48-W362 HydrophobicContact CD1-CZ3 3.91Å; L48-I418 HydrophobicContact CD1-CD1 3.9Å; L48-I418 HydrophobicContact CD2-CD1 4.19Å; L48-Y420 HydrophobicContact CD2-CE1 3.84Å; L48-E429 HydrophobicContact CD2-CB 4.43Å; L48-E429 VanDerWaalsContact CD2-OE2 3.3Å; L48-E429 WeakPolarHBondContact CD2-OE2 3.24Å; L48-L431 HydrophobicContact CD2-CD2 3.83Å; L48-L431 HydrophobicContact CG-CD2 4.15Å
49	K	88.6	Confident	88.3	Confident	194 Å²	194	71 Å²	71	84%	0.843	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	36.4	-174.6	-55.9	179.3	178.2	179	0	112.8	L45 S46 K47	L45-K49 PolarHBondContact O-N 3.29Å; S46-K49 PolarHBondContact O-N 2.72Å; S46-K49 VanDerWaalsContact O-N 3.11Å; K47-K49 PolarHBondContact O-N 2.82Å
50	L	86.3	Confident	87.4	Confident	41 Å²	41	71.5 Å²	71.5	22%	0.215	38%	0.38	C	S	.	.			trans	-102.1	135.8	175.1	-61	177.7	0	0	0	109.3	L45 L48 P54 W362	L45-L50 CarbonylContact C-O 3.56Å; L45-L50 WeakPolarHBondContact CB-O 3.47Å; L45-L50 HydrophobicContact CD2-CB 4.08Å; L45-L50 PolarHBondContact O-N 2.98Å; L48-L50 HydrophobicContact CB-CD1 3.97Å; L48-L50 HydrophobicContact CB-CG 3.9Å; L48-L50 HydrophobicContact CD1-CD1 4.18Å; L48-L50 PolarHBondContact O-N 2.88Å; L50-P54 HydrophobicContact CD1-CG 4.17Å; L50-W362 HydrophobicContact CD1-CH2 4.4Å; L50-W362 HydrophobicContact CD1-CZ3 4.42Å
51	T	87.9	Confident	86.6	Confident	145 Å²	145	80.3 Å²	80.3	89%	0.89	42%	0.422	S	S	*	.	S	Bend	trans	-81.6	-30	174	46.6	0	0	0	0	111.9
52	S	88.9	Confident	85.9	Confident	64 Å²	64	80.9 Å²	80.9	45%	0.448	43%	0.429	S	S	.	.	S	Bend	trans	-146.2	161.4	177.3	57.4	0	0	0	0	110.5
53	P	89.3	Confident	85.5	Confident	45 Å²	45	79.6 Å²	79.6	29%	0.292	41%	0.413	S	S	.	.			trans	-51.5	141.3	168.7	-29.3	38.7	0	0	0	112.1
54	P	88.4	Confident	85.4	Confident	24 Å²	24	80.1 Å²	80.1	16%	0.156	42%	0.421	C	S	.	.			trans	-59	138.4	171.6	-21	32.5	0	0	0	111.3	L50 Y57 W362	L50-P54 HydrophobicContact CD1-CG 4.17Å; P54-Y57 WeakPolarHBondContact O-CD1 3.38Å; P54-Y57 WeakPolarHBondContact O-CE1 3.45Å; P54-W362 HydrophobicContact CG-CD2 4.22Å; P54-W362 HydrophobicContact CG-CE3 3.96Å
55	E	83.9	Confident	85.2	Confident	186 Å²	186	85.3 Å²	85.3	87%	0.869	45%	0.454	S	S	*	.	S	Bend	trans	-89.6	-30.8	177.5	-64.6	-173.5	171.1	0	0	112.5
56	D	82.8	Confident	85	Confident	110 Å²	110	91.1 Å²	91.1	59%	0.588	48%	0.481	S	S	*	.			trans	-105.2	109.7	179	-176.6	28.4	0	0	0	110.7
57	Y	83.2	Confident	84.8	Confident	70 Å²	70	87.7 Å²	87.7	28%	0.275	46%	0.456	S	S	.	.			trans	-153.7	145.9	176.6	53.3	-86.4	0	0	0	110.4	P54 K361 W362	P54-Y57 WeakPolarHBondContact O-CD1 3.38Å; P54-Y57 WeakPolarHBondContact O-CE1 3.45Å; Y57-K361 HydrophobicContact CE2-CB 3.84Å; Y57-W362 HydrophobicContact CD1-CB 3.6Å; Y57-W362 HydrophobicContact CD2-CB 4.04Å; Y57-W362 HydrophobicContact CE1-CB 3.74Å; Y57-W362 HydrophobicContact CE2-CB 4.14Å; Y57-W362 HydrophobicContact CG-CB 3.77Å
58	P	82.3	Confident	84.7	Confident	26 Å²	26	87.3 Å²	87.3	17%	0.169	46%	0.456	C	S	.	.			trans	-66.1	150.7	176.8	27.8	-33.8	0	0	0	111.1	E62 H364 Y421	P58-E62 WeakPolarHBondContact CA-OE2 3.44Å; P58-E62 HydrophobicContact CB-CB 4.12Å; P58-H364 PolarHBondContact O-NE2 2.9Å; P58-Y421 HydrophobicContact CG-CD1 3.66Å; P58-Y421 HydrophobicContact CG-CD2 3.85Å; P58-Y421 HydrophobicContact CG-CE1 3.8Å; P58-Y421 HydrophobicContact CG-CE2 3.99Å; P58-Y421 HydrophobicContact CG-CG 3.68Å
59	E	80.2	Confident	84.7	Confident	126 Å²	126	89.9 Å²	89.9	59%	0.589	48%	0.476	S	S	*	.			trans	-66.6	155	174.6	-70.7	-155.9	159.4	0	0	111.1	E61 E62	E59-E61 PolarHBondContact O-N 3.37Å; E59-E61 VanDerWaalsContact O-N 3.09Å; E59-E62 HydrophobicContact CB-CG 4.24Å; E59-E62 PolarHBondContact N-OE2 3.36Å; E59-E62 WeakPolarHBondContact O-CB 3.49Å; E59-E62 PolarHBondContact O-N 3.13Å
60	P	73.8	Confident	84.7	Confident	65 Å²	65	84.8 Å²	84.8	42%	0.422	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-55.2	-29.4	-179.1	-27.9	36.1	0	0	0	115.2	E62	P60-E62 VanDerWaalsContact C-N 3.28Å
61	E	73.9	Confident	84.9	Confident	186 Å²	186	83.3 Å²	83.3	87%	0.869	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-75.4	-16.7	177.9	-63.7	-178.7	-174.8	0	0	112.8	E59	E59-E61 PolarHBondContact O-N 3.37Å; E59-E61 VanDerWaalsContact O-N 3.09Å
62	E	77.8	Confident	84.9	Confident	129 Å²	129	79 Å²	79	60%	0.603	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-94.2	-2.8	-178.1	-58.6	-179.6	149.9	0	0	113.1	P58 E59 P60 P64	P58-E62 WeakPolarHBondContact CA-OE2 3.44Å; P58-E62 HydrophobicContact CB-CB 4.12Å; E59-E62 HydrophobicContact CB-CG 4.24Å; E59-E62 PolarHBondContact N-OE2 3.36Å; E59-E62 WeakPolarHBondContact O-CB 3.49Å; E59-E62 PolarHBondContact O-N 3.13Å; P60-E62 VanDerWaalsContact C-N 3.28Å; E62-P64 VanDerWaalsContact O-CD 3.3Å; E62-P64 WeakPolarHBondContact O-CD 3.41Å
63	V	85.3	Confident	84.9	Confident	15 Å²	15	79.4 Å²	79.4	9%	0.091	42%	0.423	C	S	.	.	S	Bend	trans	-72.7	119.7	179.8	-177.6	0	0	0	0	109.8	V67 I68 H364 L419 Y421	V63-V67 HydrophobicContact CG1-CB 4.2Å; V63-V67 HydrophobicContact CG1-CG1 4.32Å; V63-I68 HydrophobicContact CG1-CD1 4.23Å; V63-I68 HydrophobicContact CG1-CG1 3.91Å; V63-H364 HydrophobicContact CG2-CB 4.39Å; V63-H364 WeakPolarHBondContact CG2-CD2 2.99Å; V63-L419 HydrophobicContact CG1-CD2 4.5Å; V63-Y421 HydrophobicContact CG1-CE2 4.36Å; V63-Y421 HydrophobicContact CG2-CE2 4.15Å
64	P	89	Confident	84.9	Confident	60 Å²	60	79.4 Å²	79.4	39%	0.39	42%	0.422	S	S	.	.			trans	-61	140.7	-179.7	-23.1	33.8	0	0	0	111.8	E62 E66 V67 I68	E62-P64 VanDerWaalsContact O-CD 3.3Å; E62-P64 WeakPolarHBondContact O-CD 3.41Å; P64-E66 PolarHBondContact O-N 3.06Å; P64-E66 VanDerWaalsContact O-N 3.12Å; P64-V67 HydrophobicContact CB-CG2 4.25Å; P64-V67 HydrophobicContact CG-CG2 4.31Å; P64-V67 WeakPolarHBondContact O-CB 3.34Å; P64-V67 PolarHBondContact O-N 3.39Å; P64-I68 PolarHBondContact O-N 3.27Å
65	P	86.9	Confident	84.8	Confident	108 Å²	108	82.5 Å²	82.5	70%	0.701	43%	0.43	S	S	*	.	H	α-helix	trans	-60.7	-26.4	-179.8	23.9	-34	0	0	0	112.8	I68 S69	P65-I68 PolarHBondContact O-N 3.49Å; P65-S69 PolarHBondContact O-N 2.85Å
66	E	86.8	Confident	85	Confident	147 Å²	147	77.5 Å²	77.5	69%	0.687	41%	0.41	S	S	*	.	H	α-helix	trans	-61.6	-41.7	173.7	-171.5	176.4	-173	0	0	112.2	P64 I68 S69 I70	P64-E66 PolarHBondContact O-N 3.06Å; P64-E66 VanDerWaalsContact O-N 3.12Å; E66-I68 PolarHBondContact O-N 3.17Å; E66-S69 WeakPolarHBondContact O-CB 3.39Å; E66-S69 PolarHBondContact O-N 3.18Å; E66-I70 HydrophobicContact CG-CD1 4.48Å; E66-I70 WeakPolarHBondContact O-CG1 3.17Å; E66-I70 PolarHBondContact O-N 2.97Å
67	V	88.4	Confident	85.3	Confident	18 Å²	18	76.4 Å²	76.4	11%	0.109	40%	0.403	C	S	.	.	H	α-helix	trans	-66.1	-40.6	178.4	178.9	0	0	0	0	110.8	V63 P64 S69 I70 Y71 L419 P426	V63-V67 HydrophobicContact CG1-CB 4.2Å; V63-V67 HydrophobicContact CG1-CG1 4.32Å; P64-V67 HydrophobicContact CB-CG2 4.25Å; P64-V67 HydrophobicContact CG-CG2 4.31Å; P64-V67 WeakPolarHBondContact O-CB 3.34Å; P64-V67 PolarHBondContact O-N 3.39Å; V67-S69 VanDerWaalsContact C-N 3.31Å; V67-S69 PolarHBondContact O-N 2.92Å; V67-I70 PolarHBondContact O-N 3.48Å; V67-Y71 PolarHBondContact O-N 2.9Å; V67-L419 HydrophobicContact CG1-CD1 3.79Å; V67-L419 HydrophobicContact CG1-CD2 4.04Å; V67-P426 HydrophobicContact CG1-CB 3.62Å; V67-P426 HydrophobicContact CG1-CG 4.19Å; V67-P426 HydrophobicContact CG2-CB 4.37Å; V67-P426 HydrophobicContact CG2-CG 4.1Å
68	I	87.9	Confident	85.3	Confident	60 Å²	60	75.1 Å²	75.1	31%	0.308	40%	0.401	S	S	.	.	H	α-helix	trans	-63.4	-39.5	175.1	-63.6	170.2	0	0	0	110.6	V63 P64 P65 E66 Y71 N72	V63-I68 HydrophobicContact CG1-CD1 4.23Å; V63-I68 HydrophobicContact CG1-CG1 3.91Å; P64-I68 PolarHBondContact O-N 3.27Å; P65-I68 PolarHBondContact O-N 3.49Å; E66-I68 PolarHBondContact O-N 3.17Å; I68-Y71 WeakPolarHBondContact O-CB 3.1Å; I68-Y71 PolarHBondContact O-N 3.41Å; I68-N72 PolarHBondContact O-N 3.24Å; I68-N72 PolarHBondContact O-ND2 2.86Å
69	S	87.9	Confident	85.4	Confident	68 Å²	68	80 Å²	80	48%	0.476	42%	0.422	S	S	.	.	H	α-helix	trans	-61.6	-43.2	174.7	-174.5	0	0	0	0	112.2	P65 E66 V67 Y71 N72 S73	P65-S69 PolarHBondContact O-N 2.85Å; E66-S69 WeakPolarHBondContact O-CB 3.39Å; E66-S69 PolarHBondContact O-N 3.18Å; V67-S69 VanDerWaalsContact C-N 3.31Å; V67-S69 PolarHBondContact O-N 2.92Å; S69-Y71 VanDerWaalsContact C-N 3.35Å; S69-Y71 PolarHBondContact O-N 2.85Å; S69-N72 PolarHBondContact O-N 2.99Å; S69-S73 WeakPolarHBondContact O-CB 3.41Å; S69-S73 PolarHBondContact O-N 2.79Å; S69-S73 PolarHBondContact O-OG 2.81Å
70	I	87.4	Confident	85.6	Confident	87 Å²	87	78.1 Å²	78.1	45%	0.446	41%	0.413	S	S	.	.	H	α-helix	trans	-63.6	-41.9	175.5	-62.8	165.5	0	0	0	110.5	E66 V67 S73 T74 I428	E66-I70 HydrophobicContact CG-CD1 4.48Å; E66-I70 WeakPolarHBondContact O-CG1 3.17Å; E66-I70 PolarHBondContact O-N 2.97Å; V67-I70 PolarHBondContact O-N 3.48Å; I70-S73 PolarHBondContact O-N 3.02Å; I70-T74 VanDerWaalsContact O-CB 3.29Å; I70-T74 WeakPolarHBondContact O-CB 3.22Å; I70-T74 PolarHBondContact O-N 2.94Å; I70-T74 PolarHBondContact O-OG1 3.31Å; I70-I428 HydrophobicContact CB-CD1 4.17Å; I70-I428 HydrophobicContact CG2-CD1 3.58Å
71	Y	90.1	Very high	86.1	Confident	10 Å²	10	80.1 Å²	80.1	4%	0.039	42%	0.415	C	S	.	.	H	α-helix	trans	-59.5	-51	176	170.7	-98.6	0	0	0	111.8	V67 I68 S69 S73 T74 R75 E365 T417 L419 I428	V67-Y71 PolarHBondContact O-N 2.9Å; I68-Y71 WeakPolarHBondContact O-CB 3.1Å; I68-Y71 PolarHBondContact O-N 3.41Å; S69-Y71 VanDerWaalsContact C-N 3.35Å; S69-Y71 PolarHBondContact O-N 2.85Å; Y71-S73 PolarHBondContact O-N 3.01Å; Y71-T74 PolarHBondContact O-N 2.64Å; Y71-R75 WeakPolarHBondContact O-CB 3.25Å; Y71-R75 PolarHBondContact O-N 3.13Å; Y71-E365 HydrophobicContact CD1-CB 4Å; Y71-E365 HydrophobicContact CD1-CG 4.38Å; Y71-E365 HydrophobicContact CE1-CB 3.64Å; Y71-E365 HydrophobicContact CE1-CG 4.31Å; Y71-E365 HydrophobicContact CE2-CB 4.17Å; Y71-E365 HydrophobicContact CG-CB 4.42Å; Y71-T417 HydrophobicContact CE2-CG2 4.04Å; Y71-T417 PolarHBondContact OH-O 3.46Å; Y71-L419 HydrophobicContact CD2-CB 3.72Å; Y71-L419 HydrophobicContact CE2-CB 4.15Å; Y71-L419 HydrophobicContact CG-CB 4.26Å; Y71-I428 HydrophobicContact CD2-CG1 4.42Å; Y71-I428 HydrophobicContact CD2-CG2 4.11Å
72	N	89.4	Confident	86.3	Confident	56 Å²	56	73.7 Å²	73.7	30%	0.299	39%	0.394	S	S	.	.	H	α-helix	trans	-60.3	-46.1	178.9	-75.5	-36.7	0	0	0	111.5	I68 S69 T74 R75 D76	I68-N72 PolarHBondContact O-N 3.24Å; I68-N72 PolarHBondContact O-ND2 2.86Å; S69-N72 PolarHBondContact O-N 2.99Å; N72-T74 VanDerWaalsContact C-N 3.33Å; N72-T74 PolarHBondContact O-N 3.07Å; N72-R75 PolarHBondContact O-N 3.49Å; N72-R75 PolarHBondContact OD1-NH1 2.88Å; N72-R75 PolarHBondContact OD1-NH2 3.15Å; N72-D76 WeakPolarHBondContact O-CB 3.34Å; N72-D76 PolarHBondContact O-N 2.86Å
73	S	89	Confident	86.3	Confident	71 Å²	71	70.7 Å²	70.7	50%	0.497	39%	0.387	S	S	.	.	H	α-helix	trans	-61.7	-41.3	177.8	-58.1	0	0	0	0	112.1	S69 I70 Y71 L77	S69-S73 WeakPolarHBondContact O-CB 3.41Å; S69-S73 PolarHBondContact O-N 2.79Å; S69-S73 PolarHBondContact O-OG 2.81Å; I70-S73 PolarHBondContact O-N 3.02Å; Y71-S73 PolarHBondContact O-N 3.01Å; S73-L77 WeakPolarHBondContact O-CB 3.37Å; S73-L77 PolarHBondContact O-N 3.34Å
74	T	87.6	Confident	85.9	Confident	46 Å²	46	78.1 Å²	78.1	28%	0.282	41%	0.413	S	S	.	.	H	α-helix	trans	-67	-44.2	178	-57.5	0	0	0	0	111.1	I70 Y71 N72 L78 I428	I70-T74 VanDerWaalsContact O-CB 3.29Å; I70-T74 WeakPolarHBondContact O-CB 3.22Å; I70-T74 PolarHBondContact O-N 2.94Å; I70-T74 PolarHBondContact O-OG1 3.31Å; Y71-T74 PolarHBondContact O-N 2.64Å; N72-T74 VanDerWaalsContact C-N 3.33Å; N72-T74 PolarHBondContact O-N 3.07Å; T74-L78 HydrophobicContact CG2-CD1 3.93Å; T74-L78 HydrophobicContact CG2-CG 4.44Å; T74-L78 WeakPolarHBondContact O-CB 3.48Å; T74-L78 VanDerWaalsContact O-CG 3.22Å; T74-L78 WeakPolarHBondContact O-CG 3.4Å; T74-L78 PolarHBondContact O-N 3.22Å; T74-I428 HydrophobicContact CG2-CG2 3.98Å
75	R	88.1	Confident	85.1	Confident	88 Å²	88	84 Å²	84	33%	0.332	43%	0.428	S	S	.	.	H	α-helix	trans	-58.4	-49.8	176.4	-178.6	-164.1	67.1	-147.5	-7.7	111.1	Y71 N72 L77 L78 Q79	Y71-R75 WeakPolarHBondContact O-CB 3.25Å; Y71-R75 PolarHBondContact O-N 3.13Å; N72-R75 PolarHBondContact O-N 3.49Å; N72-R75 PolarHBondContact OD1-NH1 2.88Å; N72-R75 PolarHBondContact OD1-NH2 3.15Å; R75-L77 PolarHBondContact O-N 3.45Å; R75-L78 PolarHBondContact O-N 2.67Å; R75-Q79 WeakPolarHBondContact O-CB 3.43Å; R75-Q79 PolarHBondContact O-N 2.85Å
76	D	88.1	Confident	84.2	Confident	81 Å²	81	81 Å²	81	43%	0.433	41%	0.413	S	S	.	.	H	α-helix	trans	-65.6	-42	-175.7	-63.3	-7.6	0	0	0	110.8	N72 L78 Q79 E80	N72-D76 WeakPolarHBondContact O-CB 3.34Å; N72-D76 PolarHBondContact O-N 2.86Å; D76-L78 PolarHBondContact O-N 2.92Å; D76-Q79 PolarHBondContact O-N 2.99Å; D76-E80 PolarHBondContact O-N 3.33Å
77	L	87.5	Confident	83.2	Confident	87 Å²	87	76.3 Å²	76.3	46%	0.455	40%	0.398	S	S	.	.	H	α-helix	trans	-60.8	-43.3	173.6	-178.7	69.8	0	0	0	112.6	S73 R75 E80 K81	S73-L77 WeakPolarHBondContact O-CB 3.37Å; S73-L77 PolarHBondContact O-N 3.34Å; R75-L77 PolarHBondContact O-N 3.45Å; L77-E80 PolarHBondContact O-N 2.03Å; L77-K81 WeakPolarHBondContact O-CG 3.43Å; L77-K81 PolarHBondContact O-N 2.77Å
78	L	84.1	Confident	81.9	Confident	44 Å²	44	78.1 Å²	78.1	23%	0.23	42%	0.416	C	S	.	.	H	α-helix	trans	-66.9	-38.5	178.5	-73.1	171.8	0	0	0	111.5	T74 R75 D76 K81 A82 T417 Q430	T74-L78 HydrophobicContact CG2-CD1 3.93Å; T74-L78 HydrophobicContact CG2-CG 4.44Å; T74-L78 WeakPolarHBondContact O-CB 3.48Å; T74-L78 VanDerWaalsContact O-CG 3.22Å; T74-L78 WeakPolarHBondContact O-CG 3.4Å; T74-L78 PolarHBondContact O-N 3.22Å; R75-L78 PolarHBondContact O-N 2.67Å; D76-L78 PolarHBondContact O-N 2.92Å; L78-K81 PolarHBondContact O-N 3.01Å; L78-A82 WeakPolarHBondContact O-CB 3.33Å; L78-A82 PolarHBondContact O-N 3.22Å; L78-T417 HydrophobicContact CD1-CG2 4.32Å; L78-Q430 HydrophobicContact CD1-CB 4.34Å
79	Q	84.1	Confident	80.4	Confident	127 Å²	127	78.7 Å²	78.7	59%	0.593	42%	0.424	S	S	*	.	H	α-helix	trans	-66.5	-40.6	176.6	-171.6	170.8	-10.9	0	0	111.6	R75 D76 A82 S83	R75-Q79 WeakPolarHBondContact O-CB 3.43Å; R75-Q79 PolarHBondContact O-N 2.85Å; D76-Q79 PolarHBondContact O-N 2.99Å; Q79-A82 PolarHBondContact O-N 3.19Å; Q79-S83 PolarHBondContact O-N 3.28Å; Q79-S83 PolarHBondContact O-OG 3.11Å
80	E	85	Confident	78.8	Confident	87 Å²	87	82.6 Å²	82.6	41%	0.407	44%	0.435	S	S	.	.	H	α-helix	trans	-64.6	-42.3	174.4	-169.1	-171.7	176.5	0	0	112	D76 L77 A82 S83 R84	D76-E80 PolarHBondContact O-N 3.33Å; L77-E80 PolarHBondContact O-N 2.03Å; E80-A82 VanDerWaalsContact C-N 3.32Å; E80-A82 PolarHBondContact O-N 3.29Å; E80-S83 PolarHBondContact O-N 3.06Å; E80-S83 PolarHBondContact O-OG 2.91Å; E80-R84 WeakPolarHBondContact O-CB 2.98Å; E80-R84 VanDerWaalsContact O-CG 3.3Å; E80-R84 WeakPolarHBondContact O-CG 3.48Å; E80-R84 PolarHBondContact O-N 2.9Å; E80-R84 IonicContact OE1-CZ 3.81Å; E80-R84 VanDerWaalsContact OE1-CZ 3.25Å; E80-R84 IonicContact OE1-NE 2.96Å; E80-R84 PolarHBondContact OE1-NE 3.36Å; E80-R84 IonicContact OE1-NH2 3.78Å; E80-R84 PolarHBondContact OE1-NH2 3.12Å
81	K	83.8	Confident	76.9	Confident	107 Å²	107	88.5 Å²	88.5	47%	0.465	45%	0.451	S	S	.	.	H	α-helix	trans	-63.1	-40.6	174	-75.9	179.3	178.8	176.7	0	111.7	L77 L78 R85	L77-K81 WeakPolarHBondContact O-CG 3.43Å; L77-K81 PolarHBondContact O-N 2.77Å; L78-K81 PolarHBondContact O-N 3.01Å; K81-R85 WeakPolarHBondContact O-CB 3.11Å; K81-R85 WeakPolarHBondContact O-CG 3.32Å; K81-R85 PolarHBondContact O-N 2.96Å
82	A	77.6	Confident	74.7	Confident	52 Å²	52	94.2 Å²	94.2	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-65.1	-43.5	177.5	0	0	0	0	0	111.6	L78 Q79 E80 R85 A86	L78-A82 WeakPolarHBondContact O-CB 3.33Å; L78-A82 PolarHBondContact O-N 3.22Å; Q79-A82 PolarHBondContact O-N 3.19Å; E80-A82 VanDerWaalsContact C-N 3.32Å; E80-A82 PolarHBondContact O-N 3.29Å; A82-R85 PolarHBondContact O-N 3.47Å; A82-A86 WeakPolarHBondContact O-CB 3.49Å; A82-A86 PolarHBondContact O-N 2.89Å
83	S	78.8	Confident	72.5	Confident	66 Å²	66	98.4 Å²	98.4	46%	0.462	49%	0.49	S	S	.	.	H	α-helix	trans	-66.1	-40.3	177.8	68.1	0	0	0	0	112.3	Q79 E80 R85 A86 A87	Q79-S83 PolarHBondContact O-N 3.28Å; Q79-S83 PolarHBondContact O-OG 3.11Å; E80-S83 PolarHBondContact O-N 3.06Å; E80-S83 PolarHBondContact O-OG 2.91Å; S83-R85 VanDerWaalsContact C-N 3.35Å; S83-R85 PolarHBondContact O-N 3.15Å; S83-A86 PolarHBondContact O-N 2.93Å; S83-A87 WeakPolarHBondContact O-CB 3.45Å; S83-A87 PolarHBondContact O-N 3.48Å
84	R	76.8	Confident	70.5	Confident	170 Å²	170	97.4 Å²	97.4	64%	0.642	48%	0.483	S	S	*	.	H	α-helix	trans	-62.3	-40.1	173.3	-71.8	177.5	-176.8	-156.4	3.2	112.2	E80 A88	E80-R84 WeakPolarHBondContact O-CB 2.98Å; E80-R84 VanDerWaalsContact O-CG 3.3Å; E80-R84 WeakPolarHBondContact O-CG 3.48Å; E80-R84 PolarHBondContact O-N 2.9Å; E80-R84 IonicContact OE1-CZ 3.81Å; E80-R84 VanDerWaalsContact OE1-CZ 3.25Å; E80-R84 IonicContact OE1-NE 2.96Å; E80-R84 PolarHBondContact OE1-NE 3.36Å; E80-R84 IonicContact OE1-NH2 3.78Å; E80-R84 PolarHBondContact OE1-NH2 3.12Å; R84-A88 PolarHBondContact O-N 2.97Å; R84-A88 VanDerWaalsContact O-N 3.14Å
85	R	72.5	Confident	68.6	Low	184 Å²	184	101.1 Å²	101.1	69%	0.694	50%	0.501	S	S	*	.	H	α-helix	trans	-67	-43.9	174.4	-75.4	175.5	-179.9	177.8	-0.4	111.9	K81 A82 S83 A87 A88 C89	K81-R85 WeakPolarHBondContact O-CB 3.11Å; K81-R85 WeakPolarHBondContact O-CG 3.32Å; K81-R85 PolarHBondContact O-N 2.96Å; A82-R85 PolarHBondContact O-N 3.47Å; S83-R85 VanDerWaalsContact C-N 3.35Å; S83-R85 PolarHBondContact O-N 3.15Å; R85-A87 VanDerWaalsContact C-N 3.35Å; R85-A87 PolarHBondContact O-N 3.5Å; R85-A88 WeakPolarHBondContact O-CB 3.23Å; R85-A88 PolarHBondContact O-N 3.42Å; R85-A88 VanDerWaalsContact O-N 3.13Å; R85-C89 PolarHBondContact O-N 3.03Å
86	A	67.9	Low	66.7	Low	46 Å²	46	100.9 Å²	100.9	38%	0.38	50%	0.504	S	S	.	.	H	α-helix	trans	-60.4	-44.6	176	0	0	0	0	0	111.1	A82 S83 A88 C89 E90	A82-A86 WeakPolarHBondContact O-CB 3.49Å; A82-A86 PolarHBondContact O-N 2.89Å; S83-A86 PolarHBondContact O-N 2.93Å; A86-A88 PolarHBondContact O-N 3.19Å; A86-C89 PolarHBondContact O-N 3.41Å; A86-E90 WeakPolarHBondContact O-CB 3.27Å; A86-E90 WeakPolarHBondContact O-CG 3.02Å; A86-E90 PolarHBondContact O-N 2.91Å
87	A	65.8	Low	64.8	Low	47 Å²	47	102.6 Å²	102.6	39%	0.388	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-24.4	175.8	0	0	0	0	0	113.8	S83 R85 R91	S83-A87 WeakPolarHBondContact O-CB 3.45Å; S83-A87 PolarHBondContact O-N 3.48Å; R85-A87 VanDerWaalsContact C-N 3.35Å; R85-A87 PolarHBondContact O-N 3.5Å; A87-R91 PolarHBondContact O-NH1 3.06Å
88	A	61.3	Low	63.1	Low	57 Å²	57	104.6 Å²	104.6	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-77.4	-46	171.3	0	0	0	0	0	111.5	R84 R85 A86 R91	R84-A88 PolarHBondContact O-N 2.97Å; R84-A88 VanDerWaalsContact O-N 3.14Å; R85-A88 WeakPolarHBondContact O-CB 3.23Å; R85-A88 PolarHBondContact O-N 3.42Å; R85-A88 VanDerWaalsContact O-N 3.13Å; A86-A88 PolarHBondContact O-N 3.19Å; A88-R91 PolarHBondContact O-N 2.94Å
89	C	55.8	Low	61.8	Low	72 Å²	72	107 Å²	107	49%	0.486	52%	0.519	S	S	.	.	H	α-helix	trans	-74.5	-29.4	179.7	-73.3	0	0	0	0	114.1	R85 A86 R91 E92 R93	R85-C89 PolarHBondContact O-N 3.03Å; A86-C89 PolarHBondContact O-N 3.41Å; C89-R91 PolarHBondContact O-N 3Å; C89-E92 WeakPolarHBondContact O-CA 3.16Å; C89-E92 WeakPolarHBondContact O-CB 3.4Å; C89-E92 PolarHBondContact O-N 2.87Å; C89-R93 PolarHBondContact O-N 3.47Å
90	E	53.2	Low	61.1	Low	149 Å²	149	104.4 Å²	104.4	70%	0.696	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.2	174.9	-81.7	-173.8	167.8	0	0	112.2	A86 E92	A86-E90 WeakPolarHBondContact O-CB 3.27Å; A86-E90 WeakPolarHBondContact O-CG 3.02Å; A86-E90 PolarHBondContact O-N 2.91Å; E90-E92 VanDerWaalsContact C-N 3.25Å; E90-E92 PolarHBondContact O-N 3.33Å
91	R	47.3	Very low	60.9	Low	211 Å²	211	103.2 Å²	103.2	80%	0.796	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-25.1	169.2	-76.5	-170.4	178.4	97.9	-5.9	112.8	A87 A88 C89	A87-R91 PolarHBondContact O-NH1 3.06Å; A88-R91 PolarHBondContact O-N 2.94Å; C89-R91 PolarHBondContact O-N 3Å
92	E	44.2	Very low	60.9	Low	130 Å²	130	101.8 Å²	101.8	61%	0.607	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-43.8	176.5	-66.5	178.8	156.2	0	0	110.9	C89 E90 S94	C89-E92 WeakPolarHBondContact O-CA 3.16Å; C89-E92 WeakPolarHBondContact O-CB 3.4Å; C89-E92 PolarHBondContact O-N 2.87Å; E90-E92 VanDerWaalsContact C-N 3.25Å; E90-E92 PolarHBondContact O-N 3.33Å; E92-S94 PolarHBondContact O-N 3.47Å
93	R	42.9	Very low	61.4	Low	144 Å²	144	103.8 Å²	103.8	54%	0.543	51%	0.514	S	S	.	.			trans	-80	34.6	-172.1	-155.9	-178	-179.2	166.4	-5.4	115.4	C89 D412	C89-R93 PolarHBondContact O-N 3.47Å; R93-D412 IonicContact CZ-OD1 3.89Å; R93-D412 VanDerWaalsContact CZ-OD1 3.29Å; R93-D412 IonicContact NH1-OD1 3.42Å; R93-D412 PolarHBondContact NH1-OD1 2.96Å; R93-D412 IonicContact NH1-OD2 3.75Å; R93-D412 IonicContact NH2-OD1 2.81Å; R93-D412 PolarHBondContact NH2-OD1 2.65Å; R93-D412 IonicContact NH2-OD2 2.68Å; R93-D412 PolarHBondContact NH2-OD2 2.86Å
94	S	47.7	Very low	61.8	Low	50 Å²	50	104.3 Å²	104.3	35%	0.35	51%	0.506	S	S	.	.			trans	-69	144.8	168.6	69.6	0	0	0	0	109.6	E92 E96 E97	E92-S94 PolarHBondContact O-N 3.47Å; S94-E96 PolarHBondContact O-N 2.93Å; S94-E97 WeakPolarHBondContact O-CB 3.27Å; S94-E97 PolarHBondContact O-N 3.16Å
95	D	47.8	Very low	62.5	Low	124 Å²	124	101 Å²	101	66%	0.663	50%	0.496	S	S	*	.	H	α-helix	trans	-54.9	-15.7	172.4	-68	-32.6	0	0	0	112.4	E97 Y98 Y99	D95-E97 VanDerWaalsContact C-N 3.32Å; D95-Y98 WeakPolarHBondContact O-CB 3.32Å; D95-Y98 PolarHBondContact O-N 2.96Å; D95-Y99 WeakPolarHBondContact O-CD2 2.76Å
96	E	49.4	Very low	63.3	Low	83 Å²	83	93.3 Å²	93.3	39%	0.388	47%	0.469	S	S	.	.	H	α-helix	trans	-73	-21.6	175.4	-53.1	-172.8	171.2	0	0	112.7	S94 Y98 K101 L314	S94-E96 PolarHBondContact O-N 2.93Å; E96-Y98 VanDerWaalsContact C-N 3.32Å; E96-K101 WeakPolarHBondContact O-CE 3.42Å; E96-K101 PolarHBondContact O-NZ 3.3Å; E96-L314 HydrophobicContact CB-CD1 4.32Å; E96-L314 HydrophobicContact CG-CD1 4.17Å
97	E	46.8	Very low	64.3	Low	117 Å²	117	94.5 Å²	94.5	55%	0.547	47%	0.469	S	S	.	.	H	α-helix	trans	-70.7	-28.3	172.9	-165.1	174.3	-155.6	0	0	112	S94 D95 Y99 K101	S94-E97 WeakPolarHBondContact O-CB 3.27Å; S94-E97 PolarHBondContact O-N 3.16Å; D95-E97 VanDerWaalsContact C-N 3.32Å; E97-Y99 VanDerWaalsContact C-N 3.34Å; E97-Y99 PolarHBondContact O-N 2.91Å; E97-K101 VanDerWaalsContact CA-NZ 3.34Å; E97-K101 PolarHBondContact O-NZ 2.99Å
98	Y	51.9	Low	65.3	Low	130 Å²	130	94 Å²	94	51%	0.51	46%	0.459	S	S	.	.	H	α-helix	trans	-66.2	-34	-179.6	178.5	-106.3	0	0	0	113.5	D95 E96 R390	D95-Y98 WeakPolarHBondContact O-CB 3.32Å; D95-Y98 PolarHBondContact O-N 2.96Å; E96-Y98 VanDerWaalsContact C-N 3.32Å; Y98-R390 PolarHBondContact OH-NH2 3.37Å
99	Y	57.4	Low	66.2	Low	95 Å²	95	94.3 Å²	94.3	37%	0.373	46%	0.456	S	S	.	.	S	Bend	trans	-85.4	145.3	-175.8	-66.3	-76	0	0	0	111.8	D95 E97 K101	D95-Y99 WeakPolarHBondContact O-CD2 2.76Å; E97-Y99 VanDerWaalsContact C-N 3.34Å; E97-Y99 PolarHBondContact O-N 2.91Å; Y99-K101 VanDerWaalsContact O-CD 3.3Å; Y99-K101 WeakPolarHBondContact O-CD 3.31Å; Y99-K101 WeakPolarHBondContact O-CE 3.46Å; Y99-K101 PolarHBondContact O-NZ 3.24Å
100	A	68.8	Low	66.7	Low	72 Å²	72	95.2 Å²	95.2	60%	0.595	46%	0.461	S	S	*	.			trans	-61	137.3	169.1	0	0	0	0	0	110.2	R318	A100-R318 PolarHBondContact O-NH1 2.96Å
101	K	80.1	Confident	66.6	Low	61 Å²	61	95.8 Å²	95.8	27%	0.265	46%	0.462	S	S	.	.			trans	-108.1	146.2	178.1	-57.8	92.3	-172.8	163	0	109.7	E96 E97 Y99 M312 L313	E96-K101 WeakPolarHBondContact O-CE 3.42Å; E96-K101 PolarHBondContact O-NZ 3.3Å; E97-K101 VanDerWaalsContact CA-NZ 3.34Å; E97-K101 PolarHBondContact O-NZ 2.99Å; Y99-K101 VanDerWaalsContact O-CD 3.3Å; Y99-K101 WeakPolarHBondContact O-CD 3.31Å; Y99-K101 WeakPolarHBondContact O-CE 3.46Å; Y99-K101 PolarHBondContact O-NZ 3.24Å; K101-M312 HydrophobicContact CB-CB 4.17Å; K101-L313 CarbonylContact C-O 3.6Å; K101-L313 WeakPolarHBondContact CA-O 3.46Å; K101-L313 WeakPolarHBondContact CB-O 3.06Å
102	E	84.2	Confident	66.2	Low	78 Å²	78	93 Å²	93	36%	0.364	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129.5	169.2	-71.3	174	161.2	0	0	109	Y104 M312 L313 P315	E102-Y104 HydrophobicContact CB-CD2 4.32Å; E102-Y104 HydrophobicContact CB-CE2 3.65Å; E102-Y104 PolarHBondContact OE2-OH 3.4Å; E102-M312 WeakPolarHBondContact O-CA 2.94Å; E102-L313 PolarHBondContact N-O 3.01Å; E102-L313 PolarHBondContact O-N 3.41Å; E102-P315 HydrophobicContact CG-CG 4.11Å
103	V	87.9	Confident	65.9	Low	94 Å²	94	92.1 Å²	92.1	57%	0.57	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	117.2	-177.9	-174.8	0	0	0	0	109.2	L310 L311 M312	V103-L310 HydrophobicContact CG1-CD2 4.43Å; V103-L311 CarbonylContact C-O 3.57Å; V103-L311 WeakPolarHBondContact CA-O 3.28Å; V103-M312 HydrophobicContact CG2-CG 4.27Å
104	Y	88.5	Confident	65.5	Low	76 Å²	76	89.5 Å²	89.5	30%	0.298	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.5	176	-66.9	-94.7	0	0	0	110	E102 M165 L310 L311 L313	E102-Y104 HydrophobicContact CB-CD2 4.32Å; E102-Y104 HydrophobicContact CB-CE2 3.65Å; E102-Y104 PolarHBondContact OE2-OH 3.4Å; Y104-M165 HydrophobicContact CD1-CE 3.89Å; Y104-M165 HydrophobicContact CD1-SD 3.77Å; Y104-M165 HydrophobicContact CD2-SD 4.26Å; Y104-M165 HydrophobicContact CE1-CE 4.12Å; Y104-M165 HydrophobicContact CE1-SD 4.19Å; Y104-M165 HydrophobicContact CG-CE 4.5Å; Y104-M165 HydrophobicContact CG-SD 3.79Å; Y104-L310 WeakPolarHBondContact O-CA 3.49Å; Y104-L311 PolarHBondContact N-O 2.92Å; Y104-L311 PolarHBondContact O-N 2.81Å; Y104-L313 HydrophobicContact CD2-CD1 3.39Å; Y104-L313 HydrophobicContact CE2-CD1 3.89Å; Y104-L313 HydrophobicContact CG-CD1 4.28Å
105	K	90.2	Very high	64.6	Low	100 Å²	100	95.6 Å²	95.6	44%	0.435	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.5	174.8	-176.3	-175.7	176.9	-126.8	0	109.7	D107 H308 L309 L310	K105-D107 VanDerWaalsContact CE-OD1 3.24Å; K105-D107 WeakPolarHBondContact CE-OD1 3.38Å; K105-D107 IonicContact NZ-OD1 2.73Å; K105-D107 PolarHBondContact NZ-OD1 3.47Å; K105-D107 IonicContact NZ-OD2 2.78Å; K105-D107 PolarHBondContact NZ-OD2 3.3Å; K105-H308 VanDerWaalsContact CE-CG 3.46Å; K105-H308 HydrophobicContact CG-CB 4.13Å; K105-L309 CarbonylContact C-O 3.54Å; K105-L309 WeakPolarHBondContact CA-O 3.34Å; K105-L310 HydrophobicContact CB-CD2 3.93Å; K105-L310 HydrophobicContact CG-CD2 3.96Å
106	I	90.6	Very high	63.8	Low	24 Å²	24	95.6 Å²	95.6	12%	0.123	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	105.5	174.3	-56.4	176.8	0	0	0	107.8	D161 V162 M165 H308 L309 L311	I106-D161 VanDerWaalsContact CG2-O 3.3Å; I106-D161 WeakPolarHBondContact CG2-O 3.32Å; I106-V162 HydrophobicContact CD1-CB 4.43Å; I106-V162 HydrophobicContact CD1-CG1 3.94Å; I106-M165 HydrophobicContact CD1-CG 4.07Å; I106-H308 CarbonylContact O-C 3.55Å; I106-H308 WeakPolarHBondContact O-CA 3.49Å; I106-H308 WeakPolarHBondContact O-CB 3.3Å; I106-L309 HydrophobicContact CB-CB 4.31Å; I106-L309 PolarHBondContact N-O 3.42Å; I106-L309 PolarHBondContact O-N 3.48Å; I106-L311 HydrophobicContact CD1-CD1 3.77Å; I106-L311 HydrophobicContact CD1-CD2 4.03Å; I106-L311 HydrophobicContact CG1-CD1 4.26Å
107	D	88.4	Confident	62.8	Low	71 Å²	71	97.4 Å²	97.4	38%	0.38	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	145.1	175.6	-79.4	-65.3	0	0	0	111.2	K105 T306	K105-D107 VanDerWaalsContact CE-OD1 3.24Å; K105-D107 WeakPolarHBondContact CE-OD1 3.38Å; K105-D107 IonicContact NZ-OD1 2.73Å; K105-D107 PolarHBondContact NZ-OD1 3.47Å; K105-D107 IonicContact NZ-OD2 2.78Å; K105-D107 PolarHBondContact NZ-OD2 3.3Å; D107-T306 PolarHBondContact OD1-OG1 2.87Å; D107-T306 VanDerWaalsContact OD1-OG1 3.13Å
108	M	87	Confident	61.7	Low	35 Å²	35	96.4 Å²	96.4	17%	0.172	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-59.1	129.5	170.3	-179.1	175.9	176.1	0	0	108.9	V158 F160 I281 P307	M108-V158 HydrophobicContact CE-CB 4.24Å; M108-V158 HydrophobicContact CE-CG1 4.17Å; M108-V158 HydrophobicContact SD-CB 4.01Å; M108-V158 HydrophobicContact SD-CG1 3.81Å; M108-F160 HydrophobicContact CB-CD1 4.33Å; M108-F160 HydrophobicContact CB-CE1 3.72Å; M108-F160 HydrophobicContact CB-CZ 4.31Å; M108-I281 HydrophobicContact SD-CG1 4.5Å; M108-P307 HydrophobicContact CB-CB 4.34Å; M108-P307 WeakPolarHBondContact CB-O 3.3Å; M108-P307 PolarHBondContact N-O 2.9Å; M108-P307 HydrophobicContact SD-CB 4.3Å; M108-P307 HydrophobicContact SD-CG 4Å
109	P	79.9	Confident	60.5	Low	64 Å²	64	95.3 Å²	95.3	42%	0.416	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-59.5	140.2	177.6	24.2	-32	0	0	0	109.6	F111 R159	P109-F111 PolarHBondContact O-N 2.83Å; P109-R159 VanDerWaalsContact CD-O 3.28Å; P109-R159 WeakPolarHBondContact CD-O 3.23Å
110	P	66.8	Low	59.2	Low	92 Å²	92	97 Å²	97	60%	0.597	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-56.2	133.2	173.3	24.4	-33.9	0	0	0	109.1	F112	P110-F112 VanDerWaalsContact C-N 3.3Å; P110-F112 HydrophobicContact CB-CD2 4.38Å; P110-F112 HydrophobicContact CB-CE2 4.01Å; P110-F112 HydrophobicContact CB-CZ 4.46Å; P110-F112 HydrophobicContact CG-CD2 3.96Å; P110-F112 HydrophobicContact CG-CE2 3.41Å; P110-F112 VanDerWaalsContact CG-CE2 3.41Å; P110-F112 HydrophobicContact CG-CZ 4.15Å; P110-F112 PolarHBondContact O-N 3.29Å
111	F	51.8	Low	57.3	Low	161 Å²	161	99 Å²	99	71%	0.706	55%	0.548	S	S	*	.			trans	-66.8	91.6	177.5	-167.7	-90.4	0	0	0	109.1	P109 P113	P109-F111 PolarHBondContact O-N 2.83Å; F111-P113 HydrophobicContact CE1-CB 4.36Å
112	F	38.5	Very low	54.8	Low	151 Å²	151	102.1 Å²	102.1	66%	0.662	57%	0.572	S	S	*	*			trans	-87.2	121.8	161.4	-67.6	-71.5	0	0	0	106.5	P110 S114	P110-F112 VanDerWaalsContact C-N 3.3Å; P110-F112 HydrophobicContact CB-CD2 4.38Å; P110-F112 HydrophobicContact CB-CE2 4.01Å; P110-F112 HydrophobicContact CB-CZ 4.46Å; P110-F112 HydrophobicContact CG-CD2 3.96Å; P110-F112 HydrophobicContact CG-CE2 3.41Å; P110-F112 VanDerWaalsContact CG-CE2 3.41Å; P110-F112 HydrophobicContact CG-CZ 4.15Å; P110-F112 PolarHBondContact O-N 3.29Å; F112-S114 PolarHBondContact O-N 2.93Å
113	P	36.6	Very low	52.4	Low	112 Å²	112	103 Å²	103	73%	0.727	58%	0.583	S	S	*	*			trans	-70.6	73.5	168.4	30	-31.1	0	0	0	107.9	F111	F111-P113 HydrophobicContact CE1-CB 4.36Å
114	S	34.6	Very low	49.9	Very low	90 Å²	90	105 Å²	105	63%	0.629	60%	0.598	S	S	*	*			trans	-120.4	76.1	173.6	61.6	0	0	0	0	107.7	F112	F112-S114 PolarHBondContact O-N 2.93Å
115	E	29.5	Very low	47.5	Very low	177 Å²	177	105.6 Å²	105.6	83%	0.827	61%	0.613	S	S	*	*			trans	-167.7	54.5	152.5	-105.4	172.6	-148.5	0	0	107.2	V117	E115-V117 PolarHBondContact O-N 3.5Å
116	T	30.6	Very low	45	Very low	125 Å²	125	105 Å²	105	77%	0.767	64%	0.636	S	S	*	*			trans	-66.1	86.8	145.8	42.2	0	0	0	0	105.7	C118	T116-C118 PolarHBondContact O-N 3.21Å
117	V	28.4	Very low	42.1	Very low	121 Å²	121	109.2 Å²	109.2	73%	0.733	67%	0.667	S	S	*	*			trans	-58.3	98.1	150.7	177.4	0	0	0	0	104.1	E115 P119	E115-V117 PolarHBondContact O-N 3.5Å; V117-P119 WeakPolarHBondContact O-CD 3.41Å
118	C	24.7	Very low	39.5	Very low	95 Å²	95	113.5 Å²	113.5	64%	0.642	70%	0.695	S	S	*	*			trans	-57.1	123	167.6	-66.8	0	0	0	0	105.8	T116 V120	T116-C118 PolarHBondContact O-N 3.21Å; C118-V120 PolarHBondContact O-N 3.48Å; C118-V120 VanDerWaalsContact O-N 3.09Å
119	P	27	Very low	36.7	Very low	108 Å²	108	115.2 Å²	115.2	70%	0.701	72%	0.722	S	S	*	*			trans	-58.2	122.7	168.7	23.5	-29.1	0	0	0	106.6	V117 V121	V117-P119 WeakPolarHBondContact O-CD 3.41Å; P119-V121 VanDerWaalsContact C-N 3.29Å; P119-V121 PolarHBondContact O-N 3.42Å
120	V	28.6	Very low	34.5	Very low	131 Å²	131	117.6 Å²	117.6	79%	0.794	74%	0.74	S	S	*	*			trans	-63.5	99.9	167.7	176.3	0	0	0	0	105.6	C118 T122	C118-V120 PolarHBondContact O-N 3.48Å; C118-V120 VanDerWaalsContact O-N 3.09Å; V120-T122 PolarHBondContact O-N 3.03Å
121	V	30.3	Very low	32.6	Very low	114 Å²	114	121.1 Å²	121.1	69%	0.691	75%	0.753	S	S	*	*			trans	-75.7	99.7	165.3	179.7	0	0	0	0	105.5	P119 T123	P119-V121 VanDerWaalsContact C-N 3.29Å; P119-V121 PolarHBondContact O-N 3.42Å; V121-T123 HydrophobicContact CG1-CG2 4.41Å; V121-T123 PolarHBondContact O-N 2.76Å
122	T	27.5	Very low	31.5	Very low	126 Å²	126	120.1 Å²	120.1	77%	0.773	76%	0.764	S	S	*	*			trans	-61.9	103.3	161.4	26.1	0	0	0	0	108	V120	V120-T122 PolarHBondContact O-N 3.03Å
123	T	33.3	Very low	30.9	Very low	97 Å²	97	118 Å²	118	60%	0.595	77%	0.768	S	S	*	*			trans	-76	144.2	161.2	48.5	0	0	0	0	109.1	V121 S125	V121-T123 HydrophobicContact CG1-CG2 4.41Å; V121-T123 PolarHBondContact O-N 2.76Å; T123-S125 PolarHBondContact O-N 3.33Å
124	P	35.9	Very low	30.7	Very low	136 Å²	136	123.4 Å²	123.4	88%	0.883	77%	0.774	S	S	*	*	S	Bend	trans	-79.9	71.5	179.3	33.3	-32.5	0	0	0	109.8
125	S	36.4	Very low	30.3	Very low	87 Å²	87	128 Å²	128	61%	0.608	79%	0.786	S	S	*	*	S	Bend	trans	-166.6	109	159.9	58.8	0	0	0	0	108.3	T123 S127	T123-S125 PolarHBondContact O-N 3.33Å; S125-S127 PolarHBondContact O-N 3.38Å
126	G	39.2	Very low	30.1	Very low	89 Å²	89	125.2 Å²	125.2	92%	0.918	79%	0.786	S	S	*	*			trans	-62.8	118.8	-178.8	0	0	0	0	0	112.4
127	S	28.8	Very low	30.3	Very low	111 Å²	111	128.4 Å²	128.4	78%	0.776	79%	0.792	S	S	*	*			trans	-163.8	117.6	152.8	53.6	0	0	0	0	109.5	S125	S125-S127 PolarHBondContact O-N 3.38Å
128	V	34.9	Very low	30.2	Very low	162 Å²	162	128.7 Å²	128.7	98%	0.982	79%	0.794	S	S	*	*			trans	-82.5	123.3	173.5	-179	0	0	0	0	107.8
129	G	27.6	Very low	30.4	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	80%	0.801	S	S	*	*			trans	-153.9	109.9	177.2	0	0	0	0	0	112.1
130	S	33.8	Very low	30.3	Very low	114 Å²	114	133 Å²	133	80%	0.797	81%	0.813	S	S	*	*			trans	-78	121.3	172.4	53.4	0	0	0	0	110.9
131	L	26.6	Very low	30	Very low	166 Å²	166	129.6 Å²	129.6	87%	0.869	80%	0.804	S	S	*	*			trans	-131.9	98.6	161.5	-107.2	97.5	0	0	0	110.5
132	C	28.2	Very low	30.1	Very low	139 Å²	139	135.2 Å²	135.2	94%	0.939	82%	0.815	S	S	*	*			trans	-84.4	115.4	153.5	-102.4	0	0	0	0	107.3
133	S	25.5	Very low	30	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	82%	0.816	S	S	*	*			trans	-138.9	133.6	159	-171.6	0	0	0	0	110.9
134	R	32.8	Very low	29.7	Very low	226 Å²	226	138.7 Å²	138.7	85%	0.853	82%	0.824	S	S	*	*			trans	-68.5	159.2	173.4	-79.8	173.3	165.5	-177.4	-4.3	110.6
135	Q	27.6	Very low	29.3	Very low	186 Å²	186	137.1 Å²	137.1	87%	0.869	82%	0.822	S	S	*	*			trans	77.3	99.3	167.6	-72.4	163.3	-41.9	0	0	117.1
136	S	24.4	Very low	29	Very low	119 Å²	119	140.3 Å²	140.3	83%	0.832	83%	0.831	S	S	*	*				-175.1	128.3	107.1	-78.3	0	0	0	0	110.3
137	Q	34.7	Very low	28.5	Very low	191 Å²	191	141 Å²	141	89%	0.893	82%	0.82	S	S	*	*			trans	-61.6	130.3	155.9	-74.7	168.4	-44.9	0	0	107.6
138	V	26.7	Very low	28.8	Very low	128 Å²	128	141 Å²	141	78%	0.776	82%	0.817	S	S	*	*			trans	177.4	126.4	141.8	159.4	0	0	0	0	109
139	L	28.7	Very low	29.2	Very low	153 Å²	153	138.2 Å²	138.2	80%	0.801	80%	0.8	S	S	*	*			trans	46.4	97.1	160.5	-86	85.5	0	0	0	120
140	C	24.1	Very low	30.1	Very low	140 Å²	140	144.2 Å²	144.2	95%	0.946	81%	0.807	S	S	*	*				-109.3	107	127.3	-82.2	0	0	0	0	105.2
141	G	22.4	Very low	31.1	Very low	59 Å²	59	146.1 Å²	146.1	61%	0.608	80%	0.797	S	S	*	*			cis	81.3	74.6	43.8	0	0	0	0	0	107.6	L143	G141-L143 PolarHBondContact O-N 2.82Å; G141-L143 VanDerWaalsContact O-N 3.13Å
142	Y	32.4	Very low	33.1	Very low	233 Å²	233	144.2 Å²	144.2	91%	0.914	78%	0.779	S	S	*	*			trans	-47.8	105.7	173.7	-164.1	-94.2	0	0	0	110.2
143	L	26.4	Very low	35.4	Very low	154 Å²	154	138.7 Å²	138.7	81%	0.806	74%	0.741	S	S	*	*			trans	-163.4	125.1	155.5	-97.5	159.4	0	0	0	107.1	G141	G141-L143 PolarHBondContact O-N 2.82Å; G141-L143 VanDerWaalsContact O-N 3.13Å
144	D	26.5	Very low	38.1	Very low	142 Å²	142	138.6 Å²	138.6	76%	0.759	73%	0.725	S	S	*	*			trans	65.5	84.1	178.7	-57.1	-21.9	0	0	0	117.2	I146	D144-I146 VanDerWaalsContact C-N 3.34Å; D144-I146 PolarHBondContact O-N 2.84Å
145	A	27.4	Very low	40.6	Very low	102 Å²	102	130.5 Å²	130.5	84%	0.843	70%	0.696	S	S	*	*			trans	-52.1	96.3	155.8	0	0	0	0	0	110.2	P147	A145-P147 WeakPolarHBondContact O-CD 3.3Å
146	I	29.9	Very low	43.5	Very low	155 Å²	155	122.8 Å²	122.8	80%	0.795	66%	0.659	S	S	*	*			trans	-61.8	117.9	163.1	-58	174.5	0	0	0	106.2	D144	D144-I146 VanDerWaalsContact C-N 3.34Å; D144-I146 PolarHBondContact O-N 2.84Å
147	P	29.6	Very low	46.5	Very low	104 Å²	104	119.5 Å²	119.5	68%	0.675	63%	0.632	S	S	*	*			trans	-64.1	144.1	-170.5	21.8	-29.7	0	0	0	111.1	A145 T149	A145-P147 WeakPolarHBondContact O-CD 3.3Å; P147-T149 PolarHBondContact O-N 2.83Å; P147-T149 VanDerWaalsContact O-N 3.09Å
148	P	35.3	Very low	49.2	Very low	111 Å²	111	110.4 Å²	110.4	72%	0.721	59%	0.589	S	S	*	*	S	Bend	trans	-69.6	112.4	-179.8	29.4	-31.1	0	0	0	108.4
149	T	42.8	Very low	52.2	Low	103 Å²	103	111.5 Å²	111.5	63%	0.632	58%	0.579	S	S	*	*	S	Bend	trans	57.3	127.5	166.6	62.4	0	0	0	0	116.3	P147 Y151	P147-T149 PolarHBondContact O-N 2.83Å; P147-T149 VanDerWaalsContact O-N 3.09Å; T149-Y151 PolarHBondContact O-N 3.12Å
150	F	45.2	Very low	55.2	Low	197 Å²	197	104.5 Å²	104.5	86%	0.864	54%	0.542	S	S	*	.			trans	-52.6	101.8	163	-86.8	-96.5	0	0	0	108.7	R152	F150-R152 PolarHBondContact O-N 2.81Å
151	Y	56.3	Low	58.4	Low	154 Å²	154	102.5 Å²	102.5	60%	0.604	52%	0.523	S	S	*	.			trans	-59.1	113.9	168.6	-176.1	-109	0	0	0	106.2	T149 P153	T149-Y151 PolarHBondContact O-N 3.12Å; Y151-P153 VanDerWaalsContact C-CD 3.42Å; Y151-P153 HydrophobicContact CD1-CB 4.03Å; Y151-P153 HydrophobicContact CD1-CG 4.24Å; Y151-P153 HydrophobicContact CE1-CB 3.67Å; Y151-P153 HydrophobicContact CE1-CG 4.36Å; Y151-P153 WeakPolarHBondContact O-CD 3.46Å
152	R	68.4	Low	61.6	Low	126 Å²	126	99.9 Å²	99.9	48%	0.475	49%	0.494	S	S	.	.			trans	-98.7	84.1	176.9	-67.2	-177.5	-179.6	-151.4	2.8	107.5	F150 Y154 F155 R156	F150-R152 PolarHBondContact O-N 2.81Å; R152-Y154 PolarHBondContact O-N 2.65Å; R152-Y154 VanDerWaalsContact O-N 3.12Å; R152-F155 HydrophobicContact CB-CE1 4.38Å; R152-F155 HydrophobicContact CB-CZ 4.45Å; R152-F155 HydrophobicContact CG-CZ 4.27Å; R152-F155 PolarHBondContact O-N 3.32Å; R152-F155 VanDerWaalsContact O-O 3.05Å; R152-R156 PolarHBondContact O-NH1 2.75Å
153	P	75.6	Confident	64.2	Low	23 Å²	23	90.5 Å²	90.5	15%	0.149	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-32	-171.3	16.9	-29.3	0	0	0	113	Y151 E273 L274	Y151-P153 VanDerWaalsContact C-CD 3.42Å; Y151-P153 HydrophobicContact CD1-CB 4.03Å; Y151-P153 HydrophobicContact CD1-CG 4.24Å; Y151-P153 HydrophobicContact CE1-CB 3.67Å; Y151-P153 HydrophobicContact CE1-CG 4.36Å; Y151-P153 WeakPolarHBondContact O-CD 3.46Å; P153-E273 HydrophobicContact CB-CB 4.33Å; P153-E273 HydrophobicContact CB-CG 3.91Å; P153-L274 WeakPolarHBondContact O-CB 3.34Å; P153-L274 PolarHBondContact O-N 3.35Å
154	Y	81.8	Confident	67.1	Low	105 Å²	105	87.1 Å²	87.1	41%	0.412	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-15.9	-168.7	-53.7	-66.2	0	0	0	115.4	R152 E272 E273	R152-Y154 PolarHBondContact O-N 2.65Å; R152-Y154 VanDerWaalsContact O-N 3.12Å; Y154-E272 WeakPolarHBondContact CD1-O 3.2Å; Y154-E273 HydrophobicContact CD1-CG 4.34Å; Y154-E273 HydrophobicContact CE1-CG 3.85Å
155	F	86.6	Confident	69.9	Low	56 Å²	56	81.6 Å²	81.6	25%	0.246	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	163.5	-174.4	67.1	-87.5	0	0	0	113.4	R152 I157 K249 I250	R152-F155 HydrophobicContact CB-CE1 4.38Å; R152-F155 HydrophobicContact CB-CZ 4.45Å; R152-F155 HydrophobicContact CG-CZ 4.27Å; R152-F155 PolarHBondContact O-N 3.32Å; R152-F155 VanDerWaalsContact O-O 3.05Å; F155-I157 HydrophobicContact CD2-CD1 4.37Å; F155-I157 HydrophobicContact CD2-CG1 3.94Å; F155-I157 HydrophobicContact CE2-CD1 3.78Å; F155-I157 HydrophobicContact CE2-CG1 3.85Å; F155-K249 HydrophobicContact CB-CD 4.36Å; F155-K249 HydrophobicContact CB-CG 4.21Å; F155-K249 HydrophobicContact CD2-CD 4.03Å; F155-K249 HydrophobicContact CD2-CG 3.93Å; F155-K249 HydrophobicContact CG-CD 4.31Å; F155-K249 HydrophobicContact CG-CG 4.4Å; F155-I250 CarbonylContact C-O 3.52Å; F155-I250 WeakPolarHBondContact CA-O 3.12Å; F155-I250 WeakPolarHBondContact CB-O 3.32Å
156	R	87.9	Confident	72.6	Confident	23 Å²	23	80.1 Å²	80.1	9%	0.087	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	145.7	171.2	-61	-57.7	178.1	-78.5	-9	110.3	R152 K249 I250 L274 F278 I281 D282	R152-R156 PolarHBondContact O-NH1 2.75Å; R156-K249 CarbonylContact O-C 3.47Å; R156-K249 WeakPolarHBondContact O-CA 3.45Å; R156-I250 PolarHBondContact N-O 3.35Å; R156-I250 PolarHBondContact O-N 3.11Å; R156-L274 HydrophobicContact CG-CD2 3.96Å; R156-F278 HydrophobicContact CG-CD2 4.44Å; R156-I281 HydrophobicContact CB-CG2 4.04Å; R156-I281 HydrophobicContact CG-CG2 3.92Å; R156-D282 IonicContact CZ-OD1 3.87Å; R156-D282 IonicContact NE-OD1 2.68Å; R156-D282 PolarHBondContact NE-OD1 3.03Å; R156-D282 IonicContact NE-OD2 3.52Å; R156-D282 IonicContact NH2-OD1 3.71Å; R156-D282 PolarHBondContact NH2-OD1 2.62Å
157	I	88.4	Confident	75.1	Confident	51 Å²	51	82 Å²	82	26%	0.262	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.9	173.6	-63.9	-178.5	0	0	0	108.2	F155 R159 I199 F248 K249	F155-I157 HydrophobicContact CD2-CD1 4.37Å; F155-I157 HydrophobicContact CD2-CG1 3.94Å; F155-I157 HydrophobicContact CE2-CD1 3.78Å; F155-I157 HydrophobicContact CE2-CG1 3.85Å; I157-R159 HydrophobicContact CG2-CG 4.43Å; I157-I199 HydrophobicContact CD1-CD1 4.06Å; I157-I199 HydrophobicContact CG1-CD1 4.17Å; I157-I199 HydrophobicContact CG2-CD1 3.82Å; I157-F248 CarbonylContact C-O 3.51Å; I157-F248 WeakPolarHBondContact CA-O 3.35Å; I157-K249 HydrophobicContact CG1-CG 4.32Å
158	V	90.6	Very high	77.6	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	144.8	173	-63.3	0	0	0	0	109.5	M108 F160 F177 G247 F248 I281	M108-V158 HydrophobicContact CE-CB 4.24Å; M108-V158 HydrophobicContact CE-CG1 4.17Å; M108-V158 HydrophobicContact SD-CB 4.01Å; M108-V158 HydrophobicContact SD-CG1 3.81Å; V158-F160 HydrophobicContact CB-CE2 4.15Å; V158-F160 HydrophobicContact CB-CZ 4.44Å; V158-F160 HydrophobicContact CG2-CE2 3.83Å; V158-F160 HydrophobicContact CG2-CZ 4.41Å; V158-F177 HydrophobicContact CG2-CE1 4.4Å; V158-F177 HydrophobicContact CG2-CE2 4.27Å; V158-F177 HydrophobicContact CG2-CZ 3.87Å; V158-G247 CarbonylContact O-C 3.58Å; V158-G247 WeakPolarHBondContact O-CA 3.46Å; V158-F248 HydrophobicContact CG2-CB 3.75Å; V158-F248 HydrophobicContact CG2-CD2 4.29Å; V158-F248 PolarHBondContact N-O 2.95Å; V158-F248 PolarHBondContact O-N 2.91Å; V158-I281 HydrophobicContact CG1-CD1 3.34Å; V158-I281 HydrophobicContact CG1-CG1 4.08Å
159	R	90.6	Very high	79.8	Confident	150 Å²	150	74.4 Å²	74.4	57%	0.566	35%	0.354	S	S	*	.			trans	-130.9	151.2	179	-67.4	-177.1	179	143	-3.7	109.1	P109 I157	P109-R159 VanDerWaalsContact CD-O 3.28Å; P109-R159 WeakPolarHBondContact CD-O 3.23Å; I157-R159 HydrophobicContact CG2-CG 4.43Å
160	F	91.6	Very high	81.7	Confident	6 Å²	6	74 Å²	74	3%	0.026	36%	0.356	C	S	.	.			trans	-136.1	141	-179.4	-64.5	-79.8	0	0	0	109.5	M108 V158 F177 N245 F248 P307 L309	M108-F160 HydrophobicContact CB-CD1 4.33Å; M108-F160 HydrophobicContact CB-CE1 3.72Å; M108-F160 HydrophobicContact CB-CZ 4.31Å; V158-F160 HydrophobicContact CB-CE2 4.15Å; V158-F160 HydrophobicContact CB-CZ 4.44Å; V158-F160 HydrophobicContact CG2-CE2 3.83Å; V158-F160 HydrophobicContact CG2-CZ 4.41Å; F160-F177 AromaticContact CE2-CD2 3.9Å; F160-F177 HydrophobicContact CE2-CD2 3.9Å; F160-F177 AromaticContact CE2-CE2 3.9Å; F160-F177 HydrophobicContact CE2-CE2 3.9Å; F160-F177 AromaticContact CZ-CD2 3.73Å; F160-F177 HydrophobicContact CZ-CD2 3.73Å; F160-F177 AromaticContact CZ-CE2 3.55Å; F160-F177 HydrophobicContact CZ-CE2 3.55Å; F160-N245 PolarHBondContact O-ND2 2.96Å; F160-F248 HydrophobicContact CD2-CD2 4.23Å; F160-F248 HydrophobicContact CD2-CE2 4.31Å; F160-F248 HydrophobicContact CE2-CD2 4.03Å; F160-F248 HydrophobicContact CE2-CE2 4.38Å; F160-P307 HydrophobicContact CZ-CB 4.4Å; F160-L309 HydrophobicContact CB-CD1 3.5Å; F160-L309 VanDerWaalsContact CB-CD1 3.5Å; F160-L309 HydrophobicContact CB-CG 4.31Å; F160-L309 HydrophobicContact CD1-CD1 3.94Å; F160-L309 HydrophobicContact CD1-CG 3.8Å; F160-L309 HydrophobicContact CD2-CD1 3.68Å; F160-L309 HydrophobicContact CD2-CD2 4.16Å; F160-L309 HydrophobicContact CD2-CG 3.82Å; F160-L309 HydrophobicContact CE1-CG 4.05Å; F160-L309 HydrophobicContact CE2-CD1 4.42Å; F160-L309 HydrophobicContact CE2-CD2 4.15Å; F160-L309 HydrophobicContact CE2-CG 4.07Å; F160-L309 HydrophobicContact CG-CD1 3.4Å; F160-L309 VanDerWaalsContact CG-CD1 3.4Å; F160-L309 HydrophobicContact CG-CG 3.68Å; F160-L309 HydrophobicContact CZ-CD2 4.49Å; F160-L309 HydrophobicContact CZ-CG 4.19Å
161	D	90	Very high	83.7	Confident	99 Å²	99	65.3 Å²	65.3	53%	0.529	32%	0.318	S	S	.	.			trans	-94.2	109.2	170.1	-173.9	2.8	0	0	0	109.2	I106 S163	I106-D161 VanDerWaalsContact CG2-O 3.3Å; I106-D161 WeakPolarHBondContact CG2-O 3.32Å; D161-S163 WeakPolarHBondContact OD1-CB 3.27Å; D161-S163 PolarHBondContact OD1-N 2.03Å; D161-S163 PolarHBondContact OD1-OG 3.42Å
162	V	89.9	Confident	85.2	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.018	29%	0.294	C	S	.	.			trans	-100.7	6.9	178.4	-63	0	0	0	0	112.6	I106 A164 M165 W238 L239 L309	I106-V162 HydrophobicContact CD1-CB 4.43Å; I106-V162 HydrophobicContact CD1-CG1 3.94Å; V162-A164 PolarHBondContact O-N 2.9Å; V162-A164 VanDerWaalsContact O-N 3.09Å; V162-M165 PolarHBondContact O-N 2.92Å; V162-W238 HydrophobicContact CG1-CE3 4.48Å; V162-W238 HydrophobicContact CG2-CB 3.98Å; V162-L239 HydrophobicContact CB-CD2 3.92Å; V162-L239 HydrophobicContact CG2-CD2 4.05Å; V162-L309 HydrophobicContact CG1-CD1 4.14Å
163	S	88	Confident	86	Confident	37 Å²	37	54.7 Å²	54.7	26%	0.259	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-56.8	-33.2	-172.5	-53.7	0	0	0	0	112.9	D161 M165 E166 K242	D161-S163 WeakPolarHBondContact OD1-CB 3.27Å; D161-S163 PolarHBondContact OD1-N 2.03Å; D161-S163 PolarHBondContact OD1-OG 3.42Å; S163-M165 PolarHBondContact O-N 3.38Å; S163-E166 WeakPolarHBondContact CA-OE1 3.3Å; S163-E166 WeakPolarHBondContact O-CG 3.44Å; S163-E166 PolarHBondContact O-N 3.36Å; S163-K242 WeakPolarHBondContact OG-CE 3.47Å; S163-K242 PolarHBondContact OG-NZ 3.33Å
164	A	85.8	Confident	86.7	Confident	82 Å²	82	57.1 Å²	57.1	68%	0.678	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-63.5	-24	178.8	0	0	0	0	0	113.6	V162	V162-A164 PolarHBondContact O-N 2.9Å; V162-A164 VanDerWaalsContact O-N 3.09Å
165	M	86.7	Confident	87.2	Confident	26 Å²	26	52.1 Å²	52.1	13%	0.128	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-101.9	-2.3	-173.4	-60.9	-66.6	108.3	0	0	113.4	Y104 I106 V162 S163 K167 N168 L239 L311	Y104-M165 HydrophobicContact CD1-CE 3.89Å; Y104-M165 HydrophobicContact CD1-SD 3.77Å; Y104-M165 HydrophobicContact CD2-SD 4.26Å; Y104-M165 HydrophobicContact CE1-CE 4.12Å; Y104-M165 HydrophobicContact CE1-SD 4.19Å; Y104-M165 HydrophobicContact CG-CE 4.5Å; Y104-M165 HydrophobicContact CG-SD 3.79Å; I106-M165 HydrophobicContact CD1-CG 4.07Å; V162-M165 PolarHBondContact O-N 2.92Å; S163-M165 PolarHBondContact O-N 3.38Å; M165-K167 VanDerWaalsContact C-N 3.26Å; M165-K167 PolarHBondContact O-N 2.99Å; M165-N168 PolarHBondContact O-N 3.48Å; M165-L239 HydrophobicContact CB-CD2 3.79Å; M165-L311 HydrophobicContact CB-CD2 4.25Å; M165-L311 HydrophobicContact CG-CD2 4.09Å
166	E	83.8	Confident	87.6	Confident	71 Å²	71	50.8 Å²	50.8	33%	0.332	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-55.2	-38.7	-177	-71.4	173.6	-176.9	0	0	112.6	S163 N168 A169 K242	S163-E166 WeakPolarHBondContact CA-OE1 3.3Å; S163-E166 WeakPolarHBondContact O-CG 3.44Å; S163-E166 PolarHBondContact O-N 3.36Å; E166-N168 PolarHBondContact O-N 3.32Å; E166-N168 VanDerWaalsContact O-N 3.16Å; E166-A169 WeakPolarHBondContact O-CB 3.5Å; E166-A169 PolarHBondContact O-N 3.24Å; E166-K242 IonicContact OE1-NZ 3.8Å
167	K	81.8	Confident	88	Confident	196 Å²	196	49.7 Å²	49.7	85%	0.852	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-63.8	-21.7	178.9	-64.9	-175.3	-179.7	-178.8	0	113.7	M165	M165-K167 VanDerWaalsContact C-N 3.26Å; M165-K167 PolarHBondContact O-N 2.99Å
168	N	81.7	Confident	88.3	Confident	45 Å²	45	51.5 Å²	51.5	24%	0.241	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-109.2	20	-177.7	-61.3	-25.9	0	0	0	111.8	M165 E166 S170 N171 L313	M165-N168 PolarHBondContact O-N 3.48Å; E166-N168 PolarHBondContact O-N 3.32Å; E166-N168 VanDerWaalsContact O-N 3.16Å; N168-S170 VanDerWaalsContact C-N 3.26Å; N168-S170 PolarHBondContact O-N 3.27Å; N168-N171 HydrophobicContact CB-CB 4.47Å; N168-N171 WeakPolarHBondContact O-CB 3.44Å; N168-N171 PolarHBondContact O-N 3.13Å; N168-L313 HydrophobicContact CB-CD2 3.6Å; N168-L313 WeakPolarHBondContact O-CD2 3.32Å
169	A	82.4	Confident	88.4	Confident	10 Å²	10	51.5 Å²	51.5	8%	0.083	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-53.5	-40.1	-175.6	0	0	0	0	0	113.7	E166 N171 L172 L239	E166-A169 WeakPolarHBondContact O-CB 3.5Å; E166-A169 PolarHBondContact O-N 3.24Å; A169-N171 PolarHBondContact O-N 3.14Å; A169-L172 PolarHBondContact O-N 2.83Å; A169-L239 HydrophobicContact CB-CB 3.68Å; A169-L239 HydrophobicContact CB-CD1 4.45Å
170	S	83	Confident	88.4	Confident	95 Å²	95	45.1 Å²	45.1	66%	0.664	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-67.9	-16.3	177.8	52.6	0	0	0	0	114.2	N168	N168-S170 VanDerWaalsContact C-N 3.26Å; N168-S170 PolarHBondContact O-N 3.27Å
171	N	86.4	Confident	88.4	Confident	13 Å²	13	45 Å²	45	7%	0.07	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-97.2	-5.3	-173	-55.5	8.9	0	0	0	111.9	N168 A169 V173 L313 L314 L319	N168-N171 HydrophobicContact CB-CB 4.47Å; N168-N171 WeakPolarHBondContact O-CB 3.44Å; N168-N171 PolarHBondContact O-N 3.13Å; A169-N171 PolarHBondContact O-N 3.14Å; N171-V173 PolarHBondContact O-N 3.49Å; N171-L313 HydrophobicContact CB-CB 4.29Å; N171-L313 HydrophobicContact CB-CD2 4.14Å; N171-L313 CarbonylContact O-C 3.45Å; N171-L313 WeakPolarHBondContact O-CA 3.27Å; N171-L314 WeakPolarHBondContact CB-O 3.11Å; N171-L314 PolarHBondContact ND2-O 2.98Å; N171-L314 PolarHBondContact O-N 3.2Å; N171-L319 HydrophobicContact CB-CD1 4.03Å; N171-L319 WeakPolarHBondContact OD1-CD1 3.44Å
172	L	87.9	Confident	88.4	Confident	18 Å²	18	41.4 Å²	41.4	9%	0.094	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	116.4	-179.9	-177.6	70.3	0	0	0	110.2	A169 A175 V235 H236 L239 L311 L313	A169-L172 PolarHBondContact O-N 2.83Å; L172-A175 HydrophobicContact CD1-CB 4.35Å; L172-V235 HydrophobicContact CD2-CB 4.34Å; L172-V235 HydrophobicContact CD2-CG1 4.01Å; L172-H236 HydrophobicContact CD2-CB 4.05Å; L172-L239 HydrophobicContact CB-CD1 4.32Å; L172-L239 HydrophobicContact CD2-CD1 3.91Å; L172-L311 HydrophobicContact CD1-CB 3.94Å; L172-L311 HydrophobicContact CD1-CD2 4.25Å; L172-L311 HydrophobicContact CD1-CG 4.02Å; L172-L313 HydrophobicContact CD1-CG 4.28Å
173	V	86.4	Confident	88.3	Confident	40 Å²	40	46.1 Å²	46.1	24%	0.242	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-44.4	175	179.5	0	0	0	0	110.6	N171 M312 L314	N171-V173 PolarHBondContact O-N 3.49Å; V173-M312 PolarHBondContact N-O 2.92Å; V173-L314 HydrophobicContact CG2-CB 4.49Å; V173-L314 HydrophobicContact CG2-CD1 3.75Å; V173-L314 HydrophobicContact CG2-CD2 4.42Å; V173-L314 HydrophobicContact CG2-CG 3.53Å
174	K	88.8	Confident	88.3	Confident	73 Å²	73	45.3 Å²	45.3	32%	0.317	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	144.4	-176.5	-170.1	173.7	-177	-162.5	0	111.2	E176 M312	K174-E176 WeakPolarHBondContact CE-OE1 3.43Å; K174-E176 IonicContact NZ-OE1 2.87Å; K174-E176 PolarHBondContact NZ-OE1 2.97Å; K174-M312 HydrophobicContact CB-CB 4.26Å; K174-M312 HydrophobicContact CB-CE 3.83Å; K174-M312 HydrophobicContact CB-SD 4.31Å; K174-M312 HydrophobicContact CD-CE 3.63Å; K174-M312 HydrophobicContact CD-SD 4.42Å; K174-M312 HydrophobicContact CG-CE 3.67Å; K174-M312 PolarHBondContact N-O 2.8Å; K174-M312 PolarHBondContact O-N 3.25Å
175	A	93.8	Very high	88.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	129.5	170	0	0	0	0	0	111.4	L172 V231 T232 V235 L310 L311	L172-A175 HydrophobicContact CD1-CB 4.35Å; A175-V231 HydrophobicContact CB-CG2 4.19Å; A175-V231 PolarHBondContact O-N 2.85Å; A175-T232 PolarHBondContact N-OG1 2.52Å; A175-T232 PolarHBondContact O-N 2.81Å; A175-T232 PolarHBondContact O-OG1 2.68Å; A175-V235 HydrophobicContact CB-CB 3.83Å; A175-V235 HydrophobicContact CB-CG1 4.12Å; A175-V235 HydrophobicContact CB-CG2 3.84Å; A175-L310 CarbonylContact C-O 3.44Å; A175-L310 VanDerWaalsContact CA-O 3.32Å; A175-L310 WeakPolarHBondContact CA-O 3.23Å; A175-L311 HydrophobicContact CB-CG 4.39Å
176	E	94.5	Very high	88.3	Confident	28 Å²	28	53.1 Å²	53.1	13%	0.131	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.7	176.5	-68.3	-174.6	177.4	0	0	110.9	K174 R178 F229 L309 L310 M312	K174-E176 WeakPolarHBondContact CE-OE1 3.43Å; K174-E176 IonicContact NZ-OE1 2.87Å; K174-E176 PolarHBondContact NZ-OE1 2.97Å; E176-R178 IonicContact OE2-CZ 3.29Å; E176-R178 IonicContact OE2-NE 2.84Å; E176-R178 PolarHBondContact OE2-NE 3.44Å; E176-R178 IonicContact OE2-NH2 2.79Å; E176-R178 PolarHBondContact OE2-NH2 2.93Å; E176-F229 CarbonylContact C-O 3.59Å; E176-F229 WeakPolarHBondContact CA-O 3.42Å; E176-L309 CarbonylContact O-C 3.59Å; E176-L309 WeakPolarHBondContact O-CA 3.48Å; E176-L310 HydrophobicContact CB-CB 4.48Å; E176-L310 PolarHBondContact N-O 2.8Å; E176-L310 PolarHBondContact O-N 3.41Å; E176-M312 HydrophobicContact CG-CE 3.96Å
177	F	95.9	Very high	88.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.2	168.5	169.1	-128.4	0	0	0	110	V158 F160 V179 L196 S228 F229 V231 F248 I250 P307 L309	V158-F177 HydrophobicContact CG2-CE1 4.4Å; V158-F177 HydrophobicContact CG2-CE2 4.27Å; V158-F177 HydrophobicContact CG2-CZ 3.87Å; F160-F177 AromaticContact CE2-CD2 3.9Å; F160-F177 HydrophobicContact CE2-CD2 3.9Å; F160-F177 AromaticContact CE2-CE2 3.9Å; F160-F177 HydrophobicContact CE2-CE2 3.9Å; F160-F177 AromaticContact CZ-CD2 3.73Å; F160-F177 HydrophobicContact CZ-CD2 3.73Å; F160-F177 AromaticContact CZ-CE2 3.55Å; F160-F177 HydrophobicContact CZ-CE2 3.55Å; F177-V179 HydrophobicContact CE1-CB 4.32Å; F177-V179 HydrophobicContact CE1-CG1 4.23Å; F177-V179 HydrophobicContact CE2-CB 4.22Å; F177-V179 HydrophobicContact CZ-CB 3.76Å; F177-V179 HydrophobicContact CZ-CG1 4.17Å; F177-V179 HydrophobicContact CZ-CG2 4.42Å; F177-L196 HydrophobicContact CD1-CD1 4.02Å; F177-L196 HydrophobicContact CD1-CD2 3.87Å; F177-L196 HydrophobicContact CE1-CD1 3.87Å; F177-S228 CarbonylContact O-C 3.58Å; F177-S228 WeakPolarHBondContact O-CA 3.19Å; F177-F229 HydrophobicContact CB-CB 4.45Å; F177-F229 HydrophobicContact CD1-CB 4.42Å; F177-F229 AromaticContact CD1-CD2 3.82Å; F177-F229 HydrophobicContact CD1-CD2 3.82Å; F177-F229 HydrophobicContact CD1-CG 4.48Å; F177-F229 HydrophobicContact CE1-CD2 4.23Å; F177-F229 PolarHBondContact N-O 2.84Å; F177-F229 PolarHBondContact O-N 2.79Å; F177-V231 HydrophobicContact CB-CB 4.47Å; F177-V231 HydrophobicContact CB-CG1 3.76Å; F177-V231 HydrophobicContact CB-CG2 3.82Å; F177-F248 HydrophobicContact CG-CD2 4.5Å; F177-I250 HydrophobicContact CE1-CD1 4.06Å; F177-I250 HydrophobicContact CZ-CD1 4.25Å; F177-P307 HydrophobicContact CE2-CB 3.89Å; F177-P307 HydrophobicContact CZ-CB 4.4Å; F177-L309 HydrophobicContact CB-CD2 3.71Å; F177-L309 HydrophobicContact CD2-CD2 4.1Å; F177-L309 HydrophobicContact CG-CD2 4.29Å
178	R	94.6	Very high	88.6	Confident	89 Å²	89	50.3 Å²	50.3	34%	0.336	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.3	179.1	-66.4	-166.8	176.7	-171.3	0.9	111.9	E176 W226 L227 P307 H308 L310	E176-R178 IonicContact OE2-CZ 3.29Å; E176-R178 IonicContact OE2-NE 2.84Å; E176-R178 PolarHBondContact OE2-NE 3.44Å; E176-R178 IonicContact OE2-NH2 2.79Å; E176-R178 PolarHBondContact OE2-NH2 2.93Å; R178-W226 HydrophobicContact CB-CE3 4.15Å; R178-W226 HydrophobicContact CB-CZ3 4.21Å; R178-L227 VanDerWaalsContact CA-O 3.31Å; R178-L227 WeakPolarHBondContact CA-O 3.45Å; R178-P307 VanDerWaalsContact O-CA 3.28Å; R178-P307 WeakPolarHBondContact O-CA 3.36Å; R178-H308 PolarHBondContact N-O 3.37Å; R178-H308 PolarHBondContact O-N 3.5Å; R178-L310 HydrophobicContact CG-CD1 4.46Å
179	V	93.4	Very high	88.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.9	177.3	65	0	0	0	0	110.5	F177 L227 F229 F278 I281 P307	F177-V179 HydrophobicContact CE1-CB 4.32Å; F177-V179 HydrophobicContact CE1-CG1 4.23Å; F177-V179 HydrophobicContact CE2-CB 4.22Å; F177-V179 HydrophobicContact CZ-CB 3.76Å; F177-V179 HydrophobicContact CZ-CG1 4.17Å; F177-V179 HydrophobicContact CZ-CG2 4.42Å; V179-L227 HydrophobicContact CG1-CB 4.02Å; V179-L227 HydrophobicContact CG1-CD1 4.44Å; V179-L227 PolarHBondContact N-O 3.03Å; V179-L227 PolarHBondContact O-N 2.95Å; V179-F229 HydrophobicContact CG1-CE2 4.13Å; V179-F278 HydrophobicContact CB-CD1 4.47Å; V179-F278 HydrophobicContact CG1-CD1 4.14Å; V179-F278 HydrophobicContact CG1-CE1 4.22Å; V179-F278 HydrophobicContact CG2-CB 3.76Å; V179-F278 HydrophobicContact CG2-CD1 3.52Å; V179-F278 HydrophobicContact CG2-CE1 4.37Å; V179-F278 HydrophobicContact CG2-CG 3.83Å; V179-I281 HydrophobicContact CG2-CD1 4.27Å; V179-P307 HydrophobicContact CB-CB 4.48Å; V179-P307 HydrophobicContact CG2-CB 4.26Å; V179-P307 HydrophobicContact CG2-CG 4.17Å
180	F	90.9	Very high	88.9	Confident	17 Å²	17	53.4 Å²	53.4	8%	0.075	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	115.5	-180	-169.2	-93.6	0	0	0	110.8	L182 E225 W226 F278 A279 K305	F180-L182 HydrophobicContact CD1-CD2 4.07Å; F180-L182 HydrophobicContact CE1-CD2 4.18Å; F180-E225 CarbonylContact C-O 3.48Å; F180-W226 HydrophobicContact CB-CD2 4.09Å; F180-W226 HydrophobicContact CB-CE3 3.86Å; F180-W226 HydrophobicContact CB-CH2 4Å; F180-W226 HydrophobicContact CB-CZ2 4.22Å; F180-W226 HydrophobicContact CB-CZ3 3.82Å; F180-W226 AromaticContact CD2-CD1 3.71Å; F180-W226 AromaticContact CD2-CD2 3.63Å; F180-W226 HydrophobicContact CD2-CD2 3.63Å; F180-W226 AromaticContact CD2-CE2 3.56Å; F180-W226 HydrophobicContact CD2-CE3 4.27Å; F180-W226 AromaticContact CD2-CG 3.74Å; F180-W226 HydrophobicContact CD2-CG 3.74Å; F180-W226 HydrophobicContact CD2-CZ2 4.16Å; F180-W226 AromaticContact CD2-NE1 3.6Å; F180-W226 AromaticContact CE2-CD1 3.98Å; F180-W226 HydrophobicContact CE2-CG 4.36Å; F180-W226 AromaticContact CE2-NE1 4Å; F180-W226 HydrophobicContact CG-CD2 4.37Å; F180-F278 WeakPolarHBondContact O-CA 3Å; F180-A279 HydrophobicContact CB-CB 4.16Å; F180-A279 HydrophobicContact CD1-CB 4.22Å; F180-A279 PolarHBondContact O-N 2.98Å; F180-K305 HydrophobicContact CB-CB 4.01Å; F180-K305 HydrophobicContact CD1-CB 4.29Å; F180-K305 HydrophobicContact CD1-CD 3.7Å; F180-K305 HydrophobicContact CD1-CG 4.48Å; F180-K305 HydrophobicContact CD2-CD 4.16Å; F180-K305 HydrophobicContact CE1-CD 3.69Å; F180-K305 HydrophobicContact CE2-CD 4.16Å; F180-K305 HydrophobicContact CG-CB 4.09Å; F180-K305 HydrophobicContact CG-CD 3.93Å; F180-K305 HydrophobicContact CG-CG 4.32Å; F180-K305 HydrophobicContact CZ-CD 3.93Å
181	R	91.4	Very high	89.2	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	130.3	171.9	-175.7	-172.7	62	74.3	-1	109.6	K219 A222 E223 G224 E225 L227 R277 F278	R181-K219 PolarHBondContact NE-O 2.85Å; R181-K219 PolarHBondContact NH1-O 2.86Å; R181-K219 PolarHBondContact NH2-O 3.37Å; R181-A222 PolarHBondContact NH1-O 2.91Å; R181-E223 PolarHBondContact NH2-O 3.48Å; R181-G224 CarbonylContact O-C 3.46Å; R181-G224 WeakPolarHBondContact O-CA 3.38Å; R181-E225 PolarHBondContact N-O 3.28Å; R181-E225 PolarHBondContact O-N 3.46Å; R181-E225 VanDerWaalsContact O-N 3.11Å; R181-L227 HydrophobicContact CB-CD1 4.32Å; R181-R277 CarbonylContact C-O 3.22Å; R181-R277 WeakPolarHBondContact CA-O 3.49Å; R181-F278 HydrophobicContact CB-CD1 4.46Å; R181-F278 HydrophobicContact CB-CE1 4.42Å
182	L	89	Confident	89.3	Confident	25 Å²	25	51.2 Å²	51.2	13%	0.131	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	149.7	171.9	-64.9	173.1	0	0	0	110.4	F180 N184 R277 A279	F180-L182 HydrophobicContact CD1-CD2 4.07Å; F180-L182 HydrophobicContact CE1-CD2 4.18Å; L182-N184 PolarHBondContact O-N 2.87Å; L182-R277 HydrophobicContact CB-CB 4.12Å; L182-R277 PolarHBondContact N-O 2.89Å; L182-A279 HydrophobicContact CD1-CB 4.33Å; L182-A279 HydrophobicContact CD2-CB 4Å; L182-A279 HydrophobicContact CG-CB 4.13Å
183	Q	88.7	Confident	89.4	Confident	102 Å²	102	53.2 Å²	53.2	48%	0.477	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-66.3	129.8	168.2	-173.4	172.6	30.4	0	0	109.6	P185 R221 A222	Q183-P185 WeakPolarHBondContact O-CD 3.01Å; Q183-R221 WeakPolarHBondContact CG-O 3.4Å; Q183-R221 PolarHBondContact NE2-O 3.33Å; Q183-A222 WeakPolarHBondContact CB-O 3Å; Q183-A222 WeakPolarHBondContact CG-O 3.48Å
184	N	88.3	Confident	89.7	Confident	19 Å²	19	51.3 Å²	51.3	10%	0.102	24%	0.241	C	C	.	.			trans	-115.8	93.9	173.2	-175.4	7.9	0	0	0	110.5	L182 K186 A187 T220 E275 R277	L182-N184 PolarHBondContact O-N 2.87Å; N184-K186 PolarHBondContact O-N 2.85Å; N184-K186 PolarHBondContact OD1-N 3.35Å; N184-K186 VanDerWaalsContact OD1-N 3.15Å; N184-A187 HydrophobicContact CB-CB 4.2Å; N184-A187 WeakPolarHBondContact O-CB 3.35Å; N184-A187 PolarHBondContact O-N 3.1Å; N184-T220 PolarHBondContact N-O 2.95Å; N184-E275 PolarHBondContact ND2-O 2.96Å; N184-R277 HydrophobicContact CB-CG 4.23Å
185	P	85.4	Confident	89.9	Confident	102 Å²	102	48 Å²	48	66%	0.662	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.3	177.7	-22.8	33.8	0	0	0	113.7	Q183 A187	Q183-P185 WeakPolarHBondContact O-CD 3.01Å; P185-A187 VanDerWaalsContact C-N 3.34Å
186	K	85.6	Confident	89.9	Confident	170 Å²	170	48 Å²	48	74%	0.739	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	0.6	-178.6	-60.7	-176.1	178.4	-176.6	0	113.4	N184	N184-K186 PolarHBondContact O-N 2.85Å; N184-K186 PolarHBondContact OD1-N 3.35Å; N184-K186 VanDerWaalsContact OD1-N 3.15Å
187	A	85.8	Confident	89.9	Confident	2 Å²	2	48 Å²	48	2%	0.017	23%	0.225	C	C	.	.			trans	-64.4	133.5	-179.6	0	0	0	0	0	111.2	N184 P185 T220 R221 E275	N184-A187 HydrophobicContact CB-CB 4.2Å; N184-A187 WeakPolarHBondContact O-CB 3.35Å; N184-A187 PolarHBondContact O-N 3.1Å; P185-A187 VanDerWaalsContact C-N 3.34Å; A187-T220 HydrophobicContact CB-CG2 4.35Å; A187-T220 VanDerWaalsContact CB-OG1 3.3Å; A187-T220 WeakPolarHBondContact CB-OG1 3.4Å; A187-R221 HydrophobicContact CB-CG 4.14Å; A187-R221 VanDerWaalsContact O-CZ 3.25Å; A187-R221 PolarHBondContact O-NE 3.26Å; A187-R221 PolarHBondContact O-NH2 2.99Å; A187-E275 VanDerWaalsContact C-OE2 3.31Å; A187-E275 VanDerWaalsContact CA-OE2 3.24Å; A187-E275 WeakPolarHBondContact CA-OE2 3.32Å; A187-E275 HydrophobicContact CB-CB 4.21Å; A187-E275 WeakPolarHBondContact CB-OE2 3.46Å
188	R	86.6	Confident	89.8	Confident	207 Å²	207	48.1 Å²	48.1	78%	0.781	23%	0.226	S	C	*	.	S	Bend	trans	-78.7	-38.6	176.5	-60.1	173.2	176.5	174.6	0.5	110.8	R221 E275	R188-R221 PolarHBondContact O-NH2 3.48Å; R188-E275 VanDerWaalsContact CB-OE1 3.26Å; R188-E275 WeakPolarHBondContact CB-OE1 3.47Å; R188-E275 WeakPolarHBondContact CG-OE1 3.41Å; R188-E275 VanDerWaalsContact N-CD 3.3Å; R188-E275 PolarHBondContact N-OE1 3.18Å; R188-E275 VanDerWaalsContact N-OE1 3.16Å; R188-E275 PolarHBondContact N-OE2 3.34Å
189	V	84.3	Confident	89.6	Confident	36 Å²	36	45.3 Å²	45.3	22%	0.218	22%	0.217	C	C	.	.	S	Bend	trans	-99.6	132.2	-176.5	-168.9	0	0	0	0	109.5	E191 Q192 T220 E275	V189-E191 WeakPolarHBondContact CG1-O 3.45Å; V189-Q192 HydrophobicContact CB-CG 4.39Å; V189-Q192 HydrophobicContact CG1-CG 4.45Å; V189-T220 WeakPolarHBondContact O-CG2 3.02Å; V189-T220 PolarHBondContact O-OG1 2.87Å; V189-E275 PolarHBondContact N-OE2 2.6Å
190	P	86.6	Confident	89.4	Confident	83 Å²	83	47 Å²	47	54%	0.539	23%	0.226	S	C	.	.	S	Bend	trans	-70.8	-30.1	-178	27.9	-35	0	0	0	113.5	K219 T220	P190-K219 CarbonylContact O-C 3.6Å; P190-K219 WeakPolarHBondContact O-CA 3.02Å; P190-T220 PolarHBondContact O-N 3.35Å; P190-T220 PolarHBondContact O-OG1 3.46Å
191	E	89.5	Confident	89.1	Confident	60 Å²	60	52.9 Å²	52.9	28%	0.28	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	140.2	-176.5	-63.4	-171.3	166.1	0	0	111.2	V189 V217 V218 K219 P261	V189-E191 WeakPolarHBondContact CG1-O 3.45Å; E191-V217 HydrophobicContact CB-CG1 4.3Å; E191-V218 CarbonylContact C-O 3.52Å; E191-V218 VanDerWaalsContact CA-O 3.29Å; E191-V218 WeakPolarHBondContact CA-O 2.97Å; E191-K219 HydrophobicContact CG-CG 3.88Å; E191-K219 WeakPolarHBondContact OE1-CE 3.34Å; E191-P261 HydrophobicContact CB-CG 4.45Å
192	Q	87.9	Confident	88.5	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.009	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	139.1	176.3	-66.4	-169.4	-61.8	0	0	110.6	V189 I194 V217 V218 T220 L252 E273	V189-Q192 HydrophobicContact CB-CG 4.39Å; V189-Q192 HydrophobicContact CG1-CG 4.45Å; Q192-I194 PolarHBondContact O-N 2.92Å; Q192-V217 WeakPolarHBondContact O-CA 3.39Å; Q192-V218 HydrophobicContact CB-CG2 4.49Å; Q192-V218 PolarHBondContact N-O 2.94Å; Q192-V218 WeakPolarHBondContact O-CG2 3.45Å; Q192-V218 PolarHBondContact O-N 3.4Å; Q192-T220 HydrophobicContact CB-CG2 4.4Å; Q192-T220 HydrophobicContact CG-CG2 3.84Å; Q192-L252 HydrophobicContact CB-CD2 4.13Å; Q192-E273 PolarHBondContact NE2-O 3.02Å
193	R	89.9	Confident	87.7	Confident	61 Å²	61	62.5 Å²	62.5	23%	0.23	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	106.7	170.3	-174.8	177.2	175.1	-141.9	-5.6	109.4	E195 S215 K216 V217 L252 F259	R193-E195 IonicContact CZ-OE1 2.84Å; R193-E195 IonicContact NH2-OE1 2.71Å; R193-S215 PolarHBondContact NE-OG 3.41Å; R193-S215 PolarHBondContact NH2-OG 3.37Å; R193-K216 CarbonylContact C-O 3.55Å; R193-K216 WeakPolarHBondContact CA-O 3.39Å; R193-V217 HydrophobicContact CB-CG2 4.2Å; R193-V217 HydrophobicContact CG-CG2 4.23Å; R193-L252 VanDerWaalsContact O-CD2 3.28Å; R193-L252 WeakPolarHBondContact O-CD2 3.41Å; R193-F259 HydrophobicContact CB-CD1 3.92Å; R193-F259 HydrophobicContact CB-CE1 4.39Å
194	I	92.1	Very high	87.2	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	152.1	174.2	64.4	167.8	0	0	0	110.5	Q192 S215 K216 V218 L227 F229 I250 L252 L274 A276 F278	Q192-I194 PolarHBondContact O-N 2.92Å; I194-S215 CarbonylContact O-C 3.51Å; I194-S215 VanDerWaalsContact O-CA 3.23Å; I194-S215 WeakPolarHBondContact O-CA 3.28Å; I194-S215 WeakPolarHBondContact O-CB 3.3Å; I194-K216 HydrophobicContact CG1-CB 4.33Å; I194-K216 VanDerWaalsContact CG1-O 3.31Å; I194-K216 WeakPolarHBondContact CG1-O 3.32Å; I194-K216 PolarHBondContact N-O 2.98Å; I194-K216 PolarHBondContact O-N 3Å; I194-V218 HydrophobicContact CD1-CG1 3.85Å; I194-V218 HydrophobicContact CG1-CG1 4.05Å; I194-V218 HydrophobicContact CG1-CG2 4.47Å; I194-V218 HydrophobicContact CG2-CG2 3.89Å; I194-L227 HydrophobicContact CD1-CD1 3.76Å; I194-F229 HydrophobicContact CD1-CZ 4.02Å; I194-I250 HydrophobicContact CB-CG2 4.34Å; I194-I250 HydrophobicContact CD1-CG2 4.38Å; I194-L252 HydrophobicContact CG2-CD2 4.19Å; I194-L274 HydrophobicContact CG2-CD1 3.73Å; I194-A276 HydrophobicContact CG2-CB 4.37Å; I194-F278 HydrophobicContact CD1-CE1 4.42Å; I194-F278 HydrophobicContact CD1-CZ 4.07Å
195	E	93.1	Very high	86.4	Confident	3 Å²	3	70.5 Å²	70.5	1%	0.014	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	141.6	179.8	-61.5	-168.7	155.1	0	0	110.3	R193 Y197 Y212 D214 I250 S251 H253	R193-E195 IonicContact CZ-OE1 2.84Å; R193-E195 IonicContact NH2-OE1 2.71Å; E195-Y197 HydrophobicContact CB-CD2 4.25Å; E195-Y197 HydrophobicContact CB-CE2 3.54Å; E195-Y197 WeakPolarHBondContact OE2-CE2 3.5Å; E195-Y197 VanDerWaalsContact OE2-CZ 3.3Å; E195-Y197 PolarHBondContact OE2-OH 2.89Å; E195-Y212 HydrophobicContact CB-CE2 4.41Å; E195-Y212 HydrophobicContact CG-CE2 4.36Å; E195-D214 WeakPolarHBondContact CA-O 3.17Å; E195-I250 WeakPolarHBondContact O-CA 3.45Å; E195-S251 PolarHBondContact N-O 2.91Å; E195-S251 PolarHBondContact O-N 3.45Å; E195-H253 IonicContact OE1-CE1 2.91Å; E195-H253 IonicContact OE1-CG 3.21Å; E195-H253 IonicContact OE1-ND1 3.44Å; E195-H253 PolarHBondContact OE1-ND1 3.32Å; E195-H253 WeakPolarHBondContact OE2-CA 3.37Å; E195-H253 IonicContact OE2-ND1 3.63Å
196	L	95.1	Very high	85.8	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.6	177.4	-171.8	72.4	0	0	0	109.9	F177 I213 D214 F229 V231 F248 I250	F177-L196 HydrophobicContact CD1-CD1 4.02Å; F177-L196 HydrophobicContact CD1-CD2 3.87Å; F177-L196 HydrophobicContact CE1-CD1 3.87Å; L196-I213 HydrophobicContact CB-CB 4.47Å; L196-I213 HydrophobicContact CD2-CB 4.38Å; L196-I213 HydrophobicContact CD2-CD1 4.04Å; L196-I213 HydrophobicContact CD2-CG2 4.34Å; L196-I213 HydrophobicContact CG-CB 4.48Å; L196-I213 HydrophobicContact CG-CD1 4.18Å; L196-I213 WeakPolarHBondContact O-CB 3.33Å; L196-I213 PolarHBondContact O-N 2.04Å; L196-D214 PolarHBondContact N-O 2.03Å; L196-F229 HydrophobicContact CB-CD1 4.13Å; L196-F229 HydrophobicContact CB-CE1 4.23Å; L196-F229 HydrophobicContact CB-CG 4.47Å; L196-F229 HydrophobicContact CD2-CB 3.5Å; L196-F229 VanDerWaalsContact CD2-CB 3.5Å; L196-F229 HydrophobicContact CD2-CD1 4.06Å; L196-F229 HydrophobicContact CD2-CD2 4.12Å; L196-F229 HydrophobicContact CD2-CG 3.64Å; L196-V231 HydrophobicContact CD2-CG1 3.79Å; L196-F248 HydrophobicContact CD1-CB 3.83Å; L196-F248 HydrophobicContact CD1-CG 4.41Å; L196-I250 HydrophobicContact CD1-CG1 3.62Å
197	Y	93	Very high	85.4	Confident	28 Å²	28	65.3 Å²	65.3	11%	0.11	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.6	178.3	-66.6	-92.5	0	0	0	111	E195 Q210 R211 Y212 F248 K249	E195-Y197 HydrophobicContact CB-CD2 4.25Å; E195-Y197 HydrophobicContact CB-CE2 3.54Å; E195-Y197 WeakPolarHBondContact OE2-CE2 3.5Å; E195-Y197 VanDerWaalsContact OE2-CZ 3.3Å; E195-Y197 PolarHBondContact OE2-OH 2.89Å; Y197-Q210 HydrophobicContact CD1-CB 4.2Å; Y197-Q210 HydrophobicContact CD1-CG 4.1Å; Y197-R211 CarbonylContact C-O 3.48Å; Y197-R211 WeakPolarHBondContact CA-O 3.35Å; Y197-Y212 HydrophobicContact CE1-CD2 4.07Å; Y197-Y212 HydrophobicContact CE1-CG 4.5Å; Y197-F248 CarbonylContact O-C 3.51Å; Y197-F248 VanDerWaalsContact O-CA 3.27Å; Y197-F248 WeakPolarHBondContact O-CA 2.97Å; Y197-K249 PolarHBondContact N-O 3.27Å; Y197-K249 PolarHBondContact O-N 2.86Å
198	Q	94.3	Very high	85	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.009	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	130.5	162.1	-177.8	-173.6	1.1	0	0	108.7	L200 Q210 R211 I213 A234 E237 F248	Q198-L200 HydrophobicContact CG-CD2 4.2Å; Q198-Q210 CarbonylContact O-C 3.56Å; Q198-Q210 VanDerWaalsContact O-CA 3.27Å; Q198-Q210 WeakPolarHBondContact O-CA 3.25Å; Q198-R211 HydrophobicContact CB-CB 4.29Å; Q198-R211 PolarHBondContact N-O 3.31Å; Q198-R211 PolarHBondContact O-N 2.89Å; Q198-I213 HydrophobicContact CB-CD1 4.06Å; Q198-I213 HydrophobicContact CB-CG1 4.37Å; Q198-A234 HydrophobicContact CG-CB 4.19Å; Q198-E237 PolarHBondContact NE2-OE2 3.23Å; Q198-F248 HydrophobicContact CB-CD1 4.45Å; Q198-F248 HydrophobicContact CB-CE1 4.48Å
199	I	91.4	Very high	84.9	Confident	31 Å²	31	63.5 Å²	63.5	16%	0.159	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	129.7	175.7	-58.5	170.8	0	0	0	108.5	I157 L246 G247 K249	I157-I199 HydrophobicContact CD1-CD1 4.06Å; I157-I199 HydrophobicContact CG1-CD1 4.17Å; I157-I199 HydrophobicContact CG2-CD1 3.82Å; I199-L246 HydrophobicContact CB-CB 3.86Å; I199-L246 HydrophobicContact CG2-CB 3.73Å; I199-L246 HydrophobicContact CG2-CD1 4.02Å; I199-G247 PolarHBondContact N-O 3.27Å; I199-G247 VanDerWaalsContact N-O 3.08Å; I199-K249 HydrophobicContact CD1-CB 4.16Å; I199-K249 HydrophobicContact CG1-CB 4.02Å
200	L	89.3	Confident	85.1	Confident	36 Å²	36	65.5 Å²	65.5	19%	0.188	35%	0.348	C	S	.	.			trans	-109.3	148	180	-59.7	-179.1	0	0	0	110.9	Q198 S202 T209 R211 L246	Q198-L200 HydrophobicContact CG-CD2 4.2Å; L200-S202 PolarHBondContact O-N 3.02Å; L200-T209 PolarHBondContact N-O 2.81Å; L200-R211 HydrophobicContact CD1-CB 4.09Å; L200-R211 HydrophobicContact CG-CB 4.4Å; L200-L246 VanDerWaalsContact C-CD1 3.46Å
201	K	83.1	Confident	85.3	Confident	139 Å²	139	66.9 Å²	66.9	60%	0.604	34%	0.342	S	S	*	.			trans	-72.2	120.4	173.2	-168.7	175.3	-178.9	178.4	0	108.4	K203 L246	K201-K203 PolarHBondContact O-N 3.11Å; K201-L246 HydrophobicContact CB-CD1 3.96Å; K201-L246 VanDerWaalsContact N-CD1 3.34Å
202	S	79.7	Confident	85.5	Confident	61 Å²	61	69.4 Å²	69.4	43%	0.427	35%	0.35	S	S	.	.			trans	-66.3	125.3	174.5	-165.2	0	0	0	0	109.7	L200 D204	L200-S202 PolarHBondContact O-N 3.02Å; S202-D204 PolarHBondContact OG-O 3.43Å
203	K	72.4	Confident	85.7	Confident	168 Å²	168	71.3 Å²	71.3	73%	0.73	36%	0.36	S	S	*	.	S	Bend	trans	-91.2	-40.1	172.7	-66.4	-175.3	179.7	-177.9	0	111	K201	K201-K203 PolarHBondContact O-N 3.11Å
204	D	77.5	Confident	85.9	Confident	104 Å²	104	70.9 Å²	70.9	56%	0.556	36%	0.362	S	S	*	.	S	Bend	trans	-140.7	164.8	179.5	-59.6	-56.3	0	0	0	111	S202 T206 S207	S202-D204 PolarHBondContact OG-O 3.43Å; D204-T206 PolarHBondContact O-N 3.33Å; D204-S207 PolarHBondContact N-OG 3.37Å; D204-S207 WeakPolarHBondContact O-CB 3.24Å; D204-S207 PolarHBondContact O-N 3.34Å
205	L	72.1	Confident	85.9	Confident	186 Å²	186	72.1 Å²	72.1	97%	0.974	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.4	178.4	-72.2	167.1	0	0	0	114.2
206	T	73.3	Confident	85.8	Confident	131 Å²	131	74.9 Å²	74.9	80%	0.804	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-7.3	179.8	56.5	0	0	0	0	113.5	D204	D204-T206 PolarHBondContact O-N 3.33Å
207	S	75.6	Confident	85.7	Confident	32 Å²	32	78.7 Å²	78.7	22%	0.224	41%	0.406	C	S	.	.	S	Bend	trans	-73.4	139.5	-178.6	-71.2	0	0	0	0	111.2	D204 T209	D204-S207 PolarHBondContact N-OG 3.37Å; D204-S207 WeakPolarHBondContact O-CB 3.24Å; D204-S207 PolarHBondContact O-N 3.34Å; S207-T209 PolarHBondContact O-N 3.2Å
208	P	78.3	Confident	85.6	Confident	95 Å²	95	77.4 Å²	77.4	62%	0.617	40%	0.401	S	S	*	.			trans	-63	125.3	175.2	26.4	-33.2	0	0	0	110.1	Q210	P208-Q210 VanDerWaalsContact C-N 3.32Å
209	T	84.5	Confident	85.5	Confident	76 Å²	76	83 Å²	83	47%	0.466	43%	0.425	S	S	.	.	S	Bend	trans	-87.9	-3.7	179.9	56.2	0	0	0	0	113.1	L200 S207	L200-T209 PolarHBondContact N-O 2.81Å; S207-T209 PolarHBondContact O-N 3.2Å
210	Q	89.1	Confident	85.3	Confident	78 Å²	78	81.5 Å²	81.5	36%	0.364	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	147.3	-176.8	63.4	-171.4	13.3	0	0	111.4	Y197 Q198 P208	Y197-Q210 HydrophobicContact CD1-CB 4.2Å; Y197-Q210 HydrophobicContact CD1-CG 4.1Å; Q198-Q210 CarbonylContact O-C 3.56Å; Q198-Q210 VanDerWaalsContact O-CA 3.27Å; Q198-Q210 WeakPolarHBondContact O-CA 3.25Å; P208-Q210 VanDerWaalsContact C-N 3.32Å
211	R	90.1	Very high	85.3	Confident	112 Å²	112	86 Å²	86	42%	0.423	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.2	172.5	178.2	-172.2	-67.8	153.2	-6.6	109.1	Y197 Q198 L200 E237	Y197-R211 CarbonylContact C-O 3.48Å; Y197-R211 WeakPolarHBondContact CA-O 3.35Å; Q198-R211 HydrophobicContact CB-CB 4.29Å; Q198-R211 PolarHBondContact N-O 3.31Å; Q198-R211 PolarHBondContact O-N 2.89Å; L200-R211 HydrophobicContact CD1-CB 4.09Å; L200-R211 HydrophobicContact CG-CB 4.4Å; R211-E237 IonicContact CZ-OE2 3.67Å; R211-E237 IonicContact NH1-OE2 3.78Å; R211-E237 PolarHBondContact NH1-OE2 3.17Å
212	Y	93	Very high	85.6	Confident	112 Å²	112	81.1 Å²	81.1	44%	0.439	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	139.1	175.7	173.8	-92.1	0	0	0	110.8	E195 Y197 S215	E195-Y212 HydrophobicContact CB-CE2 4.41Å; E195-Y212 HydrophobicContact CG-CE2 4.36Å; Y197-Y212 HydrophobicContact CE1-CD2 4.07Å; Y197-Y212 HydrophobicContact CE1-CG 4.5Å; Y212-S215 VanDerWaalsContact OH-CB 3.32Å; Y212-S215 WeakPolarHBondContact OH-CB 3.5Å; Y212-S215 PolarHBondContact OH-N 3.36Å; Y212-S215 VanDerWaalsContact OH-N 3.16Å; Y212-S215 PolarHBondContact OH-OG 2.82Å
213	I	93.4	Very high	86	Confident	42 Å²	42	85.9 Å²	85.9	22%	0.215	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	-65.7	176.1	-56.8	-179.5	0	0	0	109.8	L196 Q198 D230 V231 F248	L196-I213 HydrophobicContact CB-CB 4.47Å; L196-I213 HydrophobicContact CD2-CB 4.38Å; L196-I213 HydrophobicContact CD2-CD1 4.04Å; L196-I213 HydrophobicContact CD2-CG2 4.34Å; L196-I213 HydrophobicContact CG-CB 4.48Å; L196-I213 HydrophobicContact CG-CD1 4.18Å; L196-I213 WeakPolarHBondContact O-CB 3.33Å; L196-I213 PolarHBondContact O-N 2.04Å; Q198-I213 HydrophobicContact CB-CD1 4.06Å; Q198-I213 HydrophobicContact CB-CG1 4.37Å; I213-D230 WeakPolarHBondContact CG2-O 3.49Å; I213-V231 HydrophobicContact CD1-CG1 4.11Å; I213-V231 HydrophobicContact CG2-CG1 4.4Å; I213-F248 HydrophobicContact CD1-CD1 3.64Å; I213-F248 HydrophobicContact CD1-CE1 3.52Å
214	D	93	Very high	86.6	Confident	52 Å²	52	79.5 Å²	79.5	28%	0.278	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	164.3	-172.4	-174.9	28.3	0	0	0	111.2	E195 L196 K216 F229	E195-D214 WeakPolarHBondContact CA-O 3.17Å; L196-D214 PolarHBondContact N-O 2.03Å; D214-K216 IonicContact OD2-NZ 3.68Å; D214-F229 HydrophobicContact CB-CD1 4Å
215	S	92.9	Very high	87.3	Confident	26 Å²	26	79.4 Å²	79.4	18%	0.182	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	143.8	179.3	73.5	0	0	0	0	112	R193 I194 Y212	R193-S215 PolarHBondContact NE-OG 3.41Å; R193-S215 PolarHBondContact NH2-OG 3.37Å; I194-S215 CarbonylContact O-C 3.51Å; I194-S215 VanDerWaalsContact O-CA 3.23Å; I194-S215 WeakPolarHBondContact O-CA 3.28Å; I194-S215 WeakPolarHBondContact O-CB 3.3Å; Y212-S215 VanDerWaalsContact OH-CB 3.32Å; Y212-S215 WeakPolarHBondContact OH-CB 3.5Å; Y212-S215 PolarHBondContact OH-N 3.36Å; Y212-S215 VanDerWaalsContact OH-N 3.16Å; Y212-S215 PolarHBondContact OH-OG 2.82Å
216	K	91.4	Very high	88.2	Confident	61 Å²	61	75.4 Å²	75.4	27%	0.265	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	144.1	178	-67.4	-177.4	-164.9	-83.4	0	111.3	R193 I194 D214 S228 F229	R193-K216 CarbonylContact C-O 3.55Å; R193-K216 WeakPolarHBondContact CA-O 3.39Å; I194-K216 HydrophobicContact CG1-CB 4.33Å; I194-K216 VanDerWaalsContact CG1-O 3.31Å; I194-K216 WeakPolarHBondContact CG1-O 3.32Å; I194-K216 PolarHBondContact N-O 2.98Å; I194-K216 PolarHBondContact O-N 3Å; D214-K216 IonicContact OD2-NZ 3.68Å; K216-S228 WeakPolarHBondContact CE-O 3.48Å; K216-S228 PolarHBondContact NZ-O 2.76Å; K216-F229 HydrophobicContact CB-CE1 4.38Å; K216-F229 HydrophobicContact CD-CD1 4.26Å; K216-F229 HydrophobicContact CD-CE1 3.64Å; K216-F229 HydrophobicContact CD-CZ 3.83Å; K216-F229 VanDerWaalsContact CE-CE1 3.47Å; K216-F229 HydrophobicContact CG-CE1 3.78Å; K216-F229 HydrophobicContact CG-CZ 4.27Å
217	V	92.1	Very high	89.1	Confident	80 Å²	80	69.7 Å²	69.7	49%	0.485	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.9	170.7	-176.9	0	0	0	0	108.5	E191 Q192 R193 P261	E191-V217 HydrophobicContact CB-CG1 4.3Å; Q192-V217 WeakPolarHBondContact O-CA 3.39Å; R193-V217 HydrophobicContact CB-CG2 4.2Å; R193-V217 HydrophobicContact CG-CG2 4.23Å; V217-P261 HydrophobicContact CG1-CB 4.01Å; V217-P261 HydrophobicContact CG1-CG 4.08Å; V217-P261 HydrophobicContact CG2-CB 4.49Å
218	V	91.5	Very high	90	Very high	1 Å²	1	70.6 Å²	70.6	1%	0.006	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.6	-177.7	-61.5	0	0	0	0	111.1	E191 Q192 I194 L227 A276	E191-V218 CarbonylContact C-O 3.52Å; E191-V218 VanDerWaalsContact CA-O 3.29Å; E191-V218 WeakPolarHBondContact CA-O 2.97Å; Q192-V218 HydrophobicContact CB-CG2 4.49Å; Q192-V218 PolarHBondContact N-O 2.94Å; Q192-V218 WeakPolarHBondContact O-CG2 3.45Å; Q192-V218 PolarHBondContact O-N 3.4Å; I194-V218 HydrophobicContact CD1-CG1 3.85Å; I194-V218 HydrophobicContact CG1-CG1 4.05Å; I194-V218 HydrophobicContact CG1-CG2 4.47Å; I194-V218 HydrophobicContact CG2-CG2 3.89Å; V218-L227 HydrophobicContact CG1-CD1 3.66Å; V218-L227 HydrophobicContact CG1-CD2 4.07Å; V218-A276 HydrophobicContact CG2-CB 3.92Å
219	K	91.4	Very high	90.8	Very high	119 Å²	119	66.1 Å²	66.1	52%	0.517	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	115.6	173.2	-69.7	173.8	178.8	-178	0	109.3	R181 P190 E191 A222	R181-K219 PolarHBondContact NE-O 2.85Å; R181-K219 PolarHBondContact NH1-O 2.86Å; R181-K219 PolarHBondContact NH2-O 3.37Å; P190-K219 CarbonylContact O-C 3.6Å; P190-K219 WeakPolarHBondContact O-CA 3.02Å; E191-K219 HydrophobicContact CG-CG 3.88Å; E191-K219 WeakPolarHBondContact OE1-CE 3.34Å; K219-A222 HydrophobicContact CB-CB 3.59Å; K219-A222 HydrophobicContact CD-CB 4.41Å
220	T	88.7	Confident	91.2	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.006	32%	0.324	C	S	.	.	S	Bend	trans	-70.7	-38	-172.5	59.1	0	0	0	0	112.8	N184 A187 V189 P190 Q192 E275	N184-T220 PolarHBondContact N-O 2.95Å; A187-T220 HydrophobicContact CB-CG2 4.35Å; A187-T220 VanDerWaalsContact CB-OG1 3.3Å; A187-T220 WeakPolarHBondContact CB-OG1 3.4Å; V189-T220 WeakPolarHBondContact O-CG2 3.02Å; V189-T220 PolarHBondContact O-OG1 2.87Å; P190-T220 PolarHBondContact O-N 3.35Å; P190-T220 PolarHBondContact O-OG1 3.46Å; Q192-T220 HydrophobicContact CB-CG2 4.4Å; Q192-T220 HydrophobicContact CG-CG2 3.84Å; T220-E275 HydrophobicContact CG2-CB 4.41Å
221	R	88.9	Confident	91.5	Very high	130 Å²	130	63 Å²	63	49%	0.491	31%	0.308	S	S	.	.	S	Bend	trans	-91.2	-10.5	-176.4	-63	-175.5	-176	167.3	3.2	114.4	Q183 A187 R188	Q183-R221 WeakPolarHBondContact CG-O 3.4Å; Q183-R221 PolarHBondContact NE2-O 3.33Å; A187-R221 HydrophobicContact CB-CG 4.14Å; A187-R221 VanDerWaalsContact O-CZ 3.25Å; A187-R221 PolarHBondContact O-NE 3.26Å; A187-R221 PolarHBondContact O-NH2 2.99Å; R188-R221 PolarHBondContact O-NH2 3.48Å
222	A	88.9	Confident	91.6	Very high	36 Å²	36	58.8 Å²	58.8	30%	0.298	29%	0.294	S	S	.	.	S	Bend	trans	-69.9	159.8	179.2	0	0	0	0	0	111.6	R181 Q183 K219	R181-A222 PolarHBondContact NH1-O 2.91Å; Q183-A222 WeakPolarHBondContact CB-O 3Å; Q183-A222 WeakPolarHBondContact CG-O 3.48Å; K219-A222 HydrophobicContact CB-CB 3.59Å; K219-A222 HydrophobicContact CD-CB 4.41Å
223	E	87.3	Confident	91.6	Very high	162 Å²	162	60 Å²	60	76%	0.757	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-54.5	150	172.9	-64.9	-166.8	165.8	0	0	111.6	R181	R181-E223 PolarHBondContact NH2-O 3.48Å
224	G	86.5	Confident	91.6	Very high	34 Å²	34	58.2 Å²	58.2	35%	0.351	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-63.5	145.8	-170.9	0	0	0	0	0	114.2	R181	R181-G224 CarbonylContact O-C 3.46Å; R181-G224 WeakPolarHBondContact O-CA 3.38Å
225	E	90.8	Very high	91.6	Very high	102 Å²	102	55.7 Å²	55.7	48%	0.477	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	146.9	-169.7	-178.2	-178.7	-165.2	0	0	111.1	F180 R181	F180-E225 CarbonylContact C-O 3.48Å; R181-E225 PolarHBondContact N-O 3.28Å; R181-E225 PolarHBondContact O-N 3.46Å; R181-E225 VanDerWaalsContact O-N 3.11Å
226	W	91.7	Very high	91.6	Very high	102 Å²	102	58.2 Å²	58.2	39%	0.386	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	126.8	170.1	-78.8	108.4	0	0	0	111	R178 F180 K305 H308	R178-W226 HydrophobicContact CB-CE3 4.15Å; R178-W226 HydrophobicContact CB-CZ3 4.21Å; F180-W226 HydrophobicContact CB-CD2 4.09Å; F180-W226 HydrophobicContact CB-CE3 3.86Å; F180-W226 HydrophobicContact CB-CH2 4Å; F180-W226 HydrophobicContact CB-CZ2 4.22Å; F180-W226 HydrophobicContact CB-CZ3 3.82Å; F180-W226 AromaticContact CD2-CD1 3.71Å; F180-W226 AromaticContact CD2-CD2 3.63Å; F180-W226 HydrophobicContact CD2-CD2 3.63Å; F180-W226 AromaticContact CD2-CE2 3.56Å; F180-W226 HydrophobicContact CD2-CE3 4.27Å; F180-W226 AromaticContact CD2-CG 3.74Å; F180-W226 HydrophobicContact CD2-CG 3.74Å; F180-W226 HydrophobicContact CD2-CZ2 4.16Å; F180-W226 AromaticContact CD2-NE1 3.6Å; F180-W226 AromaticContact CE2-CD1 3.98Å; F180-W226 HydrophobicContact CE2-CG 4.36Å; F180-W226 AromaticContact CE2-NE1 4Å; F180-W226 HydrophobicContact CG-CD2 4.37Å; W226-K305 HydrophobicContact CH2-CB 4.38Å; W226-K305 HydrophobicContact CZ2-CB 4.24Å; W226-K305 HydrophobicContact CZ2-CG 4.23Å; W226-H308 AromaticContact CH2-CE1 3.55Å; W226-H308 AromaticContact CH2-ND1 3.93Å; W226-H308 AromaticContact CZ3-CE1 3.58Å; W226-H308 AromaticContact CZ3-ND1 3.98Å
227	L	92.9	Very high	91.6	Very high	11 Å²	11	56.7 Å²	56.7	6%	0.058	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.4	171.2	-52.1	177.6	0	0	0	108.9	R178 V179 R181 I194 V218 F229 F278	R178-L227 VanDerWaalsContact CA-O 3.31Å; R178-L227 WeakPolarHBondContact CA-O 3.45Å; V179-L227 HydrophobicContact CG1-CB 4.02Å; V179-L227 HydrophobicContact CG1-CD1 4.44Å; V179-L227 PolarHBondContact N-O 3.03Å; V179-L227 PolarHBondContact O-N 2.95Å; R181-L227 HydrophobicContact CB-CD1 4.32Å; I194-L227 HydrophobicContact CD1-CD1 3.76Å; V218-L227 HydrophobicContact CG1-CD1 3.66Å; V218-L227 HydrophobicContact CG1-CD2 4.07Å; L227-F229 HydrophobicContact CB-CE2 4.04Å; L227-F278 HydrophobicContact CD1-CE1 3.98Å
228	S	94.3	Very high	91.6	Very high	50 Å²	50	52.9 Å²	52.9	35%	0.35	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.7	177.4	56.7	0	0	0	0	111.6	F177 K216	F177-S228 CarbonylContact O-C 3.58Å; F177-S228 WeakPolarHBondContact O-CA 3.19Å; K216-S228 WeakPolarHBondContact CE-O 3.48Å; K216-S228 PolarHBondContact NZ-O 2.76Å
229	F	94.8	Very high	91.6	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.009	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.8	177.6	-60.4	-86.9	0	0	0	109.6	E176 F177 V179 I194 L196 D214 K216 L227 V231	E176-F229 CarbonylContact C-O 3.59Å; E176-F229 WeakPolarHBondContact CA-O 3.42Å; F177-F229 HydrophobicContact CB-CB 4.45Å; F177-F229 HydrophobicContact CD1-CB 4.42Å; F177-F229 AromaticContact CD1-CD2 3.82Å; F177-F229 HydrophobicContact CD1-CD2 3.82Å; F177-F229 HydrophobicContact CD1-CG 4.48Å; F177-F229 HydrophobicContact CE1-CD2 4.23Å; F177-F229 PolarHBondContact N-O 2.84Å; F177-F229 PolarHBondContact O-N 2.79Å; V179-F229 HydrophobicContact CG1-CE2 4.13Å; I194-F229 HydrophobicContact CD1-CZ 4.02Å; L196-F229 HydrophobicContact CB-CD1 4.13Å; L196-F229 HydrophobicContact CB-CE1 4.23Å; L196-F229 HydrophobicContact CB-CG 4.47Å; L196-F229 HydrophobicContact CD2-CB 3.5Å; L196-F229 VanDerWaalsContact CD2-CB 3.5Å; L196-F229 HydrophobicContact CD2-CD1 4.06Å; L196-F229 HydrophobicContact CD2-CD2 4.12Å; L196-F229 HydrophobicContact CD2-CG 3.64Å; D214-F229 HydrophobicContact CB-CD1 4Å; K216-F229 HydrophobicContact CB-CE1 4.38Å; K216-F229 HydrophobicContact CD-CD1 4.26Å; K216-F229 HydrophobicContact CD-CE1 3.64Å; K216-F229 HydrophobicContact CD-CZ 3.83Å; K216-F229 VanDerWaalsContact CE-CE1 3.47Å; K216-F229 HydrophobicContact CG-CE1 3.78Å; K216-F229 HydrophobicContact CG-CZ 4.27Å; L227-F229 HydrophobicContact CB-CE2 4.04Å; F229-V231 HydrophobicContact CB-CG1 4.33Å; F229-V231 PolarHBondContact O-N 2.91Å
230	D	93.1	Very high	91.5	Very high	85 Å²	85	52.2 Å²	52.2	46%	0.455	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	118	170.7	-163.7	-34.3	0	0	0	108.7	I213 T232	I213-D230 WeakPolarHBondContact CG2-O 3.49Å; D230-T232 VanDerWaalsContact OD1-CB 3.24Å; D230-T232 WeakPolarHBondContact OD1-CB 3.49Å; D230-T232 PolarHBondContact OD1-N 2.89Å; D230-T232 PolarHBondContact OD1-OG1 3.26Å
231	V	95.8	Very high	91.6	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.018	28%	0.283	C	S	.	.			trans	-125.1	22.3	-179	-64	0	0	0	0	110.9	A175 F177 L196 I213 F229 D233 A234 V235 F248 L309	A175-V231 HydrophobicContact CB-CG2 4.19Å; A175-V231 PolarHBondContact O-N 2.85Å; F177-V231 HydrophobicContact CB-CB 4.47Å; F177-V231 HydrophobicContact CB-CG1 3.76Å; F177-V231 HydrophobicContact CB-CG2 3.82Å; L196-V231 HydrophobicContact CD2-CG1 3.79Å; I213-V231 HydrophobicContact CD1-CG1 4.11Å; I213-V231 HydrophobicContact CG2-CG1 4.4Å; F229-V231 HydrophobicContact CB-CG1 4.33Å; F229-V231 PolarHBondContact O-N 2.91Å; V231-D233 PolarHBondContact O-N 3.16Å; V231-A234 PolarHBondContact O-N 3.44Å; V231-V235 HydrophobicContact CB-CG2 4.41Å; V231-V235 HydrophobicContact CG2-CG2 3.8Å; V231-V235 WeakPolarHBondContact O-CG2 3.07Å; V231-V235 PolarHBondContact O-N 3.29Å; V231-F248 HydrophobicContact CB-CE1 4.19Å; V231-F248 HydrophobicContact CB-CE2 4.28Å; V231-F248 HydrophobicContact CB-CZ 3.63Å; V231-F248 HydrophobicContact CG1-CE1 3.99Å; V231-F248 HydrophobicContact CG1-CE2 4.13Å; V231-F248 HydrophobicContact CG1-CZ 3.7Å; V231-F248 HydrophobicContact CG2-CE2 4.32Å; V231-F248 HydrophobicContact CG2-CZ 4.06Å; V231-L309 HydrophobicContact CG2-CD2 3.91Å
232	T	91.9	Very high	91.4	Very high	23 Å²	23	56.2 Å²	56.2	14%	0.141	29%	0.287	C	S	.	.	H	α-helix	trans	-52.6	-51.2	-173.8	-56.8	0	0	0	0	111.6	A175 D230 A234 V235 H236	A175-T232 PolarHBondContact N-OG1 2.52Å; A175-T232 PolarHBondContact O-N 2.81Å; A175-T232 PolarHBondContact O-OG1 2.68Å; D230-T232 VanDerWaalsContact OD1-CB 3.24Å; D230-T232 WeakPolarHBondContact OD1-CB 3.49Å; D230-T232 PolarHBondContact OD1-N 2.89Å; D230-T232 PolarHBondContact OD1-OG1 3.26Å; T232-A234 PolarHBondContact O-N 2.91Å; T232-V235 PolarHBondContact O-N 2.89Å; T232-H236 VanDerWaalsContact O-CB 3.25Å; T232-H236 WeakPolarHBondContact O-CB 3.25Å; T232-H236 PolarHBondContact O-N 2.83Å
233	D	91.5	Very high	91.2	Very high	138 Å²	138	59.1 Å²	59.1	74%	0.738	30%	0.297	S	S	*	.	H	α-helix	trans	-62.6	-41.7	-178.7	-63.2	-31.1	0	0	0	112.8	V231 H236 E237	V231-D233 PolarHBondContact O-N 3.16Å; D233-H236 PolarHBondContact O-N 2.81Å; D233-E237 PolarHBondContact O-N 2.84Å
234	A	93.6	Very high	91.1	Very high	4 Å²	4	56 Å²	56	3%	0.033	28%	0.279	C	S	.	.	H	α-helix	trans	-67.8	-43.5	-179.5	0	0	0	0	0	111.6	Q198 V231 T232 E237 W238 F248	Q198-A234 HydrophobicContact CG-CB 4.19Å; V231-A234 PolarHBondContact O-N 3.44Å; T232-A234 PolarHBondContact O-N 2.91Å; A234-E237 PolarHBondContact O-N 3.19Å; A234-W238 VanDerWaalsContact O-CD1 3.24Å; A234-W238 PolarHBondContact O-N 3.2Å; A234-F248 HydrophobicContact CB-CE1 3.7Å; A234-F248 HydrophobicContact CB-CZ 4.02Å
235	V	93.8	Very high	91.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.1	-39.7	177	176.3	0	0	0	0	110.5	L172 A175 V231 T232 E237 W238 L239 L309 L311	L172-V235 HydrophobicContact CD2-CB 4.34Å; L172-V235 HydrophobicContact CD2-CG1 4.01Å; A175-V235 HydrophobicContact CB-CB 3.83Å; A175-V235 HydrophobicContact CB-CG1 4.12Å; A175-V235 HydrophobicContact CB-CG2 3.84Å; V231-V235 HydrophobicContact CB-CG2 4.41Å; V231-V235 HydrophobicContact CG2-CG2 3.8Å; V231-V235 WeakPolarHBondContact O-CG2 3.07Å; V231-V235 PolarHBondContact O-N 3.29Å; T232-V235 PolarHBondContact O-N 2.89Å; V235-E237 VanDerWaalsContact C-N 3.31Å; V235-E237 PolarHBondContact O-N 3.47Å; V235-W238 HydrophobicContact CG2-CE3 4.17Å; V235-W238 HydrophobicContact CG2-CZ3 4.33Å; V235-W238 PolarHBondContact O-N 3.1Å; V235-W238 VanDerWaalsContact O-N 3.14Å; V235-L239 HydrophobicContact CG1-CD1 4.25Å; V235-L239 HydrophobicContact CG1-CG 4.33Å; V235-L239 WeakPolarHBondContact O-CG 3.48Å; V235-L239 PolarHBondContact O-N 3.26Å; V235-L309 HydrophobicContact CG2-CD1 4.26Å; V235-L309 HydrophobicContact CG2-CD2 4.47Å; V235-L311 HydrophobicContact CG1-CD2 3.99Å; V235-L311 HydrophobicContact CG1-CG 4.19Å
236	H	92.5	Very high	91	Very high	79 Å²	79	53.9 Å²	53.9	37%	0.366	26%	0.262	S	S	.	.	H	α-helix	trans	-58.1	-44	174.3	-169.3	82.6	0	0	0	111.5	L172 T232 D233 W238 L239 H240	L172-H236 HydrophobicContact CD2-CB 4.05Å; T232-H236 VanDerWaalsContact O-CB 3.25Å; T232-H236 WeakPolarHBondContact O-CB 3.25Å; T232-H236 PolarHBondContact O-N 2.83Å; D233-H236 PolarHBondContact O-N 2.81Å; H236-W238 PolarHBondContact O-N 3.36Å; H236-L239 PolarHBondContact O-N 3.32Å; H236-H240 AromaticContact CD2-CE1 3.86Å; H236-H240 AromaticContact CD2-ND1 3.88Å; H236-H240 AromaticContact CE1-CE1 3.36Å; H236-H240 PolarHBondContact CE1-CE1 3.16Å; H236-H240 AromaticContact ND1-CE1 3.88Å; H236-H240 AromaticContact NE2-CE1 3.31Å; H236-H240 PolarHBondContact NE2-CE1 3.21Å; H236-H240 VanDerWaalsContact NE2-CE1 3.31Å; H236-H240 AromaticContact NE2-ND1 3.79Å; H236-H240 PolarHBondContact O-N 3.44Å; H236-H240 PolarHBondContact O-ND1 3.44Å
237	E	91.1	Very high	90.9	Very high	28 Å²	28	49 Å²	49	13%	0.131	24%	0.244	C	C	.	.	H	α-helix	trans	-61.1	-42.1	173.9	-176.9	172.2	-166.4	0	0	112.1	Q198 R211 D233 A234 V235 L239 H240 H241 R244	Q198-E237 PolarHBondContact NE2-OE2 3.23Å; R211-E237 IonicContact CZ-OE2 3.67Å; R211-E237 IonicContact NH1-OE2 3.78Å; R211-E237 PolarHBondContact NH1-OE2 3.17Å; D233-E237 PolarHBondContact O-N 2.84Å; A234-E237 PolarHBondContact O-N 3.19Å; V235-E237 VanDerWaalsContact C-N 3.31Å; V235-E237 PolarHBondContact O-N 3.47Å; E237-L239 PolarHBondContact O-N 3.37Å; E237-H240 PolarHBondContact O-N 3.07Å; E237-H241 PolarHBondContact O-N 3.2Å; E237-R244 WeakPolarHBondContact OE1-CD 3.21Å; E237-R244 IonicContact OE1-CZ 3.47Å; E237-R244 IonicContact OE1-NE 2.75Å; E237-R244 IonicContact OE1-NH1 3.24Å; E237-R244 PolarHBondContact OE1-NH1 3.34Å
238	W	92.7	Very high	91	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-66.5	-34.8	178.8	-62.5	-13.9	0	0	0	113.7	V162 A234 V235 H236 H240 H241 R244 N245 F248 L309	V162-W238 HydrophobicContact CG1-CE3 4.48Å; V162-W238 HydrophobicContact CG2-CB 3.98Å; A234-W238 VanDerWaalsContact O-CD1 3.24Å; A234-W238 PolarHBondContact O-N 3.2Å; V235-W238 HydrophobicContact CG2-CE3 4.17Å; V235-W238 HydrophobicContact CG2-CZ3 4.33Å; V235-W238 PolarHBondContact O-N 3.1Å; V235-W238 VanDerWaalsContact O-N 3.14Å; H236-W238 PolarHBondContact O-N 3.36Å; W238-H240 VanDerWaalsContact C-N 3.31Å; W238-H241 CarbonylContact O-C 3.56Å; W238-R244 PolarHBondContact NE1-O 3.35Å; W238-N245 HydrophobicContact CB-CB 4.09Å; W238-N245 HydrophobicContact CD2-CB 4.08Å; W238-N245 HydrophobicContact CG-CB 3.77Å; W238-F248 HydrophobicContact CH2-CD1 4Å; W238-F248 AromaticContact CH2-CD2 3.69Å; W238-F248 HydrophobicContact CH2-CD2 3.69Å; W238-F248 AromaticContact CH2-CE1 3.54Å; W238-F248 HydrophobicContact CH2-CE1 3.54Å; W238-F248 AromaticContact CH2-CE2 3.19Å; W238-F248 HydrophobicContact CH2-CE2 3.19Å; W238-F248 HydrophobicContact CH2-CG 4.05Å; W238-F248 AromaticContact CH2-CZ 3.1Å; W238-F248 HydrophobicContact CH2-CZ 3.1Å; W238-F248 HydrophobicContact CZ2-CD1 4.19Å; W238-F248 AromaticContact CZ2-CE1 3.73Å; W238-F248 HydrophobicContact CZ2-CE1 3.73Å; W238-F248 HydrophobicContact CZ2-CE2 4.21Å; W238-F248 AromaticContact CZ2-CZ 3.73Å; W238-F248 HydrophobicContact CZ2-CZ 3.73Å; W238-F248 HydrophobicContact CZ3-CD2 4.37Å; W238-F248 HydrophobicContact CZ3-CE1 4.41Å; W238-F248 AromaticContact CZ3-CE2 3.56Å; W238-F248 HydrophobicContact CZ3-CE2 3.56Å; W238-F248 AromaticContact CZ3-CZ 3.57Å; W238-F248 HydrophobicContact CZ3-CZ 3.57Å; W238-L309 HydrophobicContact CZ3-CD1 4.36Å
239	L	91.3	Very high	90.9	Very high	10 Å²	10	47.9 Å²	47.9	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-69.8	-28.7	177.5	-66.9	176.1	0	0	0	112.5	V162 M165 A169 L172 V235 H236 E237	V162-L239 HydrophobicContact CB-CD2 3.92Å; V162-L239 HydrophobicContact CG2-CD2 4.05Å; M165-L239 HydrophobicContact CB-CD2 3.79Å; A169-L239 HydrophobicContact CB-CB 3.68Å; A169-L239 HydrophobicContact CB-CD1 4.45Å; L172-L239 HydrophobicContact CB-CD1 4.32Å; L172-L239 HydrophobicContact CD2-CD1 3.91Å; V235-L239 HydrophobicContact CG1-CD1 4.25Å; V235-L239 HydrophobicContact CG1-CG 4.33Å; V235-L239 WeakPolarHBondContact O-CG 3.48Å; V235-L239 PolarHBondContact O-N 3.26Å; H236-L239 PolarHBondContact O-N 3.32Å; E237-L239 PolarHBondContact O-N 3.37Å
240	H	90.3	Very high	90.8	Very high	96 Å²	96	47.8 Å²	47.8	44%	0.444	23%	0.232	S	C	.	.	H	α-helix	trans	-88.6	-32.2	176	-69.5	82.3	0	0	0	112.9	H236 E237 W238	H236-H240 AromaticContact CD2-CE1 3.86Å; H236-H240 AromaticContact CD2-ND1 3.88Å; H236-H240 AromaticContact CE1-CE1 3.36Å; H236-H240 PolarHBondContact CE1-CE1 3.16Å; H236-H240 AromaticContact ND1-CE1 3.88Å; H236-H240 AromaticContact NE2-CE1 3.31Å; H236-H240 PolarHBondContact NE2-CE1 3.21Å; H236-H240 VanDerWaalsContact NE2-CE1 3.31Å; H236-H240 AromaticContact NE2-ND1 3.79Å; H236-H240 PolarHBondContact O-N 3.44Å; H236-H240 PolarHBondContact O-ND1 3.44Å; E237-H240 PolarHBondContact O-N 3.07Å; W238-H240 VanDerWaalsContact C-N 3.31Å
241	H	89.3	Confident	90.6	Very high	85 Å²	85	44.3 Å²	44.3	39%	0.394	21%	0.214	S	C	.	.			trans	-134.1	91.8	-175.1	-60.4	-57.6	0	0	0	111	E237 W238 D243 R244	E237-H241 PolarHBondContact O-N 3.2Å; W238-H241 CarbonylContact O-C 3.56Å; H241-D243 PolarHBondContact O-N 2.95Å; H241-R244 HydrophobicContact CB-CB 4.28Å; H241-R244 HydrophobicContact CB-CG 3.84Å; H241-R244 WeakPolarHBondContact O-CB 3.27Å; H241-R244 PolarHBondContact O-N 3.01Å
242	K	84.5	Confident	90.1	Very high	129 Å²	129	45.2 Å²	45.2	56%	0.561	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-57.4	-35.5	-178.2	-173.2	174.7	-169.8	152.2	0	113.6	S163 E166 R244 N245	S163-K242 WeakPolarHBondContact OG-CE 3.47Å; S163-K242 PolarHBondContact OG-NZ 3.33Å; E166-K242 IonicContact OE1-NZ 3.8Å; K242-R244 PolarHBondContact O-N 3.22Å; K242-N245 PolarHBondContact O-N 3.4Å
243	D	84.8	Confident	89.1	Confident	97 Å²	97	47.5 Å²	47.5	52%	0.519	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-67.8	-14.9	-179.2	67.8	-59.8	0	0	0	113.6	H241	H241-D243 PolarHBondContact O-N 2.95Å
244	R	85.4	Confident	87.9	Confident	97 Å²	97	43.1 Å²	43.1	37%	0.366	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-91.7	-5.2	178	-58.9	-167.5	-174.5	-178.4	7.3	113.7	E237 W238 H241 K242 L246	E237-R244 WeakPolarHBondContact OE1-CD 3.21Å; E237-R244 IonicContact OE1-CZ 3.47Å; E237-R244 IonicContact OE1-NE 2.75Å; E237-R244 IonicContact OE1-NH1 3.24Å; E237-R244 PolarHBondContact OE1-NH1 3.34Å; W238-R244 PolarHBondContact NE1-O 3.35Å; H241-R244 HydrophobicContact CB-CB 4.28Å; H241-R244 HydrophobicContact CB-CG 3.84Å; H241-R244 WeakPolarHBondContact O-CB 3.27Å; H241-R244 PolarHBondContact O-N 3.01Å; K242-R244 PolarHBondContact O-N 3.22Å; R244-L246 PolarHBondContact O-N 3.5Å; R244-L246 VanDerWaalsContact O-N 3.07Å
245	N	88.7	Confident	86.4	Confident	38 Å²	38	48.5 Å²	48.5	20%	0.203	24%	0.242	C	C	.	.			trans	-79.8	89	177.1	-175.8	4.6	0	0	0	111.5	F160 W238 K242 G247	F160-N245 PolarHBondContact O-ND2 2.96Å; W238-N245 HydrophobicContact CB-CB 4.09Å; W238-N245 HydrophobicContact CD2-CB 4.08Å; W238-N245 HydrophobicContact CG-CB 3.77Å; K242-N245 PolarHBondContact O-N 3.4Å; N245-G247 PolarHBondContact OD1-N 3.48Å
246	L	86.6	Confident	84.8	Confident	53 Å²	53	52 Å²	52	28%	0.277	27%	0.266	S	S	.	.			trans	-102.9	-2.4	175.2	-60	179	0	0	0	113.4	I199 L200 K201 R244	I199-L246 HydrophobicContact CB-CB 3.86Å; I199-L246 HydrophobicContact CG2-CB 3.73Å; I199-L246 HydrophobicContact CG2-CD1 4.02Å; L200-L246 VanDerWaalsContact C-CD1 3.46Å; K201-L246 HydrophobicContact CB-CD1 3.96Å; K201-L246 VanDerWaalsContact N-CD1 3.34Å; R244-L246 PolarHBondContact O-N 3.5Å; R244-L246 VanDerWaalsContact O-N 3.07Å
247	G	90.7	Very high	83.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.			trans	89.3	-172.2	-177.9	0	0	0	0	0	114.6	V158 I199 N245	V158-G247 CarbonylContact O-C 3.58Å; V158-G247 WeakPolarHBondContact O-CA 3.46Å; I199-G247 PolarHBondContact N-O 3.27Å; I199-G247 VanDerWaalsContact N-O 3.08Å; N245-G247 PolarHBondContact OD1-N 3.48Å
248	F	94.4	Very high	82.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	150.1	178.1	-57.4	-65.1	0	0	0	111.5	I157 V158 F160 F177 L196 Y197 Q198 I213 V231 A234 W238 L309	I157-F248 CarbonylContact C-O 3.51Å; I157-F248 WeakPolarHBondContact CA-O 3.35Å; V158-F248 HydrophobicContact CG2-CB 3.75Å; V158-F248 HydrophobicContact CG2-CD2 4.29Å; V158-F248 PolarHBondContact N-O 2.95Å; V158-F248 PolarHBondContact O-N 2.91Å; F160-F248 HydrophobicContact CD2-CD2 4.23Å; F160-F248 HydrophobicContact CD2-CE2 4.31Å; F160-F248 HydrophobicContact CE2-CD2 4.03Å; F160-F248 HydrophobicContact CE2-CE2 4.38Å; F177-F248 HydrophobicContact CG-CD2 4.5Å; L196-F248 HydrophobicContact CD1-CB 3.83Å; L196-F248 HydrophobicContact CD1-CG 4.41Å; Y197-F248 CarbonylContact O-C 3.51Å; Y197-F248 VanDerWaalsContact O-CA 3.27Å; Y197-F248 WeakPolarHBondContact O-CA 2.97Å; Q198-F248 HydrophobicContact CB-CD1 4.45Å; Q198-F248 HydrophobicContact CB-CE1 4.48Å; I213-F248 HydrophobicContact CD1-CD1 3.64Å; I213-F248 HydrophobicContact CD1-CE1 3.52Å; V231-F248 HydrophobicContact CB-CE1 4.19Å; V231-F248 HydrophobicContact CB-CE2 4.28Å; V231-F248 HydrophobicContact CB-CZ 3.63Å; V231-F248 HydrophobicContact CG1-CE1 3.99Å; V231-F248 HydrophobicContact CG1-CE2 4.13Å; V231-F248 HydrophobicContact CG1-CZ 3.7Å; V231-F248 HydrophobicContact CG2-CE2 4.32Å; V231-F248 HydrophobicContact CG2-CZ 4.06Å; A234-F248 HydrophobicContact CB-CE1 3.7Å; A234-F248 HydrophobicContact CB-CZ 4.02Å; W238-F248 HydrophobicContact CH2-CD1 4Å; W238-F248 AromaticContact CH2-CD2 3.69Å; W238-F248 HydrophobicContact CH2-CD2 3.69Å; W238-F248 AromaticContact CH2-CE1 3.54Å; W238-F248 HydrophobicContact CH2-CE1 3.54Å; W238-F248 AromaticContact CH2-CE2 3.19Å; W238-F248 HydrophobicContact CH2-CE2 3.19Å; W238-F248 HydrophobicContact CH2-CG 4.05Å; W238-F248 AromaticContact CH2-CZ 3.1Å; W238-F248 HydrophobicContact CH2-CZ 3.1Å; W238-F248 HydrophobicContact CZ2-CD1 4.19Å; W238-F248 AromaticContact CZ2-CE1 3.73Å; W238-F248 HydrophobicContact CZ2-CE1 3.73Å; W238-F248 HydrophobicContact CZ2-CE2 4.21Å; W238-F248 AromaticContact CZ2-CZ 3.73Å; W238-F248 HydrophobicContact CZ2-CZ 3.73Å; W238-F248 HydrophobicContact CZ3-CD2 4.37Å; W238-F248 HydrophobicContact CZ3-CE1 4.41Å; W238-F248 AromaticContact CZ3-CE2 3.56Å; W238-F248 HydrophobicContact CZ3-CE2 3.56Å; W238-F248 AromaticContact CZ3-CZ 3.57Å; W238-F248 HydrophobicContact CZ3-CZ 3.57Å; F248-L309 HydrophobicContact CE2-CD2 3.99Å
249	K	91.9	Very high	81.2	Confident	37 Å²	37	50 Å²	50	16%	0.161	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.5	172.2	-172.1	-171	73.5	167	0	109.7	F155 R156 I157 Y197 I199 S251	F155-K249 HydrophobicContact CB-CD 4.36Å; F155-K249 HydrophobicContact CB-CG 4.21Å; F155-K249 HydrophobicContact CD2-CD 4.03Å; F155-K249 HydrophobicContact CD2-CG 3.93Å; F155-K249 HydrophobicContact CG-CD 4.31Å; F155-K249 HydrophobicContact CG-CG 4.4Å; R156-K249 CarbonylContact O-C 3.47Å; R156-K249 WeakPolarHBondContact O-CA 3.45Å; I157-K249 HydrophobicContact CG1-CG 4.32Å; Y197-K249 PolarHBondContact N-O 3.27Å; Y197-K249 PolarHBondContact O-N 2.86Å; I199-K249 HydrophobicContact CD1-CB 4.16Å; I199-K249 HydrophobicContact CG1-CB 4.02Å; K249-S251 WeakPolarHBondContact CE-OG 3.32Å
250	I	92.3	Very high	80.3	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	121.3	170.4	-58.1	164.7	0	0	0	107.6	F155 R156 F177 I194 E195 L196 L274 F278	F155-I250 CarbonylContact C-O 3.52Å; F155-I250 WeakPolarHBondContact CA-O 3.12Å; F155-I250 WeakPolarHBondContact CB-O 3.32Å; R156-I250 PolarHBondContact N-O 3.35Å; R156-I250 PolarHBondContact O-N 3.11Å; F177-I250 HydrophobicContact CE1-CD1 4.06Å; F177-I250 HydrophobicContact CZ-CD1 4.25Å; I194-I250 HydrophobicContact CB-CG2 4.34Å; I194-I250 HydrophobicContact CD1-CG2 4.38Å; E195-I250 WeakPolarHBondContact O-CA 3.45Å; L196-I250 HydrophobicContact CD1-CG1 3.62Å; I250-L274 HydrophobicContact CG2-CD2 4.48Å; I250-F278 HydrophobicContact CG2-CE2 4.16Å; I250-F278 HydrophobicContact CG2-CZ 4.15Å
251	S	89.3	Confident	79.5	Confident	11 Å²	11	47.8 Å²	47.8	8%	0.077	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	178.8	178.7	60.5	0	0	0	0	111.8	E195 K249	E195-S251 PolarHBondContact N-O 2.91Å; E195-S251 PolarHBondContact O-N 3.45Å; K249-S251 WeakPolarHBondContact CE-OG 3.32Å
252	L	86.4	Confident	78.8	Confident	23 Å²	23	48.7 Å²	48.7	12%	0.12	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	166.9	170.8	-59	177.6	0	0	0	111.4	Q192 R193 I194 C254 E272 L274	Q192-L252 HydrophobicContact CB-CD2 4.13Å; R193-L252 VanDerWaalsContact O-CD2 3.28Å; R193-L252 WeakPolarHBondContact O-CD2 3.41Å; I194-L252 HydrophobicContact CG2-CD2 4.19Å; L252-C254 VanDerWaalsContact C-N 3.28Å; L252-C254 PolarHBondContact O-N 3.41Å; L252-C254 VanDerWaalsContact O-N 3.13Å; L252-E272 HydrophobicContact CD1-CB 3.72Å; L252-E272 WeakPolarHBondContact CD1-O 3.34Å; L252-L274 HydrophobicContact CD2-CD1 3.95Å; L252-L274 HydrophobicContact CG-CD1 4.3Å
253	H	70.1	Confident	78.5	Confident	70 Å²	70	47.4 Å²	47.4	32%	0.324	27%	0.268	S	S	.	.	S	Bend	trans	-51.4	-31.8	-171	-171.9	53.9	0	0	0	116	E195	E195-H253 IonicContact OE1-CE1 2.91Å; E195-H253 IonicContact OE1-CG 3.21Å; E195-H253 IonicContact OE1-ND1 3.44Å; E195-H253 PolarHBondContact OE1-ND1 3.32Å; E195-H253 WeakPolarHBondContact OE2-CA 3.37Å; E195-H253 IonicContact OE2-ND1 3.63Å
254	C	66.9	Low	78.1	Confident	47 Å²	47	48.8 Å²	48.8	32%	0.318	28%	0.275	S	S	.	.			trans	-167.5	150.1	169.1	-156.7	0	0	0	0	111.9	L252 C256 C257	L252-C254 VanDerWaalsContact C-N 3.28Å; L252-C254 PolarHBondContact O-N 3.41Å; L252-C254 VanDerWaalsContact O-N 3.13Å; C254-C256 VanDerWaalsContact C-N 3.27Å; C254-C256 PolarHBondContact O-N 3.22Å; C254-C256 PolarHBondContact SG-SG 2.89Å; C254-C257 VanDerWaalsContact O-O 3.06Å
255	P	61.2	Low	77.7	Confident	116 Å²	116	51.2 Å²	51.2	75%	0.753	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.4	168.5	26.5	-35	0	0	0	114.8	S271	P255-S271 WeakPolarHBondContact O-CB 3.41Å
256	C	61.2	Low	77	Confident	75 Å²	75	53.5 Å²	53.5	51%	0.507	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-11.3	-178.4	70.5	0	0	0	0	114.8	C254 N269	C254-C256 VanDerWaalsContact C-N 3.27Å; C254-C256 PolarHBondContact O-N 3.22Å; C254-C256 PolarHBondContact SG-SG 2.89Å; C256-N269 WeakPolarHBondContact O-CA 3.4Å; C256-N269 PolarHBondContact O-N 3.21Å
257	C	64.8	Low	76.3	Confident	22 Å²	22	53.7 Å²	53.7	15%	0.149	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	152.8	-176.7	60.5	0	0	0	0	112.3	C254 I266 I267 K270	C254-C257 VanDerWaalsContact O-O 3.06Å; C257-I266 HydrophobicContact CB-CG2 3.68Å; C257-I267 CarbonylContact C-O 3.54Å; C257-I267 VanDerWaalsContact CA-O 3.23Å; C257-I267 WeakPolarHBondContact CA-O 3.4Å; C257-I267 WeakPolarHBondContact CB-O 3.23Å; C257-K270 CarbonylContact C-O 3.5Å; C257-K270 VanDerWaalsContact C-O 3.22Å
258	T	65.8	Low	75.4	Confident	4 Å²	4	57.9 Å²	57.9	3%	0.025	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131.3	176.3	-64.4	0	0	0	0	110.2	V260 I266 I267 K270 E272	T258-V260 HydrophobicContact CG2-CG2 4.45Å; T258-I266 CarbonylContact O-C 3.45Å; T258-I266 WeakPolarHBondContact O-CA 3.4Å; T258-I267 PolarHBondContact N-O 3.06Å; T258-I267 PolarHBondContact O-N 3.14Å; T258-K270 PolarHBondContact N-O 3.49Å; T258-K270 PolarHBondContact OG1-O 2.68Å; T258-E272 HydrophobicContact CG2-CG 3.7Å; T258-E272 WeakPolarHBondContact CG2-OE1 3.34Å; T258-E272 WeakPolarHBondContact OG1-CG 3.49Å
259	F	68.6	Low	74	Confident	40 Å²	40	65.6 Å²	65.6	18%	0.175	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.9	172	177.9	-102.1	0	0	0	110.5	R193 P261 I266	R193-F259 HydrophobicContact CB-CD1 3.92Å; R193-F259 HydrophobicContact CB-CE1 4.39Å; F259-P261 HydrophobicContact CD1-CG 4.17Å; F259-P261 HydrophobicContact CE1-CB 4.15Å; F259-P261 HydrophobicContact CE1-CG 4.13Å; F259-P261 WeakPolarHBondContact O-CD 3.38Å; F259-I266 HydrophobicContact CD2-CG1 4.11Å
260	V	73.1	Confident	73	Confident	34 Å²	34	68.9 Å²	68.9	21%	0.206	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	109.2	177.1	-178.1	0	0	0	0	109.3	T258 S262 N263 N264 Y265 I267	T258-V260 HydrophobicContact CG2-CG2 4.45Å; V260-S262 VanDerWaalsContact C-N 3.33Å; V260-S262 WeakPolarHBondContact CG1-OG 2.99Å; V260-S262 PolarHBondContact O-N 2.85Å; V260-N263 WeakPolarHBondContact CB-OD1 3.37Å; V260-N263 VanDerWaalsContact CG1-OD1 3.26Å; V260-N263 WeakPolarHBondContact CG1-OD1 3.33Å; V260-N263 PolarHBondContact O-OD1 3.39Å; V260-N264 WeakPolarHBondContact O-CA 3.29Å; V260-N264 PolarHBondContact O-N 3.41Å; V260-N264 VanDerWaalsContact O-N 3.1Å; V260-Y265 PolarHBondContact N-O 3.04Å; V260-I267 HydrophobicContact CG2-CD1 3.91Å; V260-I267 HydrophobicContact CG2-CG1 4.42Å
261	P	73.4	Confident	72	Confident	24 Å²	24	71.5 Å²	71.5	16%	0.156	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-31.2	-174	-22.9	34	0	0	0	114.6	E191 V217 F259 N263 N264	E191-P261 HydrophobicContact CB-CG 4.45Å; V217-P261 HydrophobicContact CG1-CB 4.01Å; V217-P261 HydrophobicContact CG1-CG 4.08Å; V217-P261 HydrophobicContact CG2-CB 4.49Å; F259-P261 HydrophobicContact CD1-CG 4.17Å; F259-P261 HydrophobicContact CE1-CB 4.15Å; F259-P261 HydrophobicContact CE1-CG 4.13Å; F259-P261 WeakPolarHBondContact O-CD 3.38Å; P261-N263 VanDerWaalsContact C-N 3.31Å; P261-N263 PolarHBondContact O-N 3.46Å; P261-N264 PolarHBondContact O-OD1 3.27Å
262	S	74.6	Confident	71.4	Confident	104 Å²	104	72.9 Å²	72.9	73%	0.727	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.4	-172.7	51.3	0	0	0	0	114.2	V260	V260-S262 VanDerWaalsContact C-N 3.33Å; V260-S262 WeakPolarHBondContact CG1-OG 2.99Å; V260-S262 PolarHBondContact O-N 2.85Å
263	N	79.3	Confident	71.3	Confident	103 Å²	103	75.7 Å²	75.7	55%	0.551	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	9.7	-177.4	65.2	3.1	0	0	0	113.4	V260 P261 Y265	V260-N263 WeakPolarHBondContact CB-OD1 3.37Å; V260-N263 VanDerWaalsContact CG1-OD1 3.26Å; V260-N263 WeakPolarHBondContact CG1-OD1 3.33Å; V260-N263 PolarHBondContact O-OD1 3.39Å; P261-N263 VanDerWaalsContact C-N 3.31Å; P261-N263 PolarHBondContact O-N 3.46Å; N263-Y265 PolarHBondContact O-N 2.91Å; N263-Y265 WeakPolarHBondContact OD1-CB 3.33Å; N263-Y265 PolarHBondContact OD1-N 2.87Å
264	N	75.5	Confident	72.1	Confident	125 Å²	125	72.5 Å²	72.5	67%	0.668	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	30.5	-177.6	-76.8	1.9	0	0	0	114.8	V260 P261	V260-N264 WeakPolarHBondContact O-CA 3.29Å; V260-N264 PolarHBondContact O-N 3.41Å; V260-N264 VanDerWaalsContact O-N 3.1Å; P261-N264 PolarHBondContact O-OD1 3.27Å
265	Y	75.8	Confident	73.1	Confident	148 Å²	148	71.5 Å²	71.5	58%	0.58	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	145.4	-179.9	-162.2	-99	0	0	0	112.4	V260 N263 I267	V260-Y265 PolarHBondContact N-O 3.04Å; N263-Y265 PolarHBondContact O-N 2.91Å; N263-Y265 WeakPolarHBondContact OD1-CB 3.33Å; N263-Y265 PolarHBondContact OD1-N 2.87Å; Y265-I267 HydrophobicContact CD1-CG1 3.98Å; Y265-I267 HydrophobicContact CE1-CG1 4.31Å
266	I	74.4	Confident	74.3	Confident	86 Å²	86	66 Å²	66	44%	0.441	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	119.8	175.9	-59.6	172.2	0	0	0	108.9	C257 T258 F259 P268	C257-I266 HydrophobicContact CB-CG2 3.68Å; T258-I266 CarbonylContact O-C 3.45Å; T258-I266 WeakPolarHBondContact O-CA 3.4Å; F259-I266 HydrophobicContact CD2-CG1 4.11Å; I266-P268 WeakPolarHBondContact O-CD 3.38Å
267	I	71.6	Confident	75.6	Confident	58 Å²	58	64.5 Å²	64.5	30%	0.297	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	109.8	176	-54.1	171	0	0	0	108.5	C257 T258 V260 Y265 K270	C257-I267 CarbonylContact C-O 3.54Å; C257-I267 VanDerWaalsContact CA-O 3.23Å; C257-I267 WeakPolarHBondContact CA-O 3.4Å; C257-I267 WeakPolarHBondContact CB-O 3.23Å; T258-I267 PolarHBondContact N-O 3.06Å; T258-I267 PolarHBondContact O-N 3.14Å; V260-I267 HydrophobicContact CG2-CD1 3.91Å; V260-I267 HydrophobicContact CG2-CG1 4.42Å; Y265-I267 HydrophobicContact CD1-CG1 3.98Å; Y265-I267 HydrophobicContact CE1-CG1 4.31Å; I267-K270 HydrophobicContact CG2-CB 4.22Å
268	P	72.1	Confident	76.7	Confident	88 Å²	88	63.5 Å²	63.5	57%	0.571	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	156.3	177.1	30.1	-34.4	0	0	0	111.8	I266 K270	I266-P268 WeakPolarHBondContact O-CD 3.38Å; P268-K270 PolarHBondContact O-N 3.37Å
269	N	66.1	Low	77.7	Confident	161 Å²	161	63.3 Å²	63.3	86%	0.861	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	22.9	175.5	-63.3	-19.6	0	0	0	115.9	C256	C256-N269 WeakPolarHBondContact O-CA 3.4Å; C256-N269 PolarHBondContact O-N 3.21Å
270	K	70.3	Confident	78.1	Confident	106 Å²	106	63.7 Å²	63.7	46%	0.461	35%	0.347	S	S	.	.			trans	-126.7	116.3	172.3	-168.1	-177.3	179.9	-167.9	0	109.5	C257 T258 I267 P268	C257-K270 CarbonylContact C-O 3.5Å; C257-K270 VanDerWaalsContact C-O 3.22Å; T258-K270 PolarHBondContact N-O 3.49Å; T258-K270 PolarHBondContact OG1-O 2.68Å; I267-K270 HydrophobicContact CG2-CB 4.22Å; P268-K270 PolarHBondContact O-N 3.37Å
271	S	70.9	Confident	78.5	Confident	57 Å²	57	63.5 Å²	63.5	40%	0.399	35%	0.345	S	S	.	.			trans	-94.8	115.4	172.2	58.7	0	0	0	0	109.2	P255	P255-S271 WeakPolarHBondContact O-CB 3.41Å
272	E	77.1	Confident	78.6	Confident	39 Å²	39	62.9 Å²	62.9	18%	0.182	34%	0.34	C	S	.	.			trans	-82.6	144.4	173	-82.4	-173.8	174.9	0	0	111.5	Y154 L252 T258	Y154-E272 WeakPolarHBondContact CD1-O 3.2Å; L252-E272 HydrophobicContact CD1-CB 3.72Å; L252-E272 WeakPolarHBondContact CD1-O 3.34Å; T258-E272 HydrophobicContact CG2-CG 3.7Å; T258-E272 WeakPolarHBondContact CG2-OE1 3.34Å; T258-E272 WeakPolarHBondContact OG1-CG 3.49Å
273	E	84.2	Confident	77.8	Confident	82 Å²	82	60 Å²	60	38%	0.383	33%	0.327	S	S	.	.			trans	-77.4	150.3	170.3	-59.8	-171.7	169.1	0	0	110.4	P153 Y154 Q192 E275	P153-E273 HydrophobicContact CB-CB 4.33Å; P153-E273 HydrophobicContact CB-CG 3.91Å; Y154-E273 HydrophobicContact CD1-CG 4.34Å; Y154-E273 HydrophobicContact CE1-CG 3.85Å; Q192-E273 PolarHBondContact NE2-O 3.02Å; E273-E275 PolarHBondContact O-N 3.07Å
274	L	86.7	Confident	76.5	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.016	34%	0.335	C	S	.	.			trans	-76.7	93	174.4	-177.6	64	0	0	0	109	P153 R156 I194 I250 L252 A276 F278	P153-L274 WeakPolarHBondContact O-CB 3.34Å; P153-L274 PolarHBondContact O-N 3.35Å; R156-L274 HydrophobicContact CG-CD2 3.96Å; I194-L274 HydrophobicContact CG2-CD1 3.73Å; I250-L274 HydrophobicContact CG2-CD2 4.48Å; L252-L274 HydrophobicContact CD2-CD1 3.95Å; L252-L274 HydrophobicContact CG-CD1 4.3Å; L274-A276 HydrophobicContact CD1-CB 4.03Å; L274-F278 HydrophobicContact CD2-CE2 4.35Å
275	E	87.9	Confident	75.2	Confident	27 Å²	27	57.4 Å²	57.4	13%	0.126	32%	0.322	C	S	.	.			trans	-82.2	-17.6	179.3	-59.1	-170.5	154.8	0	0	112.3	N184 A187 R188 V189 T220 E273 R277	N184-E275 PolarHBondContact ND2-O 2.96Å; A187-E275 VanDerWaalsContact C-OE2 3.31Å; A187-E275 VanDerWaalsContact CA-OE2 3.24Å; A187-E275 WeakPolarHBondContact CA-OE2 3.32Å; A187-E275 HydrophobicContact CB-CB 4.21Å; A187-E275 WeakPolarHBondContact CB-OE2 3.46Å; R188-E275 VanDerWaalsContact CB-OE1 3.26Å; R188-E275 WeakPolarHBondContact CB-OE1 3.47Å; R188-E275 WeakPolarHBondContact CG-OE1 3.41Å; R188-E275 VanDerWaalsContact N-CD 3.3Å; R188-E275 PolarHBondContact N-OE1 3.18Å; R188-E275 VanDerWaalsContact N-OE1 3.16Å; R188-E275 PolarHBondContact N-OE2 3.34Å; V189-E275 PolarHBondContact N-OE2 2.6Å; T220-E275 HydrophobicContact CG2-CB 4.41Å; E273-E275 PolarHBondContact O-N 3.07Å; E275-R277 PolarHBondContact O-N 3.4Å
276	A	87.7	Confident	73.7	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.008	31%	0.312	C	S	.	.			trans	-62.2	121.8	168.5	0	0	0	0	0	110.2	I194 V218 L274 F278	I194-A276 HydrophobicContact CG2-CB 4.37Å; V218-A276 HydrophobicContact CG2-CB 3.92Å; L274-A276 HydrophobicContact CD1-CB 4.03Å; A276-F278 HydrophobicContact CB-CE2 4.31Å; A276-F278 HydrophobicContact CB-CZ 4.07Å
277	R	87.9	Confident	72.2	Confident	43 Å²	43	56.3 Å²	56.3	16%	0.162	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	146.8	-179.4	-61.5	-169.4	68.4	-171.1	-2.7	110.6	R181 L182 N184 E275 D282 T286	R181-R277 CarbonylContact C-O 3.22Å; R181-R277 WeakPolarHBondContact CA-O 3.49Å; L182-R277 HydrophobicContact CB-CB 4.12Å; L182-R277 PolarHBondContact N-O 2.89Å; N184-R277 HydrophobicContact CB-CG 4.23Å; E275-R277 PolarHBondContact O-N 3.4Å; R277-D282 WeakPolarHBondContact CA-OD2 3Å; R277-D282 HydrophobicContact CB-CB 4.17Å; R277-D282 PolarHBondContact NH2-O 3.36Å; R277-T286 VanDerWaalsContact CZ-CG2 3.4Å; R277-T286 PolarHBondContact NH1-OG1 2.77Å; R277-T286 PolarHBondContact NH2-OG1 2.96Å
278	F	88.4	Confident	70.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.9	-177.9	-56.3	-77.2	0	0	0	112	R156 V179 F180 R181 I194 L227 I250 L274 A276 I281 D282	R156-F278 HydrophobicContact CG-CD2 4.44Å; V179-F278 HydrophobicContact CB-CD1 4.47Å; V179-F278 HydrophobicContact CG1-CD1 4.14Å; V179-F278 HydrophobicContact CG1-CE1 4.22Å; V179-F278 HydrophobicContact CG2-CB 3.76Å; V179-F278 HydrophobicContact CG2-CD1 3.52Å; V179-F278 HydrophobicContact CG2-CE1 4.37Å; V179-F278 HydrophobicContact CG2-CG 3.83Å; F180-F278 WeakPolarHBondContact O-CA 3Å; R181-F278 HydrophobicContact CB-CD1 4.46Å; R181-F278 HydrophobicContact CB-CE1 4.42Å; I194-F278 HydrophobicContact CD1-CE1 4.42Å; I194-F278 HydrophobicContact CD1-CZ 4.07Å; L227-F278 HydrophobicContact CD1-CE1 3.98Å; I250-F278 HydrophobicContact CG2-CE2 4.16Å; I250-F278 HydrophobicContact CG2-CZ 4.15Å; L274-F278 HydrophobicContact CD2-CE2 4.35Å; A276-F278 HydrophobicContact CB-CE2 4.31Å; A276-F278 HydrophobicContact CB-CZ 4.07Å; F278-I281 HydrophobicContact CB-CB 4.19Å; F278-I281 HydrophobicContact CB-CD1 3.85Å; F278-I281 HydrophobicContact CB-CG1 4.23Å; F278-I281 HydrophobicContact CG-CD1 4.41Å; F278-I281 PolarHBondContact O-N 3.38Å; F278-D282 PolarHBondContact N-OD2 2.83Å; F278-D282 PolarHBondContact O-N 3.08Å
279	A	85.1	Confident	69.4	Low	0 Å²	0	61.9 Å²	61.9	0%	0	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	142.9	175.5	0	0	0	0	0	110.4	F180 L182 I281 K305 P307	F180-A279 HydrophobicContact CB-CB 4.16Å; F180-A279 HydrophobicContact CD1-CB 4.22Å; F180-A279 PolarHBondContact O-N 2.98Å; L182-A279 HydrophobicContact CD1-CB 4.33Å; L182-A279 HydrophobicContact CD2-CB 4Å; L182-A279 HydrophobicContact CG-CB 4.13Å; A279-I281 PolarHBondContact O-N 2.8Å; A279-I281 VanDerWaalsContact O-N 3.11Å; A279-K305 HydrophobicContact CB-CB 3.93Å; A279-K305 VanDerWaalsContact CB-O 3.29Å; A279-K305 WeakPolarHBondContact CB-O 3.48Å; A279-P307 WeakPolarHBondContact O-CD 3.43Å
280	G	78.2	Confident	68.6	Low	48 Å²	48	55.7 Å²	55.7	50%	0.495	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	-17.4	-175.5	0	0	0	0	0	115.5
281	I	80.8	Confident	67.6	Low	31 Å²	31	56.8 Å²	56.8	16%	0.159	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-57	178.1	-52.2	177.2	0	0	0	110.5	M108 R156 V158 V179 F278 A279 P307	M108-I281 HydrophobicContact SD-CG1 4.5Å; R156-I281 HydrophobicContact CB-CG2 4.04Å; R156-I281 HydrophobicContact CG-CG2 3.92Å; V158-I281 HydrophobicContact CG1-CD1 3.34Å; V158-I281 HydrophobicContact CG1-CG1 4.08Å; V179-I281 HydrophobicContact CG2-CD1 4.27Å; F278-I281 HydrophobicContact CB-CB 4.19Å; F278-I281 HydrophobicContact CB-CD1 3.85Å; F278-I281 HydrophobicContact CB-CG1 4.23Å; F278-I281 HydrophobicContact CG-CD1 4.41Å; F278-I281 PolarHBondContact O-N 3.38Å; A279-I281 PolarHBondContact O-N 2.8Å; A279-I281 VanDerWaalsContact O-N 3.11Å; I281-P307 HydrophobicContact CD1-CG 3.89Å; I281-P307 HydrophobicContact CG1-CG 3.71Å
282	D	75.6	Confident	66.8	Low	11 Å²	11	61.4 Å²	61.4	6%	0.059	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-5.9	-176.2	-64.9	-72.2	0	0	0	113.2	R156 R277 F278 T284	R156-D282 IonicContact CZ-OD1 3.87Å; R156-D282 IonicContact NE-OD1 2.68Å; R156-D282 PolarHBondContact NE-OD1 3.03Å; R156-D282 IonicContact NE-OD2 3.52Å; R156-D282 IonicContact NH2-OD1 3.71Å; R156-D282 PolarHBondContact NH2-OD1 2.62Å; R277-D282 WeakPolarHBondContact CA-OD2 3Å; R277-D282 HydrophobicContact CB-CB 4.17Å; R277-D282 PolarHBondContact NH2-O 3.36Å; F278-D282 PolarHBondContact N-OD2 2.83Å; F278-D282 PolarHBondContact O-N 3.08Å; D282-T284 VanDerWaalsContact C-N 3.28Å; D282-T284 PolarHBondContact O-N 2.84Å
283	G	58.3	Low	65.5	Low	43 Å²	43	67.9 Å²	67.9	44%	0.443	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-6.8	-167.6	0	0	0	0	0	116
284	T	52.7	Low	64	Low	116 Å²	116	68 Å²	68	71%	0.712	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-17.6	-173.3	43.6	0	0	0	0	114.5	D282	D282-T284 VanDerWaalsContact C-N 3.28Å; D282-T284 PolarHBondContact O-N 2.84Å
285	S	47.1	Very low	62.4	Low	58 Å²	58	71 Å²	71	41%	0.406	41%	0.409	S	S	.	.	S	Bend	trans	-108.8	-13.3	-166.3	59.8	0	0	0	0	116.8	Y287	S285-Y287 PolarHBondContact O-N 3.13Å
286	T	44.3	Very low	60.7	Low	62 Å²	62	77 Å²	77	38%	0.38	44%	0.435	S	S	.	.	S	Bend	trans	-93	10.7	-165.8	52.2	0	0	0	0	118.2	R277	R277-T286 VanDerWaalsContact CZ-CG2 3.4Å; R277-T286 PolarHBondContact NH1-OG1 2.77Å; R277-T286 PolarHBondContact NH2-OG1 2.96Å
287	Y	43.4	Very low	59.1	Low	149 Å²	149	80.7 Å²	80.7	58%	0.584	46%	0.461	S	S	*	.			trans	-144.6	68.7	174.6	-67.5	-79.6	0	0	0	111.6	S285 S289	S285-Y287 PolarHBondContact O-N 3.13Å; Y287-S289 PolarHBondContact O-N 2.85Å; Y287-S289 VanDerWaalsContact O-N 3.17Å
288	T	39.8	Very low	57.5	Low	140 Å²	140	81.8 Å²	81.8	86%	0.859	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	17.9	165.1	39.1	0	0	0	0	113.4
289	S	45.9	Very low	56	Low	123 Å²	123	90 Å²	90	86%	0.86	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.1	34.4	178.5	-158.7	0	0	0	0	113.8	Y287	Y287-S289 PolarHBondContact O-N 2.85Å; Y287-S289 VanDerWaalsContact O-N 3.17Å
290	G	47.7	Very low	54.7	Low	31 Å²	31	98.1 Å²	98.1	32%	0.32	54%	0.539	S	S	.	.	S	Bend	trans	-128.9	138.9	177.6	0	0	0	0	0	111.8
291	D	49.2	Very low	53.9	Low	129 Å²	129	103.3 Å²	103.3	69%	0.69	55%	0.548	S	S	*	.			trans	-35.6	134.4	-178.8	-104.9	-27.4	0	0	0	114.5	K293 T294	D291-K293 PolarHBondContact O-N 3.27Å; D291-T294 PolarHBondContact O-N 2.93Å
292	Q	54.9	Low	53.2	Low	153 Å²	153	103.6 Å²	103.6	72%	0.715	55%	0.549	S	S	*	.	H	α-helix	trans	-56.7	-21.4	-177.2	-144.2	167.4	27.9	0	0	113.3	K296	Q292-K296 WeakPolarHBondContact O-CG 3.4Å; Q292-K296 PolarHBondContact O-N 2.69Å
293	K	50.4	Low	52.6	Low	176 Å²	176	107.1 Å²	107.1	77%	0.765	58%	0.575	S	S	*	*	H	α-helix	trans	-70.5	-39.2	173.5	-73.6	180	177.5	174.8	0	113	D291 K296 S297	D291-K293 PolarHBondContact O-N 3.27Å; K293-K296 PolarHBondContact O-N 2.94Å; K293-S297 PolarHBondContact O-N 3.36Å; K293-S297 VanDerWaalsContact O-N 3.1Å
294	T	51.7	Low	53.2	Low	85 Å²	85	107.7 Å²	107.7	52%	0.521	58%	0.581	S	S	.	*	H	α-helix	trans	-70.9	-34	-179	-45.6	0	0	0	0	111.5	D291 T298	D291-T294 PolarHBondContact O-N 2.93Å; T294-T298 WeakPolarHBondContact O-CB 3.29Å; T294-T298 PolarHBondContact O-N 3.35Å; T294-T298 PolarHBondContact O-OG1 3.12Å
295	I	53.6	Low	54.7	Low	64 Å²	64	105 Å²	105	33%	0.328	56%	0.559	S	S	.	*	H	α-helix	trans	-66.7	-43.2	175.4	-61.3	173	0	0	0	111	R299	I295-R299 WeakPolarHBondContact O-CB 3.45Å; I295-R299 WeakPolarHBondContact O-CG 3.27Å; I295-R299 PolarHBondContact O-N 3.04Å
296	K	51.7	Low	56.5	Low	154 Å²	154	104.5 Å²	104.5	67%	0.67	55%	0.554	S	S	*	*	H	α-helix	trans	-66.2	-41.2	176.8	-72.2	-179.1	-179	-178.8	0	112.3	Q292 K293 K300	Q292-K296 WeakPolarHBondContact O-CG 3.4Å; Q292-K296 PolarHBondContact O-N 2.69Å; K293-K296 PolarHBondContact O-N 2.94Å; K296-K300 WeakPolarHBondContact O-CB 3.47Å; K296-K300 PolarHBondContact O-N 3.23Å
297	S	53.8	Low	58.7	Low	78 Å²	78	101.6 Å²	101.6	55%	0.545	54%	0.536	S	S	.	.	H	α-helix	trans	-61.9	-46.1	175.5	175.7	0	0	0	0	112.2	K293 K300 K301	K293-S297 PolarHBondContact O-N 3.36Å; K293-S297 VanDerWaalsContact O-N 3.1Å; S297-K300 PolarHBondContact O-N 3.22Å; S297-K301 WeakPolarHBondContact O-CB 3.16Å; S297-K301 PolarHBondContact O-N 2.97Å
298	T	54.8	Low	61.1	Low	66 Å²	66	95.2 Å²	95.2	41%	0.405	51%	0.511	S	S	.	.	H	α-helix	trans	-68.6	-37.9	179.9	-53	0	0	0	0	112.3	T294 K301 N302	T294-T298 WeakPolarHBondContact O-CB 3.29Å; T294-T298 PolarHBondContact O-N 3.35Å; T294-T298 PolarHBondContact O-OG1 3.12Å; T298-K301 PolarHBondContact O-N 3.34Å; T298-N302 WeakPolarHBondContact O-CB 3.24Å; T298-N302 PolarHBondContact O-N 3.24Å
299	R	57.4	Low	63.7	Low	174 Å²	174	88.5 Å²	88.5	66%	0.657	47%	0.47	S	S	*	.	H	α-helix	trans	-63.6	-38.8	172.1	-79.3	-174.8	178.8	-178.7	0.7	112.4	I295 N302 S303	I295-R299 WeakPolarHBondContact O-CB 3.45Å; I295-R299 WeakPolarHBondContact O-CG 3.27Å; I295-R299 PolarHBondContact O-N 3.04Å; R299-N302 PolarHBondContact O-N 3.45Å; R299-S303 PolarHBondContact O-N 3.41Å
300	K	58.6	Low	65.9	Low	170 Å²	170	83.8 Å²	83.8	74%	0.739	44%	0.435	S	S	*	.	H	α-helix	trans	-70.9	-31.1	175.6	-161.2	175.6	-176.3	-178.8	0	112.5	K296 S297 S303	K296-K300 WeakPolarHBondContact O-CB 3.47Å; K296-K300 PolarHBondContact O-N 3.23Å; S297-K300 PolarHBondContact O-N 3.22Å; K300-S303 PolarHBondContact O-OG 3.26Å
301	K	61	Low	68	Low	157 Å²	157	82.3 Å²	82.3	68%	0.683	42%	0.42	S	S	*	.	H	α-helix	trans	-74.1	-27.5	174.7	-168	175	-178.1	178.5	0	113.2	S297 T298	S297-K301 WeakPolarHBondContact O-CB 3.16Å; S297-K301 PolarHBondContact O-N 2.97Å; T298-K301 PolarHBondContact O-N 3.34Å
302	N	64.5	Low	69.9	Low	36 Å²	36	78 Å²	78	19%	0.193	40%	0.396	C	S	.	.	S	Bend	trans	-102	2.7	-179.9	-65.6	-16	0	0	0	113.4	T298 R299 G304 K305	T298-N302 WeakPolarHBondContact O-CB 3.24Å; T298-N302 PolarHBondContact O-N 3.24Å; R299-N302 PolarHBondContact O-N 3.45Å; N302-G304 PolarHBondContact O-N 3.28Å; N302-K305 PolarHBondContact O-N 2.7Å; N302-K305 VanDerWaalsContact O-N 3.11Å
303	S	64.9	Low	71.4	Confident	85 Å²	85	70.8 Å²	70.8	59%	0.594	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	125.5	175.9	61	0	0	0	0	109.8	R299 K300	R299-S303 PolarHBondContact O-N 3.41Å; K300-S303 PolarHBondContact O-OG 3.26Å
304	G	70.8	Confident	73	Confident	55 Å²	55	63 Å²	63	57%	0.567	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	-0.8	-176.1	0	0	0	0	0	115.1	N302	N302-G304 PolarHBondContact O-N 3.28Å
305	K	82.7	Confident	74.3	Confident	59 Å²	59	59.1 Å²	59.1	26%	0.257	31%	0.305	S	S	.	.			trans	-98.3	19.8	176	-59.9	-175	179.3	-177.5	0	113.3	F180 W226 A279 N302	F180-K305 HydrophobicContact CB-CB 4.01Å; F180-K305 HydrophobicContact CD1-CB 4.29Å; F180-K305 HydrophobicContact CD1-CD 3.7Å; F180-K305 HydrophobicContact CD1-CG 4.48Å; F180-K305 HydrophobicContact CD2-CD 4.16Å; F180-K305 HydrophobicContact CE1-CD 3.69Å; F180-K305 HydrophobicContact CE2-CD 4.16Å; F180-K305 HydrophobicContact CG-CB 4.09Å; F180-K305 HydrophobicContact CG-CD 3.93Å; F180-K305 HydrophobicContact CG-CG 4.32Å; F180-K305 HydrophobicContact CZ-CD 3.93Å; W226-K305 HydrophobicContact CH2-CB 4.38Å; W226-K305 HydrophobicContact CZ2-CB 4.24Å; W226-K305 HydrophobicContact CZ2-CG 4.23Å; A279-K305 HydrophobicContact CB-CB 3.93Å; A279-K305 VanDerWaalsContact CB-O 3.29Å; A279-K305 WeakPolarHBondContact CB-O 3.48Å; N302-K305 PolarHBondContact O-N 2.7Å; N302-K305 VanDerWaalsContact O-N 3.11Å
306	T	84.9	Confident	75.1	Confident	48 Å²	48	59.4 Å²	59.4	29%	0.294	31%	0.313	S	S	.	.			trans	-67.6	147.3	178.2	42	0	0	0	0	111	D107 H308	D107-T306 PolarHBondContact OD1-OG1 2.87Å; D107-T306 VanDerWaalsContact OD1-OG1 3.13Å; T306-H308 PolarHBondContact O-N 3.37Å; T306-H308 PolarHBondContact O-ND1 3Å
307	P	92.1	Very high	75.9	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	31%	0.307	C	S	.	.			trans	-60.6	136.8	173.2	-13.8	28	0	0	0	109.2	M108 F160 F177 R178 V179 A279 I281	M108-P307 HydrophobicContact CB-CB 4.34Å; M108-P307 WeakPolarHBondContact CB-O 3.3Å; M108-P307 PolarHBondContact N-O 2.9Å; M108-P307 HydrophobicContact SD-CB 4.3Å; M108-P307 HydrophobicContact SD-CG 4Å; F160-P307 HydrophobicContact CZ-CB 4.4Å; F177-P307 HydrophobicContact CE2-CB 3.89Å; F177-P307 HydrophobicContact CZ-CB 4.4Å; R178-P307 VanDerWaalsContact O-CA 3.28Å; R178-P307 WeakPolarHBondContact O-CA 3.36Å; V179-P307 HydrophobicContact CB-CB 4.48Å; V179-P307 HydrophobicContact CG2-CB 4.26Å; V179-P307 HydrophobicContact CG2-CG 4.17Å; A279-P307 WeakPolarHBondContact O-CD 3.43Å; I281-P307 HydrophobicContact CD1-CG 3.89Å; I281-P307 HydrophobicContact CG1-CG 3.71Å
308	H	93.2	Very high	76.4	Confident	15 Å²	15	58.5 Å²	58.5	7%	0.069	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	157.2	-177.7	58.9	-86.6	0	0	0	111.1	K105 I106 R178 W226 T306	K105-H308 VanDerWaalsContact CE-CG 3.46Å; K105-H308 HydrophobicContact CG-CB 4.13Å; I106-H308 CarbonylContact O-C 3.55Å; I106-H308 WeakPolarHBondContact O-CA 3.49Å; I106-H308 WeakPolarHBondContact O-CB 3.3Å; R178-H308 PolarHBondContact N-O 3.37Å; R178-H308 PolarHBondContact O-N 3.5Å; W226-H308 AromaticContact CH2-CE1 3.55Å; W226-H308 AromaticContact CH2-ND1 3.93Å; W226-H308 AromaticContact CZ3-CE1 3.58Å; W226-H308 AromaticContact CZ3-ND1 3.98Å; T306-H308 PolarHBondContact O-N 3.37Å; T306-H308 PolarHBondContact O-ND1 3Å
309	L	93.8	Very high	76.5	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	139.6	167.6	-60.8	170.8	0	0	0	109.5	K105 I106 F160 V162 E176 F177 V231 V235 W238 F248 L311	K105-L309 CarbonylContact C-O 3.54Å; K105-L309 WeakPolarHBondContact CA-O 3.34Å; I106-L309 HydrophobicContact CB-CB 4.31Å; I106-L309 PolarHBondContact N-O 3.42Å; I106-L309 PolarHBondContact O-N 3.48Å; F160-L309 HydrophobicContact CB-CD1 3.5Å; F160-L309 VanDerWaalsContact CB-CD1 3.5Å; F160-L309 HydrophobicContact CB-CG 4.31Å; F160-L309 HydrophobicContact CD1-CD1 3.94Å; F160-L309 HydrophobicContact CD1-CG 3.8Å; F160-L309 HydrophobicContact CD2-CD1 3.68Å; F160-L309 HydrophobicContact CD2-CD2 4.16Å; F160-L309 HydrophobicContact CD2-CG 3.82Å; F160-L309 HydrophobicContact CE1-CG 4.05Å; F160-L309 HydrophobicContact CE2-CD1 4.42Å; F160-L309 HydrophobicContact CE2-CD2 4.15Å; F160-L309 HydrophobicContact CE2-CG 4.07Å; F160-L309 HydrophobicContact CG-CD1 3.4Å; F160-L309 VanDerWaalsContact CG-CD1 3.4Å; F160-L309 HydrophobicContact CG-CG 3.68Å; F160-L309 HydrophobicContact CZ-CD2 4.49Å; F160-L309 HydrophobicContact CZ-CG 4.19Å; V162-L309 HydrophobicContact CG1-CD1 4.14Å; E176-L309 CarbonylContact O-C 3.59Å; E176-L309 WeakPolarHBondContact O-CA 3.48Å; F177-L309 HydrophobicContact CB-CD2 3.71Å; F177-L309 HydrophobicContact CD2-CD2 4.1Å; F177-L309 HydrophobicContact CG-CD2 4.29Å; V231-L309 HydrophobicContact CG2-CD2 3.91Å; V235-L309 HydrophobicContact CG2-CD1 4.26Å; V235-L309 HydrophobicContact CG2-CD2 4.47Å; W238-L309 HydrophobicContact CZ3-CD1 4.36Å; F248-L309 HydrophobicContact CE2-CD2 3.99Å; L309-L311 HydrophobicContact CB-CD1 3.61Å
310	L	92.4	Very high	76.3	Confident	23 Å²	23	56 Å²	56	12%	0.12	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	113.9	166.6	-62.6	-177.7	0	0	0	108.1	V103 Y104 K105 A175 E176 R178	V103-L310 HydrophobicContact CG1-CD2 4.43Å; Y104-L310 WeakPolarHBondContact O-CA 3.49Å; K105-L310 HydrophobicContact CB-CD2 3.93Å; K105-L310 HydrophobicContact CG-CD2 3.96Å; A175-L310 CarbonylContact C-O 3.44Å; A175-L310 VanDerWaalsContact CA-O 3.32Å; A175-L310 WeakPolarHBondContact CA-O 3.23Å; E176-L310 HydrophobicContact CB-CB 4.48Å; E176-L310 PolarHBondContact N-O 2.8Å; E176-L310 PolarHBondContact O-N 3.41Å; R178-L310 HydrophobicContact CG-CD1 4.46Å
311	L	91.8	Very high	75.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.9	175.7	-72.3	66.1	0	0	0	108.1	V103 Y104 I106 M165 L172 A175 V235 L309 L313	V103-L311 CarbonylContact C-O 3.57Å; V103-L311 WeakPolarHBondContact CA-O 3.28Å; Y104-L311 PolarHBondContact N-O 2.92Å; Y104-L311 PolarHBondContact O-N 2.81Å; I106-L311 HydrophobicContact CD1-CD1 3.77Å; I106-L311 HydrophobicContact CD1-CD2 4.03Å; I106-L311 HydrophobicContact CG1-CD1 4.26Å; M165-L311 HydrophobicContact CB-CD2 4.25Å; M165-L311 HydrophobicContact CG-CD2 4.09Å; L172-L311 HydrophobicContact CD1-CB 3.94Å; L172-L311 HydrophobicContact CD1-CD2 4.25Å; L172-L311 HydrophobicContact CD1-CG 4.02Å; A175-L311 HydrophobicContact CB-CG 4.39Å; V235-L311 HydrophobicContact CG1-CD2 3.99Å; V235-L311 HydrophobicContact CG1-CG 4.19Å; L309-L311 HydrophobicContact CB-CD1 3.61Å; L311-L313 HydrophobicContact CB-CD1 3.65Å
312	M	88.6	Confident	75.4	Confident	39 Å²	39	48.1 Å²	48.1	19%	0.192	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	109.8	175.8	-69.2	170.3	-99.8	0	0	107.8	K101 E102 V103 V173 K174 E176	K101-M312 HydrophobicContact CB-CB 4.17Å; E102-M312 WeakPolarHBondContact O-CA 2.94Å; V103-M312 HydrophobicContact CG2-CG 4.27Å; V173-M312 PolarHBondContact N-O 2.92Å; K174-M312 HydrophobicContact CB-CB 4.26Å; K174-M312 HydrophobicContact CB-CE 3.83Å; K174-M312 HydrophobicContact CB-SD 4.31Å; K174-M312 HydrophobicContact CD-CE 3.63Å; K174-M312 HydrophobicContact CD-SD 4.42Å; K174-M312 HydrophobicContact CG-CE 3.67Å; K174-M312 PolarHBondContact N-O 2.8Å; K174-M312 PolarHBondContact O-N 3.25Å; E176-M312 HydrophobicContact CG-CE 3.96Å
313	L	86.9	Confident	74.6	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	150.3	-177.6	-63.3	98	0	0	0	112	K101 E102 Y104 N168 N171 L172 L311	K101-L313 CarbonylContact C-O 3.6Å; K101-L313 WeakPolarHBondContact CA-O 3.46Å; K101-L313 WeakPolarHBondContact CB-O 3.06Å; E102-L313 PolarHBondContact N-O 3.01Å; E102-L313 PolarHBondContact O-N 3.41Å; Y104-L313 HydrophobicContact CD2-CD1 3.39Å; Y104-L313 HydrophobicContact CE2-CD1 3.89Å; Y104-L313 HydrophobicContact CG-CD1 4.28Å; N168-L313 HydrophobicContact CB-CD2 3.6Å; N168-L313 WeakPolarHBondContact O-CD2 3.32Å; N171-L313 HydrophobicContact CB-CB 4.29Å; N171-L313 HydrophobicContact CB-CD2 4.14Å; N171-L313 CarbonylContact O-C 3.45Å; N171-L313 WeakPolarHBondContact O-CA 3.27Å; L172-L313 HydrophobicContact CD1-CG 4.28Å; L311-L313 HydrophobicContact CB-CD1 3.65Å
314	L	83.4	Confident	73.7	Confident	11 Å²	11	54.8 Å²	54.8	6%	0.058	29%	0.292	C	S	.	.			trans	-78.3	134.3	166.3	-73.7	166.5	0	0	0	110.1	E96 N171 V173 S316	E96-L314 HydrophobicContact CB-CD1 4.32Å; E96-L314 HydrophobicContact CG-CD1 4.17Å; N171-L314 WeakPolarHBondContact CB-O 3.11Å; N171-L314 PolarHBondContact ND2-O 2.98Å; N171-L314 PolarHBondContact O-N 3.2Å; V173-L314 HydrophobicContact CG2-CB 4.49Å; V173-L314 HydrophobicContact CG2-CD1 3.75Å; V173-L314 HydrophobicContact CG2-CD2 4.42Å; V173-L314 HydrophobicContact CG2-CG 3.53Å; L314-S316 PolarHBondContact O-N 2.9Å
315	P	78.8	Confident	72.5	Confident	4 Å²	4	58.3 Å²	58.3	3%	0.026	30%	0.298	C	S	.	.			trans	-61.2	134.3	175.9	-18.5	27.8	0	0	0	111.7	E102 Y317 R318	E102-P315 HydrophobicContact CG-CG 4.11Å; P315-Y317 VanDerWaalsContact C-N 3.29Å; P315-Y317 HydrophobicContact CB-CD1 3.53Å; P315-Y317 HydrophobicContact CB-CE1 3.1Å; P315-Y317 HydrophobicContact CB-CG 4.41Å; P315-Y317 HydrophobicContact CG-CE1 3.9Å; P315-Y317 PolarHBondContact O-N 3.26Å; P315-R318 PolarHBondContact O-N 2.99Å
316	S	71.9	Confident	70.6	Confident	70 Å²	70	65.7 Å²	65.7	49%	0.49	33%	0.325	S	S	.	.	H	α-helix	trans	-57.1	-37.2	-175.6	49.7	0	0	0	0	113.7	L314 R318 L319 E320	L314-S316 PolarHBondContact O-N 2.9Å; S316-R318 PolarHBondContact O-N 3.46Å; S316-R318 VanDerWaalsContact O-N 3.12Å; S316-L319 PolarHBondContact O-N 2.93Å; S316-L319 VanDerWaalsContact O-N 3.07Å; S316-E320 PolarHBondContact O-N 3.09Å
317	Y	66.8	Low	68.9	Low	137 Å²	137	74.3 Å²	74.3	54%	0.537	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-20.9	178.2	69.2	-97.2	0	0	0	114	P315	P315-Y317 VanDerWaalsContact C-N 3.29Å; P315-Y317 HydrophobicContact CB-CD1 3.53Å; P315-Y317 HydrophobicContact CB-CE1 3.1Å; P315-Y317 HydrophobicContact CB-CG 4.41Å; P315-Y317 HydrophobicContact CG-CE1 3.9Å; P315-Y317 PolarHBondContact O-N 3.26Å
318	R	64.2	Low	66.4	Low	77 Å²	77	83.1 Å²	83.1	29%	0.291	39%	0.39	S	S	.	.	H	α-helix	trans	-83.9	-29	176	-70.6	-168	167.8	150.1	-0.1	112.9	A100 P315 S316 S321 Q322	A100-R318 PolarHBondContact O-NH1 2.96Å; P315-R318 PolarHBondContact O-N 2.99Å; S316-R318 PolarHBondContact O-N 3.46Å; S316-R318 VanDerWaalsContact O-N 3.12Å; R318-S321 PolarHBondContact O-OG 2.59Å; R318-Q322 PolarHBondContact O-N 2.86Å
319	L	57	Low	64.2	Low	45 Å²	45	91.2 Å²	91.2	24%	0.236	43%	0.425	C	S	.	.	H	α-helix	trans	-73.2	-31.8	-179.9	-69.2	164.6	0	0	0	111.4	N171 S316 Q322 Q323	N171-L319 HydrophobicContact CB-CD1 4.03Å; N171-L319 WeakPolarHBondContact OD1-CD1 3.44Å; S316-L319 PolarHBondContact O-N 2.93Å; S316-L319 VanDerWaalsContact O-N 3.07Å; L319-Q322 PolarHBondContact O-N 3.39Å; L319-Q323 PolarHBondContact O-N 2.79Å
320	E	53.5	Low	61.8	Low	141 Å²	141	101 Å²	101	66%	0.659	46%	0.462	S	S	*	.	H	α-helix	trans	-67	-38.6	173.9	-72.4	178.3	169.8	0	0	112.6	S316 Q322 Q323	S316-E320 PolarHBondContact O-N 3.09Å; E320-Q322 PolarHBondContact O-N 2.85Å; E320-Q323 PolarHBondContact O-N 2.9Å
321	S	51	Low	59.6	Low	79 Å²	79	103 Å²	103	55%	0.552	48%	0.482	S	S	*	.	H	α-helix	trans	-70.2	-22.4	175.9	97.6	0	0	0	0	113	R318 T324	R318-S321 PolarHBondContact O-OG 2.59Å; S321-T324 PolarHBondContact O-OG1 3.33Å
322	Q	49.2	Very low	57.8	Low	83 Å²	83	105.8 Å²	105.8	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-77.6	-25.5	174.5	-74.9	-175.6	-5.4	0	0	113.2	R318 L319 E320 N325 R326	R318-Q322 PolarHBondContact O-N 2.86Å; L319-Q322 PolarHBondContact O-N 3.39Å; E320-Q322 PolarHBondContact O-N 2.85Å; Q322-N325 CarbonylContact O-C 3.6Å; Q322-N325 PolarHBondContact O-N 2.67Å; Q322-R326 WeakPolarHBondContact O-CG 3.4Å; Q322-R326 PolarHBondContact O-N 2.97Å
323	Q	47.7	Very low	56.1	Low	149 Å²	149	108.2 Å²	108.2	70%	0.696	51%	0.51	S	S	*	.	H	α-helix	trans	-69.1	-33.3	178.7	-74.3	-171.5	1.4	0	0	112.7	L319 E320 N325	L319-Q323 PolarHBondContact O-N 2.79Å; E320-Q323 PolarHBondContact O-N 2.9Å; Q323-N325 VanDerWaalsContact C-N 3.34Å
324	T	46	Very low	54.6	Low	113 Å²	113	109 Å²	109	69%	0.693	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-13.9	178.8	57.5	0	0	0	0	113.5	S321	S321-T324 PolarHBondContact O-OG1 3.33Å
325	N	46.5	Very low	53.3	Low	129 Å²	129	111.5 Å²	111.5	69%	0.69	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.3	51.1	179.7	-81.3	-52.3	0	0	0	112.6	Q322 Q323 R327	Q322-N325 CarbonylContact O-C 3.6Å; Q322-N325 PolarHBondContact O-N 2.67Å; Q323-N325 VanDerWaalsContact C-N 3.34Å; N325-R327 PolarHBondContact O-N 3.19Å
326	R	42.9	Very low	52.3	Low	214 Å²	214	116.4 Å²	116.4	81%	0.808	56%	0.558	S	S	*	*			trans	-70.9	50	163.5	-83	-167.3	176.7	170.5	-0.9	112.5	Q322	Q322-R326 WeakPolarHBondContact O-CG 3.4Å; Q322-R326 PolarHBondContact O-N 2.97Å
327	R	48.5	Very low	51.6	Low	229 Å²	229	113.3 Å²	113.3	86%	0.864	54%	0.536	S	S	*	.			trans	-88	97.6	142.3	-91.2	-176.7	177.7	162.3	0.5	105.5	N325 K329	N325-R327 PolarHBondContact O-N 3.19Å; R327-K329 PolarHBondContact O-N 2.91Å
328	K	40.4	Very low	51.2	Low	185 Å²	185	111.5 Å²	111.5	80%	0.804	53%	0.531	S	S	*	.			trans	-42.9	107.3	159.5	-91.9	-176.2	172.2	-176.4	0	106.4	R330	K328-R330 HydrophobicContact CB-CG 4.47Å; K328-R330 PolarHBondContact O-N 3.05Å
329	K	46.7	Very low	50.7	Low	185 Å²	185	118.1 Å²	118.1	80%	0.804	56%	0.556	S	S	*	*			trans	-77	78.3	174.4	-143.4	-177.2	-171.9	-174.5	0	105	R327 A331	R327-K329 PolarHBondContact O-N 2.91Å; K329-A331 PolarHBondContact O-N 3.18Å
330	R	44.1	Very low	50.6	Low	205 Å²	205	119.4 Å²	119.4	77%	0.774	56%	0.563	S	S	*	*			trans	-53	134.4	170.6	-58.9	177	-160	158.7	4.4	105.5	K328 L332	K328-R330 HydrophobicContact CB-CG 4.47Å; K328-R330 PolarHBondContact O-N 3.05Å; R330-L332 PolarHBondContact O-N 3.09Å
331	A	45.5	Very low	50.7	Low	67 Å²	67	119.3 Å²	119.3	55%	0.554	57%	0.572	S	S	*	*			trans	-44.7	138	156.6	0	0	0	0	0	107.1	K329 D333	K329-A331 PolarHBondContact O-N 3.18Å; A331-D333 PolarHBondContact O-N 2.83Å
332	L	53	Low	51	Low	58 Å²	58	118.3 Å²	118.3	30%	0.304	56%	0.558	S	S	.	*			trans	-67.3	80.4	-177.7	-56.9	175.9	0	0	0	107.9	R330 Y336	R330-L332 PolarHBondContact O-N 3.09Å; L332-Y336 HydrophobicContact CB-CD1 4.35Å; L332-Y336 HydrophobicContact CD2-CD1 3.43Å; L332-Y336 VanDerWaalsContact CD2-CD1 3.43Å; L332-Y336 HydrophobicContact CD2-CE1 3.47Å; L332-Y336 VanDerWaalsContact CD2-CE1 3.47Å; L332-Y336 HydrophobicContact CD2-CG 4.06Å; L332-Y336 HydrophobicContact CG-CD1 4.37Å
333	D	54.5	Low	51.8	Low	90 Å²	90	120.9 Å²	120.9	48%	0.481	58%	0.575	S	S	.	*			trans	-66.2	160.3	177.4	-178.5	25.5	0	0	0	108.8	A331 A335 Y336 C337	A331-D333 PolarHBondContact O-N 2.83Å; D333-A335 PolarHBondContact O-N 3.48Å; D333-Y336 PolarHBondContact O-N 2.86Å; D333-C337 PolarHBondContact O-N 2.8Å
334	A	55.2	Low	53.1	Low	18 Å²	18	116 Å²	116	15%	0.149	55%	0.553	C	S	.	*	H	α-helix	trans	-43.4	-41.1	179	0	0	0	0	0	112.1	Y336 C337 F338 L347	A334-Y336 VanDerWaalsContact C-N 3.31Å; A334-Y336 PolarHBondContact O-N 2.63Å; A334-C337 PolarHBondContact O-N 2.9Å; A334-F338 HydrophobicContact CB-CD2 4.19Å; A334-F338 HydrophobicContact CB-CE2 3.5Å; A334-F338 HydrophobicContact CB-CZ 3.88Å; A334-F338 WeakPolarHBondContact O-CB 3Å; A334-F338 WeakPolarHBondContact O-CD2 3.26Å; A334-F338 WeakPolarHBondContact O-CG 2.96Å; A334-F338 PolarHBondContact O-N 2.83Å; A334-L347 HydrophobicContact CB-CD2 3.49Å; A334-L347 VanDerWaalsContact CB-CD2 3.49Å
335	A	56.1	Low	54.7	Low	63 Å²	63	111 Å²	111	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-27.1	179	0	0	0	0	0	115.5	D333	D333-A335 PolarHBondContact O-N 3.48Å
336	Y	57.3	Low	56.4	Low	108 Å²	108	105 Å²	105	42%	0.424	49%	0.491	S	S	.	.	H	α-helix	trans	-86.6	-42.9	177	-177.4	-86.6	0	0	0	111.4	L332 D333 A334 F338 R339	L332-Y336 HydrophobicContact CB-CD1 4.35Å; L332-Y336 HydrophobicContact CD2-CD1 3.43Å; L332-Y336 VanDerWaalsContact CD2-CD1 3.43Å; L332-Y336 HydrophobicContact CD2-CE1 3.47Å; L332-Y336 VanDerWaalsContact CD2-CE1 3.47Å; L332-Y336 HydrophobicContact CD2-CG 4.06Å; L332-Y336 HydrophobicContact CG-CD1 4.37Å; D333-Y336 PolarHBondContact O-N 2.86Å; A334-Y336 VanDerWaalsContact C-N 3.31Å; A334-Y336 PolarHBondContact O-N 2.63Å; Y336-F338 VanDerWaalsContact C-N 3.34Å; Y336-F338 PolarHBondContact O-N 2.95Å; Y336-R339 PolarHBondContact O-N 2.81Å
337	C	57.9	Low	58.4	Low	4 Å²	4	94.8 Å²	94.8	3%	0.027	45%	0.453	C	S	.	.	H	α-helix	trans	-69	-28.8	-179.1	-70.2	0	0	0	0	113.7	D333 A334 R339 C346 L347	D333-C337 PolarHBondContact O-N 2.8Å; A334-C337 PolarHBondContact O-N 2.9Å; C337-R339 PolarHBondContact O-N 2.83Å; C337-C346 WeakPolarHBondContact CA-SG 3.35Å; C337-C346 HydrophobicContact CB-CB 3.81Å; C337-C346 WeakPolarHBondContact CB-SG 3.22Å; C337-C346 VanDerWaalsContact SG-CA 3.53Å; C337-C346 WeakPolarHBondContact SG-CB 3.46Å; C337-C346 CovalentContact SG-SG 2.03Å; C337-C346 PolarHBondContact SG-SG 3.02Å; C337-L347 HydrophobicContact CB-CB 4.21Å; C337-L347 VanDerWaalsContact CB-O 3.23Å; C337-L347 WeakPolarHBondContact CB-O 3.34Å; C337-L347 PolarHBondContact SG-N 2.89Å
338	F	57.2	Low	60.3	Low	100 Å²	100	85.3 Å²	85.3	44%	0.439	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.5	177.7	-62.4	-33.8	0	0	0	114.4	A334 Y336 L347 P349	A334-F338 HydrophobicContact CB-CD2 4.19Å; A334-F338 HydrophobicContact CB-CE2 3.5Å; A334-F338 HydrophobicContact CB-CZ 3.88Å; A334-F338 WeakPolarHBondContact O-CB 3Å; A334-F338 WeakPolarHBondContact O-CD2 3.26Å; A334-F338 WeakPolarHBondContact O-CG 2.96Å; A334-F338 PolarHBondContact O-N 2.83Å; Y336-F338 VanDerWaalsContact C-N 3.34Å; Y336-F338 PolarHBondContact O-N 2.95Å; F338-L347 HydrophobicContact CZ-CD2 4.13Å; F338-P349 HydrophobicContact CD1-CB 4.22Å; F338-P349 HydrophobicContact CD1-CG 4.04Å; F338-P349 HydrophobicContact CE1-CB 3.63Å; F338-P349 HydrophobicContact CE1-CG 3.9Å; F338-P349 HydrophobicContact CZ-CB 4.26Å
339	R	54.9	Low	62.5	Low	216 Å²	216	80.2 Å²	80.2	82%	0.815	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-24.8	-177.8	-69.2	-173.7	177.8	-152.8	-1	114.3	Y336 C337	Y336-R339 PolarHBondContact O-N 2.81Å; C337-R339 PolarHBondContact O-N 2.83Å
340	N	54.3	Low	64.7	Low	71 Å²	71	71.8 Å²	71.8	38%	0.38	37%	0.366	S	S	.	.			trans	-126.7	121.8	-175.2	-68.5	-32.3	0	0	0	110.7	Q342	N340-Q342 HydrophobicContact CB-CG 4.11Å; N340-Q342 PolarHBondContact O-N 2.86Å
341	V	55.3	Low	67	Low	140 Å²	140	67 Å²	67	85%	0.848	35%	0.349	S	S	*	.			trans	-76	79.1	167	-173.5	0	0	0	0	107.5
342	Q	58.3	Low	69.3	Low	57 Å²	57	63.8 Å²	63.8	27%	0.266	32%	0.323	S	S	.	.			trans	-91.1	143.5	173.2	-82.3	164.4	-5.2	0	0	110.1	N340 N344 R348	N340-Q342 HydrophobicContact CB-CG 4.11Å; N340-Q342 PolarHBondContact O-N 2.86Å; Q342-N344 PolarHBondContact O-N 2.82Å; Q342-R348 PolarHBondContact O-NH2 2.91Å
343	D	65.6	Low	71.3	Confident	138 Å²	138	62.9 Å²	62.9	74%	0.738	32%	0.318	S	S	*	.	S	Bend	trans	-71.2	-6	175.3	-61.9	-43.3	0	0	0	113.5	A377	D343-A377 WeakPolarHBondContact O-CB 3.48Å; D343-A377 PolarHBondContact O-N 2.84Å
344	N	74.6	Confident	73.2	Confident	45 Å²	45	58.7 Å²	58.7	24%	0.241	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-87.7	164.3	-178.6	-58.1	-46.7	0	0	0	112.8	Q342 C346 A377 W382	Q342-N344 PolarHBondContact O-N 2.82Å; N344-C346 PolarHBondContact O-N 3.48Å; N344-C346 VanDerWaalsContact O-N 3.12Å; N344-A377 CarbonylContact C-O 3.57Å; N344-A377 VanDerWaalsContact CA-O 3.27Å; N344-A377 WeakPolarHBondContact CA-O 3.19Å; N344-W382 HydrophobicContact CB-CE3 4.15Å; N344-W382 HydrophobicContact CB-CH2 3.95Å; N344-W382 HydrophobicContact CB-CZ3 3.33Å; N344-W382 VanDerWaalsContact CG-CZ3 3.45Å; N344-W382 WeakPolarHBondContact ND2-CH2 3.18Å; N344-W382 WeakPolarHBondContact ND2-CZ3 2.85Å
345	C	79.6	Confident	74.9	Confident	8 Å²	8	64.7 Å²	64.7	5%	0.054	32%	0.319	C	S	.	.	S	Bend	trans	-53.5	114.8	179	177.6	0	0	0	0	112.3	A377 C378 C408 C441	C345-A377 PolarHBondContact N-O 2.84Å; C345-C378 WeakPolarHBondContact CB-SG 3.35Å; C345-C408 WeakPolarHBondContact CA-SG 3.3Å; C345-C408 HydrophobicContact CB-CB 3.63Å; C345-C408 WeakPolarHBondContact CB-SG 3.29Å; C345-C408 WeakPolarHBondContact SG-CA 3.45Å; C345-C408 WeakPolarHBondContact SG-CB 3.35Å; C345-C408 CovalentContact SG-SG 2.03Å; C345-C408 PolarHBondContact SG-SG 3.01Å; C345-C441 VanDerWaalsContact CB-SG 3.51Å
346	C	82.3	Confident	76.6	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.02	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	161	-179.4	-123.5	0	0	0	0	111.3	C337 N344 A375	C337-C346 WeakPolarHBondContact CA-SG 3.35Å; C337-C346 HydrophobicContact CB-CB 3.81Å; C337-C346 WeakPolarHBondContact CB-SG 3.22Å; C337-C346 VanDerWaalsContact SG-CA 3.53Å; C337-C346 WeakPolarHBondContact SG-CB 3.46Å; C337-C346 CovalentContact SG-SG 2.03Å; C337-C346 PolarHBondContact SG-SG 3.02Å; N344-C346 PolarHBondContact O-N 3.48Å; N344-C346 VanDerWaalsContact O-N 3.12Å; C346-A375 PolarHBondContact N-O 2.81Å; C346-A375 PolarHBondContact O-N 2.86Å; C346-A375 VanDerWaalsContact O-N 3.11Å
347	L	86.2	Confident	78.3	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	130.3	169	-169.9	76.1	0	0	0	110.2	A334 C337 F338 N372 V436 K437 C439	A334-L347 HydrophobicContact CB-CD2 3.49Å; A334-L347 VanDerWaalsContact CB-CD2 3.49Å; C337-L347 HydrophobicContact CB-CB 4.21Å; C337-L347 VanDerWaalsContact CB-O 3.23Å; C337-L347 WeakPolarHBondContact CB-O 3.34Å; C337-L347 PolarHBondContact SG-N 2.89Å; F338-L347 HydrophobicContact CZ-CD2 4.13Å; L347-N372 HydrophobicContact CD1-CB 3.78Å; L347-N372 HydrophobicContact CD2-CB 4.42Å; L347-N372 HydrophobicContact CG-CB 4.13Å; L347-V436 HydrophobicContact CD1-CB 3.85Å; L347-V436 HydrophobicContact CD1-CG1 3.54Å; L347-K437 WeakPolarHBondContact CD2-O 3.4Å; L347-C439 VanDerWaalsContact CA-SG 3.55Å
348	R	86.4	Confident	79.8	Confident	30 Å²	30	66.9 Å²	66.9	11%	0.113	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.1	178.5	-58.7	-59.8	-178.5	-176.1	0.3	110	M29 Q342 N372 F373 A375	M29-R348 HydrophobicContact CE-CB 4.26Å; M29-R348 HydrophobicContact CE-CG 3.68Å; Q342-R348 PolarHBondContact O-NH2 2.91Å; R348-N372 VanDerWaalsContact O-CA 3.27Å; R348-N372 WeakPolarHBondContact O-CA 3.22Å; R348-N372 WeakPolarHBondContact O-CB 3.48Å; R348-F373 HydrophobicContact CB-CD1 3.74Å; R348-F373 HydrophobicContact CB-CD2 4.3Å; R348-F373 HydrophobicContact CB-CE1 3.27Å; R348-F373 HydrophobicContact CB-CE2 3.94Å; R348-F373 HydrophobicContact CB-CG 4.23Å; R348-F373 HydrophobicContact CB-CZ 3.43Å; R348-F373 VanDerWaalsContact CB-CZ 3.43Å; R348-F373 HydrophobicContact CG-CE1 4.33Å; R348-F373 HydrophobicContact CG-CE2 4.18Å; R348-F373 HydrophobicContact CG-CZ 4.02Å; R348-F373 PolarHBondContact N-O 2.87Å; R348-F373 PolarHBondContact O-N 2.86Å; R348-A375 HydrophobicContact CG-CB 4.12Å
349	P	88.5	Confident	81.4	Confident	78 Å²	78	64.9 Å²	64.9	51%	0.506	32%	0.324	S	S	.	.			trans	-71.4	133.7	-178.5	28.7	-30.5	0	0	0	109.5	F338	F338-P349 HydrophobicContact CD1-CB 4.22Å; F338-P349 HydrophobicContact CD1-CG 4.04Å; F338-P349 HydrophobicContact CE1-CB 3.63Å; F338-P349 HydrophobicContact CE1-CG 3.9Å; F338-P349 HydrophobicContact CZ-CB 4.26Å
350	L	91.1	Very high	83.2	Confident	7 Å²	7	55 Å²	55	4%	0.037	29%	0.286	C	S	.	.			trans	-143.6	111.4	171.6	167.3	58.9	0	0	0	108	M33 R36 I352 N370 A371 N372 F373	M33-L350 HydrophobicContact CE-CB 3.7Å; M33-L350 HydrophobicContact CE-CD1 3.2Å; M33-L350 HydrophobicContact CE-CG 3.9Å; M33-L350 HydrophobicContact SD-CB 3.69Å; M33-L350 HydrophobicContact SD-CD1 3.51Å; M33-L350 VanDerWaalsContact SD-CD1 3.51Å; M33-L350 HydrophobicContact SD-CD2 3.77Å; M33-L350 HydrophobicContact SD-CG 3.8Å; R36-L350 HydrophobicContact CB-CD2 3.98Å; R36-L350 HydrophobicContact CG-CD2 3.54Å; L350-I352 HydrophobicContact CD1-CG1 3.96Å; L350-I352 HydrophobicContact CD2-CD1 4.04Å; L350-I352 HydrophobicContact CD2-CG1 4.17Å; L350-I352 HydrophobicContact CG-CD1 4.25Å; L350-I352 HydrophobicContact CG-CG1 3.85Å; L350-N370 CarbonylContact O-C 3.39Å; L350-N370 WeakPolarHBondContact O-CA 3.47Å; L350-A371 PolarHBondContact O-N 3.5Å; L350-N372 PolarHBondContact N-OD1 2.86Å; L350-N372 PolarHBondContact O-N 2.81Å; L350-F373 HydrophobicContact CB-CD1 3.79Å; L350-F373 HydrophobicContact CB-CE1 4.14Å; L350-F373 HydrophobicContact CD2-CD1 4.3Å
351	Y	93.8	Very high	84.9	Confident	104 Å²	104	57.4 Å²	57.4	41%	0.408	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.1	168.9	-176.2	-96.3	0	0	0	109	D353 G368 Y369 N370	Y351-D353 HydrophobicContact CE1-CB 4.11Å; Y351-G368 WeakPolarHBondContact OH-CA 3.37Å; Y351-Y369 WeakPolarHBondContact CA-O 3.18Å; Y351-N370 WeakPolarHBondContact CD2-OD1 3.34Å
352	I	93.9	Very high	86.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.8	177.6	-59.4	178.9	0	0	0	107.9	I37 I40 L350 D357 L358 G368 Y369 A371	I37-I352 HydrophobicContact CG1-CD1 4.16Å; I37-I352 HydrophobicContact CG1-CG1 4.32Å; I40-I352 HydrophobicContact CB-CD1 4.43Å; I40-I352 HydrophobicContact CD1-CD1 3.22Å; I40-I352 HydrophobicContact CG1-CD1 4.39Å; I40-I352 HydrophobicContact CG2-CD1 4.27Å; L350-I352 HydrophobicContact CD1-CG1 3.96Å; L350-I352 HydrophobicContact CD2-CD1 4.04Å; L350-I352 HydrophobicContact CD2-CG1 4.17Å; L350-I352 HydrophobicContact CG-CD1 4.25Å; L350-I352 HydrophobicContact CG-CG1 3.85Å; I352-D357 HydrophobicContact CG2-CB 4.22Å; I352-L358 HydrophobicContact CG2-CD1 3.97Å; I352-L358 HydrophobicContact CG2-CG 4.31Å; I352-G368 CarbonylContact O-C 3.45Å; I352-G368 WeakPolarHBondContact O-CA 3.45Å; I352-Y369 HydrophobicContact CB-CE1 4.42Å; I352-Y369 PolarHBondContact N-O 3.03Å; I352-Y369 PolarHBondContact O-N 3.42Å; I352-A371 HydrophobicContact CD1-CB 3.64Å; I352-A371 HydrophobicContact CG1-CB 4.14Å
353	D	94.4	Very high	88.2	Confident	39 Å²	39	48.4 Å²	48.4	21%	0.209	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.3	169.4	-176.4	-50.6	0	0	0	108.7	Y351 K355 R356 D357	Y351-D353 HydrophobicContact CE1-CB 4.11Å; D353-K355 PolarHBondContact O-N 2.82Å; D353-K355 WeakPolarHBondContact OD1-CA 3.02Å; D353-K355 WeakPolarHBondContact OD1-CB 3.3Å; D353-K355 PolarHBondContact OD1-N 3.05Å; D353-R356 HydrophobicContact CB-CB 3.98Å; D353-R356 PolarHBondContact OD1-N 3.39Å; D353-D357 PolarHBondContact N-OD2 3.4Å; D353-D357 WeakPolarHBondContact O-CB 3.37Å; D353-D357 PolarHBondContact O-N 2.98Å
354	F	94	Very high	89.5	Confident	2 Å²	2	42 Å²	42	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-61.8	-36.1	-177.5	-69.2	-65.3	0	0	0	112	I44 L358 G359 W360 I363 P366 K367 Y369 L416	I44-F354 HydrophobicContact CD1-CE1 3.79Å; F354-L358 HydrophobicContact CD1-CD1 3.67Å; F354-L358 HydrophobicContact CE1-CD1 4.12Å; F354-L358 CarbonylContact O-C 3.48Å; F354-L358 WeakPolarHBondContact O-CB 3.17Å; F354-L358 PolarHBondContact O-N 3.36Å; F354-G359 PolarHBondContact O-N 3.38Å; F354-G359 VanDerWaalsContact O-N 3.1Å; F354-W360 CarbonylContact C-O 3.51Å; F354-W360 HydrophobicContact CB-CB 4.36Å; F354-W360 HydrophobicContact CD1-CE3 4.05Å; F354-W360 PolarHBondContact O-N 3.37Å; F354-I363 HydrophobicContact CD1-CD1 3.78Å; F354-I363 HydrophobicContact CD2-CB 4.43Å; F354-I363 HydrophobicContact CD2-CG2 4Å; F354-I363 HydrophobicContact CE1-CD1 3.75Å; F354-I363 HydrophobicContact CE2-CG2 4Å; F354-I363 HydrophobicContact CG-CB 4.44Å; F354-I363 HydrophobicContact CG-CD1 4.25Å; F354-I363 HydrophobicContact CG-CG2 4.46Å; F354-I363 HydrophobicContact CZ-CD1 4.17Å; F354-I363 HydrophobicContact CZ-CG2 4.47Å; F354-P366 WeakPolarHBondContact CD2-O 3.06Å; F354-P366 HydrophobicContact CE2-CG 4.25Å; F354-P366 WeakPolarHBondContact CE2-O 3.18Å; F354-K367 WeakPolarHBondContact CD2-O 3.34Å; F354-K367 PolarHBondContact N-O 3.47Å; F354-Y369 HydrophobicContact CE1-CD1 4.36Å; F354-Y369 AromaticContact CE1-CE1 3.99Å; F354-Y369 HydrophobicContact CE1-CE1 3.99Å; F354-Y369 HydrophobicContact CE2-CD1 4.1Å; F354-Y369 AromaticContact CZ-CD1 3.65Å; F354-Y369 HydrophobicContact CZ-CD1 3.65Å; F354-Y369 AromaticContact CZ-CE1 3.67Å; F354-Y369 HydrophobicContact CZ-CE1 3.67Å; F354-L416 HydrophobicContact CZ-CD2 4.16Å
355	K	91.4	Very high	90.3	Very high	145 Å²	145	42.5 Å²	42.5	63%	0.63	21%	0.209	S	C	*	.	H	α-helix	trans	-77.4	-48.3	-178.2	-175.3	179.6	178.8	179.9	0	111.1	D353 G359 W360	D353-K355 PolarHBondContact O-N 2.82Å; D353-K355 WeakPolarHBondContact OD1-CA 3.02Å; D353-K355 WeakPolarHBondContact OD1-CB 3.3Å; D353-K355 PolarHBondContact OD1-N 3.05Å; K355-G359 VanDerWaalsContact O-CA 3.28Å; K355-G359 WeakPolarHBondContact O-CA 3.36Å; K355-G359 PolarHBondContact O-N 3.09Å; K355-W360 WeakPolarHBondContact CA-O 3.32Å; K355-W360 PolarHBondContact N-O 3.37Å
356	R	92.2	Very high	91	Very high	166 Å²	166	43.3 Å²	43.3	63%	0.626	21%	0.214	S	C	*	.	H	α-helix	trans	-76.1	-46	-175.4	-173.5	-172.6	65	-150	-9.6	112.5	D353	D353-R356 HydrophobicContact CB-CB 3.98Å; D353-R356 PolarHBondContact OD1-N 3.39Å
357	D	91.5	Very high	91.5	Very high	50 Å²	50	47.6 Å²	47.6	27%	0.267	23%	0.232	S	C	.	.	H	α-helix	trans	-95.9	-27.9	-167	-53.4	-36.1	0	0	0	112.1	I37 I352 D353	I37-D357 HydrophobicContact CD1-CB 4.49Å; I352-D357 HydrophobicContact CG2-CB 4.22Å; D353-D357 PolarHBondContact N-OD2 3.4Å; D353-D357 WeakPolarHBondContact O-CB 3.37Å; D353-D357 PolarHBondContact O-N 2.98Å
358	L	90.2	Very high	91.9	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.026	24%	0.237	C	C	.	.	S	Bend	trans	-110.3	-11.8	179	-68	166.9	0	0	0	114	I37 R41 I352 F354 W360	I37-L358 HydrophobicContact CG2-CD2 3.79Å; I37-L358 HydrophobicContact CG2-CG 4.36Å; R41-L358 HydrophobicContact CB-CD2 3.67Å; R41-L358 HydrophobicContact CG-CD2 3.87Å; R41-L358 PolarHBondContact NH2-O 3.38Å; I352-L358 HydrophobicContact CG2-CD1 3.97Å; I352-L358 HydrophobicContact CG2-CG 4.31Å; F354-L358 HydrophobicContact CD1-CD1 3.67Å; F354-L358 HydrophobicContact CE1-CD1 4.12Å; F354-L358 CarbonylContact O-C 3.48Å; F354-L358 WeakPolarHBondContact O-CB 3.17Å; F354-L358 PolarHBondContact O-N 3.36Å; L358-W360 HydrophobicContact CB-CB 4.4Å; L358-W360 HydrophobicContact CB-CD2 3.88Å; L358-W360 HydrophobicContact CB-CE3 4.19Å; L358-W360 HydrophobicContact CB-CG 3.97Å; L358-W360 HydrophobicContact CD1-CD2 4.41Å; L358-W360 HydrophobicContact CD1-CE3 3.89Å; L358-W360 HydrophobicContact CD1-CZ3 3.99Å; L358-W360 PolarHBondContact O-N 3.25Å
359	G	90.3	Very high	92.2	Very high	58 Å²	58	47.2 Å²	47.2	60%	0.598	23%	0.234	S	C	*	.			trans	68.3	20.4	-175.8	0	0	0	0	0	113.4	F354 K355	F354-G359 PolarHBondContact O-N 3.38Å; F354-G359 VanDerWaalsContact O-N 3.1Å; K355-G359 VanDerWaalsContact O-CA 3.28Å; K355-G359 WeakPolarHBondContact O-CA 3.36Å; K355-G359 PolarHBondContact O-N 3.09Å
360	W	92.5	Very high	92.5	Very high	8 Å²	8	48 Å²	48	3%	0.03	23%	0.234	C	C	.	.			trans	-98.4	126.4	-174.2	-68.9	-7.7	0	0	0	111.4	R41 I44 L45 F354 K355 L358 W362 I363	R41-W360 HydrophobicContact CB-CZ2 4.45Å; R41-W360 HydrophobicContact CG-CH2 3.9Å; R41-W360 HydrophobicContact CG-CZ2 3.42Å; R41-W360 VanDerWaalsContact CG-CZ2 3.42Å; I44-W360 HydrophobicContact CB-CH2 3.98Å; I44-W360 HydrophobicContact CB-CZ3 3.93Å; I44-W360 HydrophobicContact CD1-CH2 4.42Å; I44-W360 HydrophobicContact CD1-CZ3 3.74Å; I44-W360 HydrophobicContact CG1-CZ3 4.43Å; I44-W360 HydrophobicContact CG2-CH2 4.07Å; I44-W360 HydrophobicContact CG2-CZ3 3.75Å; L45-W360 HydrophobicContact CD1-CZ2 4.11Å; L45-W360 HydrophobicContact CD2-CH2 4.34Å; L45-W360 HydrophobicContact CD2-CZ2 4.19Å; L45-W360 HydrophobicContact CG-CH2 4.02Å; L45-W360 HydrophobicContact CG-CZ2 3.96Å; F354-W360 CarbonylContact C-O 3.51Å; F354-W360 HydrophobicContact CB-CB 4.36Å; F354-W360 HydrophobicContact CD1-CE3 4.05Å; F354-W360 PolarHBondContact O-N 3.37Å; K355-W360 WeakPolarHBondContact CA-O 3.32Å; K355-W360 PolarHBondContact N-O 3.37Å; L358-W360 HydrophobicContact CB-CB 4.4Å; L358-W360 HydrophobicContact CB-CD2 3.88Å; L358-W360 HydrophobicContact CB-CE3 4.19Å; L358-W360 HydrophobicContact CB-CG 3.97Å; L358-W360 HydrophobicContact CD1-CD2 4.41Å; L358-W360 HydrophobicContact CD1-CE3 3.89Å; L358-W360 HydrophobicContact CD1-CZ3 3.99Å; L358-W360 PolarHBondContact O-N 3.25Å; W360-W362 AromaticContact CD1-NE1 3.59Å; W360-W362 HydrophobicContact CD2-CZ2 4.03Å; W360-W362 AromaticContact CD2-NE1 3.44Å; W360-W362 AromaticContact CE2-NE1 3.9Å; W360-W362 AromaticContact CE3-CZ2 3.75Å; W360-W362 HydrophobicContact CE3-CZ2 3.75Å; W360-W362 AromaticContact CE3-NE1 3.97Å; W360-W362 AromaticContact CG-CD1 3.93Å; W360-W362 AromaticContact CG-NE1 3.23Å; W360-W362 HydrophobicContact CH2-CZ2 4.25Å; W360-W362 HydrophobicContact CZ2-CZ2 4.48Å; W360-W362 AromaticContact CZ3-CZ2 3.88Å; W360-W362 HydrophobicContact CZ3-CZ2 3.88Å; W360-W362 AromaticContact NE1-NE1 3.95Å; W360-I363 HydrophobicContact CE3-CD1 3.68Å; W360-I363 HydrophobicContact CZ3-CD1 4.02Å
361	K	90.4	Very high	92.6	Very high	121 Å²	121	47.6 Å²	47.6	53%	0.526	23%	0.232	S	C	.	.			trans	-111.7	-9.9	173.3	-58.9	178.6	-177.3	178	0	113.3	Y57 I363	Y57-K361 HydrophobicContact CE2-CB 3.84Å; K361-I363 VanDerWaalsContact C-N 3.35Å
362	W	91.3	Very high	92.5	Very high	3 Å²	3	43.3 Å²	43.3	1%	0.011	22%	0.216	C	C	.	.	S	Bend	trans	-80.8	-13.4	-176.4	65.3	-90.8	0	0	0	113.7	I44 L45 L48 L50 P54 Y57 W360 H364 Y420	I44-W362 HydrophobicContact CG2-CH2 4.26Å; L45-W362 HydrophobicContact CD2-CZ2 4.36Å; L48-W362 HydrophobicContact CD1-CH2 3.52Å; L48-W362 HydrophobicContact CD1-CZ3 3.91Å; L50-W362 HydrophobicContact CD1-CH2 4.4Å; L50-W362 HydrophobicContact CD1-CZ3 4.42Å; P54-W362 HydrophobicContact CG-CD2 4.22Å; P54-W362 HydrophobicContact CG-CE3 3.96Å; Y57-W362 HydrophobicContact CD1-CB 3.6Å; Y57-W362 HydrophobicContact CD2-CB 4.04Å; Y57-W362 HydrophobicContact CE1-CB 3.74Å; Y57-W362 HydrophobicContact CE2-CB 4.14Å; Y57-W362 HydrophobicContact CG-CB 3.77Å; W360-W362 AromaticContact CD1-NE1 3.59Å; W360-W362 HydrophobicContact CD2-CZ2 4.03Å; W360-W362 AromaticContact CD2-NE1 3.44Å; W360-W362 AromaticContact CE2-NE1 3.9Å; W360-W362 AromaticContact CE3-CZ2 3.75Å; W360-W362 HydrophobicContact CE3-CZ2 3.75Å; W360-W362 AromaticContact CE3-NE1 3.97Å; W360-W362 AromaticContact CG-CD1 3.93Å; W360-W362 AromaticContact CG-NE1 3.23Å; W360-W362 HydrophobicContact CH2-CZ2 4.25Å; W360-W362 HydrophobicContact CZ2-CZ2 4.48Å; W360-W362 AromaticContact CZ3-CZ2 3.88Å; W360-W362 HydrophobicContact CZ3-CZ2 3.88Å; W360-W362 AromaticContact NE1-NE1 3.95Å; W362-H364 PolarHBondContact O-CE1 3.22Å; W362-H364 PolarHBondContact O-ND1 3.31Å; W362-H364 VanDerWaalsContact O-ND1 3.17Å; W362-Y420 AromaticContact CE3-CD2 3.99Å; W362-Y420 HydrophobicContact CE3-CD2 3.99Å; W362-Y420 HydrophobicContact CE3-CG 4.16Å; W362-Y420 AromaticContact CZ3-CD2 3.68Å; W362-Y420 HydrophobicContact CZ3-CD2 3.68Å; W362-Y420 HydrophobicContact CZ3-CE2 4.43Å; W362-Y420 AromaticContact CZ3-CG 3.78Å; W362-Y420 HydrophobicContact CZ3-CG 3.78Å; W362-Y420 WeakPolarHBondContact O-CB 3.47Å
363	I	92.8	Very high	92.3	Very high	6 Å²	6	44 Å²	44	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	113.1	167.4	-60.7	-178.5	0	0	0	107.2	I44 F354 W360 K361 I418	I44-I363 HydrophobicContact CG2-CD1 4.47Å; F354-I363 HydrophobicContact CD1-CD1 3.78Å; F354-I363 HydrophobicContact CD2-CB 4.43Å; F354-I363 HydrophobicContact CD2-CG2 4Å; F354-I363 HydrophobicContact CE1-CD1 3.75Å; F354-I363 HydrophobicContact CE2-CG2 4Å; F354-I363 HydrophobicContact CG-CB 4.44Å; F354-I363 HydrophobicContact CG-CD1 4.25Å; F354-I363 HydrophobicContact CG-CG2 4.46Å; F354-I363 HydrophobicContact CZ-CD1 4.17Å; F354-I363 HydrophobicContact CZ-CG2 4.47Å; W360-I363 HydrophobicContact CE3-CD1 3.68Å; W360-I363 HydrophobicContact CZ3-CD1 4.02Å; K361-I363 VanDerWaalsContact C-N 3.35Å; I363-I418 HydrophobicContact CG2-CB 4.43Å
364	H	91.9	Very high	91.9	Very high	3 Å²	3	43.2 Å²	43.2	1%	0.014	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-44	-175.5	-63.5	76	0	0	0	111.4	P58 V63 W362 K367 L419 Y421	P58-H364 PolarHBondContact O-NE2 2.9Å; V63-H364 HydrophobicContact CG2-CB 4.39Å; V63-H364 WeakPolarHBondContact CG2-CD2 2.99Å; W362-H364 PolarHBondContact O-CE1 3.22Å; W362-H364 PolarHBondContact O-ND1 3.31Å; W362-H364 VanDerWaalsContact O-ND1 3.17Å; H364-K367 WeakPolarHBondContact O-CD 3.35Å; H364-K367 WeakPolarHBondContact O-CE 3.32Å; H364-K367 PolarHBondContact O-NZ 2.91Å; H364-L419 HydrophobicContact CB-CD2 4.28Å; H364-L419 HydrophobicContact CB-CG 4.29Å; H364-L419 PolarHBondContact N-O 3.29Å; H364-Y421 AromaticContact CE1-CD2 3.54Å; H364-Y421 AromaticContact ND1-CD2 3.63Å
365	E	91.6	Very high	91.5	Very high	56 Å²	56	43.5 Å²	43.5	26%	0.262	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	141.4	175.9	-69.4	-59.7	146.2	0	0	112.1	Y71 K367 I418 L419	Y71-E365 HydrophobicContact CD1-CB 4Å; Y71-E365 HydrophobicContact CD1-CG 4.38Å; Y71-E365 HydrophobicContact CE1-CB 3.64Å; Y71-E365 HydrophobicContact CE1-CG 4.31Å; Y71-E365 HydrophobicContact CE2-CB 4.17Å; Y71-E365 HydrophobicContact CG-CB 4.42Å; E365-K367 IonicContact OE1-NZ 3.83Å; E365-I418 CarbonylContact O-C 3.46Å; E365-I418 VanDerWaalsContact O-CA 3.25Å; E365-I418 WeakPolarHBondContact O-CA 3.3Å; E365-L419 HydrophobicContact CB-CB 4.05Å; E365-L419 HydrophobicContact CB-CD2 4.45Å; E365-L419 HydrophobicContact CG-CD2 4.42Å; E365-L419 PolarHBondContact N-O 3.41Å; E365-L419 PolarHBondContact O-N 3.3Å
366	P	94.3	Very high	90.9	Very high	24 Å²	24	38.3 Å²	38.3	16%	0.156	21%	0.207	C	C	.	.			cis	-73.9	164.2	-11.4	32.7	-32	0	0	0	111.2	F354 G368 L416 T417	F354-P366 WeakPolarHBondContact CD2-O 3.06Å; F354-P366 HydrophobicContact CE2-CG 4.25Å; F354-P366 WeakPolarHBondContact CE2-O 3.18Å; P366-G368 PolarHBondContact O-N 3.43Å; P366-L416 HydrophobicContact CG-CD1 4.09Å; P366-T417 WeakPolarHBondContact CD-O 3.26Å
367	K	92.4	Very high	90.2	Very high	94 Å²	94	33.1 Å²	33.1	41%	0.409	20%	0.199	S	C	.	.	S	Bend	trans	-68.9	-23.6	174.1	-57.7	-55.1	-178.1	-164	0	113.8	F354 H364 E365	F354-K367 WeakPolarHBondContact CD2-O 3.34Å; F354-K367 PolarHBondContact N-O 3.47Å; H364-K367 WeakPolarHBondContact O-CD 3.35Å; H364-K367 WeakPolarHBondContact O-CE 3.32Å; H364-K367 PolarHBondContact O-NZ 2.91Å; E365-K367 IonicContact OE1-NZ 3.83Å
368	G	94.1	Very high	89.3	Confident	11 Å²	11	31.4 Å²	31.4	11%	0.113	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	169.3	176	0	0	0	0	0	110.7	Y351 I352 P366	Y351-G368 WeakPolarHBondContact OH-CA 3.37Å; I352-G368 CarbonylContact O-C 3.45Å; I352-G368 WeakPolarHBondContact O-CA 3.45Å; P366-G368 PolarHBondContact O-N 3.43Å
369	Y	94.8	Very high	88.2	Confident	11 Å²	11	33.6 Å²	33.6	4%	0.043	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	159.2	-176.4	73.6	-74.9	0	0	0	112.4	I40 Y351 I352 F354 A371 L416 M434 I435	I40-Y369 VanDerWaalsContact CG2-OH 3.23Å; I40-Y369 WeakPolarHBondContact CG2-OH 3.36Å; Y351-Y369 WeakPolarHBondContact CA-O 3.18Å; I352-Y369 HydrophobicContact CB-CE1 4.42Å; I352-Y369 PolarHBondContact N-O 3.03Å; I352-Y369 PolarHBondContact O-N 3.42Å; F354-Y369 HydrophobicContact CE1-CD1 4.36Å; F354-Y369 AromaticContact CE1-CE1 3.99Å; F354-Y369 HydrophobicContact CE1-CE1 3.99Å; F354-Y369 HydrophobicContact CE2-CD1 4.1Å; F354-Y369 AromaticContact CZ-CD1 3.65Å; F354-Y369 HydrophobicContact CZ-CD1 3.65Å; F354-Y369 AromaticContact CZ-CE1 3.67Å; F354-Y369 HydrophobicContact CZ-CE1 3.67Å; Y369-A371 HydrophobicContact CD2-CB 4.18Å; Y369-A371 HydrophobicContact CE2-CB 3.51Å; Y369-A371 PolarHBondContact O-N 3.21Å; Y369-L416 HydrophobicContact CD1-CD2 3.67Å; Y369-L416 HydrophobicContact CD2-CD1 4.18Å; Y369-L416 HydrophobicContact CD2-CD2 4.03Å; Y369-L416 HydrophobicContact CE1-CD2 3.69Å; Y369-L416 HydrophobicContact CE2-CD2 4.01Å; Y369-L416 HydrophobicContact CG-CD1 3.97Å; Y369-L416 HydrophobicContact CG-CD2 3.85Å; Y369-M434 HydrophobicContact CE2-CB 4.39Å; Y369-M434 WeakPolarHBondContact OH-CE 3.39Å; Y369-I435 HydrophobicContact CD2-CD1 4.31Å; Y369-I435 HydrophobicContact CD2-CG1 3.77Å; Y369-I435 HydrophobicContact CE2-CG1 4.02Å
370	N	93.8	Very high	86.7	Confident	94 Å²	94	32.8 Å²	32.8	50%	0.503	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	90.3	174.9	-67.8	-51.6	0	0	0	109.8	L350 Y351 I435	L350-N370 CarbonylContact O-C 3.39Å; L350-N370 WeakPolarHBondContact O-CA 3.47Å; Y351-N370 WeakPolarHBondContact CD2-OD1 3.34Å; N370-I435 WeakPolarHBondContact O-CG2 2.83Å
371	A	92.2	Very high	84.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.224	C	C	.	.			trans	-69.8	-37.3	178.6	0	0	0	0	0	112.3	I40 L350 I352 Y369 V436	I40-A371 HydrophobicContact CD1-CB 3.61Å; L350-A371 PolarHBondContact O-N 3.5Å; I352-A371 HydrophobicContact CD1-CB 3.64Å; I352-A371 HydrophobicContact CG1-CB 4.14Å; Y369-A371 HydrophobicContact CD2-CB 4.18Å; Y369-A371 HydrophobicContact CE2-CB 3.51Å; Y369-A371 PolarHBondContact O-N 3.21Å; A371-V436 PolarHBondContact O-N 3Å
372	N	92.1	Very high	83.1	Confident	14 Å²	14	40.2 Å²	40.2	8%	0.075	22%	0.221	C	C	.	.			trans	53.9	169.6	-171	-52.4	-33.3	0	0	0	113.2	R36 L347 R348 L350 V436	R36-N372 PolarHBondContact NE-O 3.16Å; L347-N372 HydrophobicContact CD1-CB 3.78Å; L347-N372 HydrophobicContact CD2-CB 4.42Å; L347-N372 HydrophobicContact CG-CB 4.13Å; R348-N372 VanDerWaalsContact O-CA 3.27Å; R348-N372 WeakPolarHBondContact O-CA 3.22Å; R348-N372 WeakPolarHBondContact O-CB 3.48Å; L350-N372 PolarHBondContact N-OD1 2.86Å; L350-N372 PolarHBondContact O-N 2.81Å; N372-V436 HydrophobicContact CB-CB 4.18Å; N372-V436 PolarHBondContact ND2-O 3.03Å
373	F	89.9	Confident	81.1	Confident	13 Å²	13	40.3 Å²	40.3	6%	0.057	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	161.6	174.2	67.2	-71.4	0	0	0	111.1	M29 F32 M33 R36 R348 L350 A375	M29-F373 HydrophobicContact CE-CE2 4.05Å; M29-F373 HydrophobicContact CE-CZ 3.72Å; F32-F373 HydrophobicContact CB-CD2 4.33Å; F32-F373 HydrophobicContact CB-CE2 3.87Å; M33-F373 HydrophobicContact CE-CE1 4.07Å; M33-F373 HydrophobicContact CG-CE1 4.2Å; M33-F373 HydrophobicContact CG-CZ 4.09Å; M33-F373 HydrophobicContact SD-CD1 3.66Å; M33-F373 HydrophobicContact SD-CE1 3.02Å; M33-F373 WeakPolarHBondContact SD-CE1 3.21Å; M33-F373 HydrophobicContact SD-CE2 4.49Å; M33-F373 HydrophobicContact SD-CZ 3.5Å; M33-F373 VanDerWaalsContact SD-CZ 3.5Å; R36-F373 HydrophobicContact CG-CB 4.18Å; R348-F373 HydrophobicContact CB-CD1 3.74Å; R348-F373 HydrophobicContact CB-CD2 4.3Å; R348-F373 HydrophobicContact CB-CE1 3.27Å; R348-F373 HydrophobicContact CB-CE2 3.94Å; R348-F373 HydrophobicContact CB-CG 4.23Å; R348-F373 HydrophobicContact CB-CZ 3.43Å; R348-F373 VanDerWaalsContact CB-CZ 3.43Å; R348-F373 HydrophobicContact CG-CE1 4.33Å; R348-F373 HydrophobicContact CG-CE2 4.18Å; R348-F373 HydrophobicContact CG-CZ 4.02Å; R348-F373 PolarHBondContact N-O 2.87Å; R348-F373 PolarHBondContact O-N 2.86Å; L350-F373 HydrophobicContact CB-CD1 3.79Å; L350-F373 HydrophobicContact CB-CE1 4.14Å; L350-F373 HydrophobicContact CD2-CD1 4.3Å; F373-A375 HydrophobicContact CD2-CB 3.94Å; F373-A375 HydrophobicContact CE2-CB 3.65Å
374	C	86.8	Confident	79.2	Confident	24 Å²	24	43.5 Å²	43.5	16%	0.162	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.7	176.1	-62.9	0	0	0	0	109.7	C439	C374-C439 WeakPolarHBondContact CA-SG 3.45Å; C374-C439 HydrophobicContact CB-CB 3.76Å; C374-C439 WeakPolarHBondContact CB-SG 3.47Å; C374-C439 VanDerWaalsContact SG-CA 3.54Å; C374-C439 WeakPolarHBondContact SG-CB 3.46Å; C374-C439 CovalentContact SG-SG 2.03Å; C374-C439 PolarHBondContact SG-SG 3.02Å
375	A	85.3	Confident	77.3	Confident	7 Å²	7	47.4 Å²	47.4	6%	0.058	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	149.2	175.1	0	0	0	0	0	111.5	M29 C346 R348 F373	M29-A375 HydrophobicContact CE-CB 4.38Å; M29-A375 HydrophobicContact SD-CB 4.3Å; C346-A375 PolarHBondContact N-O 2.81Å; C346-A375 PolarHBondContact O-N 2.86Å; C346-A375 VanDerWaalsContact O-N 3.11Å; R348-A375 HydrophobicContact CG-CB 4.12Å; F373-A375 HydrophobicContact CD2-CB 3.94Å; F373-A375 HydrophobicContact CE2-CB 3.65Å
376	G	79.7	Confident	75.5	Confident	37 Å²	37	47.8 Å²	47.8	38%	0.381	27%	0.272	S	S	.	.	S	Bend	trans	131.8	166.4	178.4	0	0	0	0	0	112.4
377	A	75.8	Confident	73.5	Confident	56 Å²	56	55 Å²	55	46%	0.463	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-72	142.4	179.7	0	0	0	0	0	111.6	D343 N344 C345 P379	D343-A377 WeakPolarHBondContact O-CB 3.48Å; D343-A377 PolarHBondContact O-N 2.84Å; N344-A377 CarbonylContact C-O 3.57Å; N344-A377 VanDerWaalsContact CA-O 3.27Å; N344-A377 WeakPolarHBondContact CA-O 3.19Å; C345-A377 PolarHBondContact N-O 2.84Å; A377-P379 WeakPolarHBondContact O-CD 3.41Å
378	C	73	Confident	71.8	Confident	15 Å²	15	57.4 Å²	57.4	10%	0.101	32%	0.316	C	S	.	.			trans	-112.5	94.6	172.4	-79.1	0	0	0	0	109.1	C345 P406 C441	C345-C378 WeakPolarHBondContact CB-SG 3.35Å; C378-P406 HydrophobicContact CB-CB 4.16Å; C378-P406 HydrophobicContact CB-CG 3.77Å; C378-P406 VanDerWaalsContact CB-O 3.32Å; C378-P406 WeakPolarHBondContact CB-O 3.31Å; C378-P406 VanDerWaalsContact O-CG 3.29Å; C378-P406 WeakPolarHBondContact O-CG 3.46Å; C378-C441 VanDerWaalsContact CA-SG 3.57Å; C378-C441 HydrophobicContact CB-CB 3.63Å; C378-C441 WeakPolarHBondContact CB-SG 3.48Å; C378-C441 WeakPolarHBondContact SG-CA 3.42Å; C378-C441 WeakPolarHBondContact SG-CB 3.43Å; C378-C441 CovalentContact SG-SG 2.04Å; C378-C441 PolarHBondContact SG-SG 2.95Å
379	P	67.6	Low	69.8	Low	50 Å²	50	57.1 Å²	57.1	33%	0.325	31%	0.312	S	S	.	.			trans	-67.1	143.6	170.6	26.6	-31.5	0	0	0	110.1	A377 L381 W382	A377-P379 WeakPolarHBondContact O-CD 3.41Å; P379-L381 PolarHBondContact O-N 3.44Å; P379-W382 HydrophobicContact CG-CD2 4.02Å; P379-W382 HydrophobicContact CG-CE3 4.27Å; P379-W382 HydrophobicContact CG-CG 4.18Å; P379-W382 PolarHBondContact O-N 2.99Å
380	Y	58.7	Low	67.9	Low	41 Å²	41	63 Å²	63	16%	0.161	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-58.8	-20.2	-173.9	-73.5	-83.4	0	0	0	115.7	W382 S383 L392 N396 S403 A404 S405 P406	Y380-W382 PolarHBondContact O-N 2.91Å; Y380-S383 PolarHBondContact O-OG 2.92Å; Y380-L392 HydrophobicContact CE1-CB 4.4Å; Y380-L392 HydrophobicContact CE1-CD2 4.07Å; Y380-N396 WeakPolarHBondContact CD1-ND2 3.47Å; Y380-N396 HydrophobicContact CD2-CB 4.26Å; Y380-N396 VanDerWaalsContact CD2-ND2 3.3Å; Y380-N396 WeakPolarHBondContact CD2-ND2 3.41Å; Y380-N396 WeakPolarHBondContact CD2-OD1 3.42Å; Y380-N396 WeakPolarHBondContact CE1-ND2 3.38Å; Y380-N396 HydrophobicContact CE2-CB 4.47Å; Y380-N396 WeakPolarHBondContact CE2-ND2 3.39Å; Y380-N396 WeakPolarHBondContact CE2-OD1 3.2Å; Y380-N396 HydrophobicContact CG-CB 4.42Å; Y380-N396 VanDerWaalsContact CZ-CG 3.42Å; Y380-N396 VanDerWaalsContact CZ-OD1 3.25Å; Y380-N396 PolarHBondContact OH-ND2 2.92Å; Y380-N396 PolarHBondContact OH-OD1 3.13Å; Y380-S403 WeakPolarHBondContact OH-CB 3.34Å; Y380-S403 PolarHBondContact OH-O 2.94Å; Y380-S403 PolarHBondContact OH-OG 2.84Å; Y380-A404 WeakPolarHBondContact CE1-O 3.15Å; Y380-A404 PolarHBondContact OH-N 2.86Å; Y380-A404 PolarHBondContact OH-O 2.82Å; Y380-S405 VanDerWaalsContact CZ-CA 3.46Å; Y380-S405 VanDerWaalsContact OH-CA 3.22Å; Y380-S405 WeakPolarHBondContact OH-CA 3.4Å; Y380-S405 PolarHBondContact OH-N 2.99Å; Y380-P406 HydrophobicContact CD1-CG 4.21Å; Y380-P406 HydrophobicContact CE1-CG 4.44Å
381	L	53.6	Low	66.2	Low	165 Å²	165	63 Å²	63	86%	0.864	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-72	-12	175.6	-74.1	153.2	0	0	0	112.9	P379	P379-L381 PolarHBondContact O-N 3.44Å
382	W	53.3	Low	64.4	Low	121 Å²	121	65.7 Å²	65.7	46%	0.458	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-107.8	-2.8	-176.1	-68.2	6.2	0	0	0	114.1	N344 P379 Y380	N344-W382 HydrophobicContact CB-CE3 4.15Å; N344-W382 HydrophobicContact CB-CH2 3.95Å; N344-W382 HydrophobicContact CB-CZ3 3.33Å; N344-W382 VanDerWaalsContact CG-CZ3 3.45Å; N344-W382 WeakPolarHBondContact ND2-CH2 3.18Å; N344-W382 WeakPolarHBondContact ND2-CZ3 2.85Å; P379-W382 HydrophobicContact CG-CD2 4.02Å; P379-W382 HydrophobicContact CG-CE3 4.27Å; P379-W382 HydrophobicContact CG-CG 4.18Å; P379-W382 PolarHBondContact O-N 2.99Å; Y380-W382 PolarHBondContact O-N 2.91Å
383	S	49.8	Very low	62.6	Low	5 Å²	5	66.8 Å²	66.8	4%	0.035	36%	0.361	C	S	.	.			trans	-100.2	82.5	175.9	59.1	0	0	0	0	111.6	Y380 S389	Y380-S383 PolarHBondContact O-OG 2.92Å; S383-S389 WeakPolarHBondContact O-CB 3.41Å; S383-S389 PolarHBondContact O-OG 2.76Å
384	S	53	Low	61.1	Low	72 Å²	72	71.7 Å²	71.7	50%	0.503	39%	0.387	S	S	.	.			trans	-103.6	15.5	178.5	65.8	0	0	0	0	114.6
385	D	51.3	Low	59.6	Low	85 Å²	85	76.1 Å²	76.1	46%	0.455	40%	0.401	S	S	.	.	S	Bend	trans	-86	-22.4	-163.8	-153.3	26	0	0	0	114.3	S389 K440	D385-S389 PolarHBondContact N-OG 2.71Å; D385-K440 WeakPolarHBondContact OD2-CD 3.42Å; D385-K440 WeakPolarHBondContact OD2-CE 3.48Å; D385-K440 IonicContact OD2-NZ 3.94Å; D385-K440 PolarHBondContact OD2-NZ 2.89Å
386	T	53.7	Low	58.1	Low	65 Å²	65	77 Å²	77	40%	0.399	41%	0.405	S	S	.	.	S	Bend	trans	-126.9	155.4	177.3	67.6	0	0	0	0	112.3	H388 S389 R390	T386-H388 PolarHBondContact O-N 3.44Å; T386-H388 VanDerWaalsContact O-N 3.16Å; T386-S389 PolarHBondContact N-OG 3.12Å; T386-S389 PolarHBondContact O-N 2.85Å; T386-S389 PolarHBondContact O-OG 2.83Å; T386-S389 PolarHBondContact OG1-N 2.78Å; T386-R390 PolarHBondContact O-N 3.48Å
387	Q	53.2	Low	57.2	Low	175 Å²	175	81 Å²	81	82%	0.818	42%	0.422	S	S	*	.	H	α-helix	trans	-54.8	-33.1	174.2	-72.1	-178.6	-15.3	0	0	111.5
388	H	55.3	Low	56.6	Low	144 Å²	144	84.8 Å²	84.8	67%	0.667	43%	0.433	S	S	*	.	H	α-helix	trans	-70	-37.3	175.7	-67.9	-74.7	0	0	0	113.2	T386 R390 V391 L392	T386-H388 PolarHBondContact O-N 3.44Å; T386-H388 VanDerWaalsContact O-N 3.16Å; H388-R390 VanDerWaalsContact C-N 3.34Å; H388-R390 PolarHBondContact O-N 2.85Å; H388-V391 PolarHBondContact O-N 3.03Å; H388-L392 VanDerWaalsContact O-CD1 3.23Å; H388-L392 WeakPolarHBondContact O-CD1 3.23Å; H388-L392 PolarHBondContact O-N 2.72Å
389	S	52.6	Low	55.8	Low	5 Å²	5	87.4 Å²	87.4	4%	0.035	45%	0.446	C	S	.	.	H	α-helix	trans	-69	-31.1	-177.5	75.8	0	0	0	0	112.9	S383 D385 T386 L392 S393	S383-S389 WeakPolarHBondContact O-CB 3.41Å; S383-S389 PolarHBondContact O-OG 2.76Å; D385-S389 PolarHBondContact N-OG 2.71Å; T386-S389 PolarHBondContact N-OG 3.12Å; T386-S389 PolarHBondContact O-N 2.85Å; T386-S389 PolarHBondContact O-OG 2.83Å; T386-S389 PolarHBondContact OG1-N 2.78Å; S389-L392 PolarHBondContact O-N 3.06Å; S389-S393 PolarHBondContact O-N 2.84Å
390	R	55.8	Low	55.4	Low	136 Å²	136	89.6 Å²	89.6	51%	0.513	46%	0.46	S	S	.	.	H	α-helix	trans	-66.3	-44	171.4	-69.6	-176.3	-178.3	169.7	-0.9	112.2	Y98 T386 H388 S393 L394	Y98-R390 PolarHBondContact OH-NH2 3.37Å; T386-R390 PolarHBondContact O-N 3.48Å; H388-R390 VanDerWaalsContact C-N 3.34Å; H388-R390 PolarHBondContact O-N 2.85Å; R390-S393 PolarHBondContact O-N 3.26Å; R390-S393 PolarHBondContact O-OG 2.55Å; R390-L394 PolarHBondContact O-N 2.88Å
391	V	57.7	Low	55.2	Low	92 Å²	92	96.9 Å²	96.9	56%	0.558	50%	0.496	S	S	*	.	H	α-helix	trans	-65.5	-40.1	176.8	177.7	0	0	0	0	110.6	H388 S393 L394 Y395	H388-V391 PolarHBondContact O-N 3.03Å; V391-S393 PolarHBondContact O-N 3.16Å; V391-L394 PolarHBondContact O-N 3.27Å; V391-Y395 WeakPolarHBondContact O-CB 3.3Å; V391-Y395 PolarHBondContact O-N 2.77Å
392	L	53.3	Low	55.1	Low	57 Å²	57	92 Å²	92	30%	0.298	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-38.7	173.9	-98.1	94.9	0	0	0	113	Y380 H388 S389 L394 Y395 N396 A404	Y380-L392 HydrophobicContact CE1-CB 4.4Å; Y380-L392 HydrophobicContact CE1-CD2 4.07Å; H388-L392 VanDerWaalsContact O-CD1 3.23Å; H388-L392 WeakPolarHBondContact O-CD1 3.23Å; H388-L392 PolarHBondContact O-N 2.72Å; S389-L392 PolarHBondContact O-N 3.06Å; L392-L394 VanDerWaalsContact C-N 3.3Å; L392-L394 PolarHBondContact O-N 2.92Å; L392-Y395 PolarHBondContact O-N 2.81Å; L392-N396 PolarHBondContact O-N 3.31Å; L392-N396 PolarHBondContact O-ND2 2.78Å; L392-A404 HydrophobicContact CD2-CB 4.14Å; L392-A404 WeakPolarHBondContact CD2-O 3.31Å
393	S	54.7	Low	55.2	Low	38 Å²	38	87.3 Å²	87.3	27%	0.266	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-38	177.1	76	0	0	0	0	112.4	S389 R390 V391 T397	S389-S393 PolarHBondContact O-N 2.84Å; R390-S393 PolarHBondContact O-N 3.26Å; R390-S393 PolarHBondContact O-OG 2.55Å; V391-S393 PolarHBondContact O-N 3.16Å; S393-T397 PolarHBondContact O-OG1 3.11Å
394	L	58.8	Low	55.6	Low	116 Å²	116	90.5 Å²	90.5	61%	0.607	49%	0.492	S	S	*	.	H	α-helix	trans	-70.8	-41.3	173.2	-70.5	165.1	0	0	0	111.3	R390 V391 L392 N396 T397	R390-L394 PolarHBondContact O-N 2.88Å; V391-L394 PolarHBondContact O-N 3.27Å; L392-L394 VanDerWaalsContact C-N 3.3Å; L392-L394 PolarHBondContact O-N 2.92Å; L394-N396 VanDerWaalsContact C-N 3.3Å; L394-N396 PolarHBondContact O-N 3.46Å; L394-T397 WeakPolarHBondContact O-CB 3.28Å; L394-T397 PolarHBondContact O-N 3.09Å
395	Y	55.3	Low	56	Low	117 Å²	117	91.1 Å²	91.1	46%	0.459	50%	0.496	S	S	.	.	H	α-helix	trans	-64.2	-31.8	-179.5	-154.4	-99.6	0	0	0	112.8	V391 L392 T397 I398 N399	V391-Y395 WeakPolarHBondContact O-CB 3.3Å; V391-Y395 PolarHBondContact O-N 2.77Å; L392-Y395 PolarHBondContact O-N 2.81Å; Y395-T397 VanDerWaalsContact C-N 3.28Å; Y395-T397 PolarHBondContact O-N 2.92Å; Y395-I398 PolarHBondContact O-N 3.32Å; Y395-I398 VanDerWaalsContact O-N 3.09Å; Y395-N399 PolarHBondContact O-N 2.82Å
396	N	54.6	Low	56.9	Low	25 Å²	25	87.8 Å²	87.8	13%	0.134	48%	0.479	C	S	.	.	H	α-helix	trans	-63.4	-31.5	171.2	-85.7	-79.8	0	0	0	114.6	Y380 L392 L394 I398 S403	Y380-N396 WeakPolarHBondContact CD1-ND2 3.47Å; Y380-N396 HydrophobicContact CD2-CB 4.26Å; Y380-N396 VanDerWaalsContact CD2-ND2 3.3Å; Y380-N396 WeakPolarHBondContact CD2-ND2 3.41Å; Y380-N396 WeakPolarHBondContact CD2-OD1 3.42Å; Y380-N396 WeakPolarHBondContact CE1-ND2 3.38Å; Y380-N396 HydrophobicContact CE2-CB 4.47Å; Y380-N396 WeakPolarHBondContact CE2-ND2 3.39Å; Y380-N396 WeakPolarHBondContact CE2-OD1 3.2Å; Y380-N396 HydrophobicContact CG-CB 4.42Å; Y380-N396 VanDerWaalsContact CZ-CG 3.42Å; Y380-N396 VanDerWaalsContact CZ-OD1 3.25Å; Y380-N396 PolarHBondContact OH-ND2 2.92Å; Y380-N396 PolarHBondContact OH-OD1 3.13Å; L392-N396 PolarHBondContact O-N 3.31Å; L392-N396 PolarHBondContact O-ND2 2.78Å; L394-N396 VanDerWaalsContact C-N 3.3Å; L394-N396 PolarHBondContact O-N 3.46Å; N396-I398 PolarHBondContact O-N 2.92Å; N396-S403 WeakPolarHBondContact ND2-CB 3.28Å; N396-S403 PolarHBondContact ND2-OG 2.73Å; N396-S403 WeakPolarHBondContact OD1-CB 3.32Å; N396-S403 PolarHBondContact OD1-OG 2.97Å
397	T	60.2	Low	58.1	Low	122 Å²	122	88.3 Å²	88.3	75%	0.748	49%	0.485	S	S	*	.	H	α-helix	trans	-69.8	-22.8	177.6	-46.6	0	0	0	0	110.3	S393 L394 Y395	S393-T397 PolarHBondContact O-OG1 3.11Å; L394-T397 WeakPolarHBondContact O-CB 3.28Å; L394-T397 PolarHBondContact O-N 3.09Å; Y395-T397 VanDerWaalsContact C-N 3.28Å; Y395-T397 PolarHBondContact O-N 2.92Å
398	I	62.2	Low	59.4	Low	135 Å²	135	81.3 Å²	81.3	69%	0.692	45%	0.454	S	S	*	.	H	α-helix	trans	-97.6	-38.5	-176.1	-58.1	169.9	0	0	0	111.2	Y395 N396	Y395-I398 PolarHBondContact O-N 3.32Å; Y395-I398 VanDerWaalsContact O-N 3.09Å; N396-I398 PolarHBondContact O-N 2.92Å
399	N	56.7	Low	60.8	Low	69 Å²	69	76.8 Å²	76.8	37%	0.369	44%	0.437	S	S	.	.			trans	-149.7	88.3	178.4	-160.2	-10.3	0	0	0	112.2	Y395 E401 A402	Y395-N399 PolarHBondContact O-N 2.82Å; N399-E401 VanDerWaalsContact C-N 3.3Å; N399-E401 PolarHBondContact O-N 3.32Å; N399-A402 HydrophobicContact CB-CB 4.32Å; N399-A402 PolarHBondContact O-N 2.75Å
400	P	59.5	Low	62.4	Low	96 Å²	96	78.9 Å²	78.9	62%	0.623	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.5	-175.4	23.7	-31.2	0	0	0	114.2
401	E	54.6	Low	63.7	Low	194 Å²	194	75.8 Å²	75.8	91%	0.907	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-16.9	178.5	-73.1	-164.2	152.2	0	0	113.8	N399	N399-E401 VanDerWaalsContact C-N 3.3Å; N399-E401 PolarHBondContact O-N 3.32Å
402	A	50.7	Low	65	Low	64 Å²	64	73.9 Å²	73.9	53%	0.529	43%	0.429	S	S	.	.	S	Bend	trans	-107	4.3	-173.6	0	0	0	0	0	114.6	N399	N399-A402 HydrophobicContact CB-CB 4.32Å; N399-A402 PolarHBondContact O-N 2.75Å
403	S	55.8	Low	66.6	Low	22 Å²	22	73.9 Å²	73.9	15%	0.154	43%	0.43	C	S	.	.			trans	-103.7	136.3	-170.6	-161.5	0	0	0	0	112.9	Y380 N396 S405	Y380-S403 WeakPolarHBondContact OH-CB 3.34Å; Y380-S403 PolarHBondContact OH-O 2.94Å; Y380-S403 PolarHBondContact OH-OG 2.84Å; N396-S403 WeakPolarHBondContact ND2-CB 3.28Å; N396-S403 PolarHBondContact ND2-OG 2.73Å; N396-S403 WeakPolarHBondContact OD1-CB 3.32Å; N396-S403 PolarHBondContact OD1-OG 2.97Å; S403-S405 PolarHBondContact O-N 3.11Å
404	A	59.3	Low	68.2	Low	72 Å²	72	76.1 Å²	76.1	60%	0.595	44%	0.436	S	S	*	.			trans	-78	115.4	179.9	0	0	0	0	0	111.9	Y380 L392	Y380-A404 WeakPolarHBondContact CE1-O 3.15Å; Y380-A404 PolarHBondContact OH-N 2.86Å; Y380-A404 PolarHBondContact OH-O 2.82Å; L392-A404 HydrophobicContact CD2-CB 4.14Å; L392-A404 WeakPolarHBondContact CD2-O 3.31Å
405	S	61	Low	69.7	Low	85 Å²	85	73 Å²	73	59%	0.594	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-67.8	134.4	-177.1	59	0	0	0	0	112.1	Y380 S403	Y380-S405 VanDerWaalsContact CZ-CA 3.46Å; Y380-S405 VanDerWaalsContact OH-CA 3.22Å; Y380-S405 WeakPolarHBondContact OH-CA 3.4Å; Y380-S405 PolarHBondContact OH-N 2.99Å; S403-S405 PolarHBondContact O-N 3.11Å
406	P	70.5	Confident	71.5	Confident	15 Å²	15	68.1 Å²	68.1	10%	0.097	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-63.6	149.3	177.8	26.5	-33.9	0	0	0	111.1	C378 Y380 S442	C378-P406 HydrophobicContact CB-CB 4.16Å; C378-P406 HydrophobicContact CB-CG 3.77Å; C378-P406 VanDerWaalsContact CB-O 3.32Å; C378-P406 WeakPolarHBondContact CB-O 3.31Å; C378-P406 VanDerWaalsContact O-CG 3.29Å; C378-P406 WeakPolarHBondContact O-CG 3.46Å; Y380-P406 HydrophobicContact CD1-CG 4.21Å; Y380-P406 HydrophobicContact CE1-CG 4.44Å; P406-S442 WeakPolarHBondContact CA-O 2.96Å
407	C	77.5	Confident	73.3	Confident	76 Å²	76	67.6 Å²	67.6	51%	0.514	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-100.3	144.5	-177.1	-71.7	0	0	0	0	111.3	V409 C441 S442	C407-V409 HydrophobicContact CB-CG1 4.05Å; C407-V409 PolarHBondContact O-N 3.45Å; C407-C441 WeakPolarHBondContact O-CA 3.45Å; C407-S442 PolarHBondContact N-O 2.8Å; C407-S442 PolarHBondContact O-N 3.02Å
408	C	81.9	Confident	74.8	Confident	27 Å²	27	61.8 Å²	61.8	18%	0.182	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	107.4	171.7	-172.8	0	0	0	0	110	C345	C345-C408 WeakPolarHBondContact CA-SG 3.3Å; C345-C408 HydrophobicContact CB-CB 3.63Å; C345-C408 WeakPolarHBondContact CB-SG 3.29Å; C345-C408 WeakPolarHBondContact SG-CA 3.45Å; C345-C408 WeakPolarHBondContact SG-CB 3.35Å; C345-C408 CovalentContact SG-SG 2.03Å; C345-C408 PolarHBondContact SG-SG 3.01Å
409	V	85.3	Confident	76.2	Confident	50 Å²	50	55.4 Å²	55.4	30%	0.303	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	159	-173.6	-59.1	0	0	0	0	112	C407 C439 K440 S442	C407-V409 HydrophobicContact CB-CG1 4.05Å; C407-V409 PolarHBondContact O-N 3.45Å; V409-C439 CarbonylContact O-C 3.47Å; V409-C439 WeakPolarHBondContact O-CA 3.35Å; V409-K440 HydrophobicContact CG2-CG 3.85Å; V409-K440 PolarHBondContact N-O 3.1Å; V409-K440 PolarHBondContact O-N 3.25Å; V409-S442 VanDerWaalsContact CG2-OG 3.29Å; V409-S442 WeakPolarHBondContact CG2-OG 3.41Å
410	S	86.1	Confident	77.9	Confident	48 Å²	48	52.3 Å²	52.3	34%	0.336	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	133.3	175.2	54.9	0	0	0	0	111.6
411	Q	82.8	Confident	79.2	Confident	72 Å²	72	48.2 Å²	48.2	34%	0.336	29%	0.289	S	S	.	.			trans	-99.8	-63.7	175	176.5	176.5	13.3	0	0	111.1	S438 K440	Q411-S438 WeakPolarHBondContact CB-OG 3.44Å; Q411-S438 PolarHBondContact N-O 2.84Å; Q411-K440 HydrophobicContact CB-CB 4.19Å; Q411-K440 HydrophobicContact CB-CD 3.93Å; Q411-K440 HydrophobicContact CB-CG 3.95Å; Q411-K440 HydrophobicContact CG-CD 4.09Å
412	D	84.1	Confident	80.7	Confident	51 Å²	51	42.8 Å²	42.8	27%	0.273	27%	0.265	S	S	.	.	S	Bend	trans	-102.1	131.3	178.5	-54.4	-56.3	0	0	0	110.3	R93 K437 S438	R93-D412 IonicContact CZ-OD1 3.89Å; R93-D412 VanDerWaalsContact CZ-OD1 3.29Å; R93-D412 IonicContact NH1-OD1 3.42Å; R93-D412 PolarHBondContact NH1-OD1 2.96Å; R93-D412 IonicContact NH1-OD2 3.75Å; R93-D412 IonicContact NH2-OD1 2.81Å; R93-D412 PolarHBondContact NH2-OD1 2.65Å; R93-D412 IonicContact NH2-OD2 2.68Å; R93-D412 PolarHBondContact NH2-OD2 2.86Å; D412-K437 HydrophobicContact CB-CB 4.17Å; D412-K437 PolarHBondContact O-N 3.33Å; D412-S438 WeakPolarHBondContact CB-OG 3.34Å; D412-S438 PolarHBondContact N-OG 3.43Å; D412-S438 PolarHBondContact OD2-OG 3.42Å
413	L	87.2	Confident	82.3	Confident	58 Å²	58	40.8 Å²	40.8	30%	0.304	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.3	-176.6	-70.2	155.5	0	0	0	110	N433 I435 V436	L413-N433 HydrophobicContact CB-CB 4.26Å; L413-N433 HydrophobicContact CD1-CB 4.05Å; L413-I435 CarbonylContact C-O 3.59Å; L413-I435 VanDerWaalsContact CA-O 3.28Å; L413-I435 WeakPolarHBondContact CA-O 3.41Å; L413-V436 HydrophobicContact CD2-CB 4.44Å; L413-V436 HydrophobicContact CD2-CG2 3.93Å
414	E	87.9	Confident	83.5	Confident	84 Å²	84	48.9 Å²	48.9	39%	0.393	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	148.3	175.8	-87.1	-175	-171.1	0	0	112	M434 I435 K437	E414-M434 PolarHBondContact O-N 3.19Å; E414-I435 HydrophobicContact CB-CB 3.95Å; E414-I435 HydrophobicContact CB-CG2 4.34Å; E414-I435 PolarHBondContact N-O 3.45Å; E414-I435 PolarHBondContact O-N 3.13Å; E414-K437 HydrophobicContact CG-CG 4.02Å; E414-K437 WeakPolarHBondContact OE1-CE 2.98Å; E414-K437 IonicContact OE1-NZ 2.64Å; E414-K437 PolarHBondContact OE1-NZ 2.9Å; E414-K437 WeakPolarHBondContact OE2-CE 3.44Å; E414-K437 IonicContact OE2-NZ 3.25Å; E414-K437 PolarHBondContact OE2-NZ 3.17Å
415	P	91.1	Very high	84.8	Confident	52 Å²	52	48.8 Å²	48.8	34%	0.338	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	157.8	173.7	33	-34.9	0	0	0	112.2	Q430 L431	P415-Q430 HydrophobicContact CB-CG 3.7Å; P415-Q430 HydrophobicContact CG-CG 4.35Å; P415-L431 CarbonylContact C-O 3.5Å; P415-L431 WeakPolarHBondContact CA-O 3.33Å; P415-L431 WeakPolarHBondContact CB-O 3.33Å
416	L	92.4	Very high	86.1	Confident	14 Å²	14	47.5 Å²	47.5	7%	0.073	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.6	173.3	177.4	69.5	0	0	0	110	F354 P366 Y369 I418 L431 M434 I435	F354-L416 HydrophobicContact CZ-CD2 4.16Å; P366-L416 HydrophobicContact CG-CD1 4.09Å; Y369-L416 HydrophobicContact CD1-CD2 3.67Å; Y369-L416 HydrophobicContact CD2-CD1 4.18Å; Y369-L416 HydrophobicContact CD2-CD2 4.03Å; Y369-L416 HydrophobicContact CE1-CD2 3.69Å; Y369-L416 HydrophobicContact CE2-CD2 4.01Å; Y369-L416 HydrophobicContact CG-CD1 3.97Å; Y369-L416 HydrophobicContact CG-CD2 3.85Å; L416-I418 HydrophobicContact CD2-CG2 3.9Å; L416-I418 HydrophobicContact CG-CG2 3.93Å; L416-L431 PolarHBondContact N-O 3.15Å; L416-L431 WeakPolarHBondContact O-CB 3.24Å; L416-L431 PolarHBondContact O-N 2.78Å; L416-M434 HydrophobicContact CB-CB 3.65Å; L416-M434 HydrophobicContact CB-CG 3.88Å; L416-I435 HydrophobicContact CD1-CD1 4.44Å
417	T	91.6	Very high	86.9	Confident	14 Å²	14	51 Å²	51	9%	0.086	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126.5	174.8	-52.8	0	0	0	0	110.1	Y71 L78 P366 I428 E429	Y71-T417 HydrophobicContact CE2-CG2 4.04Å; Y71-T417 PolarHBondContact OH-O 3.46Å; L78-T417 HydrophobicContact CD1-CG2 4.32Å; P366-T417 WeakPolarHBondContact CD-O 3.26Å; T417-I428 HydrophobicContact CG2-CG2 3.95Å; T417-E429 CarbonylContact C-O 3.52Å; T417-E429 WeakPolarHBondContact CA-O 3.35Å
418	I	93	Very high	87.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	152.1	-178.3	66.1	164.3	0	0	0	112.1	L48 I363 E365 L416 Y420 I428 E429 L431	L48-I418 HydrophobicContact CD1-CD1 3.9Å; L48-I418 HydrophobicContact CD2-CD1 4.19Å; I363-I418 HydrophobicContact CG2-CB 4.43Å; E365-I418 CarbonylContact O-C 3.46Å; E365-I418 VanDerWaalsContact O-CA 3.25Å; E365-I418 WeakPolarHBondContact O-CA 3.3Å; L416-I418 HydrophobicContact CD2-CG2 3.9Å; L416-I418 HydrophobicContact CG-CG2 3.93Å; I418-Y420 HydrophobicContact CD1-CD1 4.02Å; I418-Y420 HydrophobicContact CD1-CE1 4.47Å; I418-Y420 HydrophobicContact CG1-CD1 4.3Å; I418-I428 WeakPolarHBondContact O-CA 3.2Å; I418-E429 PolarHBondContact N-O 3.18Å; I418-E429 PolarHBondContact O-N 2.88Å; I418-L431 HydrophobicContact CD1-CD1 3.89Å; I418-L431 HydrophobicContact CD1-CG 4.32Å; I418-L431 HydrophobicContact CG1-CD1 4.31Å; I418-L431 HydrophobicContact CG1-CG 4.36Å; I418-L431 HydrophobicContact CG2-CD1 4.27Å
419	L	91.8	Very high	87.7	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.6	169.1	171.6	65.1	0	0	0	108.7	V63 V67 Y71 H364 E365 P426 K427 I428	V63-L419 HydrophobicContact CG1-CD2 4.5Å; V67-L419 HydrophobicContact CG1-CD1 3.79Å; V67-L419 HydrophobicContact CG1-CD2 4.04Å; Y71-L419 HydrophobicContact CD2-CB 3.72Å; Y71-L419 HydrophobicContact CE2-CB 4.15Å; Y71-L419 HydrophobicContact CG-CB 4.26Å; H364-L419 HydrophobicContact CB-CD2 4.28Å; H364-L419 HydrophobicContact CB-CG 4.29Å; H364-L419 PolarHBondContact N-O 3.29Å; E365-L419 HydrophobicContact CB-CB 4.05Å; E365-L419 HydrophobicContact CB-CD2 4.45Å; E365-L419 HydrophobicContact CG-CD2 4.42Å; E365-L419 PolarHBondContact N-O 3.41Å; E365-L419 PolarHBondContact O-N 3.3Å; L419-P426 HydrophobicContact CD1-CB 4.25Å; L419-K427 WeakPolarHBondContact CA-O 3.38Å; L419-I428 HydrophobicContact CD1-CG1 3.71Å
420	Y	91.4	Very high	87.8	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	171.1	175.5	72.7	-75.7	0	0	0	110.8	L48 W362 I418 I422 K427 E429	L48-Y420 HydrophobicContact CD2-CE1 3.84Å; W362-Y420 AromaticContact CE3-CD2 3.99Å; W362-Y420 HydrophobicContact CE3-CD2 3.99Å; W362-Y420 HydrophobicContact CE3-CG 4.16Å; W362-Y420 AromaticContact CZ3-CD2 3.68Å; W362-Y420 HydrophobicContact CZ3-CD2 3.68Å; W362-Y420 HydrophobicContact CZ3-CE2 4.43Å; W362-Y420 AromaticContact CZ3-CG 3.78Å; W362-Y420 HydrophobicContact CZ3-CG 3.78Å; W362-Y420 WeakPolarHBondContact O-CB 3.47Å; I418-Y420 HydrophobicContact CD1-CD1 4.02Å; I418-Y420 HydrophobicContact CD1-CE1 4.47Å; I418-Y420 HydrophobicContact CG1-CD1 4.3Å; Y420-I422 HydrophobicContact CD2-CG1 4.16Å; Y420-I422 HydrophobicContact CE2-CD1 3.74Å; Y420-I422 HydrophobicContact CE2-CG1 3.55Å; Y420-K427 HydrophobicContact CD1-CB 4.07Å; Y420-K427 HydrophobicContact CE1-CB 3.63Å; Y420-K427 HydrophobicContact CE2-CB 4.33Å; Y420-K427 PolarHBondContact N-O 3.26Å; Y420-K427 PolarHBondContact O-N 2.87Å; Y420-E429 HydrophobicContact CE1-CB 4.43Å; Y420-E429 HydrophobicContact CE1-CG 4.14Å; Y420-E429 PolarHBondContact OH-OE1 3.46Å
421	Y	87.5	Confident	87.9	Confident	10 Å²	10	52.1 Å²	52.1	4%	0.039	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	144.3	178.6	-81.4	-105.9	0	0	0	111.6	P58 V63 H364 T425 P426	P58-Y421 HydrophobicContact CG-CD1 3.66Å; P58-Y421 HydrophobicContact CG-CD2 3.85Å; P58-Y421 HydrophobicContact CG-CE1 3.8Å; P58-Y421 HydrophobicContact CG-CE2 3.99Å; P58-Y421 HydrophobicContact CG-CG 3.68Å; V63-Y421 HydrophobicContact CG1-CE2 4.36Å; V63-Y421 HydrophobicContact CG2-CE2 4.15Å; H364-Y421 AromaticContact CE1-CD2 3.54Å; H364-Y421 AromaticContact ND1-CD2 3.63Å; Y421-T425 WeakPolarHBondContact CA-O 3.1Å; Y421-P426 HydrophobicContact CD1-CB 4.44Å; Y421-P426 HydrophobicContact CE1-CB 3.88Å; Y421-P426 HydrophobicContact CE1-CG 4.32Å; Y421-P426 HydrophobicContact CE2-CB 4.13Å
422	I	85.8	Confident	88.1	Confident	79 Å²	79	51.6 Å²	51.6	41%	0.405	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	106.3	162.2	-60.6	174.8	0	0	0	106	Y420 K424 T425 K427	Y420-I422 HydrophobicContact CD2-CG1 4.16Å; Y420-I422 HydrophobicContact CE2-CD1 3.74Å; Y420-I422 HydrophobicContact CE2-CG1 3.55Å; I422-K424 PolarHBondContact O-N 2.75Å; I422-T425 PolarHBondContact N-O 3.11Å; I422-T425 VanDerWaalsContact N-O 3.13Å; I422-T425 PolarHBondContact O-N 2.9Å; I422-T425 VanDerWaalsContact O-N 3.15Å; I422-T425 PolarHBondContact O-OG1 3.33Å; I422-K427 HydrophobicContact CD1-CG 4.45Å
423	G	83.4	Confident	88.3	Confident	23 Å²	23	53.1 Å²	53.1	24%	0.237	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	-121.1	-166.9	0	0	0	0	0	110.4
424	K	82.7	Confident	88.5	Confident	192 Å²	192	50.3 Å²	50.3	84%	0.835	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	5.9	178.7	-62.3	-171.6	177.5	-174.7	0	114.7	I422	I422-K424 PolarHBondContact O-N 2.75Å
425	T	85	Confident	88.7	Confident	70 Å²	70	47.5 Å²	47.5	43%	0.429	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121	-175.9	63.2	0	0	0	0	111.7	Y421 I422	Y421-T425 WeakPolarHBondContact CA-O 3.1Å; I422-T425 PolarHBondContact N-O 3.11Å; I422-T425 VanDerWaalsContact N-O 3.13Å; I422-T425 PolarHBondContact O-N 2.9Å; I422-T425 VanDerWaalsContact O-N 3.15Å; I422-T425 PolarHBondContact O-OG1 3.33Å
426	P	89.5	Confident	88.7	Confident	58 Å²	58	45.1 Å²	45.1	38%	0.377	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.5	174.7	28.5	-32.3	0	0	0	110.9	V67 L419 Y421	V67-P426 HydrophobicContact CG1-CB 3.62Å; V67-P426 HydrophobicContact CG1-CG 4.19Å; V67-P426 HydrophobicContact CG2-CB 4.37Å; V67-P426 HydrophobicContact CG2-CG 4.1Å; L419-P426 HydrophobicContact CD1-CB 4.25Å; Y421-P426 HydrophobicContact CD1-CB 4.44Å; Y421-P426 HydrophobicContact CE1-CB 3.88Å; Y421-P426 HydrophobicContact CE1-CG 4.32Å; Y421-P426 HydrophobicContact CE2-CB 4.13Å
427	K	87.9	Confident	88.4	Confident	89 Å²	89	48.1 Å²	48.1	39%	0.387	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	127.5	177.4	-64.3	-64.7	-177.7	-179.8	0	109.9	L419 Y420 I422	L419-K427 WeakPolarHBondContact CA-O 3.38Å; Y420-K427 HydrophobicContact CD1-CB 4.07Å; Y420-K427 HydrophobicContact CE1-CB 3.63Å; Y420-K427 HydrophobicContact CE2-CB 4.33Å; Y420-K427 PolarHBondContact N-O 3.26Å; Y420-K427 PolarHBondContact O-N 2.87Å; I422-K427 HydrophobicContact CD1-CG 4.45Å
428	I	89.3	Confident	88.1	Confident	49 Å²	49	47.8 Å²	47.8	25%	0.251	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.7	175.2	-61	159.6	0	0	0	107.2	I70 Y71 T74 T417 I418 L419	I70-I428 HydrophobicContact CB-CD1 4.17Å; I70-I428 HydrophobicContact CG2-CD1 3.58Å; Y71-I428 HydrophobicContact CD2-CG1 4.42Å; Y71-I428 HydrophobicContact CD2-CG2 4.11Å; T74-I428 HydrophobicContact CG2-CG2 3.98Å; T417-I428 HydrophobicContact CG2-CG2 3.95Å; I418-I428 WeakPolarHBondContact O-CA 3.2Å; L419-I428 HydrophobicContact CD1-CG1 3.71Å
429	E	85.4	Confident	87.6	Confident	77 Å²	77	48.6 Å²	48.6	36%	0.36	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149.8	-176.2	-66.5	-163	-177.1	0	0	111.8	L48 T417 I418 Y420	L48-E429 HydrophobicContact CD2-CB 4.43Å; L48-E429 VanDerWaalsContact CD2-OE2 3.3Å; L48-E429 WeakPolarHBondContact CD2-OE2 3.24Å; T417-E429 CarbonylContact C-O 3.52Å; T417-E429 WeakPolarHBondContact CA-O 3.35Å; I418-E429 PolarHBondContact N-O 3.18Å; I418-E429 PolarHBondContact O-N 2.88Å; Y420-E429 HydrophobicContact CE1-CB 4.43Å; Y420-E429 HydrophobicContact CE1-CG 4.14Å; Y420-E429 PolarHBondContact OH-OE1 3.46Å
430	Q	87.6	Confident	87	Confident	93 Å²	93	51.6 Å²	51.6	44%	0.435	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.8	177.3	-173.7	174.8	56.2	0	0	110.4	L78 P415	L78-Q430 HydrophobicContact CD1-CB 4.34Å; P415-Q430 HydrophobicContact CB-CG 3.7Å; P415-Q430 HydrophobicContact CG-CG 4.35Å
431	L	87.4	Confident	86.2	Confident	5 Å²	5	52 Å²	52	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	116	177.6	-57.7	-177.9	0	0	0	110	I44 K47 L48 P415 L416 I418 M434	I44-L431 HydrophobicContact CB-CD1 4.42Å; I44-L431 HydrophobicContact CG1-CD1 3.94Å; I44-L431 HydrophobicContact CG2-CD1 4.11Å; K47-L431 HydrophobicContact CB-CD2 3.78Å; K47-L431 HydrophobicContact CD-CB 4.24Å; K47-L431 HydrophobicContact CD-CD2 4.27Å; L48-L431 HydrophobicContact CD2-CD2 3.83Å; L48-L431 HydrophobicContact CG-CD2 4.15Å; P415-L431 CarbonylContact C-O 3.5Å; P415-L431 WeakPolarHBondContact CA-O 3.33Å; P415-L431 WeakPolarHBondContact CB-O 3.33Å; L416-L431 PolarHBondContact N-O 3.15Å; L416-L431 WeakPolarHBondContact O-CB 3.24Å; L416-L431 PolarHBondContact O-N 2.78Å; I418-L431 HydrophobicContact CD1-CD1 3.89Å; I418-L431 HydrophobicContact CD1-CG 4.32Å; I418-L431 HydrophobicContact CG1-CD1 4.31Å; I418-L431 HydrophobicContact CG1-CG 4.36Å; I418-L431 HydrophobicContact CG2-CD1 4.27Å; L431-M434 HydrophobicContact CB-CG 3.54Å; L431-M434 HydrophobicContact CB-SD 4.11Å; L431-M434 HydrophobicContact CD1-CG 4.49Å; L431-M434 HydrophobicContact CD1-SD 4.47Å; L431-M434 WeakPolarHBondContact O-CG 3.34Å
432	S	88.9	Confident	85.3	Confident	61 Å²	61	54.7 Å²	54.7	43%	0.427	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	149.9	175.8	58.1	0	0	0	0	112.5	K47	K47-S432 WeakPolarHBondContact CE-O 3.29Å; K47-S432 PolarHBondContact NZ-O 3.05Å; K47-S432 PolarHBondContact NZ-OG 3.49Å
433	N	87.2	Confident	85.2	Confident	82 Å²	82	53.5 Å²	53.5	44%	0.439	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.4	43.4	169.6	-57.6	-15.3	0	0	0	115.5	Q43 L413	Q43-N433 PolarHBondContact NE2-O 2.7Å; L413-N433 HydrophobicContact CB-CB 4.26Å; L413-N433 HydrophobicContact CD1-CB 4.05Å
434	M	91.8	Very high	85.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-36.1	-176.4	-65.7	-56.2	-58.7	0	0	113.1	R36 I40 Q43 I44 K47 Y369 E414 L416 L431	R36-M434 PolarHBondContact NH2-O 2.91Å; I40-M434 HydrophobicContact CG2-CE 4.06Å; Q43-M434 VanDerWaalsContact CD-SD 3.57Å; Q43-M434 HydrophobicContact CG-SD 3.86Å; Q43-M434 PolarHBondContact NE2-SD 3.01Å; I44-M434 HydrophobicContact CD1-CE 3.93Å; I44-M434 HydrophobicContact CG1-CE 3.5Å; I44-M434 HydrophobicContact CG1-SD 4.49Å; K47-M434 HydrophobicContact CD-SD 4.23Å; Y369-M434 HydrophobicContact CE2-CB 4.39Å; Y369-M434 WeakPolarHBondContact OH-CE 3.39Å; E414-M434 PolarHBondContact O-N 3.19Å; L416-M434 HydrophobicContact CB-CB 3.65Å; L416-M434 HydrophobicContact CB-CG 3.88Å; L431-M434 HydrophobicContact CB-CG 3.54Å; L431-M434 HydrophobicContact CB-SD 4.11Å; L431-M434 HydrophobicContact CD1-CG 4.49Å; L431-M434 HydrophobicContact CD1-SD 4.47Å; L431-M434 WeakPolarHBondContact O-CG 3.34Å
435	I	92.3	Very high	85.5	Confident	25 Å²	25	47.4 Å²	47.4	13%	0.128	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.2	-174.8	-63.3	167.2	0	0	0	109.4	Y369 N370 L413 E414 L416	Y369-I435 HydrophobicContact CD2-CD1 4.31Å; Y369-I435 HydrophobicContact CD2-CG1 3.77Å; Y369-I435 HydrophobicContact CE2-CG1 4.02Å; N370-I435 WeakPolarHBondContact O-CG2 2.83Å; L413-I435 CarbonylContact C-O 3.59Å; L413-I435 VanDerWaalsContact CA-O 3.28Å; L413-I435 WeakPolarHBondContact CA-O 3.41Å; E414-I435 HydrophobicContact CB-CB 3.95Å; E414-I435 HydrophobicContact CB-CG2 4.34Å; E414-I435 PolarHBondContact N-O 3.45Å; E414-I435 PolarHBondContact O-N 3.13Å; L416-I435 HydrophobicContact CD1-CD1 4.44Å
436	V	90.5	Very high	85.5	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.5	175.2	-168.2	0	0	0	0	110.2	L347 A371 N372 L413	L347-V436 HydrophobicContact CD1-CB 3.85Å; L347-V436 HydrophobicContact CD1-CG1 3.54Å; A371-V436 PolarHBondContact O-N 3Å; N372-V436 HydrophobicContact CB-CB 4.18Å; N372-V436 PolarHBondContact ND2-O 3.03Å; L413-V436 HydrophobicContact CD2-CB 4.44Å; L413-V436 HydrophobicContact CD2-CG2 3.93Å
437	K	87.3	Confident	85.2	Confident	77 Å²	77	45.4 Å²	45.4	34%	0.335	24%	0.237	S	C	.	.			trans	-106.3	-38.3	177.5	-72.7	-61.9	-166.1	178.5	0	114.1	L347 D412 E414	L347-K437 WeakPolarHBondContact CD2-O 3.4Å; D412-K437 HydrophobicContact CB-CB 4.17Å; D412-K437 PolarHBondContact O-N 3.33Å; E414-K437 HydrophobicContact CG-CG 4.02Å; E414-K437 WeakPolarHBondContact OE1-CE 2.98Å; E414-K437 IonicContact OE1-NZ 2.64Å; E414-K437 PolarHBondContact OE1-NZ 2.9Å; E414-K437 WeakPolarHBondContact OE2-CE 3.44Å; E414-K437 IonicContact OE2-NZ 3.25Å; E414-K437 PolarHBondContact OE2-NZ 3.17Å
438	S	83.8	Confident	85.1	Confident	6 Å²	6	42.5 Å²	42.5	4%	0.042	23%	0.227	C	C	.	.			trans	-141.3	152.9	-178.5	64.8	0	0	0	0	110.8	Q411 D412	Q411-S438 WeakPolarHBondContact CB-OG 3.44Å; Q411-S438 PolarHBondContact N-O 2.84Å; D412-S438 WeakPolarHBondContact CB-OG 3.34Å; D412-S438 PolarHBondContact N-OG 3.43Å; D412-S438 PolarHBondContact OD2-OG 3.42Å
439	C	83.7	Confident	84.8	Confident	18 Å²	18	42 Å²	42	12%	0.122	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	147.5	-179.7	-59.9	0	0	0	0	109.8	L347 C374 V409	L347-C439 VanDerWaalsContact CA-SG 3.55Å; C374-C439 WeakPolarHBondContact CA-SG 3.45Å; C374-C439 HydrophobicContact CB-CB 3.76Å; C374-C439 WeakPolarHBondContact CB-SG 3.47Å; C374-C439 VanDerWaalsContact SG-CA 3.54Å; C374-C439 WeakPolarHBondContact SG-CB 3.46Å; C374-C439 CovalentContact SG-SG 2.03Å; C374-C439 PolarHBondContact SG-SG 3.02Å; V409-C439 CarbonylContact O-C 3.47Å; V409-C439 WeakPolarHBondContact O-CA 3.35Å
440	K	78	Confident	84.7	Confident	63 Å²	63	39.3 Å²	39.3	27%	0.274	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	162	175.8	70.2	175.5	-176.4	173.4	0	111.4	D385 V409 Q411	D385-K440 WeakPolarHBondContact OD2-CD 3.42Å; D385-K440 WeakPolarHBondContact OD2-CE 3.48Å; D385-K440 IonicContact OD2-NZ 3.94Å; D385-K440 PolarHBondContact OD2-NZ 2.89Å; V409-K440 HydrophobicContact CG2-CG 3.85Å; V409-K440 PolarHBondContact N-O 3.1Å; V409-K440 PolarHBondContact O-N 3.25Å; Q411-K440 HydrophobicContact CB-CB 4.19Å; Q411-K440 HydrophobicContact CB-CD 3.93Å; Q411-K440 HydrophobicContact CB-CG 3.95Å; Q411-K440 HydrophobicContact CG-CD 4.09Å
441	C	74.4	Confident	84.5	Confident	12 Å²	12	34.8 Å²	34.8	8%	0.081	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	119.9	170.6	-66.7	0	0	0	0	109.8	C345 C378 C407	C345-C441 VanDerWaalsContact CB-SG 3.51Å; C378-C441 VanDerWaalsContact CA-SG 3.57Å; C378-C441 HydrophobicContact CB-CB 3.63Å; C378-C441 WeakPolarHBondContact CB-SG 3.48Å; C378-C441 WeakPolarHBondContact SG-CA 3.42Å; C378-C441 WeakPolarHBondContact SG-CB 3.43Å; C378-C441 CovalentContact SG-SG 2.04Å; C378-C441 PolarHBondContact SG-SG 2.95Å; C407-C441 WeakPolarHBondContact O-CA 3.45Å
442	S	68.4	Low	84.2	Confident	67 Å²	67	37.5 Å²	37.5	47%	0.469	21%	0.212	S	C	.	.			trans	-125.1	0	179.7	68.8	0	0	0	0	113.1	P406 C407 V409	P406-S442 WeakPolarHBondContact CA-O 2.96Å; C407-S442 PolarHBondContact N-O 2.8Å; C407-S442 PolarHBondContact O-N 3.02Å; V409-S442 VanDerWaalsContact CG2-OG 3.29Å; V409-S442 WeakPolarHBondContact CG2-OG 3.41Å

Retrieved 442 of 442 residues in 109.1 ms (Link to these results)

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