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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 A0A093H6T4, Species STRCA (Struthio camelus australis), Gene n/a, Length 412 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.3	Low	54.3	Low	212 Å²	212	122 Å²	122	100%	1.044	63%	0.628	S	S	*	*				0	-7.5	0	-74.5	-166.7	105.9	0	0	114.8
2	H	53	Low	54	Low	156 Å²	156	120.7 Å²	120.7	72%	0.722	62%	0.622	S	S	*	*	H	α-helix	trans	-85.2	-23.8	179.1	-77	-42.5	0	0	0	115.8	L6	H2-L6 PolarHBondContact O-N 3.46Å
3	C	53.8	Low	53.3	Low	110 Å²	110	119.5 Å²	119.5	74%	0.743	62%	0.617	S	S	*	*	H	α-helix	trans	-73.6	-31.2	178.8	-60.9	0	0	0	0	113.8	S7	C3-S7 PolarHBondContact O-N 2.76Å; C3-S7 VanDerWaalsContact O-N 3.13Å
4	Y	54.4	Low	52.6	Low	193 Å²	193	119.8 Å²	119.8	76%	0.757	62%	0.619	S	S	*	*	H	α-helix	trans	-73.4	-31	177.5	-86	-84.4	0	0	0	112.9	S7 V8	Y4-S7 PolarHBondContact O-OG 2.75Å; Y4-V8 VanDerWaalsContact O-CG2 3.24Å; Y4-V8 WeakPolarHBondContact O-CG2 2.95Å; Y4-V8 PolarHBondContact O-N 3.01Å
5	L	54.3	Low	51.9	Low	98 Å²	98	115.9 Å²	115.9	51%	0.513	61%	0.612	S	S	.	*	H	α-helix	trans	-71	-41.2	174.6	-98.3	141	0	0	0	111.2	V8 F9	L5-V8 PolarHBondContact O-N 3.31Å; L5-F9 HydrophobicContact CD2-CD2 4.42Å; L5-F9 HydrophobicContact CD2-CE2 4.03Å; L5-F9 WeakPolarHBondContact O-CD2 3.28Å; L5-F9 PolarHBondContact O-N 3.28Å
6	L	54.3	Low	51.4	Low	113 Å²	113	114.9 Å²	114.9	59%	0.592	61%	0.612	S	S	*	*	H	α-helix	trans	-65	-37.4	175.7	-92.4	151.7	0	0	0	112.8	H2 L10	H2-L6 PolarHBondContact O-N 3.46Å; L6-L10 WeakPolarHBondContact O-CB 3.39Å; L6-L10 PolarHBondContact O-N 2.83Å
7	S	55.6	Low	51	Low	56 Å²	56	115.4 Å²	115.4	39%	0.392	62%	0.62	S	S	.	*	H	α-helix	trans	-68	-37.4	175.4	70	0	0	0	0	112.2	C3 Y4 L10 T11	C3-S7 PolarHBondContact O-N 2.76Å; C3-S7 VanDerWaalsContact O-N 3.13Å; Y4-S7 PolarHBondContact O-OG 2.75Å; S7-L10 PolarHBondContact O-N 2.8Å; S7-T11 VanDerWaalsContact O-CG2 3.29Å; S7-T11 WeakPolarHBondContact O-CG2 3.28Å; S7-T11 PolarHBondContact O-N 3.13Å; S7-T11 PolarHBondContact O-OG1 3.12Å; S7-T11 VanDerWaalsContact O-OG1 3.08Å
8	V	58	Low	50.5	Low	75 Å²	75	113.1 Å²	113.1	46%	0.455	62%	0.62	S	S	.	*	H	α-helix	trans	-68	-40.7	177.8	171.4	0	0	0	0	111.1	Y4 L5 T11 L12	Y4-V8 VanDerWaalsContact O-CG2 3.24Å; Y4-V8 WeakPolarHBondContact O-CG2 2.95Å; Y4-V8 PolarHBondContact O-N 3.01Å; L5-V8 PolarHBondContact O-N 3.31Å; V8-T11 WeakPolarHBondContact CA-OG1 3.47Å; V8-T11 PolarHBondContact O-N 3.09Å; V8-T11 PolarHBondContact O-OG1 3.26Å; V8-L12 HydrophobicContact CG1-CD1 3.76Å; V8-L12 VanDerWaalsContact O-CD1 3.32Å; V8-L12 WeakPolarHBondContact O-CD1 3.43Å; V8-L12 PolarHBondContact O-N 3.19Å
9	F	53.5	Low	50.1	Low	133 Å²	133	117.1 Å²	117.1	58%	0.583	63%	0.63	S	S	*	*	H	α-helix	trans	-66.3	-41.5	175	-88.7	-76.3	0	0	0	112.6	L5 T11 L12 D13	L5-F9 HydrophobicContact CD2-CD2 4.42Å; L5-F9 HydrophobicContact CD2-CE2 4.03Å; L5-F9 WeakPolarHBondContact O-CD2 3.28Å; L5-F9 PolarHBondContact O-N 3.28Å; F9-T11 VanDerWaalsContact C-N 3.33Å; F9-T11 PolarHBondContact O-N 3.11Å; F9-L12 PolarHBondContact O-N 2.73Å; F9-D13 PolarHBondContact O-N 3.18Å
10	L	52.8	Low	49.4	Very low	109 Å²	109	115.2 Å²	115.2	57%	0.571	63%	0.627	S	S	*	*	H	α-helix	trans	-63.8	-36	174.5	-98.9	145	0	0	0	112.7	L6 S7 L14	L6-L10 WeakPolarHBondContact O-CB 3.39Å; L6-L10 PolarHBondContact O-N 2.83Å; S7-L10 PolarHBondContact O-N 2.8Å; L10-L14 WeakPolarHBondContact O-CB 3.42Å; L10-L14 WeakPolarHBondContact O-CD1 3.45Å; L10-L14 PolarHBondContact O-N 3.07Å; L10-L14 VanDerWaalsContact O-N 3.13Å
11	T	54.2	Low	49	Very low	87 Å²	87	117.6 Å²	117.6	53%	0.534	64%	0.638	S	S	.	*	H	α-helix	trans	-73.6	-29.1	174.9	54.4	0	0	0	0	113.5	S7 V8 F9 A15	S7-T11 VanDerWaalsContact O-CG2 3.29Å; S7-T11 WeakPolarHBondContact O-CG2 3.28Å; S7-T11 PolarHBondContact O-N 3.13Å; S7-T11 PolarHBondContact O-OG1 3.12Å; S7-T11 VanDerWaalsContact O-OG1 3.08Å; V8-T11 WeakPolarHBondContact CA-OG1 3.47Å; V8-T11 PolarHBondContact O-N 3.09Å; V8-T11 PolarHBondContact O-OG1 3.26Å; F9-T11 VanDerWaalsContact C-N 3.33Å; F9-T11 PolarHBondContact O-N 3.11Å; T11-A15 WeakPolarHBondContact O-CB 3.31Å; T11-A15 PolarHBondContact O-N 3.45Å
12	L	50.4	Low	48.3	Very low	106 Å²	106	111.9 Å²	111.9	56%	0.555	62%	0.619	S	S	*	*	H	α-helix	trans	-74.7	-39	174.8	-102.2	105.5	0	0	0	111.7	V8 F9 A15 T16	V8-L12 HydrophobicContact CG1-CD1 3.76Å; V8-L12 VanDerWaalsContact O-CD1 3.32Å; V8-L12 WeakPolarHBondContact O-CD1 3.43Å; V8-L12 PolarHBondContact O-N 3.19Å; F9-L12 PolarHBondContact O-N 2.73Å; L12-A15 PolarHBondContact O-N 3.22Å; L12-T16 PolarHBondContact O-N 2.96Å
13	D	44.7	Very low	47.9	Very low	106 Å²	106	110.1 Å²	110.1	57%	0.567	62%	0.619	S	S	*	*	H	α-helix	trans	-67.4	-38.2	175	-82.3	-28.8	0	0	0	111.5	F9 A15 T16	F9-D13 PolarHBondContact O-N 3.18Å; D13-A15 VanDerWaalsContact C-N 3.3Å; D13-A15 PolarHBondContact O-N 3.07Å; D13-T16 PolarHBondContact O-N 3.48Å; D13-T16 PolarHBondContact O-OG1 2.95Å
14	L	44.7	Very low	47.8	Very low	123 Å²	123	109.7 Å²	109.7	64%	0.644	62%	0.616	S	S	*	*	H	α-helix	trans	-66.4	-26.9	173.1	-89.8	152.5	0	0	0	113.6	L10 T16	L10-L14 WeakPolarHBondContact O-CB 3.42Å; L10-L14 WeakPolarHBondContact O-CD1 3.45Å; L10-L14 PolarHBondContact O-N 3.07Å; L10-L14 VanDerWaalsContact O-N 3.13Å; L14-T16 VanDerWaalsContact C-N 3.34Å
15	A	41.9	Very low	47.4	Very low	61 Å²	61	104.7 Å²	104.7	50%	0.504	61%	0.61	S	S	.	*	H	α-helix	trans	-76	-20.8	175	0	0	0	0	0	113.1	T11 L12 D13	T11-A15 WeakPolarHBondContact O-CB 3.31Å; T11-A15 PolarHBondContact O-N 3.45Å; L12-A15 PolarHBondContact O-N 3.22Å; D13-A15 VanDerWaalsContact C-N 3.3Å; D13-A15 PolarHBondContact O-N 3.07Å
16	T	44.1	Very low	47.1	Very low	100 Å²	100	106 Å²	106	61%	0.613	62%	0.622	S	S	*	*	H	α-helix	trans	-85.7	-11.9	177.5	61.9	0	0	0	0	114.2	L12 D13 L14	L12-T16 PolarHBondContact O-N 2.96Å; D13-T16 PolarHBondContact O-N 3.48Å; D13-T16 PolarHBondContact O-OG1 2.95Å; L14-T16 VanDerWaalsContact C-N 3.34Å
17	V	44.6	Very low	47.1	Very low	123 Å²	123	104.5 Å²	104.5	75%	0.745	61%	0.614	S	S	*	*	S	Bend	trans	-97.6	-3.7	-179.7	-173.5	0	0	0	0	112.6
18	A	42.1	Very low	47.8	Very low	75 Å²	75	105.7 Å²	105.7	62%	0.62	62%	0.616	S	S	*	*			trans	-92.4	6.8	-178.2	0	0	0	0	0	115.5	S20	A18-S20 VanDerWaalsContact C-N 3.35Å; A18-S20 PolarHBondContact O-N 3.06Å
19	F	41.3	Very low	48.5	Very low	188 Å²	188	105.1 Å²	105.1	83%	0.825	61%	0.61	S	S	*	*			trans	-92.1	77.4	165.1	-73.3	-76.6	0	0	0	109.1	L21	F19-L21 PolarHBondContact O-N 3.36Å
20	S	37.6	Very low	49.5	Very low	79 Å²	79	103.2 Å²	103.2	55%	0.552	61%	0.605	S	S	*	*			trans	-52.8	125.5	161.4	45.6	0	0	0	0	108.6	A18 S22	A18-S20 VanDerWaalsContact C-N 3.35Å; A18-S20 PolarHBondContact O-N 3.06Å; S20-S22 PolarHBondContact O-N 3.02Å
21	L	41.3	Very low	50.8	Low	167 Å²	167	102.3 Å²	102.3	87%	0.874	60%	0.598	S	S	*	*			trans	-64.8	78.5	173.8	-81.7	149.5	0	0	0	109.2	F19 T23	F19-L21 PolarHBondContact O-N 3.36Å; L21-T23 PolarHBondContact O-N 3.42Å
22	S	37.8	Very low	51.9	Low	92 Å²	92	101.6 Å²	101.6	64%	0.643	59%	0.588	S	S	*	*			trans	-75.3	100.6	162	58.9	0	0	0	0	107.6	S20 C24	S20-S22 PolarHBondContact O-N 3.02Å; S22-C24 PolarHBondContact O-N 3.46Å
23	T	45	Very low	53.3	Low	118 Å²	118	99.2 Å²	99.2	72%	0.724	57%	0.574	S	S	*	*	S	Bend	trans	-70.5	24.4	-178.6	41	0	0	0	0	114.5	L21	L21-T23 PolarHBondContact O-N 3.42Å
24	C	50.7	Low	55.2	Low	101 Å²	101	102.7 Å²	102.7	68%	0.682	58%	0.58	S	S	*	*			trans	-149.8	71.1	171.8	-139.3	0	0	0	0	109.6	S22 T26	S22-C24 PolarHBondContact O-N 3.46Å; C24-T26 PolarHBondContact O-N 3.17Å
25	S	46.4	Very low	57.1	Low	88 Å²	88	102.4 Å²	102.4	62%	0.615	57%	0.573	S	S	*	*			trans	-57.4	135.3	167.1	56.1	0	0	0	0	109.7
26	T	47.2	Very low	59.1	Low	127 Å²	127	101.9 Å²	101.9	78%	0.779	56%	0.558	S	S	*	*			trans	-7.1	120.6	170.7	55.2	0	0	0	0	116	C24 D28	C24-T26 PolarHBondContact O-N 3.17Å; T26-D28 VanDerWaalsContact C-N 3.32Å; T26-D28 PolarHBondContact O-N 3.47Å
27	L	55.9	Low	61.1	Low	81 Å²	81	98.6 Å²	98.6	42%	0.424	54%	0.537	S	S	.	.			trans	-55.1	81.8	175.8	-81.9	140.3	0	0	0	112.6	M29 F32 A345	L27-M29 HydrophobicContact CD2-SD 3.95Å; L27-M29 PolarHBondContact O-N 3.45Å; L27-F32 HydrophobicContact CD2-CD2 4.47Å; L27-F32 HydrophobicContact CD2-CE2 4.13Å; L27-A345 HydrophobicContact CD2-CB 4.29Å
28	D	70.1	Confident	63.1	Low	81 Å²	81	99.1 Å²	99.1	43%	0.433	53%	0.531	S	S	.	.			trans	-77.5	97	158.9	-177.9	10.6	0	0	0	108.2	T26 D30 Q31 F32	T26-D28 VanDerWaalsContact C-N 3.32Å; T26-D28 PolarHBondContact O-N 3.47Å; D28-D30 PolarHBondContact O-N 3.11Å; D28-D30 PolarHBondContact OD1-N 3.22Å; D28-Q31 HydrophobicContact CB-CB 4Å; D28-Q31 WeakPolarHBondContact O-CB 3.49Å; D28-Q31 PolarHBondContact O-N 2.57Å; D28-Q31 VanDerWaalsContact O-N 3.07Å; D28-F32 WeakPolarHBondContact O-CD2 3.46Å; D28-F32 PolarHBondContact O-N 2.84Å
29	M	71.3	Confident	65.1	Low	63 Å²	63	98.1 Å²	98.1	31%	0.31	52%	0.523	S	S	.	.	H	α-helix	trans	-57.3	-31.8	-178.4	-67.3	-60	-73.6	0	0	111.9	L27 F32 M33 R318 F343 A345	L27-M29 HydrophobicContact CD2-SD 3.95Å; L27-M29 PolarHBondContact O-N 3.45Å; M29-F32 PolarHBondContact O-N 2.9Å; M29-M33 WeakPolarHBondContact O-CG 3.18Å; M29-M33 PolarHBondContact O-N 3.4Å; M29-R318 HydrophobicContact CE-CB 4.38Å; M29-R318 HydrophobicContact CE-CG 3.86Å; M29-F343 HydrophobicContact CE-CE2 3.79Å; M29-F343 HydrophobicContact CE-CZ 3.6Å; M29-A345 HydrophobicContact CE-CB 4.28Å; M29-A345 HydrophobicContact SD-CB 4.38Å
30	D	76.1	Confident	67.2	Low	92 Å²	92	89.2 Å²	89.2	49%	0.492	48%	0.483	S	S	.	.	H	α-helix	trans	-69	-37.8	178.5	-69.8	-19.1	0	0	0	111.4	D28 M33 R34	D28-D30 PolarHBondContact O-N 3.11Å; D28-D30 PolarHBondContact OD1-N 3.22Å; D30-M33 PolarHBondContact O-N 3.47Å; D30-M33 WeakPolarHBondContact OD1-CE 3.24Å; D30-R34 WeakPolarHBondContact O-CG 3.48Å; D30-R34 PolarHBondContact O-N 2.86Å
31	Q	80	Confident	69.5	Low	90 Å²	90	90.6 Å²	90.6	42%	0.421	48%	0.476	S	S	.	.	H	α-helix	trans	-65.2	-40.3	174.5	-162.8	-174.8	30.2	0	0	111.8	D28 R34 K35	D28-Q31 HydrophobicContact CB-CB 4Å; D28-Q31 WeakPolarHBondContact O-CB 3.49Å; D28-Q31 PolarHBondContact O-N 2.57Å; D28-Q31 VanDerWaalsContact O-N 3.07Å; Q31-R34 PolarHBondContact O-N 3Å; Q31-K35 WeakPolarHBondContact O-CG 3.37Å; Q31-K35 PolarHBondContact O-N 3.27Å
32	F	77.1	Confident	71.4	Confident	73 Å²	73	84.6 Å²	84.6	32%	0.32	46%	0.455	S	S	.	.	H	α-helix	trans	-65.1	-42	174.5	-83.3	-79.3	0	0	0	112.2	L27 D28 M29 K35 R36 F343	L27-F32 HydrophobicContact CD2-CD2 4.47Å; L27-F32 HydrophobicContact CD2-CE2 4.13Å; D28-F32 WeakPolarHBondContact O-CD2 3.46Å; D28-F32 PolarHBondContact O-N 2.84Å; M29-F32 PolarHBondContact O-N 2.9Å; F32-K35 PolarHBondContact O-N 2.95Å; F32-R36 WeakPolarHBondContact O-CB 3.3Å; F32-R36 PolarHBondContact O-N 2.68Å; F32-F343 HydrophobicContact CB-CE2 4.08Å
33	M	80.3	Confident	73.5	Confident	55 Å²	55	82.6 Å²	82.6	27%	0.271	44%	0.435	S	S	.	.	H	α-helix	trans	-61	-46.1	175.8	-73.4	-168.8	-70.6	0	0	111.4	M29 D30 R36 I37 L320 F343	M29-M33 WeakPolarHBondContact O-CG 3.18Å; M29-M33 PolarHBondContact O-N 3.4Å; D30-M33 PolarHBondContact O-N 3.47Å; D30-M33 WeakPolarHBondContact OD1-CE 3.24Å; M33-R36 PolarHBondContact O-N 3.24Å; M33-I37 VanDerWaalsContact O-CG1 3.31Å; M33-I37 WeakPolarHBondContact O-CG1 3.25Å; M33-I37 PolarHBondContact O-N 3.42Å; M33-L320 HydrophobicContact CB-CD1 4.32Å; M33-L320 HydrophobicContact CG-CD1 3.99Å; M33-L320 HydrophobicContact SD-CD1 3.84Å; M33-F343 HydrophobicContact CG-CE1 3.74Å; M33-F343 HydrophobicContact CG-CZ 3.77Å; M33-F343 HydrophobicContact SD-CE1 4.43Å
34	R	84.3	Confident	75.2	Confident	180 Å²	180	77 Å²	77	68%	0.679	40%	0.401	S	S	*	.	H	α-helix	trans	-60.4	-48.7	176.9	-71.7	177.7	-171.8	-162.6	4.5	112.4	D30 Q31 R36 I37 E38	D30-R34 WeakPolarHBondContact O-CG 3.48Å; D30-R34 PolarHBondContact O-N 2.86Å; Q31-R34 PolarHBondContact O-N 3Å; R34-R36 VanDerWaalsContact C-N 3.26Å; R34-R36 PolarHBondContact O-N 3.37Å; R34-I37 PolarHBondContact O-N 3.12Å; R34-I37 VanDerWaalsContact O-N 3.16Å; R34-E38 PolarHBondContact O-N 3.18Å
35	K	84	Confident	76.7	Confident	116 Å²	116	73.2 Å²	73.2	50%	0.504	37%	0.374	S	S	.	.	H	α-helix	trans	-58.7	-38.4	176.4	-75	178	178.3	175.5	0	112	Q31 F32 A39	Q31-K35 WeakPolarHBondContact O-CG 3.37Å; Q31-K35 PolarHBondContact O-N 3.27Å; F32-K35 PolarHBondContact O-N 2.95Å; K35-A39 WeakPolarHBondContact O-CB 3.09Å; K35-A39 PolarHBondContact O-N 3.12Å
36	R	84.9	Confident	78.2	Confident	51 Å²	51	73.3 Å²	73.3	19%	0.192	38%	0.375	C	S	.	.	H	α-helix	trans	-67.1	-41.9	177	-177.7	62.6	174.2	179.4	9.5	112.1	F32 M33 R34 E38 A39 I40 L320 N342 F343	F32-R36 WeakPolarHBondContact O-CB 3.3Å; F32-R36 PolarHBondContact O-N 2.68Å; M33-R36 PolarHBondContact O-N 3.24Å; R34-R36 VanDerWaalsContact C-N 3.26Å; R34-R36 PolarHBondContact O-N 3.37Å; R36-E38 VanDerWaalsContact C-N 3.35Å; R36-A39 PolarHBondContact O-N 3.02Å; R36-I40 HydrophobicContact CG-CD1 3.92Å; R36-I40 WeakPolarHBondContact O-CB 3.42Å; R36-I40 WeakPolarHBondContact O-CG1 3.03Å; R36-I40 PolarHBondContact O-N 2.75Å; R36-L320 HydrophobicContact CB-CD2 4.11Å; R36-L320 HydrophobicContact CG-CD2 3.74Å; R36-N342 PolarHBondContact NE-O 3.25Å; R36-F343 HydrophobicContact CG-CB 4.14Å
37	I	85.8	Confident	79.7	Confident	31 Å²	31	69 Å²	69	16%	0.159	35%	0.345	C	S	.	.	H	α-helix	trans	-61	-45.3	176.8	-68.4	163.5	0	0	0	110.2	M33 R34 I40 R41 I322 D327 L328	M33-I37 VanDerWaalsContact O-CG1 3.31Å; M33-I37 WeakPolarHBondContact O-CG1 3.25Å; M33-I37 PolarHBondContact O-N 3.42Å; R34-I37 PolarHBondContact O-N 3.12Å; R34-I37 VanDerWaalsContact O-N 3.16Å; I37-I40 PolarHBondContact O-N 2.74Å; I37-R41 PolarHBondContact O-N 2.94Å; I37-I322 HydrophobicContact CG1-CD1 4.11Å; I37-I322 HydrophobicContact CG1-CG1 4.29Å; I37-D327 HydrophobicContact CD1-CB 4.41Å; I37-L328 HydrophobicContact CG2-CD2 3.74Å; I37-L328 HydrophobicContact CG2-CG 4.27Å
38	E	85.7	Confident	80.7	Confident	134 Å²	134	65.5 Å²	65.5	63%	0.626	33%	0.327	S	S	*	.	H	α-helix	trans	-64	-41.9	176.4	-71.2	178	177.2	0	0	112.6	R34 R36 I40 R41 G42	R34-E38 PolarHBondContact O-N 3.18Å; R36-E38 VanDerWaalsContact C-N 3.35Å; E38-I40 VanDerWaalsContact C-N 3.32Å; E38-I40 PolarHBondContact O-N 3.23Å; E38-R41 VanDerWaalsContact O-CB 3.3Å; E38-R41 WeakPolarHBondContact O-CB 3.47Å; E38-R41 PolarHBondContact O-N 3.15Å; E38-G42 PolarHBondContact O-N 2.75Å; E38-G42 VanDerWaalsContact O-N 3.14Å
39	A	84.5	Confident	81	Confident	54 Å²	54	67.6 Å²	67.6	45%	0.446	33%	0.332	S	S	.	.	H	α-helix	trans	-60.9	-42.1	175.3	0	0	0	0	0	111.8	K35 R36 G42 Q43	K35-A39 WeakPolarHBondContact O-CB 3.09Å; K35-A39 PolarHBondContact O-N 3.12Å; R36-A39 PolarHBondContact O-N 3.02Å; A39-G42 PolarHBondContact O-N 3Å; A39-Q43 VanDerWaalsContact O-CB 3.27Å; A39-Q43 WeakPolarHBondContact O-CB 3.48Å; A39-Q43 PolarHBondContact O-N 2.9Å
40	I	85.3	Confident	81.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.2	-39.5	177.3	-76.2	167.1	0	0	0	111.1	R36 I37 E38 G42 Q43 I44 I322 Y339 A341 M404	R36-I40 HydrophobicContact CG-CD1 3.92Å; R36-I40 WeakPolarHBondContact O-CB 3.42Å; R36-I40 WeakPolarHBondContact O-CG1 3.03Å; R36-I40 PolarHBondContact O-N 2.75Å; I37-I40 PolarHBondContact O-N 2.74Å; E38-I40 VanDerWaalsContact C-N 3.32Å; E38-I40 PolarHBondContact O-N 3.23Å; I40-G42 PolarHBondContact O-N 3.16Å; I40-Q43 PolarHBondContact O-N 3.39Å; I40-I44 HydrophobicContact CG2-CD1 3.75Å; I40-I44 HydrophobicContact CG2-CG1 4.33Å; I40-I44 WeakPolarHBondContact O-CG1 3.43Å; I40-I44 PolarHBondContact O-N 3.21Å; I40-I322 HydrophobicContact CB-CD1 4.45Å; I40-I322 HydrophobicContact CD1-CD1 3.23Å; I40-I322 HydrophobicContact CG1-CD1 4.41Å; I40-I322 HydrophobicContact CG2-CD1 4.33Å; I40-Y339 VanDerWaalsContact CG2-OH 3.26Å; I40-Y339 WeakPolarHBondContact CG2-OH 3.39Å; I40-A341 HydrophobicContact CD1-CB 3.57Å; I40-M404 HydrophobicContact CG2-CE 3.93Å
41	R	85.5	Confident	81.5	Confident	108 Å²	108	69 Å²	69	41%	0.408	35%	0.346	S	S	.	.	H	α-helix	trans	-53.7	-53.5	173.4	-169.6	-178	-105.5	172.3	-4.5	111.2	I37 E38 L45 L328 W330	I37-R41 PolarHBondContact O-N 2.94Å; E38-R41 VanDerWaalsContact O-CB 3.3Å; E38-R41 WeakPolarHBondContact O-CB 3.47Å; E38-R41 PolarHBondContact O-N 3.15Å; R41-L45 WeakPolarHBondContact O-CG 3.42Å; R41-L45 PolarHBondContact O-N 3.18Å; R41-L328 HydrophobicContact CB-CD2 3.64Å; R41-L328 HydrophobicContact CG-CD2 3.98Å; R41-L328 PolarHBondContact NH2-O 2.96Å; R41-W330 HydrophobicContact CB-CH2 4.49Å; R41-W330 HydrophobicContact CB-CZ2 4.4Å; R41-W330 HydrophobicContact CG-CH2 3.92Å; R41-W330 HydrophobicContact CG-CZ2 3.39Å
42	G	82.4	Confident	81.7	Confident	41 Å²	41	67.4 Å²	67.4	42%	0.423	35%	0.345	S	S	.	.	H	α-helix	trans	-64.8	-39.3	178.5	0	0	0	0	0	112.7	E38 A39 I40 S46	E38-G42 PolarHBondContact O-N 2.75Å; E38-G42 VanDerWaalsContact O-N 3.14Å; A39-G42 PolarHBondContact O-N 3Å; I40-G42 PolarHBondContact O-N 3.16Å; G42-S46 WeakPolarHBondContact O-CB 3.26Å; G42-S46 PolarHBondContact O-N 3.38Å
43	Q	80.8	Confident	82.1	Confident	50 Å²	50	65.9 Å²	65.9	23%	0.234	34%	0.342	C	S	.	.	H	α-helix	trans	-63.4	-43.5	179.9	-171.6	179.6	3.8	0	0	112.2	A39 I40 K47 N403 M404	A39-Q43 VanDerWaalsContact O-CB 3.27Å; A39-Q43 WeakPolarHBondContact O-CB 3.48Å; A39-Q43 PolarHBondContact O-N 2.9Å; I40-Q43 PolarHBondContact O-N 3.39Å; Q43-K47 HydrophobicContact CG-CD 4.03Å; Q43-K47 VanDerWaalsContact NE2-CE 3.33Å; Q43-K47 VanDerWaalsContact O-CB 3.28Å; Q43-K47 WeakPolarHBondContact O-CB 3.28Å; Q43-K47 WeakPolarHBondContact O-CG 3.41Å; Q43-K47 PolarHBondContact O-N 3.27Å; Q43-N403 PolarHBondContact NE2-O 3.25Å; Q43-M404 HydrophobicContact CG-SD 3.93Å
44	I	81.4	Confident	82.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.7	-51.7	178.7	-67.3	170	0	0	0	110.2	I40 S46 K47 L48 F324 W330 W332 I333 L401 M404	I40-I44 HydrophobicContact CG2-CD1 3.75Å; I40-I44 HydrophobicContact CG2-CG1 4.33Å; I40-I44 WeakPolarHBondContact O-CG1 3.43Å; I40-I44 PolarHBondContact O-N 3.21Å; I44-S46 VanDerWaalsContact C-N 3.34Å; I44-S46 PolarHBondContact O-N 3.01Å; I44-K47 PolarHBondContact O-N 3.21Å; I44-L48 HydrophobicContact CG2-CD1 3.75Å; I44-L48 HydrophobicContact CG2-CG 4.39Å; I44-L48 WeakPolarHBondContact O-CB 3.36Å; I44-L48 WeakPolarHBondContact O-CG 3.48Å; I44-L48 PolarHBondContact O-N 2.76Å; I44-F324 HydrophobicContact CD1-CE1 3.76Å; I44-W330 HydrophobicContact CB-CH2 3.97Å; I44-W330 HydrophobicContact CB-CZ3 3.93Å; I44-W330 HydrophobicContact CD1-CH2 4.41Å; I44-W330 HydrophobicContact CD1-CZ3 3.73Å; I44-W330 HydrophobicContact CG1-CZ3 4.42Å; I44-W330 HydrophobicContact CG2-CH2 4.04Å; I44-W330 HydrophobicContact CG2-CZ3 3.74Å; I44-W332 HydrophobicContact CG2-CH2 4.26Å; I44-I333 HydrophobicContact CG2-CD1 4.47Å; I44-L401 HydrophobicContact CB-CD1 4.38Å; I44-L401 HydrophobicContact CG1-CD1 3.94Å; I44-L401 HydrophobicContact CG2-CD1 4Å; I44-M404 HydrophobicContact CD1-CE 3.9Å; I44-M404 HydrophobicContact CG1-CE 3.45Å; I44-M404 VanDerWaalsContact CG1-CE 3.45Å; I44-M404 HydrophobicContact CG1-SD 4.38Å
45	L	82.6	Confident	81.9	Confident	23 Å²	23	63 Å²	63	12%	0.12	34%	0.342	C	S	.	.	H	α-helix	trans	-59	-45.7	-179.8	-69.7	178.3	0	0	0	111.5	R41 K47 L48 K49 L50 W330 W332	R41-L45 WeakPolarHBondContact O-CG 3.42Å; R41-L45 PolarHBondContact O-N 3.18Å; L45-K47 PolarHBondContact O-N 3.14Å; L45-L48 CarbonylContact O-C 3.38Å; L45-L48 PolarHBondContact O-N 3.31Å; L45-K49 PolarHBondContact O-N 3.14Å; L45-L50 CarbonylContact C-O 3.53Å; L45-L50 WeakPolarHBondContact CB-O 3.48Å; L45-L50 HydrophobicContact CD2-CB 4.05Å; L45-L50 PolarHBondContact O-N 3.01Å; L45-W330 HydrophobicContact CD1-CZ2 4.06Å; L45-W330 HydrophobicContact CD2-CH2 4.23Å; L45-W330 HydrophobicContact CD2-CZ2 4.11Å; L45-W330 HydrophobicContact CG-CH2 3.95Å; L45-W330 HydrophobicContact CG-CZ2 3.91Å; L45-W332 HydrophobicContact CD2-CZ2 4.3Å
46	S	77.4	Confident	81.5	Confident	89 Å²	89	64.7 Å²	64.7	62%	0.622	35%	0.352	S	S	*	.	H	α-helix	trans	-61.1	-43.8	176.2	-179.1	0	0	0	0	112.6	G42 I44 L48 K49	G42-S46 WeakPolarHBondContact O-CB 3.26Å; G42-S46 PolarHBondContact O-N 3.38Å; I44-S46 VanDerWaalsContact C-N 3.34Å; I44-S46 PolarHBondContact O-N 3.01Å; S46-L48 VanDerWaalsContact C-N 3.3Å; S46-L48 PolarHBondContact O-N 2.86Å; S46-K49 PolarHBondContact O-N 3.09Å
47	K	78.7	Confident	81.1	Confident	36 Å²	36	66.3 Å²	66.3	16%	0.157	36%	0.359	C	S	.	.	H	α-helix	trans	-68.7	-27.5	178.2	-76.8	176.8	-177.6	-74.2	0	113.1	Q43 I44 L45 K49 R288 L401 S402 M404	Q43-K47 HydrophobicContact CG-CD 4.03Å; Q43-K47 VanDerWaalsContact NE2-CE 3.33Å; Q43-K47 VanDerWaalsContact O-CB 3.28Å; Q43-K47 WeakPolarHBondContact O-CB 3.28Å; Q43-K47 WeakPolarHBondContact O-CG 3.41Å; Q43-K47 PolarHBondContact O-N 3.27Å; I44-K47 PolarHBondContact O-N 3.21Å; L45-K47 PolarHBondContact O-N 3.14Å; K47-K49 VanDerWaalsContact C-N 3.31Å; K47-R288 PolarHBondContact O-NH2 2.99Å; K47-L401 HydrophobicContact CB-CD2 3.83Å; K47-L401 HydrophobicContact CD-CB 4.41Å; K47-L401 HydrophobicContact CD-CD2 4.47Å; K47-S402 WeakPolarHBondContact CE-O 3.46Å; K47-S402 PolarHBondContact NZ-O 3.17Å; K47-S402 PolarHBondContact NZ-OG 2.68Å; K47-M404 HydrophobicContact CD-SD 4.09Å
48	L	76.5	Confident	80.5	Confident	9 Å²	9	66.3 Å²	66.3	5%	0.047	36%	0.361	C	S	.	.	H	α-helix	trans	-86.7	-5.1	171.7	-63.9	175.8	0	0	0	112.6	I44 L45 S46 L50 W332 I388 Y390 E399 L401	I44-L48 HydrophobicContact CG2-CD1 3.75Å; I44-L48 HydrophobicContact CG2-CG 4.39Å; I44-L48 WeakPolarHBondContact O-CB 3.36Å; I44-L48 WeakPolarHBondContact O-CG 3.48Å; I44-L48 PolarHBondContact O-N 2.76Å; L45-L48 CarbonylContact O-C 3.38Å; L45-L48 PolarHBondContact O-N 3.31Å; S46-L48 VanDerWaalsContact C-N 3.3Å; S46-L48 PolarHBondContact O-N 2.86Å; L48-L50 HydrophobicContact CB-CB 4.47Å; L48-L50 HydrophobicContact CB-CD1 3.92Å; L48-L50 HydrophobicContact CB-CG 3.84Å; L48-L50 HydrophobicContact CD1-CD1 4.07Å; L48-L50 PolarHBondContact O-N 3.07Å; L48-W332 HydrophobicContact CD1-CH2 3.5Å; L48-W332 VanDerWaalsContact CD1-CH2 3.5Å; L48-W332 HydrophobicContact CD1-CZ3 3.88Å; L48-I388 HydrophobicContact CD1-CD1 3.88Å; L48-I388 HydrophobicContact CD2-CD1 4.19Å; L48-I388 HydrophobicContact CG-CD1 4.49Å; L48-Y390 HydrophobicContact CD1-CE1 4.48Å; L48-Y390 HydrophobicContact CD2-CE1 3.82Å; L48-E399 HydrophobicContact CD2-CB 4.41Å; L48-E399 VanDerWaalsContact CD2-OE2 3.27Å; L48-E399 WeakPolarHBondContact CD2-OE2 3.06Å; L48-L401 HydrophobicContact CD2-CD2 3.76Å; L48-L401 HydrophobicContact CG-CD2 4.08Å
49	K	76.9	Confident	79.9	Confident	125 Å²	125	66 Å²	66	54%	0.543	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	35.1	-170.4	-61.6	-170.9	174.8	-167.8	0	113	L45 S46 K47 Y287	L45-K49 PolarHBondContact O-N 3.14Å; S46-K49 PolarHBondContact O-N 3.09Å; K47-K49 VanDerWaalsContact C-N 3.31Å; K49-Y287 HydrophobicContact CD-CD2 4.1Å; K49-Y287 HydrophobicContact CD-CE2 3.68Å; K49-Y287 VanDerWaalsContact NZ-CD2 3.27Å
50	L	77.3	Confident	79.1	Confident	40 Å²	40	66 Å²	66	21%	0.209	36%	0.355	C	S	.	.			trans	-97.7	135.2	173.4	-62.2	177.1	0	0	0	109.2	L45 L48 P54 W332 Y390	L45-L50 CarbonylContact C-O 3.53Å; L45-L50 WeakPolarHBondContact CB-O 3.48Å; L45-L50 HydrophobicContact CD2-CB 4.05Å; L45-L50 PolarHBondContact O-N 3.01Å; L48-L50 HydrophobicContact CB-CB 4.47Å; L48-L50 HydrophobicContact CB-CD1 3.92Å; L48-L50 HydrophobicContact CB-CG 3.84Å; L48-L50 HydrophobicContact CD1-CD1 4.07Å; L48-L50 PolarHBondContact O-N 3.07Å; L50-P54 HydrophobicContact CD1-CG 4.23Å; L50-W332 HydrophobicContact CD1-CH2 4.38Å; L50-W332 HydrophobicContact CD1-CZ3 4.36Å; L50-Y390 HydrophobicContact CD1-CE2 4.34Å
51	T	80.4	Confident	78.2	Confident	144 Å²	144	75 Å²	75	88%	0.883	40%	0.397	S	S	*	.	S	Bend	trans	-78.5	-29.9	173.2	46.7	0	0	0	0	111.9
52	S	84.5	Confident	77.5	Confident	56 Å²	56	76 Å²	76	39%	0.392	41%	0.407	S	S	.	.	S	Bend	trans	-147.8	161.6	178.5	52.1	0	0	0	0	109.7
53	P	85.1	Confident	77.4	Confident	42 Å²	42	74.7 Å²	74.7	27%	0.273	39%	0.39	S	S	.	.			trans	-47.5	144.6	165.6	-30.9	39.6	0	0	0	112.1	D55 W332	P53-D55 PolarHBondContact O-N 2.95Å; P53-W332 HydrophobicContact CB-CG 4.38Å
54	P	84.6	Confident	77.6	Confident	19 Å²	19	75.1 Å²	75.1	12%	0.123	40%	0.397	C	S	.	.			trans	-58.9	135.3	172.8	-21.6	33.1	0	0	0	111.2	L50 Y57 W332	L50-P54 HydrophobicContact CD1-CG 4.23Å; P54-Y57 VanDerWaalsContact O-CD1 3.26Å; P54-Y57 WeakPolarHBondContact O-CD1 3.5Å; P54-Y57 WeakPolarHBondContact O-CE1 3.1Å; P54-W332 HydrophobicContact CG-CD2 4.34Å; P54-W332 HydrophobicContact CG-CE3 3.99Å
55	D	76.4	Confident	77.7	Confident	154 Å²	154	80.4 Å²	80.4	82%	0.824	43%	0.431	S	S	*	.	S	Bend	trans	-76.3	-29.5	-178.7	-62.6	-47.1	0	0	0	112.6	P53	P53-D55 PolarHBondContact O-N 2.95Å
56	E	75.9	Confident	77.6	Confident	152 Å²	152	85.8 Å²	85.8	71%	0.71	46%	0.456	S	S	*	.			trans	-119.1	123.3	176.9	-70	-176.8	-176.7	0	0	111
57	Y	76.1	Confident	77.9	Confident	85 Å²	85	82.2 Å²	82.2	33%	0.333	43%	0.43	S	S	.	.			trans	-152.1	142.2	174.8	50.8	-89.3	0	0	0	110	P54 K331 W332	P54-Y57 VanDerWaalsContact O-CD1 3.26Å; P54-Y57 WeakPolarHBondContact O-CD1 3.5Å; P54-Y57 WeakPolarHBondContact O-CE1 3.1Å; Y57-K331 HydrophobicContact CE2-CB 3.83Å; Y57-W332 HydrophobicContact CD1-CB 3.44Å; Y57-W332 VanDerWaalsContact CD1-CB 3.44Å; Y57-W332 HydrophobicContact CD2-CB 3.98Å; Y57-W332 HydrophobicContact CE1-CB 3.64Å; Y57-W332 HydrophobicContact CE2-CB 4.16Å; Y57-W332 HydrophobicContact CG-CB 3.63Å
58	P	73.3	Confident	78.2	Confident	31 Å²	31	83.4 Å²	83.4	20%	0.201	44%	0.438	C	S	.	.			trans	-65.4	159.7	175.8	28.2	-33.2	0	0	0	110.7	E62 H334 Y391	P58-E62 HydrophobicContact CB-CB 4.41Å; P58-H334 PolarHBondContact O-CE1 2.93Å; P58-H334 PolarHBondContact O-NE2 2.95Å; P58-Y391 VanDerWaalsContact CD-CG 3.47Å; P58-Y391 HydrophobicContact CG-CD1 3.61Å; P58-Y391 HydrophobicContact CG-CD2 3.6Å; P58-Y391 HydrophobicContact CG-CE1 3.82Å; P58-Y391 HydrophobicContact CG-CE2 3.81Å; P58-Y391 HydrophobicContact CG-CG 3.5Å
59	E	73.1	Confident	78.6	Confident	128 Å²	128	84.1 Å²	84.1	60%	0.598	44%	0.444	S	S	*	.			trans	-72.7	153.9	177.3	-71.3	-156.8	159.5	0	0	112	E61 E62	E59-E61 PolarHBondContact O-N 3.37Å; E59-E61 VanDerWaalsContact O-N 3.09Å; E59-E62 HydrophobicContact CB-CG 4.29Å; E59-E62 PolarHBondContact N-OE2 2.97Å; E59-E62 VanDerWaalsContact N-OE2 3.15Å; E59-E62 WeakPolarHBondContact O-CB 3.33Å; E59-E62 PolarHBondContact O-N 3.04Å
60	P	66.3	Low	78.9	Confident	55 Å²	55	79.6 Å²	79.6	36%	0.357	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-49.8	-32.4	177.3	-32.3	38.6	0	0	0	116.7	E62	P60-E62 VanDerWaalsContact C-N 3.28Å
61	E	67.1	Low	79.3	Confident	188 Å²	188	78.1 Å²	78.1	88%	0.879	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-79.6	-12.7	-178.4	-65.3	176.8	-176.3	0	0	112.6	E59	E59-E61 PolarHBondContact O-N 3.37Å; E59-E61 VanDerWaalsContact O-N 3.09Å
62	E	70.8	Confident	79.7	Confident	130 Å²	130	73.8 Å²	73.8	61%	0.607	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-96.4	-0.1	-177.2	-58.7	-177.5	146.9	0	0	113.4	P58 E59 P60 P64	P58-E62 HydrophobicContact CB-CB 4.41Å; E59-E62 HydrophobicContact CB-CG 4.29Å; E59-E62 PolarHBondContact N-OE2 2.97Å; E59-E62 VanDerWaalsContact N-OE2 3.15Å; E59-E62 WeakPolarHBondContact O-CB 3.33Å; E59-E62 PolarHBondContact O-N 3.04Å; P60-E62 VanDerWaalsContact C-N 3.28Å; E62-P64 WeakPolarHBondContact O-CD 3.22Å
63	V	80.4	Confident	79.7	Confident	13 Å²	13	71.5 Å²	71.5	8%	0.079	37%	0.372	C	S	.	.			trans	-66.8	125.2	-177.7	-176.5	0	0	0	0	110	V67 I68 H334 L389 Y391	V63-V67 HydrophobicContact CG1-CB 4.04Å; V63-V67 HydrophobicContact CG1-CG1 4.14Å; V63-I68 HydrophobicContact CB-CD1 4Å; V63-I68 HydrophobicContact CB-CG1 4.18Å; V63-I68 HydrophobicContact CG1-CD1 4.01Å; V63-I68 HydrophobicContact CG1-CG1 3.64Å; V63-H334 HydrophobicContact CG2-CB 4.19Å; V63-H334 WeakPolarHBondContact CG2-CD2 3.35Å; V63-L389 HydrophobicContact CG1-CD2 3.99Å; V63-Y391 HydrophobicContact CG1-CE2 4.32Å; V63-Y391 HydrophobicContact CG2-CE2 4.04Å
64	P	85.4	Confident	79.7	Confident	58 Å²	58	69.7 Å²	69.7	38%	0.377	36%	0.36	S	S	.	.			trans	-59.4	142.6	179.1	-25	35.5	0	0	0	112.1	E62 E66 V67 I68 Y391	E62-P64 WeakPolarHBondContact O-CD 3.22Å; P64-E66 PolarHBondContact O-N 2.86Å; P64-E66 VanDerWaalsContact O-N 3.12Å; P64-V67 HydrophobicContact CB-CG2 4.32Å; P64-V67 HydrophobicContact CG-CG2 4.47Å; P64-V67 PolarHBondContact O-N 3.1Å; P64-I68 PolarHBondContact O-N 3.19Å; P64-Y391 WeakPolarHBondContact CD-OH 3.29Å
65	P	82.3	Confident	79.7	Confident	111 Å²	111	73.8 Å²	73.8	72%	0.721	37%	0.373	S	S	*	.	H	α-helix	trans	-60.9	-26.8	-177.6	24	-34.3	0	0	0	113	S69	P65-S69 WeakPolarHBondContact O-CB 3.44Å; P65-S69 PolarHBondContact O-N 2.87Å
66	E	81.5	Confident	80.2	Confident	137 Å²	137	68.9 Å²	68.9	64%	0.64	35%	0.347	S	S	*	.	H	α-helix	trans	-62.7	-45	175.2	-172.1	175.5	-176.9	0	0	111.9	P64 S69 I70	P64-E66 PolarHBondContact O-N 2.86Å; P64-E66 VanDerWaalsContact O-N 3.12Å; E66-S69 VanDerWaalsContact O-CB 3.29Å; E66-S69 WeakPolarHBondContact O-CB 3.43Å; E66-S69 PolarHBondContact O-N 2.8Å; E66-I70 WeakPolarHBondContact O-CG1 3.38Å; E66-I70 PolarHBondContact O-N 3.44Å
67	V	83.6	Confident	80.5	Confident	14 Å²	14	61.7 Å²	61.7	9%	0.085	31%	0.313	C	S	.	.	H	α-helix	trans	-67.2	-43	179.8	-179.5	0	0	0	0	110.8	V63 P64 S69 I70 Y71 L389 P396 I398	V63-V67 HydrophobicContact CG1-CB 4.04Å; V63-V67 HydrophobicContact CG1-CG1 4.14Å; P64-V67 HydrophobicContact CB-CG2 4.32Å; P64-V67 HydrophobicContact CG-CG2 4.47Å; P64-V67 PolarHBondContact O-N 3.1Å; V67-S69 VanDerWaalsContact C-N 3.25Å; V67-S69 PolarHBondContact O-N 2.84Å; V67-I70 WeakPolarHBondContact O-CB 3.26Å; V67-I70 PolarHBondContact O-N 2.81Å; V67-I70 VanDerWaalsContact O-N 3.15Å; V67-Y71 PolarHBondContact O-N 3.06Å; V67-Y71 VanDerWaalsContact O-N 3.14Å; V67-L389 HydrophobicContact CG1-CD1 3.36Å; V67-L389 HydrophobicContact CG1-CD2 3.9Å; V67-L389 HydrophobicContact CG1-CG 4.3Å; V67-P396 HydrophobicContact CB-CB 4.36Å; V67-P396 HydrophobicContact CG1-CB 3.61Å; V67-P396 HydrophobicContact CG1-CG 4.39Å; V67-P396 HydrophobicContact CG2-CB 3.75Å; V67-P396 HydrophobicContact CG2-CG 3.65Å; V67-I398 HydrophobicContact CG1-CD1 4.16Å
68	I	85.4	Confident	80.7	Confident	61 Å²	61	59.9 Å²	59.9	31%	0.313	31%	0.309	S	S	.	.	H	α-helix	trans	-61.5	-36.7	175.3	-67.2	164.3	0	0	0	110.8	V63 P64 I70 Y71 N72	V63-I68 HydrophobicContact CB-CD1 4Å; V63-I68 HydrophobicContact CB-CG1 4.18Å; V63-I68 HydrophobicContact CG1-CD1 4.01Å; V63-I68 HydrophobicContact CG1-CG1 3.64Å; P64-I68 PolarHBondContact O-N 3.19Å; I68-I70 VanDerWaalsContact C-N 3.32Å; I68-I70 PolarHBondContact O-N 3.09Å; I68-Y71 PolarHBondContact O-N 2.98Å; I68-N72 WeakPolarHBondContact CG2-ND2 3.02Å; I68-N72 WeakPolarHBondContact O-CB 3.4Å; I68-N72 PolarHBondContact O-N 3.46Å; I68-N72 PolarHBondContact O-ND2 2.81Å
69	S	84.1	Confident	81.1	Confident	24 Å²	24	63.6 Å²	63.6	17%	0.168	32%	0.324	C	S	.	.	H	α-helix	trans	-60.1	-40.4	175.4	172.2	0	0	0	0	112	P65 E66 V67 S73 K105	P65-S69 WeakPolarHBondContact O-CB 3.44Å; P65-S69 PolarHBondContact O-N 2.87Å; E66-S69 VanDerWaalsContact O-CB 3.29Å; E66-S69 WeakPolarHBondContact O-CB 3.43Å; E66-S69 PolarHBondContact O-N 2.8Å; V67-S69 VanDerWaalsContact C-N 3.25Å; V67-S69 PolarHBondContact O-N 2.84Å; S69-S73 WeakPolarHBondContact O-CB 3.13Å; S69-S73 PolarHBondContact O-N 3.42Å; S69-K105 PolarHBondContact OG-NZ 3.4Å
70	I	83.4	Confident	81.4	Confident	29 Å²	29	60.5 Å²	60.5	15%	0.149	31%	0.309	C	S	.	.	H	α-helix	trans	-64.6	-47.8	176	-52.4	-179.4	0	0	0	110.6	E66 V67 I68 S73 T74 K105 I398	E66-I70 WeakPolarHBondContact O-CG1 3.38Å; E66-I70 PolarHBondContact O-N 3.44Å; V67-I70 WeakPolarHBondContact O-CB 3.26Å; V67-I70 PolarHBondContact O-N 2.81Å; V67-I70 VanDerWaalsContact O-N 3.15Å; I68-I70 VanDerWaalsContact C-N 3.32Å; I68-I70 PolarHBondContact O-N 3.09Å; I70-S73 PolarHBondContact O-N 2.83Å; I70-T74 WeakPolarHBondContact O-CB 3.21Å; I70-T74 PolarHBondContact O-N 3.35Å; I70-T74 PolarHBondContact O-OG1 3.22Å; I70-K105 HydrophobicContact CB-CB 4.26Å; I70-K105 HydrophobicContact CD1-CB 3.88Å; I70-K105 HydrophobicContact CG1-CB 3.57Å; I70-K105 HydrophobicContact CG1-CD 3.78Å; I70-K105 HydrophobicContact CG1-CG 4.32Å; I70-K105 HydrophobicContact CG2-CB 4.04Å; I70-I398 HydrophobicContact CB-CD1 3.41Å; I70-I398 VanDerWaalsContact CB-CD1 3.41Å; I70-I398 HydrophobicContact CD1-CD1 4.39Å; I70-I398 HydrophobicContact CG1-CD1 4.4Å; I70-I398 HydrophobicContact CG2-CD1 3.41Å; I70-I398 VanDerWaalsContact CG2-CD1 3.41Å
71	Y	85.8	Confident	81.9	Confident	10 Å²	10	60.7 Å²	60.7	4%	0.039	30%	0.304	C	S	.	.	H	α-helix	trans	-60	-50.3	-179.7	172.8	-96.7	0	0	0	111.6	V67 I68 S73 T74 R75 E335 P336 T387 L389	V67-Y71 PolarHBondContact O-N 3.06Å; V67-Y71 VanDerWaalsContact O-N 3.14Å; I68-Y71 PolarHBondContact O-N 2.98Å; Y71-S73 PolarHBondContact O-N 3.32Å; Y71-T74 PolarHBondContact O-N 3.21Å; Y71-R75 WeakPolarHBondContact O-CB 3.33Å; Y71-R75 PolarHBondContact O-N 2.97Å; Y71-E335 HydrophobicContact CD1-CB 3.95Å; Y71-E335 HydrophobicContact CD1-CG 4.33Å; Y71-E335 HydrophobicContact CD2-CB 4.26Å; Y71-E335 HydrophobicContact CE1-CB 3.59Å; Y71-E335 HydrophobicContact CE1-CG 4.15Å; Y71-E335 HydrophobicContact CE2-CB 3.93Å; Y71-E335 HydrophobicContact CG-CB 4.27Å; Y71-P336 WeakPolarHBondContact OH-CB 3.38Å; Y71-P336 WeakPolarHBondContact OH-CD 3.26Å; Y71-T387 HydrophobicContact CD2-CG2 4.2Å; Y71-T387 HydrophobicContact CE2-CG2 4.23Å; Y71-L389 HydrophobicContact CD2-CB 4.03Å; Y71-L389 HydrophobicContact CG-CB 4.46Å
72	N	87.8	Confident	82.1	Confident	52 Å²	52	53.2 Å²	53.2	28%	0.278	28%	0.275	S	S	.	.	H	α-helix	trans	-61.2	-45.2	179.1	-76.7	-31	0	0	0	111.6	I68 T74 R75 D76	I68-N72 WeakPolarHBondContact CG2-ND2 3.02Å; I68-N72 WeakPolarHBondContact O-CB 3.4Å; I68-N72 PolarHBondContact O-N 3.46Å; I68-N72 PolarHBondContact O-ND2 2.81Å; N72-T74 VanDerWaalsContact C-N 3.32Å; N72-T74 PolarHBondContact O-N 2.97Å; N72-R75 PolarHBondContact O-N 2.81Å; N72-R75 PolarHBondContact OD1-NH1 3.37Å; N72-R75 PolarHBondContact OD1-NH2 2.7Å; N72-D76 WeakPolarHBondContact O-CB 3.29Å; N72-D76 PolarHBondContact O-N 2.81Å
73	S	85.8	Confident	82.4	Confident	8 Å²	8	51.6 Å²	51.6	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-62.5	-41.4	177.3	-169	0	0	0	0	111.7	S69 I70 Y71 D76 L77 R149 H278	S69-S73 WeakPolarHBondContact O-CB 3.13Å; S69-S73 PolarHBondContact O-N 3.42Å; I70-S73 PolarHBondContact O-N 2.83Å; Y71-S73 PolarHBondContact O-N 3.32Å; S73-D76 PolarHBondContact O-N 2.96Å; S73-L77 WeakPolarHBondContact O-CB 3.5Å; S73-L77 PolarHBondContact O-N 3.28Å; S73-R149 PolarHBondContact O-NH1 2.97Å; S73-R149 WeakPolarHBondContact OG-CD 3.28Å; S73-R149 PolarHBondContact OG-NH1 3.06Å; S73-H278 PolarHBondContact OG-CE1 3.49Å; S73-H278 PolarHBondContact OG-NE2 3.44Å
74	T	84.1	Confident	82	Confident	4 Å²	4	56.2 Å²	56.2	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-47.4	177.3	-53.7	0	0	0	0	111.4	I70 Y71 N72 L77 L78 V103 T387	I70-T74 WeakPolarHBondContact O-CB 3.21Å; I70-T74 PolarHBondContact O-N 3.35Å; I70-T74 PolarHBondContact O-OG1 3.22Å; Y71-T74 PolarHBondContact O-N 3.21Å; N72-T74 VanDerWaalsContact C-N 3.32Å; N72-T74 PolarHBondContact O-N 2.97Å; T74-L77 PolarHBondContact O-N 3.37Å; T74-L78 HydrophobicContact CG2-CD1 4.06Å; T74-L78 VanDerWaalsContact O-CG 3.25Å; T74-L78 WeakPolarHBondContact O-CG 3.43Å; T74-L78 PolarHBondContact O-N 3.25Å; T74-L78 VanDerWaalsContact O-N 3.08Å; T74-V103 HydrophobicContact CG2-CB 4.49Å; T74-V103 HydrophobicContact CG2-CG1 4.22Å; T74-V103 HydrophobicContact CG2-CG2 4.03Å; T74-V103 WeakPolarHBondContact OG1-CG1 3.36Å; T74-T387 HydrophobicContact CG2-CG2 3.99Å
75	R	85.7	Confident	81.2	Confident	106 Å²	106	58.2 Å²	58.2	40%	0.4	29%	0.291	S	S	.	.	H	α-helix	trans	-59.4	-48.8	177.9	-177.1	-164.3	66.4	-153.3	-8.6	111.6	Y71 N72 L77 L78 Q79	Y71-R75 WeakPolarHBondContact O-CB 3.33Å; Y71-R75 PolarHBondContact O-N 2.97Å; N72-R75 PolarHBondContact O-N 2.81Å; N72-R75 PolarHBondContact OD1-NH1 3.37Å; N72-R75 PolarHBondContact OD1-NH2 2.7Å; R75-L77 VanDerWaalsContact C-N 3.35Å; R75-L77 PolarHBondContact O-N 2.94Å; R75-L78 PolarHBondContact O-N 2.91Å; R75-Q79 PolarHBondContact O-N 3.09Å
76	D	85.4	Confident	80.5	Confident	51 Å²	51	56.5 Å²	56.5	27%	0.273	29%	0.287	S	S	.	.	H	α-helix	trans	-65	-40.2	-176.2	-63.7	-7.3	0	0	0	110.9	N72 S73 Q79 E80	N72-D76 WeakPolarHBondContact O-CB 3.29Å; N72-D76 PolarHBondContact O-N 2.81Å; S73-D76 PolarHBondContact O-N 2.96Å; D76-Q79 PolarHBondContact O-N 2.84Å; D76-E80 WeakPolarHBondContact O-CG 3.49Å; D76-E80 PolarHBondContact O-N 2.83Å
77	L	82.9	Confident	80.2	Confident	1 Å²	1	54 Å²	54	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-60.9	-45.8	174.4	175.4	68.2	0	0	0	111.9	S73 T74 R75 Q79 E80 K81 E147 L280 M282	S73-L77 WeakPolarHBondContact O-CB 3.5Å; S73-L77 PolarHBondContact O-N 3.28Å; T74-L77 PolarHBondContact O-N 3.37Å; R75-L77 VanDerWaalsContact C-N 3.35Å; R75-L77 PolarHBondContact O-N 2.94Å; L77-Q79 VanDerWaalsContact C-N 3.33Å; L77-E80 PolarHBondContact O-N 2.77Å; L77-K81 WeakPolarHBondContact O-CG 3.31Å; L77-K81 PolarHBondContact O-N 3.47Å; L77-K81 VanDerWaalsContact O-N 3.11Å; L77-E147 HydrophobicContact CD2-CB 3.99Å; L77-E147 HydrophobicContact CD2-CG 3.91Å; L77-L280 HydrophobicContact CB-CD1 4.47Å; L77-L280 HydrophobicContact CD2-CD1 3.81Å; L77-M282 HydrophobicContact CD2-CE 3.85Å
78	L	80.8	Confident	79.7	Confident	46 Å²	46	56.1 Å²	56.1	24%	0.241	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-39	-179.5	-69.7	170.9	0	0	0	111.5	T74 R75 K81 A82 T387 Q400	T74-L78 HydrophobicContact CG2-CD1 4.06Å; T74-L78 VanDerWaalsContact O-CG 3.25Å; T74-L78 WeakPolarHBondContact O-CG 3.43Å; T74-L78 PolarHBondContact O-N 3.25Å; T74-L78 VanDerWaalsContact O-N 3.08Å; R75-L78 PolarHBondContact O-N 2.91Å; L78-K81 PolarHBondContact O-N 3.13Å; L78-A82 WeakPolarHBondContact O-CB 3.3Å; L78-A82 PolarHBondContact O-N 3.36Å; L78-T387 WeakPolarHBondContact CD1-OG1 3.44Å; L78-Q400 VanDerWaalsContact CD1-NE2 3.26Å; L78-Q400 VanDerWaalsContact CD2-NE2 3.34Å
79	Q	80.4	Confident	78.7	Confident	109 Å²	109	57.6 Å²	57.6	51%	0.509	32%	0.317	S	S	.	.	H	α-helix	trans	-64.5	-45.4	176	-172.7	64.1	46.6	0	0	112	R75 D76 L77 K81 A82 N83	R75-Q79 PolarHBondContact O-N 3.09Å; D76-Q79 PolarHBondContact O-N 2.84Å; L77-Q79 VanDerWaalsContact C-N 3.33Å; Q79-K81 VanDerWaalsContact C-N 3.28Å; Q79-K81 PolarHBondContact O-N 3.21Å; Q79-A82 PolarHBondContact O-N 2.85Å; Q79-N83 PolarHBondContact NE2-OD1 2.88Å; Q79-N83 PolarHBondContact O-N 3.42Å; Q79-N83 PolarHBondContact O-OD1 3.4Å
80	E	81	Confident	77.4	Confident	64 Å²	64	62.1 Å²	62.1	30%	0.299	34%	0.335	S	S	.	.	H	α-helix	trans	-56.5	-43.6	175.5	-77.5	167.6	-166.5	0	0	111.3	D76 L77 N83 H84 R149	D76-E80 WeakPolarHBondContact O-CG 3.49Å; D76-E80 PolarHBondContact O-N 2.83Å; L77-E80 PolarHBondContact O-N 2.77Å; E80-N83 PolarHBondContact O-N 2.75Å; E80-H84 PolarHBondContact O-N 2.83Å; E80-R149 VanDerWaalsContact CD-NH2 3.34Å; E80-R149 IonicContact OE1-NH2 3.79Å; E80-R149 PolarHBondContact OE1-NH2 3.09Å; E80-R149 IonicContact OE2-NH2 2.83Å; E80-R149 PolarHBondContact OE2-NH2 3.35Å; E80-R149 VanDerWaalsContact OE2-NH2 3.09Å
81	K	77.1	Confident	75.9	Confident	58 Å²	58	69 Å²	69	25%	0.252	36%	0.359	S	S	.	.	H	α-helix	trans	-68.8	-40	178.2	-73.6	-171.6	173.6	-166	0	113.3	L77 L78 Q79 N83 H84 R85 E147	L77-K81 WeakPolarHBondContact O-CG 3.31Å; L77-K81 PolarHBondContact O-N 3.47Å; L77-K81 VanDerWaalsContact O-N 3.11Å; L78-K81 PolarHBondContact O-N 3.13Å; Q79-K81 VanDerWaalsContact C-N 3.28Å; Q79-K81 PolarHBondContact O-N 3.21Å; K81-N83 VanDerWaalsContact C-N 3.3Å; K81-N83 PolarHBondContact O-N 3.36Å; K81-H84 PolarHBondContact O-N 3.25Å; K81-R85 WeakPolarHBondContact O-CB 3.32Å; K81-R85 WeakPolarHBondContact O-CG 3.41Å; K81-R85 PolarHBondContact O-N 3.36Å; K81-E147 VanDerWaalsContact NZ-CD 3.3Å; K81-E147 IonicContact NZ-OE1 2.84Å; K81-E147 PolarHBondContact NZ-OE1 2.77Å; K81-E147 IonicContact NZ-OE2 2.96Å
82	A	70.2	Confident	73.9	Confident	32 Å²	32	75.9 Å²	75.9	26%	0.264	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-44.4	174.4	0	0	0	0	0	110.7	L78 Q79 R85 A86	L78-A82 WeakPolarHBondContact O-CB 3.3Å; L78-A82 PolarHBondContact O-N 3.36Å; Q79-A82 PolarHBondContact O-N 2.85Å; A82-R85 PolarHBondContact O-N 2.93Å; A82-A86 WeakPolarHBondContact O-CB 3.41Å; A82-A86 PolarHBondContact O-N 3.47Å
83	N	77	Confident	72.1	Confident	95 Å²	95	77.7 Å²	77.7	51%	0.508	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-43.2	176.4	-65.8	-7.9	0	0	0	111.8	Q79 E80 K81 A86 A87	Q79-N83 PolarHBondContact NE2-OD1 2.88Å; Q79-N83 PolarHBondContact O-N 3.42Å; Q79-N83 PolarHBondContact O-OD1 3.4Å; E80-N83 PolarHBondContact O-N 2.75Å; K81-N83 VanDerWaalsContact C-N 3.3Å; K81-N83 PolarHBondContact O-N 3.36Å; N83-A86 PolarHBondContact O-N 3.08Å; N83-A87 PolarHBondContact O-N 3.41Å
84	H	71.6	Confident	70.3	Confident	111 Å²	111	80.4 Å²	80.4	51%	0.514	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-48.1	176.9	-175.2	-85.4	0	0	0	111.9	E80 K81 A86 A87 T88	E80-H84 PolarHBondContact O-N 2.83Å; K81-H84 PolarHBondContact O-N 3.25Å; H84-A86 VanDerWaalsContact C-N 3.28Å; H84-A86 PolarHBondContact O-N 3.38Å; H84-A87 WeakPolarHBondContact O-CB 3.31Å; H84-A87 PolarHBondContact O-N 3.02Å; H84-A87 VanDerWaalsContact O-N 3.07Å; H84-T88 VanDerWaalsContact CE1-CG2 3.46Å; H84-T88 WeakPolarHBondContact CE1-CG2 3.34Å; H84-T88 PolarHBondContact O-N 3.24Å; H84-T88 PolarHBondContact O-OG1 3.39Å; H84-T88 VanDerWaalsContact O-OG1 3.06Å
85	R	68.9	Low	68.3	Low	99 Å²	99	85.6 Å²	85.6	37%	0.374	44%	0.441	S	S	.	.	H	α-helix	trans	-57.2	-41.4	175.9	-74.4	175.2	175.6	-179	-5.9	111.8	K81 A82 T88 C89 E90 E97	K81-R85 WeakPolarHBondContact O-CB 3.32Å; K81-R85 WeakPolarHBondContact O-CG 3.41Å; K81-R85 PolarHBondContact O-N 3.36Å; A82-R85 PolarHBondContact O-N 2.93Å; R85-T88 PolarHBondContact O-N 3.37Å; R85-T88 PolarHBondContact O-OG1 2.88Å; R85-C89 PolarHBondContact O-N 3.2Å; R85-C89 VanDerWaalsContact O-N 3.08Å; R85-E90 PolarHBondContact O-N 3.09Å; R85-E97 IonicContact CZ-OE2 3.03Å; R85-E97 IonicContact NH1-OE1 3.45Å; R85-E97 PolarHBondContact NH1-OE1 2.86Å; R85-E97 IonicContact NH1-OE2 3.28Å; R85-E97 PolarHBondContact NH1-OE2 2.83Å; R85-E97 IonicContact NH2-OE2 3.62Å; R85-E97 PolarHBondContact NH2-OE2 2.84Å
86	A	68.9	Low	66.5	Low	76 Å²	76	86.6 Å²	86.6	63%	0.628	45%	0.45	S	S	*	.	H	α-helix	trans	-63.4	-41.4	175.7	0	0	0	0	0	111.8	A82 N83 H84	A82-A86 WeakPolarHBondContact O-CB 3.41Å; A82-A86 PolarHBondContact O-N 3.47Å; N83-A86 PolarHBondContact O-N 3.08Å; H84-A86 VanDerWaalsContact C-N 3.28Å; H84-A86 PolarHBondContact O-N 3.38Å
87	A	74.4	Confident	64.7	Low	83 Å²	83	85.6 Å²	85.6	69%	0.686	44%	0.444	S	S	*	.	H	α-helix	trans	-68.7	-38.5	177.8	0	0	0	0	0	113.1	N83 H84 C89	N83-A87 PolarHBondContact O-N 3.41Å; H84-A87 WeakPolarHBondContact O-CB 3.31Å; H84-A87 PolarHBondContact O-N 3.02Å; H84-A87 VanDerWaalsContact O-N 3.07Å; A87-C89 VanDerWaalsContact C-N 3.33Å
88	T	72.6	Confident	62.9	Low	59 Å²	59	91.5 Å²	91.5	36%	0.362	47%	0.467	S	S	.	.	H	α-helix	trans	-85.2	-3.3	-179.4	56.6	0	0	0	0	113.9	H84 R85 E90	H84-T88 VanDerWaalsContact CE1-CG2 3.46Å; H84-T88 WeakPolarHBondContact CE1-CG2 3.34Å; H84-T88 PolarHBondContact O-N 3.24Å; H84-T88 PolarHBondContact O-OG1 3.39Å; H84-T88 VanDerWaalsContact O-OG1 3.06Å; R85-T88 PolarHBondContact O-N 3.37Å; R85-T88 PolarHBondContact O-OG1 2.88Å; T88-E90 PolarHBondContact O-N 3.41Å; T88-E90 VanDerWaalsContact O-N 3.13Å; T88-E90 VanDerWaalsContact OG1-CD 3.3Å; T88-E90 WeakPolarHBondContact OG1-CG 3.27Å; T88-E90 PolarHBondContact OG1-OE2 2.99Å
89	C	64.4	Low	61.5	Low	92 Å²	92	93.5 Å²	93.5	62%	0.622	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	23.6	-173.6	-66.6	0	0	0	0	113.6	R85 A87 R91	R85-C89 PolarHBondContact O-N 3.2Å; R85-C89 VanDerWaalsContact O-N 3.08Å; A87-C89 VanDerWaalsContact C-N 3.33Å; C89-R91 PolarHBondContact O-N 2.87Å
90	E	56.8	Low	60.4	Low	120 Å²	120	88.5 Å²	88.5	56%	0.561	45%	0.45	S	S	*	.			trans	-74	111.1	177.1	-77.4	172.7	172.8	0	0	109.4	R85 T88	R85-E90 PolarHBondContact O-N 3.09Å; T88-E90 PolarHBondContact O-N 3.41Å; T88-E90 VanDerWaalsContact O-N 3.13Å; T88-E90 VanDerWaalsContact OG1-CD 3.3Å; T88-E90 WeakPolarHBondContact OG1-CG 3.27Å; T88-E90 PolarHBondContact OG1-OE2 2.99Å
91	R	52.7	Low	60.2	Low	173 Å²	173	86.3 Å²	86.3	65%	0.653	44%	0.439	S	S	*	.			trans	-108.7	-1.6	-175.2	-73	179	165.2	128.5	-6	113.8	C89 R93	C89-R91 PolarHBondContact O-N 2.87Å; R91-R93 PolarHBondContact O-N 3.23Å
92	E	43.5	Very low	60.3	Low	154 Å²	154	84.8 Å²	84.8	72%	0.72	43%	0.433	S	S	*	.			trans	-82	117.8	178.4	-72.2	-163.1	139.6	0	0	109.9	R297	E92-R297 IonicContact OE1-CZ 2.83Å; E92-R297 IonicContact OE1-NE 2.81Å; E92-R297 IonicContact OE1-NH2 3.92Å; E92-R297 PolarHBondContact OE1-NH2 2.88Å
93	R	49.4	Very low	61	Low	91 Å²	91	83.8 Å²	83.8	34%	0.343	42%	0.423	S	S	.	.			trans	-106.5	126.1	174.8	-147.8	-179.7	-169.3	-168.8	6.6	107.8	R91 E97 L383	R91-R93 PolarHBondContact O-N 3.23Å; R93-E97 HydrophobicContact CG-CB 4.24Å; R93-E97 VanDerWaalsContact CG-OE2 3.23Å; R93-E97 WeakPolarHBondContact CG-OE2 3.2Å; R93-E97 IonicContact CZ-OE1 3.75Å; R93-E97 VanDerWaalsContact CZ-OE1 3.24Å; R93-E97 IonicContact NE-OE1 2.89Å; R93-E97 PolarHBondContact NE-OE1 2.83Å; R93-E97 IonicContact NE-OE2 2.82Å; R93-E97 PolarHBondContact NE-OE2 3.01Å; R93-E97 IonicContact NH2-OE1 3.77Å; R93-E97 PolarHBondContact NH2-OE1 2.82Å; R93-L383 PolarHBondContact NH1-O 2.81Å; R93-L383 PolarHBondContact NH2-O 2.98Å; R93-L383 VanDerWaalsContact NH2-O 3.16Å
94	S	47.8	Very low	61.6	Low	64 Å²	64	82.1 Å²	82.1	45%	0.448	41%	0.411	S	S	.	.			trans	-73.4	146.9	175.8	60.7	0	0	0	0	110.4	E96 E97	S94-E96 PolarHBondContact O-N 2.65Å; S94-E97 WeakPolarHBondContact O-CB 3.5Å; S94-E97 PolarHBondContact O-N 2.79Å
95	D	42.9	Very low	62.4	Low	113 Å²	113	78.4 Å²	78.4	60%	0.604	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-58.9	-18.7	177.5	-67	-26.1	0	0	0	112.3	E97 Y98	D95-E97 PolarHBondContact O-N 2.81Å; D95-Y98 WeakPolarHBondContact O-CB 3.28Å; D95-Y98 PolarHBondContact O-N 3.26Å
96	E	46.6	Very low	63.5	Low	127 Å²	127	74.8 Å²	74.8	59%	0.593	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-64.9	-12	174	-59	173.5	174.1	0	0	114.4	S94 K101	S94-E96 PolarHBondContact O-N 2.65Å; E96-K101 WeakPolarHBondContact O-CE 3.43Å; E96-K101 PolarHBondContact O-NZ 2.83Å
97	E	49.2	Very low	64.5	Low	31 Å²	31	73.9 Å²	73.9	15%	0.145	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-87.8	-4.8	178	-144	174.5	133.2	0	0	112.6	R85 R93 S94 D95	R85-E97 IonicContact CZ-OE2 3.03Å; R85-E97 IonicContact NH1-OE1 3.45Å; R85-E97 PolarHBondContact NH1-OE1 2.86Å; R85-E97 IonicContact NH1-OE2 3.28Å; R85-E97 PolarHBondContact NH1-OE2 2.83Å; R85-E97 IonicContact NH2-OE2 3.62Å; R85-E97 PolarHBondContact NH2-OE2 2.84Å; R93-E97 HydrophobicContact CG-CB 4.24Å; R93-E97 VanDerWaalsContact CG-OE2 3.23Å; R93-E97 WeakPolarHBondContact CG-OE2 3.2Å; R93-E97 IonicContact CZ-OE1 3.75Å; R93-E97 VanDerWaalsContact CZ-OE1 3.24Å; R93-E97 IonicContact NE-OE1 2.89Å; R93-E97 PolarHBondContact NE-OE1 2.83Å; R93-E97 IonicContact NE-OE2 2.82Å; R93-E97 PolarHBondContact NE-OE2 3.01Å; R93-E97 IonicContact NH2-OE1 3.77Å; R93-E97 PolarHBondContact NH2-OE1 2.82Å; S94-E97 WeakPolarHBondContact O-CB 3.5Å; S94-E97 PolarHBondContact O-N 2.79Å; D95-E97 PolarHBondContact O-N 2.81Å
98	Y	45.4	Very low	65.2	Low	124 Å²	124	71.2 Å²	71.2	49%	0.486	34%	0.339	S	S	.	.	S	Bend	trans	-77.5	-22.5	-175.6	-176.7	-94.2	0	0	0	114.5	D95 S402 N403	D95-Y98 WeakPolarHBondContact O-CB 3.28Å; D95-Y98 PolarHBondContact O-N 3.26Å; Y98-S402 WeakPolarHBondContact O-CB 3.34Å; Y98-S402 PolarHBondContact O-OG 3.48Å; Y98-N403 VanDerWaalsContact CD2-ND2 3.35Å; Y98-N403 WeakPolarHBondContact CD2-ND2 3.39Å; Y98-N403 VanDerWaalsContact CE2-ND2 3.27Å; Y98-N403 WeakPolarHBondContact CE2-ND2 3.42Å
99	Y	50.3	Low	65.7	Low	88 Å²	88	72.2 Å²	72.2	35%	0.345	34%	0.34	S	S	.	.	S	Bend	trans	-108.7	149.8	-178.2	-65.5	-73.7	0	0	0	112.7	S291	Y99-S291 PolarHBondContact OH-O 3.37Å
100	A	56.7	Low	66	Low	4 Å²	4	72.8 Å²	72.8	3%	0.033	34%	0.342	C	S	.	.			trans	-69.2	132.9	175.2	0	0	0	0	0	111.4	Q400	A100-Q400 WeakPolarHBondContact CA-O 3.25Å; A100-Q400 WeakPolarHBondContact CB-O 3.45Å
101	K	76.7	Confident	66	Low	18 Å²	18	72.8 Å²	72.8	8%	0.078	34%	0.34	C	S	.	.			trans	-109	136.8	-179.2	-60.6	170.8	-170.2	175.9	0	108.6	E96 V144 M282 L283 L284 Q400	E96-K101 WeakPolarHBondContact O-CE 3.43Å; E96-K101 PolarHBondContact O-NZ 2.83Å; K101-V144 HydrophobicContact CD-CB 4.41Å; K101-V144 HydrophobicContact CD-CG1 4.33Å; K101-M282 HydrophobicContact CB-CB 4.17Å; K101-M282 HydrophobicContact CD-CB 4.08Å; K101-L283 CarbonylContact C-O 3.46Å; K101-L283 WeakPolarHBondContact CA-O 3.41Å; K101-L284 HydrophobicContact CG-CD2 4.44Å; K101-Q400 PolarHBondContact O-N 3.02Å
102	E	79.4	Confident	66.2	Low	27 Å²	27	67 Å²	67	13%	0.126	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	133.9	168.4	-71.1	-171.1	143.8	0	0	108.5	Y104 M282 L283 P285 K397	E102-Y104 HydrophobicContact CB-CD2 4.37Å; E102-Y104 HydrophobicContact CB-CE2 3.61Å; E102-Y104 PolarHBondContact OE2-OH 2.9Å; E102-M282 WeakPolarHBondContact O-CA 3.45Å; E102-L283 PolarHBondContact N-O 3.47Å; E102-L283 PolarHBondContact O-N 3.23Å; E102-P285 HydrophobicContact CG-CG 4.3Å; E102-K397 IonicContact OE1-NZ 3.79Å; E102-K397 PolarHBondContact OE1-NZ 3.43Å
103	V	86.3	Confident	66.6	Low	10 Å²	10	64.3 Å²	64.3	6%	0.061	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.6	-179.1	-172.5	0	0	0	0	110.4	T74 L280 L281 M282 I398	T74-V103 HydrophobicContact CG2-CB 4.49Å; T74-V103 HydrophobicContact CG2-CG1 4.22Å; T74-V103 HydrophobicContact CG2-CG2 4.03Å; T74-V103 WeakPolarHBondContact OG1-CG1 3.36Å; V103-L280 HydrophobicContact CG1-CD2 4.42Å; V103-L281 CarbonylContact C-O 3.48Å; V103-L281 WeakPolarHBondContact CA-O 3.3Å; V103-M282 HydrophobicContact CG2-CG 4.36Å; V103-I398 HydrophobicContact CB-CG2 4.47Å; V103-I398 PolarHBondContact N-O 3.22Å
104	Y	88.1	Confident	66.6	Low	61 Å²	61	69.4 Å²	69.4	24%	0.239	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.1	176.9	-63.8	-95.5	0	0	0	109.8	E102 M136 L280 L281 L283	E102-Y104 HydrophobicContact CB-CD2 4.37Å; E102-Y104 HydrophobicContact CB-CE2 3.61Å; E102-Y104 PolarHBondContact OE2-OH 2.9Å; Y104-M136 HydrophobicContact CD1-CE 3.86Å; Y104-M136 HydrophobicContact CD1-SD 3.85Å; Y104-M136 HydrophobicContact CD2-SD 4.25Å; Y104-M136 HydrophobicContact CE1-CE 4.06Å; Y104-M136 HydrophobicContact CE1-SD 4.18Å; Y104-M136 HydrophobicContact CG-CE 4.47Å; Y104-M136 HydrophobicContact CG-SD 3.89Å; Y104-L280 CarbonylContact O-C 3.5Å; Y104-L280 WeakPolarHBondContact O-CA 3.26Å; Y104-L281 PolarHBondContact N-O 2.97Å; Y104-L281 PolarHBondContact O-N 2.75Å; Y104-L283 HydrophobicContact CD2-CD1 3.43Å; Y104-L283 VanDerWaalsContact CD2-CD1 3.43Å; Y104-L283 HydrophobicContact CE2-CD1 3.9Å; Y104-L283 HydrophobicContact CG-CD1 4.35Å
105	K	90.3	Very high	66.5	Low	32 Å²	32	74 Å²	74	14%	0.139	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	129.2	173.1	-174.8	-172.3	174.1	-134.1	0	109.4	S69 I70 D107 H278 L279 L280	S69-K105 PolarHBondContact OG-NZ 3.4Å; I70-K105 HydrophobicContact CB-CB 4.26Å; I70-K105 HydrophobicContact CD1-CB 3.88Å; I70-K105 HydrophobicContact CG1-CB 3.57Å; I70-K105 HydrophobicContact CG1-CD 3.78Å; I70-K105 HydrophobicContact CG1-CG 4.32Å; I70-K105 HydrophobicContact CG2-CB 4.04Å; K105-D107 WeakPolarHBondContact CE-OD1 3.4Å; K105-D107 IonicContact NZ-OD1 3.4Å; K105-D107 PolarHBondContact NZ-OD1 2.93Å; K105-D107 IonicContact NZ-OD2 3.78Å; K105-D107 PolarHBondContact NZ-OD2 2.97Å; K105-H278 HydrophobicContact CG-CB 4.08Å; K105-L279 CarbonylContact C-O 3.48Å; K105-L279 WeakPolarHBondContact CA-O 3.43Å; K105-L280 HydrophobicContact CB-CD2 4.02Å; K105-L280 HydrophobicContact CG-CD2 4.09Å
106	I	91.4	Very high	66.5	Low	23 Å²	23	70.7 Å²	70.7	12%	0.118	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	109	174.1	-58.1	177.7	0	0	0	107.8	F131 D132 V133 M136 H278 L279 L281	I106-F131 HydrophobicContact CG2-CB 4.31Å; I106-F131 HydrophobicContact CG2-CD1 4.42Å; I106-D132 VanDerWaalsContact CG2-O 3.24Å; I106-D132 WeakPolarHBondContact CG2-O 3.33Å; I106-V133 HydrophobicContact CD1-CB 4.41Å; I106-V133 HydrophobicContact CD1-CG1 3.95Å; I106-M136 HydrophobicContact CD1-CG 4.23Å; I106-H278 CarbonylContact O-C 3.47Å; I106-H278 VanDerWaalsContact O-CA 3.22Å; I106-H278 WeakPolarHBondContact O-CA 3.48Å; I106-H278 WeakPolarHBondContact O-CB 3.43Å; I106-L279 HydrophobicContact CB-CB 4.3Å; I106-L279 PolarHBondContact N-O 2.73Å; I106-L279 PolarHBondContact O-N 3.39Å; I106-L281 HydrophobicContact CD1-CD1 3.49Å; I106-L281 VanDerWaalsContact CD1-CD1 3.49Å; I106-L281 HydrophobicContact CD1-CG 4.23Å; I106-L281 HydrophobicContact CG1-CD1 4.42Å
107	D	89.9	Confident	66.5	Low	57 Å²	57	72.1 Å²	72.1	31%	0.305	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	151.5	177.1	-76.9	-60.8	0	0	0	111.6	K105 Q109 T276	K105-D107 WeakPolarHBondContact CE-OD1 3.4Å; K105-D107 IonicContact NZ-OD1 3.4Å; K105-D107 PolarHBondContact NZ-OD1 2.93Å; K105-D107 IonicContact NZ-OD2 3.78Å; K105-D107 PolarHBondContact NZ-OD2 2.97Å; D107-Q109 PolarHBondContact O-N 3.37Å; D107-T276 PolarHBondContact OD1-OG1 2.85Å
108	M	89.2	Confident	66.4	Low	28 Å²	28	73.2 Å²	73.2	14%	0.138	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-58.2	135.6	176.6	-175.5	-173.4	77.1	0	0	110.9	V129 R130 F131 I252 P277	M108-V129 HydrophobicContact CG-CB 4.24Å; M108-V129 HydrophobicContact SD-CB 3.85Å; M108-V129 HydrophobicContact SD-CG1 3.55Å; M108-V129 VanDerWaalsContact SD-CG1 3.55Å; M108-R130 WeakPolarHBondContact CG-O 3.25Å; M108-F131 VanDerWaalsContact CA-CE1 3.49Å; M108-F131 HydrophobicContact CB-CD1 4.42Å; M108-F131 HydrophobicContact CB-CE1 3.78Å; M108-F131 HydrophobicContact CB-CZ 4.27Å; M108-F131 HydrophobicContact CG-CE1 4.39Å; M108-I252 HydrophobicContact CE-CG1 4.33Å; M108-I252 HydrophobicContact SD-CG1 4.1Å; M108-P277 HydrophobicContact CB-CB 4.3Å; M108-P277 VanDerWaalsContact CB-O 3.25Å; M108-P277 WeakPolarHBondContact CB-O 3.47Å; M108-P277 PolarHBondContact N-O 2.77Å; M108-P277 HydrophobicContact SD-CB 4.32Å; M108-P277 HydrophobicContact SD-CG 3.92Å
109	Q	83.4	Confident	66.3	Low	80 Å²	80	70.1 Å²	70.1	37%	0.374	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-61.4	132.7	171.9	-76.7	-176.8	-23.2	0	0	109.9	D107 F111 R130 D132	D107-Q109 PolarHBondContact O-N 3.37Å; Q109-F111 PolarHBondContact O-N 3.25Å; Q109-R130 PolarHBondContact N-O 3.43Å; Q109-D132 HydrophobicContact CG-CB 4.33Å
110	P	70.1	Confident	65.9	Low	104 Å²	104	71.3 Å²	71.3	68%	0.675	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-61.5	137	176.2	25.7	-32.3	0	0	0	109.3	Y112	P110-Y112 PolarHBondContact O-N 3.14Å; P110-Y112 VanDerWaalsContact O-N 3.09Å
111	F	56.4	Low	65.4	Low	120 Å²	120	80.7 Å²	80.7	53%	0.526	42%	0.423	S	S	.	.	S	Bend	trans	-63	-18.8	-178.1	-131.4	-90.9	0	0	0	112.5	Q109 I128	Q109-F111 PolarHBondContact O-N 3.25Å; F111-I128 WeakPolarHBondContact CE2-O 2.94Å
112	Y	57.2	Low	64.7	Low	50 Å²	50	83.4 Å²	83.4	20%	0.196	43%	0.433	C	S	.	.	S	Bend	trans	-145.1	145	-178.1	-56.6	-64.4	0	0	0	111.5	P110 P118 P119	P110-Y112 PolarHBondContact O-N 3.14Å; P110-Y112 VanDerWaalsContact O-N 3.09Å; Y112-P118 HydrophobicContact CD2-CB 3.74Å; Y112-P118 HydrophobicContact CE2-CB 3.3Å; Y112-P119 HydrophobicContact CE1-CG 3.49Å; Y112-P119 VanDerWaalsContact CE1-CG 3.49Å; Y112-P119 VanDerWaalsContact CZ-CD 3.45Å; Y112-P119 WeakPolarHBondContact OH-CD 2.97Å; Y112-P119 VanDerWaalsContact OH-CG 3.28Å; Y112-P119 WeakPolarHBondContact OH-CG 3.49Å
113	P	51.1	Low	64.4	Low	98 Å²	98	83.4 Å²	83.4	64%	0.636	44%	0.436	S	S	*	.			trans	-59.3	145.9	159.4	24.2	-27.3	0	0	0	108.8	N115 A116	P113-N115 PolarHBondContact O-N 3.04Å; P113-A116 HydrophobicContact CG-CB 4.12Å; P113-A116 PolarHBondContact O-N 3.41Å
114	E	49.9	Very low	64	Low	198 Å²	198	87.5 Å²	87.5	93%	0.925	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-17.1	-172	-71.2	-170.4	140.2	0	0	115.4
115	N	46.2	Very low	63.7	Low	161 Å²	161	89.3 Å²	89.3	86%	0.861	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	5.3	-174.9	-60.4	-30.8	0	0	0	115.2	P113	P113-N115 PolarHBondContact O-N 3.04Å
116	A	43.7	Very low	63.5	Low	44 Å²	44	91.2 Å²	91.2	36%	0.364	47%	0.472	S	S	.	.	S	Bend	trans	-101.7	136.8	179.8	0	0	0	0	0	112.7	P113	P113-A116 HydrophobicContact CG-CB 4.12Å; P113-A116 PolarHBondContact O-N 3.41Å
117	I	45.8	Very low	63.3	Low	156 Å²	156	91.3 Å²	91.3	80%	0.8	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-63.7	124.2	169.5	-59.4	168.8	0	0	0	107.2	P119	I117-P119 WeakPolarHBondContact O-CD 3.3Å
118	P	47.2	Very low	63.2	Low	54 Å²	54	91 Å²	91	35%	0.351	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-64.5	118.3	178.9	25.2	-33	0	0	0	109.7	Y112 S120	Y112-P118 HydrophobicContact CD2-CB 3.74Å; Y112-P118 HydrophobicContact CE2-CB 3.3Å; P118-S120 PolarHBondContact O-N 3.05Å
119	P	42.2	Very low	63.3	Low	60 Å²	60	89.6 Å²	89.6	39%	0.39	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-48.4	140.8	168.7	-2.8	-16.3	0	0	0	111.8	Y112 I117 Y121	Y112-P119 HydrophobicContact CE1-CG 3.49Å; Y112-P119 VanDerWaalsContact CE1-CG 3.49Å; Y112-P119 VanDerWaalsContact CZ-CD 3.45Å; Y112-P119 WeakPolarHBondContact OH-CD 2.97Å; Y112-P119 VanDerWaalsContact OH-CG 3.28Å; Y112-P119 WeakPolarHBondContact OH-CG 3.49Å; I117-P119 WeakPolarHBondContact O-CD 3.3Å; P119-Y121 HydrophobicContact CB-CD2 3.89Å; P119-Y121 PolarHBondContact O-N 2.89Å
120	S	42.1	Very low	63.6	Low	113 Å²	113	92.5 Å²	92.5	79%	0.79	47%	0.47	S	S	*	.	S	Bend	trans	-65.5	21.9	176.7	56	0	0	0	0	114.5	P118 Y122	P118-S120 PolarHBondContact O-N 3.05Å; S120-Y122 PolarHBondContact O-N 3.14Å
121	Y	47.2	Very low	64.7	Low	201 Å²	201	87.7 Å²	87.7	79%	0.788	44%	0.438	S	S	*	.			trans	-99.5	44.7	-177.8	-70.2	-82	0	0	0	112	P119 S123	P119-Y121 HydrophobicContact CB-CD2 3.89Å; P119-Y121 PolarHBondContact O-N 2.89Å; Y121-S123 PolarHBondContact O-N 3.44Å
122	Y	62.1	Low	66.3	Low	74 Å²	74	85.6 Å²	85.6	29%	0.29	43%	0.433	S	S	.	.			trans	-74.2	105.7	161	-72.8	-83.5	0	0	0	107.6	S120 L124 Y255	S120-Y122 PolarHBondContact O-N 3.14Å; Y122-L124 PolarHBondContact O-N 3.3Å; Y122-Y255 VanDerWaalsContact OH-CD2 3.28Å; Y122-Y255 WeakPolarHBondContact OH-CD2 3.23Å
123	S	71.9	Confident	67.9	Low	27 Å²	27	83.3 Å²	83.3	19%	0.189	42%	0.424	C	S	.	.			trans	-63.1	129.2	171.3	175.3	0	0	0	0	109.1	Y121 Y125 F126 R127	Y121-S123 PolarHBondContact O-N 3.44Å; S123-Y125 PolarHBondContact O-N 3.15Å; S123-Y125 PolarHBondContact OG-N 3.46Å; S123-F126 WeakPolarHBondContact OG-CD1 3.46Å; S123-F126 WeakPolarHBondContact OG-CE1 3.37Å; S123-F126 PolarHBondContact OG-N 2.92Å; S123-R127 PolarHBondContact O-NH1 3.02Å
124	L	78.2	Confident	69.6	Low	96 Å²	96	80.4 Å²	80.4	50%	0.503	41%	0.406	S	S	.	.	S	Bend	trans	-69	-13.8	175.2	-64.8	171.6	0	0	0	112.5	Y122 E244 L245	Y122-L124 PolarHBondContact O-N 3.3Å; L124-E244 HydrophobicContact CB-CG 4.19Å; L124-L245 PolarHBondContact O-N 3.25Å
125	Y	81.9	Confident	71.3	Confident	100 Å²	100	74.8 Å²	74.8	39%	0.392	39%	0.393	S	S	.	.	S	Bend	trans	-108.5	-19.5	-168.6	-54.3	-70	0	0	0	113.9	S123 S242 E243 E244	S123-Y125 PolarHBondContact O-N 3.15Å; S123-Y125 PolarHBondContact OG-N 3.46Å; Y125-S242 WeakPolarHBondContact CE1-O 3.02Å; Y125-E243 WeakPolarHBondContact CD1-O 3.21Å; Y125-E244 HydrophobicContact CD1-CG 4.21Å; Y125-E244 HydrophobicContact CE1-CG 3.66Å
126	F	86.2	Confident	73.1	Confident	71 Å²	71	68.4 Å²	68.4	31%	0.311	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	162.3	-177.4	64.5	-98.8	0	0	0	112.5	S123 I128 K220 I221	S123-F126 WeakPolarHBondContact OG-CD1 3.46Å; S123-F126 WeakPolarHBondContact OG-CE1 3.37Å; S123-F126 PolarHBondContact OG-N 2.92Å; F126-I128 HydrophobicContact CD2-CD1 4.2Å; F126-I128 HydrophobicContact CD2-CG1 3.91Å; F126-I128 HydrophobicContact CE2-CD1 3.71Å; F126-I128 HydrophobicContact CE2-CG1 3.93Å; F126-K220 HydrophobicContact CB-CG 4.19Å; F126-K220 HydrophobicContact CD2-CG 4.39Å; F126-I221 CarbonylContact C-O 3.45Å; F126-I221 WeakPolarHBondContact CA-O 3.41Å; F126-I221 WeakPolarHBondContact CB-O 3.36Å
127	R	87.8	Confident	74.9	Confident	25 Å²	25	69.7 Å²	69.7	9%	0.094	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.4	168.9	-61.3	-59.8	178.9	-82.9	-3.7	109.3	S123 K220 I221 L245 F249 I252 D253	S123-R127 PolarHBondContact O-NH1 3.02Å; R127-K220 CarbonylContact O-C 3.58Å; R127-K220 VanDerWaalsContact O-CA 3.29Å; R127-K220 WeakPolarHBondContact O-CA 3.39Å; R127-I221 PolarHBondContact N-O 3Å; R127-I221 PolarHBondContact O-N 3.38Å; R127-L245 HydrophobicContact CG-CD2 4.03Å; R127-F249 HydrophobicContact CG-CD2 4.49Å; R127-I252 HydrophobicContact CB-CG2 4.09Å; R127-I252 HydrophobicContact CG-CG2 3.85Å; R127-D253 IonicContact CZ-OD1 3.61Å; R127-D253 IonicContact NE-OD1 2.73Å; R127-D253 PolarHBondContact NE-OD1 3.36Å; R127-D253 IonicContact NE-OD2 2.86Å; R127-D253 IonicContact NH2-OD1 3.85Å; R127-D253 PolarHBondContact NH2-OD1 3.46Å
128	I	87.9	Confident	76.4	Confident	50 Å²	50	71.8 Å²	71.8	26%	0.256	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	138.5	172.7	-63.7	174.8	0	0	0	107.2	F111 F126 F219 K220	F111-I128 WeakPolarHBondContact CE2-O 2.94Å; F126-I128 HydrophobicContact CD2-CD1 4.2Å; F126-I128 HydrophobicContact CD2-CG1 3.91Å; F126-I128 HydrophobicContact CE2-CD1 3.71Å; F126-I128 HydrophobicContact CE2-CG1 3.93Å; I128-F219 CarbonylContact C-O 3.55Å; I128-F219 VanDerWaalsContact CA-O 3.3Å; I128-F219 WeakPolarHBondContact CA-O 3.39Å; I128-K220 HydrophobicContact CG1-CB 4.38Å; I128-K220 HydrophobicContact CG1-CG 4.45Å
129	V	90.3	Very high	77.8	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142	177	-63.3	0	0	0	0	109.4	M108 F131 F148 G218 F219 I252	M108-V129 HydrophobicContact CG-CB 4.24Å; M108-V129 HydrophobicContact SD-CB 3.85Å; M108-V129 HydrophobicContact SD-CG1 3.55Å; M108-V129 VanDerWaalsContact SD-CG1 3.55Å; V129-F131 HydrophobicContact CB-CE2 4.16Å; V129-F131 HydrophobicContact CB-CZ 4.34Å; V129-F131 HydrophobicContact CG2-CE2 3.75Å; V129-F131 HydrophobicContact CG2-CZ 4.19Å; V129-F148 HydrophobicContact CG2-CE2 4.3Å; V129-F148 HydrophobicContact CG2-CZ 3.96Å; V129-G218 CarbonylContact O-C 3.4Å; V129-G218 WeakPolarHBondContact O-CA 3.39Å; V129-F219 HydrophobicContact CG2-CB 3.79Å; V129-F219 HydrophobicContact CG2-CD2 4.47Å; V129-F219 PolarHBondContact N-O 3.26Å; V129-F219 PolarHBondContact O-N 2.96Å; V129-I252 HydrophobicContact CG1-CD1 3.41Å; V129-I252 VanDerWaalsContact CG1-CD1 3.41Å; V129-I252 HydrophobicContact CG1-CG1 4.22Å
130	R	90.6	Very high	79.5	Confident	141 Å²	141	69.1 Å²	69.1	53%	0.532	34%	0.341	S	S	.	.			trans	-127.7	149.6	-178.3	-67.9	-176.3	177.9	162.9	1.5	110.8	M108 Q109	M108-R130 WeakPolarHBondContact CG-O 3.25Å; Q109-R130 PolarHBondContact N-O 3.43Å
131	F	92.3	Very high	81.2	Confident	2 Å²	2	68 Å²	68	1%	0.009	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-135.8	141.6	-177	-60.9	-80.6	0	0	0	110.2	I106 M108 V129 F148 W209 N216 F219 L279	I106-F131 HydrophobicContact CG2-CB 4.31Å; I106-F131 HydrophobicContact CG2-CD1 4.42Å; M108-F131 VanDerWaalsContact CA-CE1 3.49Å; M108-F131 HydrophobicContact CB-CD1 4.42Å; M108-F131 HydrophobicContact CB-CE1 3.78Å; M108-F131 HydrophobicContact CB-CZ 4.27Å; M108-F131 HydrophobicContact CG-CE1 4.39Å; V129-F131 HydrophobicContact CB-CE2 4.16Å; V129-F131 HydrophobicContact CB-CZ 4.34Å; V129-F131 HydrophobicContact CG2-CE2 3.75Å; V129-F131 HydrophobicContact CG2-CZ 4.19Å; F131-F148 HydrophobicContact CE2-CD2 4.13Å; F131-F148 HydrophobicContact CE2-CE2 4.13Å; F131-F148 AromaticContact CZ-CD2 3.78Å; F131-F148 HydrophobicContact CZ-CD2 3.78Å; F131-F148 AromaticContact CZ-CE2 3.6Å; F131-F148 HydrophobicContact CZ-CE2 3.6Å; F131-W209 HydrophobicContact CD2-CZ3 4.39Å; F131-N216 PolarHBondContact O-ND2 3.11Å; F131-F219 HydrophobicContact CD2-CD2 4.25Å; F131-F219 HydrophobicContact CD2-CE2 4.39Å; F131-F219 AromaticContact CE2-CD2 3.92Å; F131-F219 HydrophobicContact CE2-CD2 3.92Å; F131-F219 HydrophobicContact CE2-CE2 4.35Å; F131-L279 HydrophobicContact CB-CD1 3.58Å; F131-L279 HydrophobicContact CB-CG 4.37Å; F131-L279 HydrophobicContact CD1-CD1 3.91Å; F131-L279 HydrophobicContact CD1-CG 3.75Å; F131-L279 HydrophobicContact CD2-CD1 3.73Å; F131-L279 HydrophobicContact CD2-CD2 4.28Å; F131-L279 HydrophobicContact CD2-CG 3.93Å; F131-L279 HydrophobicContact CE1-CG 4Å; F131-L279 HydrophobicContact CE2-CD1 4.44Å; F131-L279 HydrophobicContact CE2-CD2 4.22Å; F131-L279 HydrophobicContact CE2-CG 4.16Å; F131-L279 HydrophobicContact CG-CD1 3.43Å; F131-L279 VanDerWaalsContact CG-CD1 3.43Å; F131-L279 HydrophobicContact CG-CG 3.73Å; F131-L279 HydrophobicContact CZ-CD2 4.44Å; F131-L279 HydrophobicContact CZ-CG 4.2Å
132	D	90.6	Very high	82.9	Confident	76 Å²	76	58.9 Å²	58.9	41%	0.406	30%	0.298	S	S	.	.			trans	-92.7	108	170	-158.9	-22.4	0	0	0	109.9	I106 Q109 S134	I106-D132 VanDerWaalsContact CG2-O 3.24Å; I106-D132 WeakPolarHBondContact CG2-O 3.33Å; Q109-D132 HydrophobicContact CG-CB 4.33Å; D132-S134 WeakPolarHBondContact OD1-CB 3.3Å; D132-S134 PolarHBondContact OD1-N 3.43Å; D132-S134 PolarHBondContact OD1-OG 2.86Å
133	V	90.3	Very high	84.1	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.018	29%	0.289	C	S	.	.			trans	-101.1	6.2	176.9	-59.3	0	0	0	0	112.7	I106 A135 M136 W209 L210 L279	I106-V133 HydrophobicContact CD1-CB 4.41Å; I106-V133 HydrophobicContact CD1-CG1 3.95Å; V133-A135 PolarHBondContact O-N 3.01Å; V133-A135 VanDerWaalsContact O-N 3.11Å; V133-M136 PolarHBondContact O-N 2.92Å; V133-W209 HydrophobicContact CG1-CE3 4.45Å; V133-W209 HydrophobicContact CG2-CB 3.93Å; V133-L210 HydrophobicContact CB-CD2 3.89Å; V133-L210 HydrophobicContact CG2-CD2 3.99Å; V133-L279 HydrophobicContact CG1-CD1 4.21Å
134	S	87.5	Confident	84.5	Confident	36 Å²	36	56.5 Å²	56.5	25%	0.252	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-58.3	-32.6	-172.2	-48.3	0	0	0	0	112.5	D132 M136 E137	D132-S134 WeakPolarHBondContact OD1-CB 3.3Å; D132-S134 PolarHBondContact OD1-N 3.43Å; D132-S134 PolarHBondContact OD1-OG 2.86Å; S134-M136 PolarHBondContact O-N 3.04Å; S134-E137 WeakPolarHBondContact O-CG 3.25Å; S134-E137 PolarHBondContact O-N 2.8Å
135	A	85	Confident	85	Confident	80 Å²	80	54.6 Å²	54.6	66%	0.661	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-63.3	-23.4	178	0	0	0	0	0	113.7	V133	V133-A135 PolarHBondContact O-N 3.01Å; V133-A135 VanDerWaalsContact O-N 3.11Å
136	M	85.2	Confident	85.5	Confident	27 Å²	27	49.8 Å²	49.8	13%	0.133	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-103	-2.5	-173.1	-62	-65.1	115.1	0	0	113.5	Y104 I106 V133 S134 K138 N139 L210 L281	Y104-M136 HydrophobicContact CD1-CE 3.86Å; Y104-M136 HydrophobicContact CD1-SD 3.85Å; Y104-M136 HydrophobicContact CD2-SD 4.25Å; Y104-M136 HydrophobicContact CE1-CE 4.06Å; Y104-M136 HydrophobicContact CE1-SD 4.18Å; Y104-M136 HydrophobicContact CG-CE 4.47Å; Y104-M136 HydrophobicContact CG-SD 3.89Å; I106-M136 HydrophobicContact CD1-CG 4.23Å; V133-M136 PolarHBondContact O-N 2.92Å; S134-M136 PolarHBondContact O-N 3.04Å; M136-K138 VanDerWaalsContact C-N 3.25Å; M136-K138 PolarHBondContact O-N 3.15Å; M136-N139 CarbonylContact O-C 3.52Å; M136-N139 PolarHBondContact O-N 2.73Å; M136-L210 HydrophobicContact CB-CD2 3.77Å; M136-L281 HydrophobicContact CB-CD1 4.33Å; M136-L281 HydrophobicContact CG-CD1 3.95Å
137	E	81.1	Confident	85.9	Confident	71 Å²	71	46.6 Å²	46.6	33%	0.332	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-54.7	-39.2	-177.3	-71	176.2	176.9	0	0	112.6	S134 N139 A140	S134-E137 WeakPolarHBondContact O-CG 3.25Å; S134-E137 PolarHBondContact O-N 2.8Å; E137-N139 PolarHBondContact O-N 3.33Å; E137-N139 VanDerWaalsContact O-N 3.14Å; E137-A140 WeakPolarHBondContact O-CB 3.41Å; E137-A140 PolarHBondContact O-N 3.24Å
138	K	76.5	Confident	86.3	Confident	200 Å²	200	45.4 Å²	45.4	87%	0.87	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-63.6	-20.1	178.9	-66.5	-177	179	179.3	0	113.7	M136	M136-K138 VanDerWaalsContact C-N 3.25Å; M136-K138 PolarHBondContact O-N 3.15Å
139	N	77.9	Confident	86.6	Confident	50 Å²	50	43 Å²	43	27%	0.267	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-111.1	20.6	-178.1	-61.2	-34.3	0	0	0	111.7	M136 E137 S141 N142 L283	M136-N139 CarbonylContact O-C 3.52Å; M136-N139 PolarHBondContact O-N 2.73Å; E137-N139 PolarHBondContact O-N 3.33Å; E137-N139 VanDerWaalsContact O-N 3.14Å; N139-S141 VanDerWaalsContact C-N 3.31Å; N139-S141 PolarHBondContact O-N 3.06Å; N139-N142 HydrophobicContact CB-CB 4.47Å; N139-N142 VanDerWaalsContact O-CB 3.31Å; N139-N142 WeakPolarHBondContact O-CB 3.35Å; N139-N142 PolarHBondContact O-N 3.43Å; N139-L283 HydrophobicContact CB-CD2 3.56Å; N139-L283 WeakPolarHBondContact O-CD2 3.09Å
140	A	78.1	Confident	86.8	Confident	9 Å²	9	43 Å²	43	7%	0.074	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-54.3	-42	-174.6	0	0	0	0	0	114	E137 N142 L143 L210	E137-A140 WeakPolarHBondContact O-CB 3.41Å; E137-A140 PolarHBondContact O-N 3.24Å; A140-N142 PolarHBondContact O-N 3Å; A140-L143 PolarHBondContact O-N 2.92Å; A140-L210 HydrophobicContact CB-CB 3.66Å; A140-L210 HydrophobicContact CB-CD1 4.41Å
141	S	77.2	Confident	86.9	Confident	90 Å²	90	37.1 Å²	37.1	63%	0.629	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-65.1	-17.5	177.6	54	0	0	0	0	113.9	N139	N139-S141 VanDerWaalsContact C-N 3.31Å; N139-S141 PolarHBondContact O-N 3.06Å
142	N	83	Confident	86.9	Confident	9 Å²	9	37 Å²	37	5%	0.048	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-96.6	-7.3	-173.1	-60.7	7.2	0	0	0	112.3	N139 A140 V144 L283 L284 L289	N139-N142 HydrophobicContact CB-CB 4.47Å; N139-N142 VanDerWaalsContact O-CB 3.31Å; N139-N142 WeakPolarHBondContact O-CB 3.35Å; N139-N142 PolarHBondContact O-N 3.43Å; A140-N142 PolarHBondContact O-N 3Å; N142-V144 PolarHBondContact O-N 2.95Å; N142-V144 VanDerWaalsContact O-N 3.14Å; N142-L283 HydrophobicContact CB-CB 4.36Å; N142-L283 HydrophobicContact CB-CD2 4.23Å; N142-L283 CarbonylContact O-C 3.54Å; N142-L283 VanDerWaalsContact O-CA 3.26Å; N142-L283 WeakPolarHBondContact O-CA 3.39Å; N142-L284 WeakPolarHBondContact CB-O 3.35Å; N142-L284 PolarHBondContact ND2-O 3.22Å; N142-L284 PolarHBondContact O-N 2.71Å; N142-L289 WeakPolarHBondContact OD1-CD1 3.47Å
143	L	85.8	Confident	86.9	Confident	17 Å²	17	34.2 Å²	34.2	9%	0.089	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	114.6	177.7	-177.8	69.6	0	0	0	109.4	A140 K145 A146 V206 H207 L210 L281 L283	A140-L143 PolarHBondContact O-N 2.92Å; L143-K145 WeakPolarHBondContact CD1-O 3.29Å; L143-A146 HydrophobicContact CD1-CB 4.36Å; L143-A146 HydrophobicContact CD2-CB 4.5Å; L143-V206 HydrophobicContact CD2-CB 4.27Å; L143-V206 HydrophobicContact CD2-CG1 4.02Å; L143-H207 HydrophobicContact CD2-CB 4.08Å; L143-L210 HydrophobicContact CB-CD1 4.25Å; L143-L210 HydrophobicContact CD2-CD1 3.91Å; L143-L281 HydrophobicContact CD1-CB 4.08Å; L143-L281 HydrophobicContact CD1-CD2 4.15Å; L143-L283 HydrophobicContact CD1-CG 4.33Å
144	V	82.4	Confident	86.8	Confident	33 Å²	33	39.3 Å²	39.3	20%	0.2	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-38.9	173.1	178.4	0	0	0	0	110.7	K101 N142 M282 L284	K101-V144 HydrophobicContact CD-CB 4.41Å; K101-V144 HydrophobicContact CD-CG1 4.33Å; N142-V144 PolarHBondContact O-N 2.95Å; N142-V144 VanDerWaalsContact O-N 3.14Å; V144-M282 PolarHBondContact N-O 3.16Å; V144-L284 HydrophobicContact CG2-CB 4.25Å; V144-L284 HydrophobicContact CG2-CD1 3.4Å; V144-L284 HydrophobicContact CG2-CG 3.41Å; V144-L284 VanDerWaalsContact CG2-CG 3.41Å
145	K	87.1	Confident	86.9	Confident	56 Å²	56	38 Å²	38	24%	0.243	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	141.3	-174.6	-163.3	163.5	-174.3	92	0	111.8	L143 E147 D201 M282	L143-K145 WeakPolarHBondContact CD1-O 3.29Å; K145-E147 WeakPolarHBondContact CE-OE1 3.34Å; K145-E147 HydrophobicContact CG-CG 4.47Å; K145-E147 IonicContact NZ-OE1 3.24Å; K145-D201 IonicContact NZ-OD2 2.97Å; K145-D201 PolarHBondContact NZ-OD2 2.79Å; K145-M282 HydrophobicContact CB-CB 4.22Å; K145-M282 HydrophobicContact CB-CG 4.47Å; K145-M282 HydrophobicContact CB-SD 4.14Å; K145-M282 HydrophobicContact CD-CE 4.36Å; K145-M282 HydrophobicContact CD-SD 4.4Å; K145-M282 HydrophobicContact CG-CE 4.45Å; K145-M282 PolarHBondContact N-O 2.95Å; K145-M282 PolarHBondContact O-N 3.31Å
146	A	93.1	Very high	86.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.6	171.1	0	0	0	0	0	110.9	L143 V202 T203 V206 L280 L281	L143-A146 HydrophobicContact CD1-CB 4.36Å; L143-A146 HydrophobicContact CD2-CB 4.5Å; A146-V202 HydrophobicContact CB-CG2 4.09Å; A146-V202 PolarHBondContact O-N 3.43Å; A146-T203 PolarHBondContact N-OG1 3.42Å; A146-T203 PolarHBondContact O-N 2.8Å; A146-T203 PolarHBondContact O-OG1 3.29Å; A146-V206 HydrophobicContact CB-CB 3.84Å; A146-V206 HydrophobicContact CB-CG1 4.27Å; A146-V206 HydrophobicContact CB-CG2 3.79Å; A146-L280 WeakPolarHBondContact CA-O 3.22Å; A146-L281 HydrophobicContact CB-CD2 3.47Å; A146-L281 VanDerWaalsContact CB-CD2 3.47Å
147	E	94.3	Very high	87	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.019	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	122.8	-178.6	-70.1	-76.1	166.6	0	0	110	L77 K81 K145 F200 L279 L280 M282	L77-E147 HydrophobicContact CD2-CB 3.99Å; L77-E147 HydrophobicContact CD2-CG 3.91Å; K81-E147 VanDerWaalsContact NZ-CD 3.3Å; K81-E147 IonicContact NZ-OE1 2.84Å; K81-E147 PolarHBondContact NZ-OE1 2.77Å; K81-E147 IonicContact NZ-OE2 2.96Å; K145-E147 WeakPolarHBondContact CE-OE1 3.34Å; K145-E147 HydrophobicContact CG-CG 4.47Å; K145-E147 IonicContact NZ-OE1 3.24Å; E147-F200 CarbonylContact C-O 3.52Å; E147-F200 WeakPolarHBondContact CA-O 3.47Å; E147-L279 CarbonylContact O-C 3.52Å; E147-L279 WeakPolarHBondContact O-CA 3.27Å; E147-L280 HydrophobicContact CB-CB 4.42Å; E147-L280 PolarHBondContact N-O 3.16Å; E147-L280 PolarHBondContact O-N 3.04Å; E147-M282 HydrophobicContact CG-CE 4.02Å
148	F	96.2	Very high	87.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120	172.1	170.2	-127.9	0	0	0	109.7	V129 F131 V150 L167 S199 F200 V202 F219 I221 P277 L279	V129-F148 HydrophobicContact CG2-CE2 4.3Å; V129-F148 HydrophobicContact CG2-CZ 3.96Å; F131-F148 HydrophobicContact CE2-CD2 4.13Å; F131-F148 HydrophobicContact CE2-CE2 4.13Å; F131-F148 AromaticContact CZ-CD2 3.78Å; F131-F148 HydrophobicContact CZ-CD2 3.78Å; F131-F148 AromaticContact CZ-CE2 3.6Å; F131-F148 HydrophobicContact CZ-CE2 3.6Å; F148-V150 HydrophobicContact CE1-CB 4.3Å; F148-V150 HydrophobicContact CE1-CG1 4.23Å; F148-V150 HydrophobicContact CE2-CB 4.31Å; F148-V150 HydrophobicContact CZ-CB 3.81Å; F148-V150 HydrophobicContact CZ-CG1 4.24Å; F148-V150 HydrophobicContact CZ-CG2 4.44Å; F148-L167 HydrophobicContact CD1-CD1 3.98Å; F148-L167 HydrophobicContact CD1-CD2 3.92Å; F148-L167 HydrophobicContact CE1-CD1 3.89Å; F148-S199 CarbonylContact O-C 3.58Å; F148-S199 WeakPolarHBondContact O-CA 3.27Å; F148-F200 HydrophobicContact CB-CB 4.43Å; F148-F200 HydrophobicContact CD1-CB 4.44Å; F148-F200 AromaticContact CD1-CD2 3.82Å; F148-F200 HydrophobicContact CD1-CD2 3.82Å; F148-F200 HydrophobicContact CD1-CG 4.49Å; F148-F200 HydrophobicContact CE1-CD2 4.28Å; F148-F200 PolarHBondContact N-O 2.92Å; F148-F200 PolarHBondContact O-N 3.15Å; F148-V202 HydrophobicContact CB-CB 4.49Å; F148-V202 HydrophobicContact CB-CG1 3.77Å; F148-V202 HydrophobicContact CB-CG2 3.85Å; F148-F219 HydrophobicContact CG-CD2 4.49Å; F148-I221 HydrophobicContact CE1-CD1 3.96Å; F148-I221 HydrophobicContact CE1-CG1 4.42Å; F148-I221 HydrophobicContact CZ-CD1 4.14Å; F148-P277 HydrophobicContact CE2-CB 3.83Å; F148-P277 HydrophobicContact CZ-CB 4.28Å; F148-L279 HydrophobicContact CB-CD2 3.76Å; F148-L279 HydrophobicContact CD2-CD2 4.09Å; F148-L279 HydrophobicContact CG-CD2 4.32Å
149	R	94.5	Very high	87.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.2	177.5	-60.4	-160	81.1	-176.4	10.2	111.6	S73 E80 W197 L198 P277 H278 L280	S73-R149 PolarHBondContact O-NH1 2.97Å; S73-R149 WeakPolarHBondContact OG-CD 3.28Å; S73-R149 PolarHBondContact OG-NH1 3.06Å; E80-R149 VanDerWaalsContact CD-NH2 3.34Å; E80-R149 IonicContact OE1-NH2 3.79Å; E80-R149 PolarHBondContact OE1-NH2 3.09Å; E80-R149 IonicContact OE2-NH2 2.83Å; E80-R149 PolarHBondContact OE2-NH2 3.35Å; E80-R149 VanDerWaalsContact OE2-NH2 3.09Å; R149-W197 HydrophobicContact CB-CE3 4.14Å; R149-W197 HydrophobicContact CB-CZ3 4.11Å; R149-L198 VanDerWaalsContact CA-O 3.3Å; R149-L198 WeakPolarHBondContact CA-O 3.26Å; R149-P277 VanDerWaalsContact O-CA 3.26Å; R149-P277 WeakPolarHBondContact O-CA 3.23Å; R149-H278 PolarHBondContact N-O 3.27Å; R149-H278 PolarHBondContact O-N 3.46Å; R149-L280 HydrophobicContact CG-CD1 4.33Å
150	V	94.1	Very high	88	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	135.8	176.2	65	0	0	0	0	110.2	F148 L198 F200 F249 I252 P277	F148-V150 HydrophobicContact CE1-CB 4.3Å; F148-V150 HydrophobicContact CE1-CG1 4.23Å; F148-V150 HydrophobicContact CE2-CB 4.31Å; F148-V150 HydrophobicContact CZ-CB 3.81Å; F148-V150 HydrophobicContact CZ-CG1 4.24Å; F148-V150 HydrophobicContact CZ-CG2 4.44Å; V150-L198 HydrophobicContact CG1-CB 3.97Å; V150-L198 HydrophobicContact CG1-CD1 4.42Å; V150-L198 PolarHBondContact N-O 3.14Å; V150-L198 PolarHBondContact O-N 2.94Å; V150-F200 HydrophobicContact CG1-CE2 4.13Å; V150-F249 HydrophobicContact CB-CD1 4.43Å; V150-F249 HydrophobicContact CG1-CD1 4.12Å; V150-F249 HydrophobicContact CG1-CE1 4.23Å; V150-F249 HydrophobicContact CG2-CB 3.68Å; V150-F249 HydrophobicContact CG2-CD1 3.46Å; V150-F249 VanDerWaalsContact CG2-CD1 3.46Å; V150-F249 HydrophobicContact CG2-CE1 4.33Å; V150-F249 HydrophobicContact CG2-CG 3.76Å; V150-I252 HydrophobicContact CG2-CD1 4.42Å; V150-P277 HydrophobicContact CB-CB 4.41Å; V150-P277 HydrophobicContact CG2-CB 4.19Å; V150-P277 HydrophobicContact CG2-CG 4.13Å
151	F	92.4	Very high	88.4	Confident	16 Å²	16	44.6 Å²	44.6	7%	0.07	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	115.3	179.4	-169.9	-97	0	0	0	110.4	L153 G195 E196 W197 F249 A250 K275	F151-L153 HydrophobicContact CD1-CD2 4.02Å; F151-L153 HydrophobicContact CE1-CD2 4.13Å; F151-G195 VanDerWaalsContact CZ-C 3.42Å; F151-E196 CarbonylContact C-O 3.41Å; F151-W197 HydrophobicContact CB-CD2 4.08Å; F151-W197 HydrophobicContact CB-CE3 3.83Å; F151-W197 HydrophobicContact CB-CH2 3.98Å; F151-W197 HydrophobicContact CB-CZ2 4.21Å; F151-W197 HydrophobicContact CB-CZ3 3.78Å; F151-W197 AromaticContact CD2-CD1 3.8Å; F151-W197 AromaticContact CD2-CD2 3.64Å; F151-W197 HydrophobicContact CD2-CD2 3.64Å; F151-W197 AromaticContact CD2-CE2 3.62Å; F151-W197 HydrophobicContact CD2-CE3 4.26Å; F151-W197 AromaticContact CD2-CG 3.77Å; F151-W197 HydrophobicContact CD2-CG 3.77Å; F151-W197 HydrophobicContact CD2-CZ2 4.23Å; F151-W197 AromaticContact CD2-NE1 3.71Å; F151-W197 HydrophobicContact CE2-CG 4.4Å; F151-W197 HydrophobicContact CG-CD2 4.36Å; F151-F249 VanDerWaalsContact O-CA 3.32Å; F151-F249 WeakPolarHBondContact O-CA 3.46Å; F151-A250 HydrophobicContact CB-CB 4.19Å; F151-A250 HydrophobicContact CD1-CB 4.19Å; F151-A250 PolarHBondContact O-N 2.84Å; F151-K275 HydrophobicContact CB-CB 3.97Å; F151-K275 WeakPolarHBondContact CB-O 3.22Å; F151-K275 HydrophobicContact CD1-CB 4.3Å; F151-K275 HydrophobicContact CD1-CD 3.75Å; F151-K275 HydrophobicContact CD2-CD 4.05Å; F151-K275 HydrophobicContact CE1-CD 3.78Å; F151-K275 HydrophobicContact CE2-CD 4.08Å; F151-K275 HydrophobicContact CG-CB 4.07Å; F151-K275 HydrophobicContact CG-CD 3.89Å; F151-K275 HydrophobicContact CG-CG 4.39Å; F151-K275 HydrophobicContact CZ-CD 3.96Å
152	R	92.6	Very high	89	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.1	173.5	-173.5	-170.9	61	69.9	-0.4	109.8	K190 A193 E194 G195 E196 L198 R248 F249	R152-K190 PolarHBondContact NE-O 2.89Å; R152-K190 PolarHBondContact NH1-O 3.45Å; R152-K190 PolarHBondContact NH2-O 3.42Å; R152-A193 PolarHBondContact NH1-O 3.17Å; R152-A193 PolarHBondContact NH2-O 2.89Å; R152-E194 PolarHBondContact NH2-O 2.91Å; R152-G195 CarbonylContact O-C 3.44Å; R152-G195 WeakPolarHBondContact O-CA 3.35Å; R152-E196 HydrophobicContact CB-CG 4.27Å; R152-E196 IonicContact CZ-OE1 3.42Å; R152-E196 PolarHBondContact N-O 2.84Å; R152-E196 IonicContact NE-OE1 3.5Å; R152-E196 PolarHBondContact NE-OE1 2.87Å; R152-E196 IonicContact NH2-OE1 3.07Å; R152-E196 PolarHBondContact NH2-OE1 3.02Å; R152-E196 PolarHBondContact O-N 3.33Å; R152-E196 VanDerWaalsContact O-N 3.15Å; R152-L198 HydrophobicContact CB-CD1 4.18Å; R152-R248 CarbonylContact C-O 3.5Å; R152-R248 VanDerWaalsContact CA-O 3.3Å; R152-R248 WeakPolarHBondContact CA-O 3.16Å; R152-F249 HydrophobicContact CB-CD1 4.45Å; R152-F249 HydrophobicContact CB-CE1 4.44Å
153	L	90.3	Very high	89.3	Confident	16 Å²	16	44.7 Å²	44.7	8%	0.084	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	152.8	172.9	-62.8	175.6	0	0	0	111.2	F151 N155 R248 A250 Y272	F151-L153 HydrophobicContact CD1-CD2 4.02Å; F151-L153 HydrophobicContact CE1-CD2 4.13Å; L153-N155 PolarHBondContact O-N 3.23Å; L153-R248 HydrophobicContact CB-CB 4.06Å; L153-R248 HydrophobicContact CD1-CB 4.49Å; L153-R248 PolarHBondContact N-O 3.42Å; L153-A250 HydrophobicContact CD1-CB 4.45Å; L153-A250 HydrophobicContact CD2-CB 3.99Å; L153-A250 HydrophobicContact CG-CB 4.23Å; L153-Y272 HydrophobicContact CD2-CD1 3.74Å; L153-Y272 HydrophobicContact CD2-CD2 4.23Å; L153-Y272 HydrophobicContact CD2-CE1 3.48Å; L153-Y272 VanDerWaalsContact CD2-CE1 3.48Å; L153-Y272 HydrophobicContact CD2-CE2 4Å; L153-Y272 HydrophobicContact CD2-CG 4.12Å
154	Q	89.4	Confident	89.5	Confident	111 Å²	111	49.9 Å²	49.9	52%	0.519	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-70.4	124.8	168.3	-174.5	175	30	0	0	109.8	R192 A193	Q154-R192 WeakPolarHBondContact CG-O 3.38Å; Q154-R192 PolarHBondContact NE2-O 3.48Å; Q154-A193 WeakPolarHBondContact CB-O 3.39Å; Q154-A193 WeakPolarHBondContact CG-O 3.48Å
155	N	88.5	Confident	90	Very high	7 Å²	7	48.3 Å²	48.3	4%	0.037	23%	0.232	C	C	.	.			trans	-110	93.8	172.2	-177.3	5.8	0	0	0	109.9	L153 K157 A158 T191 E246 R248	L153-N155 PolarHBondContact O-N 3.23Å; N155-K157 PolarHBondContact O-N 3.39Å; N155-K157 PolarHBondContact OD1-N 3.09Å; N155-K157 VanDerWaalsContact OD1-N 3.13Å; N155-A158 HydrophobicContact CB-CB 4.13Å; N155-A158 VanDerWaalsContact O-CB 3.29Å; N155-A158 WeakPolarHBondContact O-CB 3.27Å; N155-A158 PolarHBondContact O-N 2.93Å; N155-A158 VanDerWaalsContact O-N 3.16Å; N155-A158 PolarHBondContact OD1-N 2.59Å; N155-T191 PolarHBondContact N-O 2.8Å; N155-E246 PolarHBondContact ND2-O 3.06Å; N155-R248 HydrophobicContact CB-CG 4.49Å; N155-R248 PolarHBondContact ND2-NE 3.07Å
156	S	86	Confident	90.3	Very high	98 Å²	98	45.9 Å²	45.9	69%	0.685	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-20	178.5	56.7	0	0	0	0	113.7
157	K	85.9	Confident	90.4	Very high	145 Å²	145	45.9 Å²	45.9	63%	0.63	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	4.1	178.4	-52.6	-159	-165.7	166	0	113.4	N155 Y257	N155-K157 PolarHBondContact O-N 3.39Å; N155-K157 PolarHBondContact OD1-N 3.09Å; N155-K157 VanDerWaalsContact OD1-N 3.13Å; K157-Y257 HydrophobicContact CD-CE1 4.2Å; K157-Y257 VanDerWaalsContact CD-OH 3.28Å; K157-Y257 WeakPolarHBondContact CD-OH 3.39Å
158	A	85.4	Confident	90.4	Very high	2 Å²	2	47.1 Å²	47.1	2%	0.017	23%	0.227	C	C	.	.			trans	-62.3	134.3	178	0	0	0	0	0	111	N155 T191 R192 E246	N155-A158 HydrophobicContact CB-CB 4.13Å; N155-A158 VanDerWaalsContact O-CB 3.29Å; N155-A158 WeakPolarHBondContact O-CB 3.27Å; N155-A158 PolarHBondContact O-N 2.93Å; N155-A158 VanDerWaalsContact O-N 3.16Å; N155-A158 PolarHBondContact OD1-N 2.59Å; A158-T191 HydrophobicContact CB-CG2 4.44Å; A158-T191 WeakPolarHBondContact CB-OG1 2.9Å; A158-R192 HydrophobicContact CB-CG 4.14Å; A158-R192 VanDerWaalsContact O-CZ 3.27Å; A158-R192 PolarHBondContact O-NE 3.04Å; A158-R192 PolarHBondContact O-NH2 3.09Å; A158-E246 VanDerWaalsContact C-OE2 3.31Å; A158-E246 VanDerWaalsContact CA-OE2 3.25Å; A158-E246 WeakPolarHBondContact CA-OE2 3.33Å; A158-E246 HydrophobicContact CB-CB 4.28Å; A158-E246 WeakPolarHBondContact CB-OE2 3.4Å
159	R	86.8	Confident	90.3	Very high	199 Å²	199	47.3 Å²	47.3	75%	0.751	23%	0.227	S	C	*	.	S	Bend	trans	-77.5	-40.2	176.4	-59	174.3	179.4	174	3.2	110.8	R192 E246	R159-R192 PolarHBondContact O-NH2 2.82Å; R159-E246 VanDerWaalsContact CB-OE1 3.25Å; R159-E246 WeakPolarHBondContact CB-OE1 3.4Å; R159-E246 VanDerWaalsContact CG-OE1 3.3Å; R159-E246 WeakPolarHBondContact CG-OE1 3.48Å; R159-E246 VanDerWaalsContact N-CD 3.33Å; R159-E246 PolarHBondContact N-OE1 3.05Å; R159-E246 PolarHBondContact N-OE2 2.81Å
160	V	84.8	Confident	90.1	Very high	59 Å²	59	48.7 Å²	48.7	36%	0.358	24%	0.236	S	C	.	.	S	Bend	trans	-96.4	140.4	-179.6	-166.1	0	0	0	0	109.1	E162 Q163 T191 E246	V160-E162 WeakPolarHBondContact CG1-O 3.27Å; V160-Q163 HydrophobicContact CB-CG 4.41Å; V160-T191 PolarHBondContact O-OG1 3.03Å; V160-E246 PolarHBondContact N-OE2 2.97Å
161	S	86.6	Confident	89.8	Confident	74 Å²	74	50.6 Å²	50.6	52%	0.517	25%	0.246	S	C	.	.	S	Bend	trans	-77.4	-30.3	179.3	52.1	0	0	0	0	113.6	K190 T191	S161-K190 CarbonylContact O-C 3.45Å; S161-K190 WeakPolarHBondContact O-CA 3.42Å; S161-T191 PolarHBondContact O-N 2.69Å; S161-T191 PolarHBondContact O-OG1 3.46Å
162	E	89.9	Confident	89.3	Confident	93 Å²	93	56.7 Å²	56.7	44%	0.435	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.1	-177	-54.2	-167.1	156.9	0	0	110.4	V160 V188 V189 K190	V160-E162 WeakPolarHBondContact CG1-O 3.27Å; E162-V188 HydrophobicContact CB-CG1 4.3Å; E162-V189 CarbonylContact C-O 3.47Å; E162-V189 VanDerWaalsContact CA-O 3.25Å; E162-V189 WeakPolarHBondContact CA-O 2.9Å; E162-K190 HydrophobicContact CG-CG 4.11Å; E162-K190 WeakPolarHBondContact OE1-CE 3.19Å
163	Q	88.7	Confident	88.5	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.037	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	138.1	176.2	-71.7	-169.3	-52.4	0	0	110.1	V160 I165 V188 V189 T191 L223 E244	V160-Q163 HydrophobicContact CB-CG 4.41Å; Q163-I165 PolarHBondContact O-N 3.26Å; Q163-V188 WeakPolarHBondContact O-CA 3.48Å; Q163-V189 HydrophobicContact CB-CG2 4.45Å; Q163-V189 PolarHBondContact N-O 3.4Å; Q163-V189 WeakPolarHBondContact O-CG2 3.29Å; Q163-V189 PolarHBondContact O-N 3.34Å; Q163-T191 HydrophobicContact CB-CG2 4.24Å; Q163-T191 HydrophobicContact CG-CG2 3.8Å; Q163-L223 HydrophobicContact CB-CD2 3.86Å; Q163-L223 HydrophobicContact CG-CD2 4.37Å; Q163-E244 PolarHBondContact NE2-O 2.51Å
164	R	91	Very high	87.4	Confident	125 Å²	125	67.9 Å²	67.9	47%	0.472	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	105.9	170	-174.1	179.2	178.4	-168.4	-3.6	109.2	S186 K187 V188	R164-S186 PolarHBondContact NE-OG 2.85Å; R164-S186 VanDerWaalsContact NE-OG 3.14Å; R164-S186 PolarHBondContact NH2-OG 3.49Å; R164-K187 CarbonylContact C-O 3.58Å; R164-K187 WeakPolarHBondContact CA-O 3.44Å; R164-V188 HydrophobicContact CB-CG2 4.22Å; R164-V188 HydrophobicContact CG-CG2 4.21Å
165	I	92.9	Very high	86.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	149.9	173.3	62.3	167.8	0	0	0	110.1	Q163 S186 K187 V189 L198 F200 I221 L223 L245 A247 F249	Q163-I165 PolarHBondContact O-N 3.26Å; I165-S186 CarbonylContact O-C 3.57Å; I165-S186 WeakPolarHBondContact O-CA 3.27Å; I165-S186 WeakPolarHBondContact O-CB 3.37Å; I165-K187 HydrophobicContact CG1-CB 4.29Å; I165-K187 VanDerWaalsContact CG1-O 3.29Å; I165-K187 WeakPolarHBondContact CG1-O 3.34Å; I165-K187 PolarHBondContact N-O 2.83Å; I165-K187 PolarHBondContact O-N 2.97Å; I165-V189 HydrophobicContact CD1-CG1 3.88Å; I165-V189 HydrophobicContact CG1-CG1 4.05Å; I165-V189 HydrophobicContact CG1-CG2 4.47Å; I165-V189 HydrophobicContact CG2-CG2 3.96Å; I165-L198 HydrophobicContact CD1-CD1 3.8Å; I165-F200 HydrophobicContact CD1-CZ 3.92Å; I165-I221 HydrophobicContact CB-CG2 4.36Å; I165-I221 HydrophobicContact CD1-CG2 4.42Å; I165-L223 HydrophobicContact CG2-CD2 4.08Å; I165-L245 HydrophobicContact CG2-CD1 3.85Å; I165-A247 HydrophobicContact CG2-CB 4.23Å; I165-F249 HydrophobicContact CD1-CE1 4.42Å; I165-F249 HydrophobicContact CD1-CZ 4.15Å
166	E	93.7	Very high	85.2	Confident	6 Å²	6	77.4 Å²	77.4	3%	0.028	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	140.8	178.3	-64.7	-175.5	158.2	0	0	109.6	Y168 Y183 D185 I221 S222 H224	E166-Y168 HydrophobicContact CB-CD2 4.23Å; E166-Y168 HydrophobicContact CB-CE2 3.49Å; E166-Y168 VanDerWaalsContact CB-CE2 3.49Å; E166-Y168 WeakPolarHBondContact OE2-CE2 3.33Å; E166-Y168 PolarHBondContact OE2-OH 2.62Å; E166-Y183 HydrophobicContact CB-CE2 4.38Å; E166-Y183 HydrophobicContact CG-CE2 4.28Å; E166-D185 WeakPolarHBondContact CA-O 3.25Å; E166-I221 WeakPolarHBondContact O-CA 3.49Å; E166-S222 PolarHBondContact N-O 3.39Å; E166-S222 PolarHBondContact O-N 2.89Å; E166-H224 VanDerWaalsContact CD-CA 3.49Å; E166-H224 HydrophobicContact CG-CB 4.39Å; E166-H224 WeakPolarHBondContact OE1-CB 3.47Å; E166-H224 IonicContact OE1-CE1 2.65Å; E166-H224 IonicContact OE1-CG 2.58Å; E166-H224 IonicContact OE1-ND1 3.72Å; E166-H224 PolarHBondContact OE1-ND1 2.87Å; E166-H224 WeakPolarHBondContact OE2-CA 3.42Å; E166-H224 IonicContact OE2-ND1 2.8Å
167	L	95.4	Very high	84.2	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.2	176.9	-172.4	72.5	0	0	0	109.8	F148 I184 D185 F200 V202 F219 I221	F148-L167 HydrophobicContact CD1-CD1 3.98Å; F148-L167 HydrophobicContact CD1-CD2 3.92Å; F148-L167 HydrophobicContact CE1-CD1 3.89Å; L167-I184 HydrophobicContact CB-CB 4.46Å; L167-I184 HydrophobicContact CD2-CB 4.35Å; L167-I184 HydrophobicContact CD2-CD1 4.07Å; L167-I184 HydrophobicContact CD2-CG2 4.29Å; L167-I184 HydrophobicContact CG-CB 4.45Å; L167-I184 HydrophobicContact CG-CD1 4.2Å; L167-I184 WeakPolarHBondContact O-CB 3.43Å; L167-I184 PolarHBondContact O-N 2.87Å; L167-D185 PolarHBondContact N-O 2.74Å; L167-F200 HydrophobicContact CB-CD1 4.16Å; L167-F200 HydrophobicContact CB-CE1 4.27Å; L167-F200 HydrophobicContact CD2-CB 3.5Å; L167-F200 VanDerWaalsContact CD2-CB 3.5Å; L167-F200 HydrophobicContact CD2-CD1 4.06Å; L167-F200 HydrophobicContact CD2-CD2 4.16Å; L167-F200 HydrophobicContact CD2-CG 3.66Å; L167-V202 HydrophobicContact CD2-CG1 3.75Å; L167-F219 HydrophobicContact CD1-CB 3.87Å; L167-F219 HydrophobicContact CD1-CG 4.42Å; L167-I221 HydrophobicContact CD1-CG1 3.71Å
168	Y	92.9	Very high	83.3	Confident	30 Å²	30	72.9 Å²	72.9	12%	0.118	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.2	179	-66.7	-92.2	0	0	0	111.4	E166 Q181 R182 Y183 F219 K220	E166-Y168 HydrophobicContact CB-CD2 4.23Å; E166-Y168 HydrophobicContact CB-CE2 3.49Å; E166-Y168 VanDerWaalsContact CB-CE2 3.49Å; E166-Y168 WeakPolarHBondContact OE2-CE2 3.33Å; E166-Y168 PolarHBondContact OE2-OH 2.62Å; Y168-Q181 HydrophobicContact CD1-CB 4.24Å; Y168-Q181 HydrophobicContact CD1-CG 4Å; Y168-Q181 HydrophobicContact CE1-CG 4.49Å; Y168-R182 CarbonylContact C-O 3.56Å; Y168-R182 WeakPolarHBondContact CA-O 3.29Å; Y168-Y183 AromaticContact CE1-CD2 3.99Å; Y168-Y183 HydrophobicContact CE1-CD2 3.99Å; Y168-Y183 HydrophobicContact CE1-CG 4.41Å; Y168-F219 CarbonylContact O-C 3.52Å; Y168-F219 VanDerWaalsContact O-CA 3.28Å; Y168-F219 WeakPolarHBondContact O-CA 3.5Å; Y168-K220 PolarHBondContact N-O 3.37Å; Y168-K220 PolarHBondContact O-N 3.33Å
169	Q	93.9	Very high	82.7	Confident	3 Å²	3	77.5 Å²	77.5	1%	0.014	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	127.7	161.9	-177.4	-174.7	0.3	0	0	108.7	L171 Q181 R182 I184 A205 E208 F219	Q169-L171 HydrophobicContact CG-CD2 4.12Å; Q169-Q181 CarbonylContact O-C 3.52Å; Q169-Q181 VanDerWaalsContact O-CA 3.27Å; Q169-Q181 WeakPolarHBondContact O-CA 3.46Å; Q169-R182 HydrophobicContact CB-CB 4.29Å; Q169-R182 PolarHBondContact N-O 3.46Å; Q169-R182 PolarHBondContact O-N 3.08Å; Q169-I184 HydrophobicContact CB-CD1 4.08Å; Q169-I184 HydrophobicContact CB-CG1 4.4Å; Q169-A205 HydrophobicContact CB-CB 4.47Å; Q169-A205 HydrophobicContact CG-CB 4.16Å; Q169-E208 PolarHBondContact NE2-OE2 2.91Å; Q169-F219 HydrophobicContact CB-CD1 4.47Å; Q169-F219 HydrophobicContact CB-CE1 4.46Å
170	V	90.5	Very high	82.5	Confident	30 Å²	30	69.8 Å²	69.8	18%	0.182	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	128.8	175.5	-177.6	0	0	0	0	108.9	L217 G218 K220	V170-L217 HydrophobicContact CB-CB 3.87Å; V170-L217 HydrophobicContact CG1-CB 3.8Å; V170-L217 HydrophobicContact CG1-CD1 4.11Å; V170-G218 PolarHBondContact N-O 3.29Å; V170-G218 VanDerWaalsContact N-O 3.1Å; V170-K220 HydrophobicContact CG2-CB 3.89Å
171	L	88.9	Confident	82.7	Confident	39 Å²	39	70.4 Å²	70.4	20%	0.204	38%	0.375	C	S	.	.			trans	-111.7	147.3	-178.9	-62.4	-178.2	0	0	0	111.1	Q169 S173 G180 R182	Q169-L171 HydrophobicContact CG-CD2 4.12Å; L171-S173 PolarHBondContact O-N 3.38Å; L171-S173 VanDerWaalsContact O-N 3.14Å; L171-G180 PolarHBondContact N-O 3.38Å; L171-R182 HydrophobicContact CD1-CB 3.96Å; L171-R182 HydrophobicContact CG-CB 4.34Å
172	K	80.9	Confident	82.9	Confident	145 Å²	145	72.2 Å²	72.2	63%	0.63	37%	0.37	S	S	*	.			trans	-75.7	102.4	173.7	-167	174.2	-177.6	175.7	0	108.4	K174 L217	K172-K174 PolarHBondContact O-N 2.51Å; K172-L217 HydrophobicContact CB-CD1 3.9Å
173	S	75.3	Confident	83	Confident	57 Å²	57	72.8 Å²	72.8	40%	0.399	37%	0.369	S	S	.	.			trans	-77.2	122.3	175.2	-165.4	0	0	0	0	110.4	L171 E175 S178	L171-S173 PolarHBondContact O-N 3.38Å; L171-S173 VanDerWaalsContact O-N 3.14Å; S173-E175 PolarHBondContact OG-O 2.88Å; S173-S178 WeakPolarHBondContact OG-CB 3.41Å; S173-S178 PolarHBondContact OG-O 2.82Å
174	K	67.3	Low	83.3	Confident	195 Å²	195	74.5 Å²	74.5	85%	0.848	38%	0.378	S	S	*	.	S	Bend	trans	-91.6	-21.5	173.8	-71	-175.8	178.6	179.5	0	112.4	K172	K172-K174 PolarHBondContact O-N 2.51Å
175	E	69.3	Low	83.4	Confident	125 Å²	125	71.2 Å²	71.2	58%	0.584	37%	0.37	S	S	*	.	S	Bend	trans	-132	145.8	-176.9	-65.8	177.6	-177.2	0	0	110	S173 S177 S178	S173-E175 PolarHBondContact OG-O 2.88Å; E175-S177 PolarHBondContact O-N 2.73Å; E175-S177 VanDerWaalsContact O-N 3.07Å; E175-S178 WeakPolarHBondContact O-CB 3.19Å; E175-S178 PolarHBondContact O-N 2.89Å
176	L	63.6	Low	83.5	Confident	192 Å²	192	72.3 Å²	72.3	100%	1.005	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.7	-177.2	-149.4	77.8	0	0	0	113.4
177	S	64.1	Low	83.4	Confident	101 Å²	101	75.1 Å²	75.1	71%	0.706	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-17.2	178.1	51.8	0	0	0	0	114.1	E175	E175-S177 PolarHBondContact O-N 2.73Å; E175-S177 VanDerWaalsContact O-N 3.07Å
178	S	67	Low	83.3	Confident	47 Å²	47	79.8 Å²	79.8	33%	0.329	42%	0.418	S	S	.	.	S	Bend	trans	-75.5	136.5	-177.5	-74	0	0	0	0	110.5	S173 E175 G180	S173-S178 WeakPolarHBondContact OG-CB 3.41Å; S173-S178 PolarHBondContact OG-O 2.82Å; E175-S178 WeakPolarHBondContact O-CB 3.19Å; E175-S178 PolarHBondContact O-N 2.89Å; S178-G180 PolarHBondContact O-N 3.04Å; S178-G180 VanDerWaalsContact O-N 3.09Å
179	P	72.6	Confident	83.3	Confident	100 Å²	100	78.4 Å²	78.4	65%	0.649	41%	0.413	S	S	*	.			trans	-63.3	115.6	179.8	24.7	-31.9	0	0	0	110.2	Q181	P179-Q181 PolarHBondContact O-N 2.85Å
180	G	83.3	Confident	83.2	Confident	36 Å²	36	83.8 Å²	83.8	37%	0.371	44%	0.436	S	S	.	.	S	Bend	trans	-74.5	-0.3	179.3	0	0	0	0	0	114.7	L171 S178	L171-G180 PolarHBondContact N-O 3.38Å; S178-G180 PolarHBondContact O-N 3.04Å; S178-G180 VanDerWaalsContact O-N 3.09Å
181	Q	88.7	Confident	83.1	Confident	73 Å²	73	82.3 Å²	82.3	34%	0.341	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	148.8	-179.5	62.7	-175.7	22.9	0	0	111	Y168 Q169 P179	Y168-Q181 HydrophobicContact CD1-CB 4.24Å; Y168-Q181 HydrophobicContact CD1-CG 4Å; Y168-Q181 HydrophobicContact CE1-CG 4.49Å; Q169-Q181 CarbonylContact O-C 3.52Å; Q169-Q181 VanDerWaalsContact O-CA 3.27Å; Q169-Q181 WeakPolarHBondContact O-CA 3.46Å; P179-Q181 PolarHBondContact O-N 2.85Å
182	R	90.4	Very high	83.1	Confident	111 Å²	111	86.7 Å²	86.7	42%	0.419	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128	174.9	177.5	-170.2	-66.6	155.2	-5.8	109.3	Y168 Q169 L171 E208	Y168-R182 CarbonylContact C-O 3.56Å; Y168-R182 WeakPolarHBondContact CA-O 3.29Å; Q169-R182 HydrophobicContact CB-CB 4.29Å; Q169-R182 PolarHBondContact N-O 3.46Å; Q169-R182 PolarHBondContact O-N 3.08Å; L171-R182 HydrophobicContact CD1-CB 3.96Å; L171-R182 HydrophobicContact CG-CB 4.34Å; R182-E208 IonicContact CZ-OE2 3.04Å; R182-E208 IonicContact NH1-OE2 3.09Å; R182-E208 PolarHBondContact NH1-OE2 2.65Å; R182-E208 IonicContact NH2-OE2 3.35Å
183	Y	93	Very high	83.5	Confident	106 Å²	106	81.5 Å²	81.5	42%	0.416	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	140.7	176.8	174.6	-92.4	0	0	0	111	E166 Y168 D185 S186	E166-Y183 HydrophobicContact CB-CE2 4.38Å; E166-Y183 HydrophobicContact CG-CE2 4.28Å; Y168-Y183 AromaticContact CE1-CD2 3.99Å; Y168-Y183 HydrophobicContact CE1-CD2 3.99Å; Y168-Y183 HydrophobicContact CE1-CG 4.41Å; Y183-D185 VanDerWaalsContact OH-C 3.28Å; Y183-S186 WeakPolarHBondContact OH-CB 3.33Å; Y183-S186 PolarHBondContact OH-N 2.82Å; Y183-S186 PolarHBondContact OH-OG 2.92Å
184	I	94.1	Very high	84.1	Confident	43 Å²	43	86.4 Å²	86.4	22%	0.221	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-65	175.8	-57.6	179.7	0	0	0	109.9	L167 Q169 D201 V202 A205 F219	L167-I184 HydrophobicContact CB-CB 4.46Å; L167-I184 HydrophobicContact CD2-CB 4.35Å; L167-I184 HydrophobicContact CD2-CD1 4.07Å; L167-I184 HydrophobicContact CD2-CG2 4.29Å; L167-I184 HydrophobicContact CG-CB 4.45Å; L167-I184 HydrophobicContact CG-CD1 4.2Å; L167-I184 WeakPolarHBondContact O-CB 3.43Å; L167-I184 PolarHBondContact O-N 2.87Å; Q169-I184 HydrophobicContact CB-CD1 4.08Å; Q169-I184 HydrophobicContact CB-CG1 4.4Å; I184-D201 VanDerWaalsContact CG2-O 3.27Å; I184-D201 WeakPolarHBondContact CG2-O 3.45Å; I184-V202 HydrophobicContact CD1-CG1 4.13Å; I184-V202 HydrophobicContact CG2-CG1 4.39Å; I184-A205 HydrophobicContact CD1-CB 4.44Å; I184-F219 HydrophobicContact CD1-CD1 3.63Å; I184-F219 HydrophobicContact CD1-CE1 3.49Å; I184-F219 VanDerWaalsContact CD1-CE1 3.49Å
185	D	94.2	Very high	85.1	Confident	56 Å²	56	78.7 Å²	78.7	30%	0.299	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	167.3	-172.2	-173.6	27.6	0	0	0	111.3	E166 L167 Y183 F200	E166-D185 WeakPolarHBondContact CA-O 3.25Å; L167-D185 PolarHBondContact N-O 2.74Å; Y183-D185 VanDerWaalsContact OH-C 3.28Å; D185-F200 HydrophobicContact CB-CD1 4.03Å
186	S	94.1	Very high	86.1	Confident	24 Å²	24	76.2 Å²	76.2	17%	0.168	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	144.2	179.6	74.5	0	0	0	0	112.2	R164 I165 Y183	R164-S186 PolarHBondContact NE-OG 2.85Å; R164-S186 VanDerWaalsContact NE-OG 3.14Å; R164-S186 PolarHBondContact NH2-OG 3.49Å; I165-S186 CarbonylContact O-C 3.57Å; I165-S186 WeakPolarHBondContact O-CA 3.27Å; I165-S186 WeakPolarHBondContact O-CB 3.37Å; Y183-S186 WeakPolarHBondContact OH-CB 3.33Å; Y183-S186 PolarHBondContact OH-N 2.82Å; Y183-S186 PolarHBondContact OH-OG 2.92Å
187	K	92.4	Very high	87.4	Confident	64 Å²	64	69.2 Å²	69.2	28%	0.278	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.2	177.7	-67	-172.4	-171.7	-124.6	0	111.6	R164 I165 S199 F200	R164-K187 CarbonylContact C-O 3.58Å; R164-K187 WeakPolarHBondContact CA-O 3.44Å; I165-K187 HydrophobicContact CG1-CB 4.29Å; I165-K187 VanDerWaalsContact CG1-O 3.29Å; I165-K187 WeakPolarHBondContact CG1-O 3.34Å; I165-K187 PolarHBondContact N-O 2.83Å; I165-K187 PolarHBondContact O-N 2.97Å; K187-S199 WeakPolarHBondContact CE-O 3.33Å; K187-S199 PolarHBondContact NZ-O 3.45Å; K187-F200 HydrophobicContact CB-CE1 4.33Å; K187-F200 HydrophobicContact CB-CZ 4.47Å; K187-F200 HydrophobicContact CD-CD1 4.31Å; K187-F200 HydrophobicContact CD-CE1 3.73Å; K187-F200 HydrophobicContact CD-CZ 3.93Å; K187-F200 HydrophobicContact CG-CD1 4.5Å; K187-F200 HydrophobicContact CG-CE1 3.73Å; K187-F200 HydrophobicContact CG-CZ 4.2Å
188	V	92.3	Very high	88.8	Confident	99 Å²	99	65 Å²	65	60%	0.6	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	124.3	170	-175.8	0	0	0	0	108.3	E162 Q163 R164	E162-V188 HydrophobicContact CB-CG1 4.3Å; Q163-V188 WeakPolarHBondContact O-CA 3.48Å; R164-V188 HydrophobicContact CB-CG2 4.22Å; R164-V188 HydrophobicContact CG-CG2 4.21Å
189	V	92.7	Very high	90.1	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	142.3	-177	-61.1	0	0	0	0	111	E162 Q163 I165 L198 A247	E162-V189 CarbonylContact C-O 3.47Å; E162-V189 VanDerWaalsContact CA-O 3.25Å; E162-V189 WeakPolarHBondContact CA-O 2.9Å; Q163-V189 HydrophobicContact CB-CG2 4.45Å; Q163-V189 PolarHBondContact N-O 3.4Å; Q163-V189 WeakPolarHBondContact O-CG2 3.29Å; Q163-V189 PolarHBondContact O-N 3.34Å; I165-V189 HydrophobicContact CD1-CG1 3.88Å; I165-V189 HydrophobicContact CG1-CG1 4.05Å; I165-V189 HydrophobicContact CG1-CG2 4.47Å; I165-V189 HydrophobicContact CG2-CG2 3.96Å; V189-L198 HydrophobicContact CG1-CD1 3.65Å; V189-L198 HydrophobicContact CG1-CD2 3.99Å; V189-A247 HydrophobicContact CG2-CB 3.98Å
190	K	91.8	Very high	91.2	Very high	116 Å²	116	58.8 Å²	58.8	50%	0.504	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	105.2	177.8	-60.6	-172	179.9	-176.2	0	109.9	R152 S161 E162 R192 A193	R152-K190 PolarHBondContact NE-O 2.89Å; R152-K190 PolarHBondContact NH1-O 3.45Å; R152-K190 PolarHBondContact NH2-O 3.42Å; S161-K190 CarbonylContact O-C 3.45Å; S161-K190 WeakPolarHBondContact O-CA 3.42Å; E162-K190 HydrophobicContact CG-CG 4.11Å; E162-K190 WeakPolarHBondContact OE1-CE 3.19Å; K190-R192 VanDerWaalsContact C-N 3.34Å; K190-R192 PolarHBondContact O-N 3.23Å; K190-A193 HydrophobicContact CB-CB 3.61Å; K190-A193 HydrophobicContact CD-CB 4.5Å; K190-A193 PolarHBondContact O-N 2.9Å
191	T	89	Confident	91.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-37.8	-171	58.1	0	0	0	0	113.6	N155 A158 V160 S161 Q163 E246	N155-T191 PolarHBondContact N-O 2.8Å; A158-T191 HydrophobicContact CB-CG2 4.44Å; A158-T191 WeakPolarHBondContact CB-OG1 2.9Å; V160-T191 PolarHBondContact O-OG1 3.03Å; S161-T191 PolarHBondContact O-N 2.69Å; S161-T191 PolarHBondContact O-OG1 3.46Å; Q163-T191 HydrophobicContact CB-CG2 4.24Å; Q163-T191 HydrophobicContact CG-CG2 3.8Å; T191-E246 HydrophobicContact CG2-CB 4.46Å
192	R	89.4	Confident	92	Very high	130 Å²	130	57 Å²	57	49%	0.491	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-10.8	-177.2	-64.3	-174.8	-177.2	170	3.5	114	Q154 A158 R159 K190	Q154-R192 WeakPolarHBondContact CG-O 3.38Å; Q154-R192 PolarHBondContact NE2-O 3.48Å; A158-R192 HydrophobicContact CB-CG 4.14Å; A158-R192 VanDerWaalsContact O-CZ 3.27Å; A158-R192 PolarHBondContact O-NE 3.04Å; A158-R192 PolarHBondContact O-NH2 3.09Å; R159-R192 PolarHBondContact O-NH2 2.82Å; K190-R192 VanDerWaalsContact C-N 3.34Å; K190-R192 PolarHBondContact O-N 3.23Å
193	A	89.3	Confident	92.1	Very high	37 Å²	37	52.8 Å²	52.8	31%	0.306	27%	0.265	S	S	.	.	S	Bend	trans	-70.8	160.1	178.3	0	0	0	0	0	110.8	R152 Q154 K190	R152-A193 PolarHBondContact NH1-O 3.17Å; R152-A193 PolarHBondContact NH2-O 2.89Å; Q154-A193 WeakPolarHBondContact CB-O 3.39Å; Q154-A193 WeakPolarHBondContact CG-O 3.48Å; K190-A193 HydrophobicContact CB-CB 3.61Å; K190-A193 HydrophobicContact CD-CB 4.5Å; K190-A193 PolarHBondContact O-N 2.9Å
194	E	88.7	Confident	92.1	Very high	159 Å²	159	55.1 Å²	55.1	74%	0.743	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-53.2	151	172.1	-66.3	-170.5	172.1	0	0	111.2	R152	R152-E194 PolarHBondContact NH2-O 2.91Å
195	G	87.5	Confident	92	Very high	33 Å²	33	53.2 Å²	53.2	34%	0.34	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-63.6	143.2	-172.5	0	0	0	0	0	113.2	F151 R152	F151-G195 VanDerWaalsContact CZ-C 3.42Å; R152-G195 CarbonylContact O-C 3.44Å; R152-G195 WeakPolarHBondContact O-CA 3.35Å
196	E	90.2	Very high	92	Very high	73 Å²	73	50.5 Å²	50.5	34%	0.341	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	153.2	-174.9	75	-164.7	132.7	0	0	111.4	F151 R152 L198	F151-E196 CarbonylContact C-O 3.41Å; R152-E196 HydrophobicContact CB-CG 4.27Å; R152-E196 IonicContact CZ-OE1 3.42Å; R152-E196 PolarHBondContact N-O 2.84Å; R152-E196 IonicContact NE-OE1 3.5Å; R152-E196 PolarHBondContact NE-OE1 2.87Å; R152-E196 IonicContact NH2-OE1 3.07Å; R152-E196 PolarHBondContact NH2-OE1 3.02Å; R152-E196 PolarHBondContact O-N 3.33Å; R152-E196 VanDerWaalsContact O-N 3.15Å; E196-L198 HydrophobicContact CG-CD2 3.87Å; E196-L198 HydrophobicContact CG-CG 4.39Å
197	W	91.6	Very high	91.9	Very high	46 Å²	46	53 Å²	53	17%	0.174	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	134.4	170.2	-80	111.2	0	0	0	110.4	R149 F151 K275 H278	R149-W197 HydrophobicContact CB-CE3 4.14Å; R149-W197 HydrophobicContact CB-CZ3 4.11Å; F151-W197 HydrophobicContact CB-CD2 4.08Å; F151-W197 HydrophobicContact CB-CE3 3.83Å; F151-W197 HydrophobicContact CB-CH2 3.98Å; F151-W197 HydrophobicContact CB-CZ2 4.21Å; F151-W197 HydrophobicContact CB-CZ3 3.78Å; F151-W197 AromaticContact CD2-CD1 3.8Å; F151-W197 AromaticContact CD2-CD2 3.64Å; F151-W197 HydrophobicContact CD2-CD2 3.64Å; F151-W197 AromaticContact CD2-CE2 3.62Å; F151-W197 HydrophobicContact CD2-CE3 4.26Å; F151-W197 AromaticContact CD2-CG 3.77Å; F151-W197 HydrophobicContact CD2-CG 3.77Å; F151-W197 HydrophobicContact CD2-CZ2 4.23Å; F151-W197 AromaticContact CD2-NE1 3.71Å; F151-W197 HydrophobicContact CE2-CG 4.4Å; F151-W197 HydrophobicContact CG-CD2 4.36Å; W197-K275 HydrophobicContact CH2-CB 4.22Å; W197-K275 HydrophobicContact CZ2-CB 4.06Å; W197-K275 HydrophobicContact CZ2-CG 4.05Å; W197-H278 AromaticContact CH2-CE1 3.63Å; W197-H278 AromaticContact CZ3-CE1 3.76Å
198	L	93.5	Very high	91.8	Very high	12 Å²	12	51.2 Å²	51.2	6%	0.063	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.7	171.3	-54.2	175.2	0	0	0	108.4	R149 V150 R152 I165 V189 E196 F200 F249	R149-L198 VanDerWaalsContact CA-O 3.3Å; R149-L198 WeakPolarHBondContact CA-O 3.26Å; V150-L198 HydrophobicContact CG1-CB 3.97Å; V150-L198 HydrophobicContact CG1-CD1 4.42Å; V150-L198 PolarHBondContact N-O 3.14Å; V150-L198 PolarHBondContact O-N 2.94Å; R152-L198 HydrophobicContact CB-CD1 4.18Å; I165-L198 HydrophobicContact CD1-CD1 3.8Å; V189-L198 HydrophobicContact CG1-CD1 3.65Å; V189-L198 HydrophobicContact CG1-CD2 3.99Å; E196-L198 HydrophobicContact CG-CD2 3.87Å; E196-L198 HydrophobicContact CG-CG 4.39Å; L198-F200 HydrophobicContact CB-CE2 4.07Å; L198-F249 HydrophobicContact CD1-CE1 4.05Å
199	S	93.9	Very high	91.9	Very high	15 Å²	15	46.5 Å²	46.5	11%	0.105	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	132.7	-179.9	48.6	0	0	0	0	110.9	F148 K187	F148-S199 CarbonylContact O-C 3.58Å; F148-S199 WeakPolarHBondContact O-CA 3.27Å; K187-S199 WeakPolarHBondContact CE-O 3.33Å; K187-S199 PolarHBondContact NZ-O 3.45Å
200	F	95.1	Very high	91.8	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.7	178.9	-60.2	-88.8	0	0	0	110.1	E147 F148 V150 I165 L167 D185 K187 L198 V202	E147-F200 CarbonylContact C-O 3.52Å; E147-F200 WeakPolarHBondContact CA-O 3.47Å; F148-F200 HydrophobicContact CB-CB 4.43Å; F148-F200 HydrophobicContact CD1-CB 4.44Å; F148-F200 AromaticContact CD1-CD2 3.82Å; F148-F200 HydrophobicContact CD1-CD2 3.82Å; F148-F200 HydrophobicContact CD1-CG 4.49Å; F148-F200 HydrophobicContact CE1-CD2 4.28Å; F148-F200 PolarHBondContact N-O 2.92Å; F148-F200 PolarHBondContact O-N 3.15Å; V150-F200 HydrophobicContact CG1-CE2 4.13Å; I165-F200 HydrophobicContact CD1-CZ 3.92Å; L167-F200 HydrophobicContact CB-CD1 4.16Å; L167-F200 HydrophobicContact CB-CE1 4.27Å; L167-F200 HydrophobicContact CD2-CB 3.5Å; L167-F200 VanDerWaalsContact CD2-CB 3.5Å; L167-F200 HydrophobicContact CD2-CD1 4.06Å; L167-F200 HydrophobicContact CD2-CD2 4.16Å; L167-F200 HydrophobicContact CD2-CG 3.66Å; D185-F200 HydrophobicContact CB-CD1 4.03Å; K187-F200 HydrophobicContact CB-CE1 4.33Å; K187-F200 HydrophobicContact CB-CZ 4.47Å; K187-F200 HydrophobicContact CD-CD1 4.31Å; K187-F200 HydrophobicContact CD-CE1 3.73Å; K187-F200 HydrophobicContact CD-CZ 3.93Å; K187-F200 HydrophobicContact CG-CD1 4.5Å; K187-F200 HydrophobicContact CG-CE1 3.73Å; K187-F200 HydrophobicContact CG-CZ 4.2Å; L198-F200 HydrophobicContact CB-CE2 4.07Å; F200-V202 HydrophobicContact CB-CG1 4.34Å; F200-V202 PolarHBondContact O-N 2.96Å
201	D	93.4	Very high	91.6	Very high	69 Å²	69	46 Å²	46	37%	0.369	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	113.7	173.4	-164.2	-29.7	0	0	0	108.9	K145 I184 T203	K145-D201 IonicContact NZ-OD2 2.97Å; K145-D201 PolarHBondContact NZ-OD2 2.79Å; I184-D201 VanDerWaalsContact CG2-O 3.27Å; I184-D201 WeakPolarHBondContact CG2-O 3.45Å; D201-T203 VanDerWaalsContact OD1-CB 3.27Å; D201-T203 WeakPolarHBondContact OD1-CB 3.36Å; D201-T203 PolarHBondContact OD1-N 3.23Å; D201-T203 VanDerWaalsContact OD1-N 3.09Å; D201-T203 PolarHBondContact OD1-OG1 3.3Å
202	V	95.9	Very high	91.6	Very high	2 Å²	2	50 Å²	50	1%	0.012	25%	0.247	C	C	.	.			trans	-121.1	21.7	-177.9	-64.4	0	0	0	0	111.2	A146 F148 L167 I184 F200 E204 A205 V206 F219 L279	A146-V202 HydrophobicContact CB-CG2 4.09Å; A146-V202 PolarHBondContact O-N 3.43Å; F148-V202 HydrophobicContact CB-CB 4.49Å; F148-V202 HydrophobicContact CB-CG1 3.77Å; F148-V202 HydrophobicContact CB-CG2 3.85Å; L167-V202 HydrophobicContact CD2-CG1 3.75Å; I184-V202 HydrophobicContact CD1-CG1 4.13Å; I184-V202 HydrophobicContact CG2-CG1 4.39Å; F200-V202 HydrophobicContact CB-CG1 4.34Å; F200-V202 PolarHBondContact O-N 2.96Å; V202-E204 PolarHBondContact O-N 3.46Å; V202-A205 PolarHBondContact O-N 2.7Å; V202-V206 HydrophobicContact CB-CG2 4.48Å; V202-V206 HydrophobicContact CG2-CG2 3.89Å; V202-V206 WeakPolarHBondContact O-CG2 3.35Å; V202-V206 PolarHBondContact O-N 3.2Å; V202-F219 HydrophobicContact CB-CE1 4.21Å; V202-F219 HydrophobicContact CB-CE2 4.16Å; V202-F219 HydrophobicContact CB-CZ 3.6Å; V202-F219 HydrophobicContact CG1-CE1 4.04Å; V202-F219 HydrophobicContact CG1-CE2 4.06Å; V202-F219 HydrophobicContact CG1-CZ 3.72Å; V202-F219 HydrophobicContact CG2-CE2 4.2Å; V202-F219 HydrophobicContact CG2-CZ 4.04Å; V202-L279 HydrophobicContact CG2-CD2 3.91Å
203	T	91.9	Very high	91.3	Very high	23 Å²	23	51.9 Å²	51.9	14%	0.141	26%	0.255	C	S	.	.	H	α-helix	trans	-52.3	-50.8	-173.9	-56.5	0	0	0	0	112.1	A146 D201 A205 V206 H207	A146-T203 PolarHBondContact N-OG1 3.42Å; A146-T203 PolarHBondContact O-N 2.8Å; A146-T203 PolarHBondContact O-OG1 3.29Å; D201-T203 VanDerWaalsContact OD1-CB 3.27Å; D201-T203 WeakPolarHBondContact OD1-CB 3.36Å; D201-T203 PolarHBondContact OD1-N 3.23Å; D201-T203 VanDerWaalsContact OD1-N 3.09Å; D201-T203 PolarHBondContact OD1-OG1 3.3Å; T203-A205 PolarHBondContact O-N 3.38Å; T203-V206 PolarHBondContact O-N 2.54Å; T203-H207 VanDerWaalsContact O-CB 3.28Å; T203-H207 WeakPolarHBondContact O-CB 3.49Å; T203-H207 PolarHBondContact O-N 2.95Å
204	E	92.2	Very high	91.1	Very high	155 Å²	155	55 Å²	55	72%	0.724	27%	0.266	S	S	*	.	H	α-helix	trans	-59.8	-45.7	179.5	-66.4	-62.7	145.2	0	0	112.8	V202 H207 E208	V202-E204 PolarHBondContact O-N 3.46Å; E204-H207 PolarHBondContact O-N 2.86Å; E204-E208 PolarHBondContact O-N 3.02Å
205	A	93.9	Very high	91	Very high	3 Å²	3	52.8 Å²	52.8	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-66.9	-41.8	-178.2	0	0	0	0	0	111.8	Q169 I184 V202 T203 E208 W209 F219	Q169-A205 HydrophobicContact CB-CB 4.47Å; Q169-A205 HydrophobicContact CG-CB 4.16Å; I184-A205 HydrophobicContact CD1-CB 4.44Å; V202-A205 PolarHBondContact O-N 2.7Å; T203-A205 PolarHBondContact O-N 3.38Å; A205-E208 PolarHBondContact O-N 2.93Å; A205-W209 VanDerWaalsContact O-CD1 3.25Å; A205-W209 PolarHBondContact O-N 2.93Å; A205-W209 VanDerWaalsContact O-N 3.08Å; A205-F219 HydrophobicContact CB-CE1 3.61Å; A205-F219 HydrophobicContact CB-CZ 3.91Å
206	V	93.9	Very high	91	Very high	0 Å²	0	53 Å²	53	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.9	-38.8	177	178.1	0	0	0	0	111	L143 A146 V202 T203 E208 W209 L210 F219 L279 L281	L143-V206 HydrophobicContact CD2-CB 4.27Å; L143-V206 HydrophobicContact CD2-CG1 4.02Å; A146-V206 HydrophobicContact CB-CB 3.84Å; A146-V206 HydrophobicContact CB-CG1 4.27Å; A146-V206 HydrophobicContact CB-CG2 3.79Å; V202-V206 HydrophobicContact CB-CG2 4.48Å; V202-V206 HydrophobicContact CG2-CG2 3.89Å; V202-V206 WeakPolarHBondContact O-CG2 3.35Å; V202-V206 PolarHBondContact O-N 3.2Å; T203-V206 PolarHBondContact O-N 2.54Å; V206-E208 VanDerWaalsContact C-N 3.27Å; V206-E208 PolarHBondContact O-N 3.43Å; V206-W209 HydrophobicContact CG2-CE3 4.08Å; V206-W209 HydrophobicContact CG2-CZ3 4.24Å; V206-W209 PolarHBondContact O-N 3.4Å; V206-W209 VanDerWaalsContact O-N 3.09Å; V206-L210 HydrophobicContact CG1-CD1 4.22Å; V206-L210 HydrophobicContact CG1-CG 4.23Å; V206-L210 WeakPolarHBondContact O-CG 3.39Å; V206-L210 PolarHBondContact O-N 3.25Å; V206-F219 HydrophobicContact CG2-CZ 4.46Å; V206-L279 HydrophobicContact CG2-CD1 4.21Å; V206-L281 HydrophobicContact CG1-CD2 3.72Å; V206-L281 HydrophobicContact CG2-CD2 4.47Å
207	H	91.3	Very high	90.8	Very high	75 Å²	75	51.9 Å²	51.9	35%	0.347	24%	0.24	S	C	.	.	H	α-helix	trans	-57.6	-42.7	174.5	-170.3	79.9	0	0	0	111.4	L143 T203 E204 L210 H211	L143-H207 HydrophobicContact CD2-CB 4.08Å; T203-H207 VanDerWaalsContact O-CB 3.28Å; T203-H207 WeakPolarHBondContact O-CB 3.49Å; T203-H207 PolarHBondContact O-N 2.95Å; E204-H207 PolarHBondContact O-N 2.86Å; H207-L210 PolarHBondContact O-N 3.21Å; H207-H211 AromaticContact CD2-CE1 3.96Å; H207-H211 AromaticContact CD2-ND1 3.94Å; H207-H211 AromaticContact CE1-CE1 3.36Å; H207-H211 PolarHBondContact CE1-CE1 2.95Å; H207-H211 AromaticContact ND1-CE1 3.89Å; H207-H211 AromaticContact NE2-CE1 3.36Å; H207-H211 PolarHBondContact NE2-CE1 3.3Å; H207-H211 AromaticContact NE2-ND1 3.78Å; H207-H211 PolarHBondContact O-N 3.46Å; H207-H211 PolarHBondContact O-ND1 3.19Å
208	E	91.3	Very high	90.8	Very high	28 Å²	28	49.7 Å²	49.7	13%	0.131	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-42.6	173.3	-176.1	173	-167.8	0	0	112	Q169 R182 E204 A205 V206 L210 H211 H212 R215	Q169-E208 PolarHBondContact NE2-OE2 2.91Å; R182-E208 IonicContact CZ-OE2 3.04Å; R182-E208 IonicContact NH1-OE2 3.09Å; R182-E208 PolarHBondContact NH1-OE2 2.65Å; R182-E208 IonicContact NH2-OE2 3.35Å; E204-E208 PolarHBondContact O-N 3.02Å; A205-E208 PolarHBondContact O-N 2.93Å; V206-E208 VanDerWaalsContact C-N 3.27Å; V206-E208 PolarHBondContact O-N 3.43Å; E208-L210 PolarHBondContact O-N 2.65Å; E208-H211 PolarHBondContact O-N 2.91Å; E208-H212 PolarHBondContact O-N 3.42Å; E208-R215 WeakPolarHBondContact OE1-CD 3.09Å; E208-R215 IonicContact OE1-CZ 3.17Å; E208-R215 IonicContact OE1-NE 2.75Å; E208-R215 IonicContact OE1-NH1 2.74Å; E208-R215 PolarHBondContact OE1-NH1 2.73Å
209	W	92.6	Very high	90.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-34.5	178.9	-62.7	-14.4	0	0	0	113.7	F131 V133 A205 V206 H211 H212 R215 N216 F219 L279	F131-W209 HydrophobicContact CD2-CZ3 4.39Å; V133-W209 HydrophobicContact CG1-CE3 4.45Å; V133-W209 HydrophobicContact CG2-CB 3.93Å; A205-W209 VanDerWaalsContact O-CD1 3.25Å; A205-W209 PolarHBondContact O-N 2.93Å; A205-W209 VanDerWaalsContact O-N 3.08Å; V206-W209 HydrophobicContact CG2-CE3 4.08Å; V206-W209 HydrophobicContact CG2-CZ3 4.24Å; V206-W209 PolarHBondContact O-N 3.4Å; V206-W209 VanDerWaalsContact O-N 3.09Å; W209-H211 VanDerWaalsContact C-N 3.31Å; W209-H212 CarbonylContact O-C 3.48Å; W209-R215 PolarHBondContact NE1-O 3.14Å; W209-N216 HydrophobicContact CB-CB 4.09Å; W209-N216 HydrophobicContact CD2-CB 4.1Å; W209-N216 HydrophobicContact CG-CB 3.77Å; W209-F219 AromaticContact CH2-CD1 3.96Å; W209-F219 HydrophobicContact CH2-CD1 3.96Å; W209-F219 AromaticContact CH2-CD2 3.67Å; W209-F219 HydrophobicContact CH2-CD2 3.67Å; W209-F219 AromaticContact CH2-CE1 3.52Å; W209-F219 HydrophobicContact CH2-CE1 3.52Å; W209-F219 AromaticContact CH2-CE2 3.19Å; W209-F219 HydrophobicContact CH2-CE2 3.19Å; W209-F219 HydrophobicContact CH2-CG 4.01Å; W209-F219 AromaticContact CH2-CZ 3.09Å; W209-F219 HydrophobicContact CH2-CZ 3.09Å; W209-F219 HydrophobicContact CZ2-CD1 4.16Å; W209-F219 AromaticContact CZ2-CE1 3.7Å; W209-F219 HydrophobicContact CZ2-CE1 3.7Å; W209-F219 HydrophobicContact CZ2-CE2 4.2Å; W209-F219 AromaticContact CZ2-CZ 3.71Å; W209-F219 HydrophobicContact CZ2-CZ 3.71Å; W209-F219 HydrophobicContact CZ3-CD2 4.33Å; W209-F219 HydrophobicContact CZ3-CE1 4.39Å; W209-F219 AromaticContact CZ3-CE2 3.53Å; W209-F219 HydrophobicContact CZ3-CE2 3.53Å; W209-F219 AromaticContact CZ3-CZ 3.56Å; W209-F219 HydrophobicContact CZ3-CZ 3.56Å; W209-L279 HydrophobicContact CZ3-CD1 4.31Å
210	L	90.4	Very high	90.7	Very high	8 Å²	8	50.3 Å²	50.3	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-69.8	-28	177.6	-66.9	175.7	0	0	0	112.5	V133 M136 A140 L143 V206 H207 E208	V133-L210 HydrophobicContact CB-CD2 3.89Å; V133-L210 HydrophobicContact CG2-CD2 3.99Å; M136-L210 HydrophobicContact CB-CD2 3.77Å; A140-L210 HydrophobicContact CB-CB 3.66Å; A140-L210 HydrophobicContact CB-CD1 4.41Å; L143-L210 HydrophobicContact CB-CD1 4.25Å; L143-L210 HydrophobicContact CD2-CD1 3.91Å; V206-L210 HydrophobicContact CG1-CD1 4.22Å; V206-L210 HydrophobicContact CG1-CG 4.23Å; V206-L210 WeakPolarHBondContact O-CG 3.39Å; V206-L210 PolarHBondContact O-N 3.25Å; H207-L210 PolarHBondContact O-N 3.21Å; E208-L210 PolarHBondContact O-N 2.65Å
211	H	88.6	Confident	90.6	Very high	97 Å²	97	50.3 Å²	50.3	45%	0.449	23%	0.233	S	C	.	.	H	α-helix	trans	-90.4	-30.8	175.6	-69.7	85.2	0	0	0	112.9	H207 E208 W209	H207-H211 AromaticContact CD2-CE1 3.96Å; H207-H211 AromaticContact CD2-ND1 3.94Å; H207-H211 AromaticContact CE1-CE1 3.36Å; H207-H211 PolarHBondContact CE1-CE1 2.95Å; H207-H211 AromaticContact ND1-CE1 3.89Å; H207-H211 AromaticContact NE2-CE1 3.36Å; H207-H211 PolarHBondContact NE2-CE1 3.3Å; H207-H211 AromaticContact NE2-ND1 3.78Å; H207-H211 PolarHBondContact O-N 3.46Å; H207-H211 PolarHBondContact O-ND1 3.19Å; E208-H211 PolarHBondContact O-N 2.91Å; W209-H211 VanDerWaalsContact C-N 3.31Å
212	H	89.1	Confident	90.4	Very high	84 Å²	84	47.6 Å²	47.6	39%	0.389	22%	0.219	S	C	.	.			trans	-133.6	88	-174.3	-58.8	-53.5	0	0	0	110.9	E208 W209 D214 R215	E208-H212 PolarHBondContact O-N 3.42Å; W209-H212 CarbonylContact O-C 3.48Å; H212-D214 PolarHBondContact O-N 3.29Å; H212-D214 VanDerWaalsContact O-N 3.17Å; H212-R215 HydrophobicContact CB-CB 4.21Å; H212-R215 HydrophobicContact CB-CG 3.81Å; H212-R215 WeakPolarHBondContact O-CB 3.48Å; H212-R215 PolarHBondContact O-N 2.58Å
213	R	83.9	Confident	90	Very high	170 Å²	170	48.2 Å²	48.2	64%	0.642	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-55.6	-34.8	-179	-170.1	-178.4	-175.8	-149.3	0.3	113.4	R215 N216	R213-R215 PolarHBondContact O-N 2.89Å; R213-N216 PolarHBondContact O-N 3.18Å
214	D	84.6	Confident	89.1	Confident	103 Å²	103	51.6 Å²	51.6	55%	0.551	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-69.6	-15	-179.3	68.4	-56.2	0	0	0	113.8	H212	H212-D214 PolarHBondContact O-N 3.29Å; H212-D214 VanDerWaalsContact O-N 3.17Å
215	R	85.2	Confident	87.8	Confident	111 Å²	111	48.6 Å²	48.6	42%	0.419	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-91.8	-6	177.6	-59.3	-169.1	-174.7	-174.6	4.6	113.5	E208 W209 H212 R213 L217	E208-R215 WeakPolarHBondContact OE1-CD 3.09Å; E208-R215 IonicContact OE1-CZ 3.17Å; E208-R215 IonicContact OE1-NE 2.75Å; E208-R215 IonicContact OE1-NH1 2.74Å; E208-R215 PolarHBondContact OE1-NH1 2.73Å; W209-R215 PolarHBondContact NE1-O 3.14Å; H212-R215 HydrophobicContact CB-CB 4.21Å; H212-R215 HydrophobicContact CB-CG 3.81Å; H212-R215 WeakPolarHBondContact O-CB 3.48Å; H212-R215 PolarHBondContact O-N 2.58Å; R213-R215 PolarHBondContact O-N 2.89Å; R215-L217 PolarHBondContact O-N 3.43Å
216	N	88.1	Confident	85.9	Confident	37 Å²	37	51 Å²	51	20%	0.198	25%	0.247	C	C	.	.			trans	-77.9	90.5	176.1	-175.7	3	0	0	0	111.1	F131 W209 R213 G218	F131-N216 PolarHBondContact O-ND2 3.11Å; W209-N216 HydrophobicContact CB-CB 4.09Å; W209-N216 HydrophobicContact CD2-CB 4.1Å; W209-N216 HydrophobicContact CG-CB 3.77Å; R213-N216 PolarHBondContact O-N 3.18Å; N216-G218 PolarHBondContact OD1-N 2.75Å
217	L	86.1	Confident	83.9	Confident	50 Å²	50	56.2 Å²	56.2	26%	0.262	28%	0.282	S	S	.	.			trans	-104.9	-0.4	174.4	-60.7	-179.9	0	0	0	113.2	V170 K172 R215	V170-L217 HydrophobicContact CB-CB 3.87Å; V170-L217 HydrophobicContact CG1-CB 3.8Å; V170-L217 HydrophobicContact CG1-CD1 4.11Å; K172-L217 HydrophobicContact CB-CD1 3.9Å; R215-L217 PolarHBondContact O-N 3.43Å
218	G	91	Very high	82.1	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.281	C	S	.	.			trans	88.9	-173.5	-178.3	0	0	0	0	0	114.6	V129 V170 N216	V129-G218 CarbonylContact O-C 3.4Å; V129-G218 WeakPolarHBondContact O-CA 3.39Å; V170-G218 PolarHBondContact N-O 3.29Å; V170-G218 VanDerWaalsContact N-O 3.1Å; N216-G218 PolarHBondContact OD1-N 2.75Å
219	F	94.3	Very high	80.4	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	150.4	176.8	-60.2	-61.7	0	0	0	111.2	I128 V129 F131 F148 L167 Y168 Q169 I184 V202 A205 V206 W209 L279	I128-F219 CarbonylContact C-O 3.55Å; I128-F219 VanDerWaalsContact CA-O 3.3Å; I128-F219 WeakPolarHBondContact CA-O 3.39Å; V129-F219 HydrophobicContact CG2-CB 3.79Å; V129-F219 HydrophobicContact CG2-CD2 4.47Å; V129-F219 PolarHBondContact N-O 3.26Å; V129-F219 PolarHBondContact O-N 2.96Å; F131-F219 HydrophobicContact CD2-CD2 4.25Å; F131-F219 HydrophobicContact CD2-CE2 4.39Å; F131-F219 AromaticContact CE2-CD2 3.92Å; F131-F219 HydrophobicContact CE2-CD2 3.92Å; F131-F219 HydrophobicContact CE2-CE2 4.35Å; F148-F219 HydrophobicContact CG-CD2 4.49Å; L167-F219 HydrophobicContact CD1-CB 3.87Å; L167-F219 HydrophobicContact CD1-CG 4.42Å; Y168-F219 CarbonylContact O-C 3.52Å; Y168-F219 VanDerWaalsContact O-CA 3.28Å; Y168-F219 WeakPolarHBondContact O-CA 3.5Å; Q169-F219 HydrophobicContact CB-CD1 4.47Å; Q169-F219 HydrophobicContact CB-CE1 4.46Å; I184-F219 HydrophobicContact CD1-CD1 3.63Å; I184-F219 HydrophobicContact CD1-CE1 3.49Å; I184-F219 VanDerWaalsContact CD1-CE1 3.49Å; V202-F219 HydrophobicContact CB-CE1 4.21Å; V202-F219 HydrophobicContact CB-CE2 4.16Å; V202-F219 HydrophobicContact CB-CZ 3.6Å; V202-F219 HydrophobicContact CG1-CE1 4.04Å; V202-F219 HydrophobicContact CG1-CE2 4.06Å; V202-F219 HydrophobicContact CG1-CZ 3.72Å; V202-F219 HydrophobicContact CG2-CE2 4.2Å; V202-F219 HydrophobicContact CG2-CZ 4.04Å; A205-F219 HydrophobicContact CB-CE1 3.61Å; A205-F219 HydrophobicContact CB-CZ 3.91Å; V206-F219 HydrophobicContact CG2-CZ 4.46Å; W209-F219 AromaticContact CH2-CD1 3.96Å; W209-F219 HydrophobicContact CH2-CD1 3.96Å; W209-F219 AromaticContact CH2-CD2 3.67Å; W209-F219 HydrophobicContact CH2-CD2 3.67Å; W209-F219 AromaticContact CH2-CE1 3.52Å; W209-F219 HydrophobicContact CH2-CE1 3.52Å; W209-F219 AromaticContact CH2-CE2 3.19Å; W209-F219 HydrophobicContact CH2-CE2 3.19Å; W209-F219 HydrophobicContact CH2-CG 4.01Å; W209-F219 AromaticContact CH2-CZ 3.09Å; W209-F219 HydrophobicContact CH2-CZ 3.09Å; W209-F219 HydrophobicContact CZ2-CD1 4.16Å; W209-F219 AromaticContact CZ2-CE1 3.7Å; W209-F219 HydrophobicContact CZ2-CE1 3.7Å; W209-F219 HydrophobicContact CZ2-CE2 4.2Å; W209-F219 AromaticContact CZ2-CZ 3.71Å; W209-F219 HydrophobicContact CZ2-CZ 3.71Å; W209-F219 HydrophobicContact CZ3-CD2 4.33Å; W209-F219 HydrophobicContact CZ3-CE1 4.39Å; W209-F219 AromaticContact CZ3-CE2 3.53Å; W209-F219 HydrophobicContact CZ3-CE2 3.53Å; W209-F219 AromaticContact CZ3-CZ 3.56Å; W209-F219 HydrophobicContact CZ3-CZ 3.56Å; F219-L279 HydrophobicContact CE2-CD2 3.94Å
220	K	92	Very high	78.4	Confident	41 Å²	41	59.6 Å²	59.6	18%	0.178	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.5	172.7	174.9	-176.6	166.7	-170.2	0	109.2	F126 R127 I128 Y168 V170	F126-K220 HydrophobicContact CB-CG 4.19Å; F126-K220 HydrophobicContact CD2-CG 4.39Å; R127-K220 CarbonylContact O-C 3.58Å; R127-K220 VanDerWaalsContact O-CA 3.29Å; R127-K220 WeakPolarHBondContact O-CA 3.39Å; I128-K220 HydrophobicContact CG1-CB 4.38Å; I128-K220 HydrophobicContact CG1-CG 4.45Å; Y168-K220 PolarHBondContact N-O 3.37Å; Y168-K220 PolarHBondContact O-N 3.33Å; V170-K220 HydrophobicContact CG2-CB 3.89Å
221	I	92.4	Very high	76.9	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.9	170.3	-53.6	171.3	0	0	0	107	F126 R127 F148 I165 E166 L167 F249	F126-I221 CarbonylContact C-O 3.45Å; F126-I221 WeakPolarHBondContact CA-O 3.41Å; F126-I221 WeakPolarHBondContact CB-O 3.36Å; R127-I221 PolarHBondContact N-O 3Å; R127-I221 PolarHBondContact O-N 3.38Å; F148-I221 HydrophobicContact CE1-CD1 3.96Å; F148-I221 HydrophobicContact CE1-CG1 4.42Å; F148-I221 HydrophobicContact CZ-CD1 4.14Å; I165-I221 HydrophobicContact CB-CG2 4.36Å; I165-I221 HydrophobicContact CD1-CG2 4.42Å; E166-I221 WeakPolarHBondContact O-CA 3.49Å; L167-I221 HydrophobicContact CD1-CG1 3.71Å; I221-F249 HydrophobicContact CD1-CE2 4.48Å; I221-F249 HydrophobicContact CG2-CE2 4.11Å; I221-F249 HydrophobicContact CG2-CZ 4.06Å
222	S	89.9	Confident	75.3	Confident	12 Å²	12	61.6 Å²	61.6	8%	0.084	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	171.6	175.2	59.9	0	0	0	0	110.5	E166	E166-S222 PolarHBondContact N-O 3.39Å; E166-S222 PolarHBondContact O-N 2.89Å
223	L	87.1	Confident	74	Confident	15 Å²	15	62.2 Å²	62.2	8%	0.079	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	160.2	164.7	-61.7	-179.7	0	0	0	110.2	Q163 I165 C225 E243 E244 L245	Q163-L223 HydrophobicContact CB-CD2 3.86Å; Q163-L223 HydrophobicContact CG-CD2 4.37Å; I165-L223 HydrophobicContact CG2-CD2 4.08Å; L223-C225 PolarHBondContact O-N 3.1Å; L223-E243 HydrophobicContact CD1-CB 3.57Å; L223-E243 WeakPolarHBondContact CD1-O 2.92Å; L223-E244 WeakPolarHBondContact CD1-O 3.32Å; L223-L245 HydrophobicContact CD2-CD1 3.72Å; L223-L245 HydrophobicContact CG-CB 4.48Å; L223-L245 HydrophobicContact CG-CD1 3.99Å
224	H	74.1	Confident	73.3	Confident	93 Å²	93	59.5 Å²	59.5	43%	0.431	34%	0.335	S	S	.	.			trans	-51.2	129	162	-173.8	68	0	0	0	108.4	E166 P226	E166-H224 VanDerWaalsContact CD-CA 3.49Å; E166-H224 HydrophobicContact CG-CB 4.39Å; E166-H224 WeakPolarHBondContact OE1-CB 3.47Å; E166-H224 IonicContact OE1-CE1 2.65Å; E166-H224 IonicContact OE1-CG 2.58Å; E166-H224 IonicContact OE1-ND1 3.72Å; E166-H224 PolarHBondContact OE1-ND1 2.87Å; E166-H224 WeakPolarHBondContact OE2-CA 3.42Å; E166-H224 IonicContact OE2-ND1 2.8Å; H224-P226 VanDerWaalsContact C-CD 3.41Å; H224-P226 WeakPolarHBondContact O-CD 3.1Å
225	C	63.9	Low	72.1	Confident	93 Å²	93	60.5 Å²	60.5	63%	0.628	34%	0.34	S	S	*	.			trans	-95.1	87.9	174.3	-170.1	0	0	0	0	107.2	L223	L223-C225 PolarHBondContact O-N 3.1Å
226	P	54	Low	70.9	Confident	53 Å²	53	63.1 Å²	63.1	34%	0.344	35%	0.351	S	S	.	.			trans	-68.5	144.5	165.9	33.6	-35	0	0	0	106.8	H224 C228	H224-P226 VanDerWaalsContact C-CD 3.41Å; H224-P226 WeakPolarHBondContact O-CD 3.1Å; P226-C228 WeakPolarHBondContact CB-O 3.43Å; P226-C228 VanDerWaalsContact CG-O 3.27Å; P226-C228 WeakPolarHBondContact CG-O 3.35Å; P226-C228 PolarHBondContact O-N 3.07Å
227	C	51.9	Low	69.4	Low	109 Å²	109	66.1 Å²	66.1	74%	0.736	37%	0.366	S	S	*	.	S	Bend	trans	-55.8	-6.7	165.1	44.9	0	0	0	0	113.3
228	C	53	Low	68.1	Low	49 Å²	49	66.8 Å²	66.8	33%	0.331	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	116	-161.5	-72.9	0	0	0	0	110.8	P226 I237	P226-C228 WeakPolarHBondContact CB-O 3.43Å; P226-C228 VanDerWaalsContact CG-O 3.27Å; P226-C228 WeakPolarHBondContact CG-O 3.35Å; P226-C228 PolarHBondContact O-N 3.07Å; C228-I237 HydrophobicContact CB-CG2 3.32Å; C228-I237 WeakPolarHBondContact SG-CG2 3.25Å
229	T	55.7	Low	66.2	Low	9 Å²	9	70.9 Å²	70.9	6%	0.055	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	124.3	165.5	38.9	0	0	0	0	110.6	I238 K241 E243	T229-I238 PolarHBondContact N-O 2.8Å; T229-I238 PolarHBondContact O-N 3.44Å; T229-I238 PolarHBondContact OG1-O 3.32Å; T229-I238 VanDerWaalsContact OG1-O 3.14Å; T229-K241 WeakPolarHBondContact CG2-O 3.1Å; T229-K241 PolarHBondContact OG1-O 3.31Å; T229-E243 HydrophobicContact CG2-CG 3.73Å
230	F	51.3	Low	64.3	Low	116 Å²	116	78.4 Å²	78.4	51%	0.509	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	122.4	174.8	-177.2	-105.3	0	0	0	110	P232 N235 I237	F230-P232 HydrophobicContact CD1-CG 4.36Å; F230-P232 HydrophobicContact CE1-CB 4.42Å; F230-P232 HydrophobicContact CE1-CG 4.48Å; F230-P232 WeakPolarHBondContact O-CD 3.3Å; F230-N235 WeakPolarHBondContact CZ-OD1 3.06Å; F230-I237 HydrophobicContact CD2-CG1 4.13Å
231	V	59.8	Low	62.7	Low	44 Å²	44	82.8 Å²	82.8	27%	0.267	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	106.9	177.7	-179.4	0	0	0	0	109.1	S233 N234 N235 Y236 I238	V231-S233 VanDerWaalsContact CG1-OG 3.3Å; V231-S233 WeakPolarHBondContact CG1-OG 3.45Å; V231-S233 PolarHBondContact O-N 3.27Å; V231-N234 PolarHBondContact O-N 3.07Å; V231-N235 PolarHBondContact O-N 3.38Å; V231-Y236 PolarHBondContact N-O 3.2Å; V231-I238 HydrophobicContact CG2-CD1 3.72Å; V231-I238 HydrophobicContact CG2-CG1 4.16Å
232	P	54.7	Low	61.4	Low	103 Å²	103	85.8 Å²	85.8	67%	0.669	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-26	-172.5	-21.2	32.6	0	0	0	114.1	F230	F230-P232 HydrophobicContact CD1-CG 4.36Å; F230-P232 HydrophobicContact CE1-CB 4.42Å; F230-P232 HydrophobicContact CE1-CG 4.48Å; F230-P232 WeakPolarHBondContact O-CD 3.3Å
233	S	61.8	Low	60.8	Low	97 Å²	97	90.1 Å²	90.1	68%	0.678	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-31.8	-175.7	40.6	0	0	0	0	113.9	V231	V231-S233 VanDerWaalsContact CG1-OG 3.3Å; V231-S233 WeakPolarHBondContact CG1-OG 3.45Å; V231-S233 PolarHBondContact O-N 3.27Å
234	N	67.8	Low	60.6	Low	114 Å²	114	93.3 Å²	93.3	61%	0.61	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	7.3	-177.9	-72.2	12.2	0	0	0	113.7	V231 Y236	V231-N234 PolarHBondContact O-N 3.07Å; N234-Y236 HydrophobicContact CB-CD2 3.7Å; N234-Y236 HydrophobicContact CB-CE2 4.21Å; N234-Y236 WeakPolarHBondContact O-CD2 3.28Å; N234-Y236 WeakPolarHBondContact O-CE2 3.5Å; N234-Y236 PolarHBondContact O-N 2.88Å; N234-Y236 VanDerWaalsContact O-N 3.1Å
235	N	60.1	Low	61.2	Low	124 Å²	124	89.3 Å²	89.3	66%	0.663	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	23.5	-178.6	-96.7	11.7	0	0	0	115.1	F230 V231	F230-N235 WeakPolarHBondContact CZ-OD1 3.06Å; V231-N235 PolarHBondContact O-N 3.38Å
236	Y	61.1	Low	62.4	Low	166 Å²	166	86.1 Å²	86.1	65%	0.651	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	137.8	175.4	-75.5	-83.5	0	0	0	111.4	V231 N234	V231-Y236 PolarHBondContact N-O 3.2Å; N234-Y236 HydrophobicContact CB-CD2 3.7Å; N234-Y236 HydrophobicContact CB-CE2 4.21Å; N234-Y236 WeakPolarHBondContact O-CD2 3.28Å; N234-Y236 WeakPolarHBondContact O-CE2 3.5Å; N234-Y236 PolarHBondContact O-N 2.88Å; N234-Y236 VanDerWaalsContact O-N 3.1Å
237	I	55	Low	64	Low	100 Å²	100	83.6 Å²	83.6	51%	0.513	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	115.3	166	-68.2	168	0	0	0	107.3	C228 F230 P239	C228-I237 HydrophobicContact CB-CG2 3.32Å; C228-I237 WeakPolarHBondContact SG-CG2 3.25Å; F230-I237 HydrophobicContact CD2-CG1 4.13Å; I237-P239 WeakPolarHBondContact O-CD 3.02Å
238	I	59.2	Low	65.8	Low	64 Å²	64	80.6 Å²	80.6	33%	0.328	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	107.5	173	-55.2	174.3	0	0	0	107.5	T229 V231 K241	T229-I238 PolarHBondContact N-O 2.8Å; T229-I238 PolarHBondContact O-N 3.44Å; T229-I238 PolarHBondContact OG1-O 3.32Å; T229-I238 VanDerWaalsContact OG1-O 3.14Å; V231-I238 HydrophobicContact CG2-CD1 3.72Å; V231-I238 HydrophobicContact CG2-CG1 4.16Å; I238-K241 HydrophobicContact CB-CB 4.32Å; I238-K241 HydrophobicContact CD1-CD 4.22Å; I238-K241 HydrophobicContact CG2-CB 3.74Å; I238-K241 HydrophobicContact CG2-CD 4.45Å
239	P	52	Low	67.5	Low	85 Å²	85	78.3 Å²	78.3	55%	0.552	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	144.9	170.3	27.8	-31.9	0	0	0	109.3	I237 K241	I237-P239 WeakPolarHBondContact O-CD 3.02Å; P239-K241 VanDerWaalsContact C-N 3.32Å; P239-K241 PolarHBondContact O-N 2.96Å
240	N	54	Low	69.1	Low	158 Å²	158	77.9 Å²	77.9	85%	0.845	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	6.9	175.2	-60.9	-22.3	0	0	0	118.4	S242	N240-S242 PolarHBondContact O-N 3.02Å
241	K	58.3	Low	70.5	Confident	133 Å²	133	73.2 Å²	73.2	58%	0.578	39%	0.391	S	S	*	.			trans	-89.2	100	169	-169	177	-175	-179.7	0	109	T229 I238 P239	T229-K241 WeakPolarHBondContact CG2-O 3.1Å; T229-K241 PolarHBondContact OG1-O 3.31Å; I238-K241 HydrophobicContact CB-CB 4.32Å; I238-K241 HydrophobicContact CD1-CD 4.22Å; I238-K241 HydrophobicContact CG2-CB 3.74Å; I238-K241 HydrophobicContact CG2-CD 4.45Å; P239-K241 VanDerWaalsContact C-N 3.32Å; P239-K241 PolarHBondContact O-N 2.96Å
242	S	65	Low	71.6	Confident	65 Å²	65	71.7 Å²	71.7	46%	0.455	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-75.2	128.5	171.4	-61.7	0	0	0	0	109.1	Y125 N240	Y125-S242 WeakPolarHBondContact CE1-O 3.02Å; N240-S242 PolarHBondContact O-N 3.02Å
243	E	76.4	Confident	72.7	Confident	103 Å²	103	67 Å²	67	48%	0.481	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-65.2	138.9	171.1	-68.4	-174.6	179.8	0	0	110	Y125 L223 T229	Y125-E243 WeakPolarHBondContact CD1-O 3.21Å; L223-E243 HydrophobicContact CD1-CB 3.57Å; L223-E243 WeakPolarHBondContact CD1-O 2.92Å; T229-E243 HydrophobicContact CG2-CG 3.73Å
244	E	84.3	Confident	73	Confident	81 Å²	81	63.5 Å²	63.5	38%	0.379	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-74.1	141.8	174.9	-69.7	177.5	-167.4	0	0	110.3	L124 Y125 Q163 L223 E246	L124-E244 HydrophobicContact CB-CG 4.19Å; Y125-E244 HydrophobicContact CD1-CG 4.21Å; Y125-E244 HydrophobicContact CE1-CG 3.66Å; Q163-E244 PolarHBondContact NE2-O 2.51Å; L223-E244 WeakPolarHBondContact CD1-O 3.32Å; E244-E246 PolarHBondContact O-N 3.2Å
245	L	86.7	Confident	72.6	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.047	31%	0.311	C	S	.	.			trans	-74.9	96	175	-179.1	64.2	0	0	0	108.7	L124 R127 I165 L223 A247 F249	L124-L245 PolarHBondContact O-N 3.25Å; R127-L245 HydrophobicContact CG-CD2 4.03Å; I165-L245 HydrophobicContact CG2-CD1 3.85Å; L223-L245 HydrophobicContact CD2-CD1 3.72Å; L223-L245 HydrophobicContact CG-CB 4.48Å; L223-L245 HydrophobicContact CG-CD1 3.99Å; L245-A247 HydrophobicContact CD1-CB 4.01Å; L245-F249 HydrophobicContact CD2-CE2 4.38Å
246	E	88.2	Confident	72.3	Confident	26 Å²	26	59.1 Å²	59.1	12%	0.121	30%	0.297	C	S	.	.			trans	-85.6	-19.1	179.4	-59.9	-169.6	158.8	0	0	112.2	N155 A158 R159 V160 T191 E244 R248	N155-E246 PolarHBondContact ND2-O 3.06Å; A158-E246 VanDerWaalsContact C-OE2 3.31Å; A158-E246 VanDerWaalsContact CA-OE2 3.25Å; A158-E246 WeakPolarHBondContact CA-OE2 3.33Å; A158-E246 HydrophobicContact CB-CB 4.28Å; A158-E246 WeakPolarHBondContact CB-OE2 3.4Å; R159-E246 VanDerWaalsContact CB-OE1 3.25Å; R159-E246 WeakPolarHBondContact CB-OE1 3.4Å; R159-E246 VanDerWaalsContact CG-OE1 3.3Å; R159-E246 WeakPolarHBondContact CG-OE1 3.48Å; R159-E246 VanDerWaalsContact N-CD 3.33Å; R159-E246 PolarHBondContact N-OE1 3.05Å; R159-E246 PolarHBondContact N-OE2 2.81Å; V160-E246 PolarHBondContact N-OE2 2.97Å; T191-E246 HydrophobicContact CG2-CB 4.46Å; E244-E246 PolarHBondContact O-N 3.2Å; E246-R248 PolarHBondContact O-N 3.39Å
247	A	88.6	Confident	71.8	Confident	1 Å²	1	56 Å²	56	1%	0.008	29%	0.285	C	S	.	.			trans	-61.2	129.8	167.9	0	0	0	0	0	110.2	I165 V189 L245 F249	I165-A247 HydrophobicContact CG2-CB 4.23Å; V189-A247 HydrophobicContact CG2-CB 3.98Å; L245-A247 HydrophobicContact CD1-CB 4.01Å; A247-F249 HydrophobicContact CB-CE2 4.41Å; A247-F249 HydrophobicContact CB-CZ 4.1Å
248	R	88.7	Confident	71.5	Confident	46 Å²	46	52.4 Å²	52.4	17%	0.174	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	151.5	-178	-68	-177	-170.8	-178.1	1.2	111.2	R152 L153 N155 E246 D253 Y257	R152-R248 CarbonylContact C-O 3.5Å; R152-R248 VanDerWaalsContact CA-O 3.3Å; R152-R248 WeakPolarHBondContact CA-O 3.16Å; L153-R248 HydrophobicContact CB-CB 4.06Å; L153-R248 HydrophobicContact CD1-CB 4.49Å; L153-R248 PolarHBondContact N-O 3.42Å; N155-R248 HydrophobicContact CB-CG 4.49Å; N155-R248 PolarHBondContact ND2-NE 3.07Å; E246-R248 PolarHBondContact O-N 3.39Å; R248-D253 VanDerWaalsContact CA-OD2 3.31Å; R248-D253 WeakPolarHBondContact CA-OD2 3.39Å; R248-D253 HydrophobicContact CB-CB 4.12Å; R248-D253 HydrophobicContact CG-CB 4.29Å; R248-Y257 PolarHBondContact NH2-OH 2.97Å
249	F	89.9	Confident	70.9	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.5	-175.5	-54.4	-75.4	0	0	0	111.5	R127 V150 F151 R152 I165 L198 I221 L245 A247 I252 D253	R127-F249 HydrophobicContact CG-CD2 4.49Å; V150-F249 HydrophobicContact CB-CD1 4.43Å; V150-F249 HydrophobicContact CG1-CD1 4.12Å; V150-F249 HydrophobicContact CG1-CE1 4.23Å; V150-F249 HydrophobicContact CG2-CB 3.68Å; V150-F249 HydrophobicContact CG2-CD1 3.46Å; V150-F249 VanDerWaalsContact CG2-CD1 3.46Å; V150-F249 HydrophobicContact CG2-CE1 4.33Å; V150-F249 HydrophobicContact CG2-CG 3.76Å; F151-F249 VanDerWaalsContact O-CA 3.32Å; F151-F249 WeakPolarHBondContact O-CA 3.46Å; R152-F249 HydrophobicContact CB-CD1 4.45Å; R152-F249 HydrophobicContact CB-CE1 4.44Å; I165-F249 HydrophobicContact CD1-CE1 4.42Å; I165-F249 HydrophobicContact CD1-CZ 4.15Å; L198-F249 HydrophobicContact CD1-CE1 4.05Å; I221-F249 HydrophobicContact CD1-CE2 4.48Å; I221-F249 HydrophobicContact CG2-CE2 4.11Å; I221-F249 HydrophobicContact CG2-CZ 4.06Å; L245-F249 HydrophobicContact CD2-CE2 4.38Å; A247-F249 HydrophobicContact CB-CE2 4.41Å; A247-F249 HydrophobicContact CB-CZ 4.1Å; F249-I252 HydrophobicContact CB-CB 4.21Å; F249-I252 HydrophobicContact CB-CD1 3.87Å; F249-I252 HydrophobicContact CB-CG1 4.25Å; F249-I252 HydrophobicContact CG-CD1 4.46Å; F249-I252 PolarHBondContact O-N 2.87Å; F249-D253 PolarHBondContact N-OD2 3.25Å; F249-D253 PolarHBondContact O-N 3.14Å
250	A	87.4	Confident	70.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	139.5	177	0	0	0	0	0	110.7	F151 L153 I252 Y272 K275 P277	F151-A250 HydrophobicContact CB-CB 4.19Å; F151-A250 HydrophobicContact CD1-CB 4.19Å; F151-A250 PolarHBondContact O-N 2.84Å; L153-A250 HydrophobicContact CD1-CB 4.45Å; L153-A250 HydrophobicContact CD2-CB 3.99Å; L153-A250 HydrophobicContact CG-CB 4.23Å; A250-I252 PolarHBondContact O-N 3.25Å; A250-Y272 HydrophobicContact CB-CG 4.45Å; A250-K275 HydrophobicContact CB-CB 4.13Å; A250-K275 WeakPolarHBondContact CB-O 2.97Å; A250-P277 WeakPolarHBondContact O-CD 3.3Å
251	G	80.9	Confident	70.8	Confident	18 Å²	18	51.3 Å²	51.3	19%	0.186	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	-12.5	-177.7	0	0	0	0	0	115.2	D254	G251-D254 WeakPolarHBondContact CA-OD2 3.34Å; G251-D254 VanDerWaalsContact N-CG 3.28Å; G251-D254 PolarHBondContact N-OD1 2.82Å; G251-D254 PolarHBondContact N-OD2 3.28Å; G251-D254 VanDerWaalsContact N-OD2 3.12Å
252	I	83	Confident	70.7	Confident	13 Å²	13	49.5 Å²	49.5	7%	0.067	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-52.2	175.4	-54.6	178.5	0	0	0	110	M108 R127 V129 V150 F249 A250 P277	M108-I252 HydrophobicContact CE-CG1 4.33Å; M108-I252 HydrophobicContact SD-CG1 4.1Å; R127-I252 HydrophobicContact CB-CG2 4.09Å; R127-I252 HydrophobicContact CG-CG2 3.85Å; V129-I252 HydrophobicContact CG1-CD1 3.41Å; V129-I252 VanDerWaalsContact CG1-CD1 3.41Å; V129-I252 HydrophobicContact CG1-CG1 4.22Å; V150-I252 HydrophobicContact CG2-CD1 4.42Å; F249-I252 HydrophobicContact CB-CB 4.21Å; F249-I252 HydrophobicContact CB-CD1 3.87Å; F249-I252 HydrophobicContact CB-CG1 4.25Å; F249-I252 HydrophobicContact CG-CD1 4.46Å; F249-I252 PolarHBondContact O-N 2.87Å; A250-I252 PolarHBondContact O-N 3.25Å; I252-P277 HydrophobicContact CD1-CG 3.71Å; I252-P277 HydrophobicContact CG1-CG 3.62Å
253	D	78.5	Confident	70.2	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.027	30%	0.301	C	S	.	.	S	Bend	trans	-96.1	4	-173	-67.2	-66.6	0	0	0	114	R127 R248 F249 Y255 T256	R127-D253 IonicContact CZ-OD1 3.61Å; R127-D253 IonicContact NE-OD1 2.73Å; R127-D253 PolarHBondContact NE-OD1 3.36Å; R127-D253 IonicContact NE-OD2 2.86Å; R127-D253 IonicContact NH2-OD1 3.85Å; R127-D253 PolarHBondContact NH2-OD1 3.46Å; R248-D253 VanDerWaalsContact CA-OD2 3.31Å; R248-D253 WeakPolarHBondContact CA-OD2 3.39Å; R248-D253 HydrophobicContact CB-CB 4.12Å; R248-D253 HydrophobicContact CG-CB 4.29Å; F249-D253 PolarHBondContact N-OD2 3.25Å; F249-D253 PolarHBondContact O-N 3.14Å; D253-Y255 PolarHBondContact O-N 2.96Å; D253-T256 PolarHBondContact O-N 3.44Å; D253-T256 VanDerWaalsContact O-N 3.07Å; D253-T256 PolarHBondContact O-OG1 2.92Å
254	D	68.3	Low	69.3	Low	23 Å²	23	51.6 Å²	51.6	12%	0.123	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.7	-174.3	-68.1	-0.5	0	0	0	113.4	G251	G251-D254 WeakPolarHBondContact CA-OD2 3.34Å; G251-D254 VanDerWaalsContact N-CG 3.28Å; G251-D254 PolarHBondContact N-OD1 2.82Å; G251-D254 PolarHBondContact N-OD2 3.28Å; G251-D254 VanDerWaalsContact N-OD2 3.12Å
255	Y	58.3	Low	67.9	Low	85 Å²	85	49.4 Å²	49.4	33%	0.333	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.3	-178.1	-58.8	-80.5	0	0	0	114.1	Y122 D253 Y257 L265 R269	Y122-Y255 VanDerWaalsContact OH-CD2 3.28Å; Y122-Y255 WeakPolarHBondContact OH-CD2 3.23Å; D253-Y255 PolarHBondContact O-N 2.96Å; Y255-Y257 PolarHBondContact O-N 2.93Å; Y255-L265 HydrophobicContact CD1-CD1 3.97Å; Y255-L265 HydrophobicContact CD1-CD2 4.28Å; Y255-L265 HydrophobicContact CE1-CD2 4.17Å; Y255-R269 PolarHBondContact OH-NH2 2.59Å
256	T	55.2	Low	66.5	Low	60 Å²	60	56 Å²	56	37%	0.368	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13	-168	60	0	0	0	0	114.2	D253	D253-T256 PolarHBondContact O-N 3.44Å; D253-T256 VanDerWaalsContact O-N 3.07Å; D253-T256 PolarHBondContact O-OG1 2.92Å
257	Y	50	Low	65	Low	101 Å²	101	58.4 Å²	58.4	40%	0.396	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-4	-174	-97	-113.2	0	0	0	115.7	K157 R248 Y255 S259	K157-Y257 HydrophobicContact CD-CE1 4.2Å; K157-Y257 VanDerWaalsContact CD-OH 3.28Å; K157-Y257 WeakPolarHBondContact CD-OH 3.39Å; R248-Y257 PolarHBondContact NH2-OH 2.97Å; Y255-Y257 PolarHBondContact O-N 2.93Å; Y257-S259 VanDerWaalsContact C-N 3.33Å; Y257-S259 PolarHBondContact O-N 2.76Å; Y257-S259 VanDerWaalsContact O-N 3.13Å
258	S	49.3	Very low	63.6	Low	24 Å²	24	60.8 Å²	60.8	17%	0.168	35%	0.345	C	S	.	.			trans	-88.7	84	173.1	-62.6	0	0	0	0	108.3	G260 L265	S258-G260 PolarHBondContact O-N 3.02Å; S258-L265 VanDerWaalsContact CB-CD1 3.43Å; S258-L265 VanDerWaalsContact OG-CD1 3.31Å; S258-L265 WeakPolarHBondContact OG-CD1 3.4Å; S258-L265 PolarHBondContact OG-N 3.35Å
259	S	45.7	Very low	62.3	Low	120 Å²	120	64.1 Å²	64.1	84%	0.839	36%	0.357	S	S	*	.	S	Bend	trans	-57.3	88.3	164.7	-161.4	0	0	0	0	108.3	Y257 D261	Y257-S259 VanDerWaalsContact C-N 3.33Å; Y257-S259 PolarHBondContact O-N 2.76Å; Y257-S259 VanDerWaalsContact O-N 3.13Å; S259-D261 PolarHBondContact O-N 3.33Å
260	G	49.5	Very low	60.9	Low	79 Å²	79	72.7 Å²	72.7	81%	0.814	40%	0.395	S	S	*	.	S	Bend	trans	61.4	-11.5	173.6	0	0	0	0	0	118.1	S258 V262	S258-G260 PolarHBondContact O-N 3.02Å; G260-V262 PolarHBondContact O-N 2.9Å
261	D	54.2	Low	59.9	Low	85 Å²	85	79.4 Å²	79.4	46%	0.455	42%	0.424	S	S	.	.			trans	-92.1	98.2	-171.5	-161.9	-5.8	0	0	0	111.8	S259 K263 A264 L265	S259-D261 PolarHBondContact O-N 3.33Å; D261-K263 PolarHBondContact O-N 3.27Å; D261-K263 VanDerWaalsContact O-N 3.12Å; D261-K263 PolarHBondContact OD1-N 2.93Å; D261-A264 HydrophobicContact CB-CB 4.28Å; D261-A264 PolarHBondContact O-N 3.5Å; D261-A264 VanDerWaalsContact O-N 3.11Å; D261-L265 PolarHBondContact O-N 2.96Å
262	V	57.5	Low	59.3	Low	95 Å²	95	80.8 Å²	80.8	58%	0.576	42%	0.424	S	S	*	.	H	α-helix	trans	-56.6	-26.8	179.5	-176.8	0	0	0	0	111.9	G260 K266	G260-V262 PolarHBondContact O-N 2.9Å; V262-K266 WeakPolarHBondContact O-CG 3.24Å; V262-K266 PolarHBondContact O-N 3.39Å
263	K	54.6	Low	58.6	Low	173 Å²	173	84.6 Å²	84.6	75%	0.752	45%	0.452	S	S	*	.	H	α-helix	trans	-73.3	-39.6	178.3	-69.2	-179.7	179	176.5	0	112.3	D261 L265 K266 S267	D261-K263 PolarHBondContact O-N 3.27Å; D261-K263 VanDerWaalsContact O-N 3.12Å; D261-K263 PolarHBondContact OD1-N 2.93Å; K263-L265 VanDerWaalsContact C-N 3.35Å; K263-K266 PolarHBondContact O-N 2.92Å; K263-S267 WeakPolarHBondContact O-CB 3.49Å; K263-S267 PolarHBondContact O-N 2.95Å
264	A	55.9	Low	58.3	Low	40 Å²	40	86 Å²	86	33%	0.331	47%	0.468	S	S	.	.	H	α-helix	trans	-66.4	-37.7	175.7	0	0	0	0	0	111.7	D261 S267 N268	D261-A264 HydrophobicContact CB-CB 4.28Å; D261-A264 PolarHBondContact O-N 3.5Å; D261-A264 VanDerWaalsContact O-N 3.11Å; A264-S267 PolarHBondContact O-N 2.91Å; A264-N268 PolarHBondContact O-N 3.19Å
265	L	56	Low	59	Low	34 Å²	34	88.3 Å²	88.3	18%	0.178	48%	0.476	C	S	.	.	H	α-helix	trans	-64.1	-44.4	176.5	-157.3	94.8	0	0	0	111.9	Y255 S258 D261 K263 N268 R269	Y255-L265 HydrophobicContact CD1-CD1 3.97Å; Y255-L265 HydrophobicContact CD1-CD2 4.28Å; Y255-L265 HydrophobicContact CE1-CD2 4.17Å; S258-L265 VanDerWaalsContact CB-CD1 3.43Å; S258-L265 VanDerWaalsContact OG-CD1 3.31Å; S258-L265 WeakPolarHBondContact OG-CD1 3.4Å; S258-L265 PolarHBondContact OG-N 3.35Å; D261-L265 PolarHBondContact O-N 2.96Å; K263-L265 VanDerWaalsContact C-N 3.35Å; L265-N268 PolarHBondContact O-N 2.99Å; L265-R269 WeakPolarHBondContact O-CB 3.4Å; L265-R269 WeakPolarHBondContact O-CG 3.33Å; L265-R269 PolarHBondContact O-N 2.9Å
266	K	56.4	Low	60.3	Low	148 Å²	148	86.5 Å²	86.5	64%	0.643	47%	0.474	S	S	*	.	H	α-helix	trans	-65.4	-38.1	175.8	-74.3	-176.7	178.8	-175.4	0	112.3	V262 K263 K270	V262-K266 WeakPolarHBondContact O-CG 3.24Å; V262-K266 PolarHBondContact O-N 3.39Å; K263-K266 PolarHBondContact O-N 2.92Å; K266-K270 WeakPolarHBondContact O-CB 3.31Å; K266-K270 PolarHBondContact O-N 2.85Å
267	S	56.5	Low	62.1	Low	77 Å²	77	83.7 Å²	83.7	54%	0.538	46%	0.457	S	S	.	.	H	α-helix	trans	-64.6	-46.7	175.9	-176.6	0	0	0	0	112	K263 A264 K270 K271	K263-S267 WeakPolarHBondContact O-CB 3.49Å; K263-S267 PolarHBondContact O-N 2.95Å; A264-S267 PolarHBondContact O-N 2.91Å; S267-K270 PolarHBondContact O-N 3.46Å; S267-K271 WeakPolarHBondContact O-CB 2.98Å; S267-K271 PolarHBondContact O-N 3.3Å
268	N	59.1	Low	64.2	Low	51 Å²	51	78.9 Å²	78.9	27%	0.273	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-41.3	176.6	-83.1	-21.9	0	0	0	112.7	A264 L265 K270 K271 Y272	A264-N268 PolarHBondContact O-N 3.19Å; L265-N268 PolarHBondContact O-N 2.99Å; N268-K270 VanDerWaalsContact C-N 3.29Å; N268-K270 PolarHBondContact O-N 2.95Å; N268-K271 PolarHBondContact O-N 3.35Å; N268-K271 VanDerWaalsContact O-N 3.16Å; N268-Y272 VanDerWaalsContact O-CD2 3.26Å; N268-Y272 WeakPolarHBondContact O-CD2 3.41Å; N268-Y272 PolarHBondContact O-N 2.97Å
269	R	61.1	Low	66.3	Low	116 Å²	116	77.8 Å²	77.8	44%	0.438	43%	0.43	S	S	.	.	H	α-helix	trans	-58.8	-40.6	172.9	-80	-174.4	179.4	178.8	1.4	112	Y255 L265 S273	Y255-R269 PolarHBondContact OH-NH2 2.59Å; L265-R269 WeakPolarHBondContact O-CB 3.4Å; L265-R269 WeakPolarHBondContact O-CG 3.33Å; L265-R269 PolarHBondContact O-N 2.9Å; R269-S273 WeakPolarHBondContact O-CA 3.21Å; R269-S273 WeakPolarHBondContact O-CB 3.07Å; R269-S273 PolarHBondContact O-N 2.72Å
270	K	61.3	Low	68.5	Low	180 Å²	180	72.1 Å²	72.1	78%	0.783	39%	0.39	S	S	*	.	H	α-helix	trans	-68.9	-36.6	176.3	-161.6	172.7	-177	178.8	0	111.9	K266 S267 N268 S273	K266-K270 WeakPolarHBondContact O-CB 3.31Å; K266-K270 PolarHBondContact O-N 2.85Å; S267-K270 PolarHBondContact O-N 3.46Å; N268-K270 VanDerWaalsContact C-N 3.29Å; N268-K270 PolarHBondContact O-N 2.95Å; K270-S273 WeakPolarHBondContact O-CB 3.42Å
271	K	65.8	Low	70.5	Confident	140 Å²	140	68.3 Å²	68.3	61%	0.609	35%	0.352	S	S	*	.	H	α-helix	trans	-67.2	-34.6	178.4	-174.1	176.5	179	-179.9	0	113.4	S267 N268	S267-K271 WeakPolarHBondContact O-CB 2.98Å; S267-K271 PolarHBondContact O-N 3.3Å; N268-K271 PolarHBondContact O-N 3.35Å; N268-K271 VanDerWaalsContact O-N 3.16Å
272	Y	69.9	Low	72	Confident	47 Å²	47	64.9 Å²	64.9	18%	0.184	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	15.1	-179.7	-53.2	-61.8	0	0	0	113.2	L153 A250 N268 G274 K275	L153-Y272 HydrophobicContact CD2-CD1 3.74Å; L153-Y272 HydrophobicContact CD2-CD2 4.23Å; L153-Y272 HydrophobicContact CD2-CE1 3.48Å; L153-Y272 VanDerWaalsContact CD2-CE1 3.48Å; L153-Y272 HydrophobicContact CD2-CE2 4Å; L153-Y272 HydrophobicContact CD2-CG 4.12Å; A250-Y272 HydrophobicContact CB-CG 4.45Å; N268-Y272 VanDerWaalsContact O-CD2 3.26Å; N268-Y272 WeakPolarHBondContact O-CD2 3.41Å; N268-Y272 PolarHBondContact O-N 2.97Å; Y272-G274 PolarHBondContact O-N 3.16Å; Y272-K275 HydrophobicContact CD1-CD 4.33Å; Y272-K275 WeakPolarHBondContact O-CB 3.21Å; Y272-K275 PolarHBondContact O-N 3.2Å
273	S	67.1	Low	73.3	Confident	94 Å²	94	60.5 Å²	60.5	66%	0.657	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	124.2	174.1	-173.9	0	0	0	0	110	R269 K270	R269-S273 WeakPolarHBondContact O-CA 3.21Å; R269-S273 WeakPolarHBondContact O-CB 3.07Å; R269-S273 PolarHBondContact O-N 2.72Å; K270-S273 WeakPolarHBondContact O-CB 3.42Å
274	G	72.4	Confident	74.4	Confident	35 Å²	35	53.7 Å²	53.7	36%	0.361	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	0.1	-175.4	0	0	0	0	0	115.4	Y272	Y272-G274 PolarHBondContact O-N 3.16Å
275	K	83.2	Confident	75	Confident	70 Å²	70	52 Å²	52	30%	0.304	26%	0.264	S	S	.	.			trans	-103	15.6	173.8	-60.7	-173.2	176.1	-171.1	0	113.7	F151 W197 A250 Y272	F151-K275 HydrophobicContact CB-CB 3.97Å; F151-K275 WeakPolarHBondContact CB-O 3.22Å; F151-K275 HydrophobicContact CD1-CB 4.3Å; F151-K275 HydrophobicContact CD1-CD 3.75Å; F151-K275 HydrophobicContact CD2-CD 4.05Å; F151-K275 HydrophobicContact CE1-CD 3.78Å; F151-K275 HydrophobicContact CE2-CD 4.08Å; F151-K275 HydrophobicContact CG-CB 4.07Å; F151-K275 HydrophobicContact CG-CD 3.89Å; F151-K275 HydrophobicContact CG-CG 4.39Å; F151-K275 HydrophobicContact CZ-CD 3.96Å; W197-K275 HydrophobicContact CH2-CB 4.22Å; W197-K275 HydrophobicContact CZ2-CB 4.06Å; W197-K275 HydrophobicContact CZ2-CG 4.05Å; A250-K275 HydrophobicContact CB-CB 4.13Å; A250-K275 WeakPolarHBondContact CB-O 2.97Å; Y272-K275 HydrophobicContact CD1-CD 4.33Å; Y272-K275 WeakPolarHBondContact O-CB 3.21Å; Y272-K275 PolarHBondContact O-N 3.2Å
276	T	86.1	Confident	75.4	Confident	48 Å²	48	54.2 Å²	54.2	29%	0.294	28%	0.282	S	S	.	.	S	Bend	trans	-65.7	151.9	177.9	45.9	0	0	0	0	111.4	D107 H278	D107-T276 PolarHBondContact OD1-OG1 2.85Å; T276-H278 PolarHBondContact O-N 3.06Å; T276-H278 PolarHBondContact O-ND1 3.08Å
277	P	92.6	Very high	75.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.			trans	-63.6	136.9	177	-11.7	26.9	0	0	0	109.6	M108 F148 R149 V150 A250 I252	M108-P277 HydrophobicContact CB-CB 4.3Å; M108-P277 VanDerWaalsContact CB-O 3.25Å; M108-P277 WeakPolarHBondContact CB-O 3.47Å; M108-P277 PolarHBondContact N-O 2.77Å; M108-P277 HydrophobicContact SD-CB 4.32Å; M108-P277 HydrophobicContact SD-CG 3.92Å; F148-P277 HydrophobicContact CE2-CB 3.83Å; F148-P277 HydrophobicContact CZ-CB 4.28Å; R149-P277 VanDerWaalsContact O-CA 3.26Å; R149-P277 WeakPolarHBondContact O-CA 3.23Å; V150-P277 HydrophobicContact CB-CB 4.41Å; V150-P277 HydrophobicContact CG2-CB 4.19Å; V150-P277 HydrophobicContact CG2-CG 4.13Å; A250-P277 WeakPolarHBondContact O-CD 3.3Å; I252-P277 HydrophobicContact CD1-CG 3.71Å; I252-P277 HydrophobicContact CG1-CG 3.62Å
278	H	93.9	Very high	75.5	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	157.5	-177.2	59.7	-86.2	0	0	0	111.5	S73 K105 I106 R149 W197 T276	S73-H278 PolarHBondContact OG-CE1 3.49Å; S73-H278 PolarHBondContact OG-NE2 3.44Å; K105-H278 HydrophobicContact CG-CB 4.08Å; I106-H278 CarbonylContact O-C 3.47Å; I106-H278 VanDerWaalsContact O-CA 3.22Å; I106-H278 WeakPolarHBondContact O-CA 3.48Å; I106-H278 WeakPolarHBondContact O-CB 3.43Å; R149-H278 PolarHBondContact N-O 3.27Å; R149-H278 PolarHBondContact O-N 3.46Å; W197-H278 AromaticContact CH2-CE1 3.63Å; W197-H278 AromaticContact CZ3-CE1 3.76Å; T276-H278 PolarHBondContact O-N 3.06Å; T276-H278 PolarHBondContact O-ND1 3.08Å
279	L	94.3	Very high	75.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	137.9	168.4	-59.8	172.1	0	0	0	109.7	K105 I106 F131 V133 E147 F148 V202 V206 W209 F219 L281	K105-L279 CarbonylContact C-O 3.48Å; K105-L279 WeakPolarHBondContact CA-O 3.43Å; I106-L279 HydrophobicContact CB-CB 4.3Å; I106-L279 PolarHBondContact N-O 2.73Å; I106-L279 PolarHBondContact O-N 3.39Å; F131-L279 HydrophobicContact CB-CD1 3.58Å; F131-L279 HydrophobicContact CB-CG 4.37Å; F131-L279 HydrophobicContact CD1-CD1 3.91Å; F131-L279 HydrophobicContact CD1-CG 3.75Å; F131-L279 HydrophobicContact CD2-CD1 3.73Å; F131-L279 HydrophobicContact CD2-CD2 4.28Å; F131-L279 HydrophobicContact CD2-CG 3.93Å; F131-L279 HydrophobicContact CE1-CG 4Å; F131-L279 HydrophobicContact CE2-CD1 4.44Å; F131-L279 HydrophobicContact CE2-CD2 4.22Å; F131-L279 HydrophobicContact CE2-CG 4.16Å; F131-L279 HydrophobicContact CG-CD1 3.43Å; F131-L279 VanDerWaalsContact CG-CD1 3.43Å; F131-L279 HydrophobicContact CG-CG 3.73Å; F131-L279 HydrophobicContact CZ-CD2 4.44Å; F131-L279 HydrophobicContact CZ-CG 4.2Å; V133-L279 HydrophobicContact CG1-CD1 4.21Å; E147-L279 CarbonylContact O-C 3.52Å; E147-L279 WeakPolarHBondContact O-CA 3.27Å; F148-L279 HydrophobicContact CB-CD2 3.76Å; F148-L279 HydrophobicContact CD2-CD2 4.09Å; F148-L279 HydrophobicContact CG-CD2 4.32Å; V202-L279 HydrophobicContact CG2-CD2 3.91Å; V206-L279 HydrophobicContact CG2-CD1 4.21Å; W209-L279 HydrophobicContact CZ3-CD1 4.31Å; F219-L279 HydrophobicContact CE2-CD2 3.94Å; L279-L281 HydrophobicContact CB-CD2 4.37Å
280	L	91.6	Very high	74.5	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	114.1	165.1	-64.6	179.9	0	0	0	108.5	L77 V103 Y104 K105 A146 E147 R149	L77-L280 HydrophobicContact CB-CD1 4.47Å; L77-L280 HydrophobicContact CD2-CD1 3.81Å; V103-L280 HydrophobicContact CG1-CD2 4.42Å; Y104-L280 CarbonylContact O-C 3.5Å; Y104-L280 WeakPolarHBondContact O-CA 3.26Å; K105-L280 HydrophobicContact CB-CD2 4.02Å; K105-L280 HydrophobicContact CG-CD2 4.09Å; A146-L280 WeakPolarHBondContact CA-O 3.22Å; E147-L280 HydrophobicContact CB-CB 4.42Å; E147-L280 PolarHBondContact N-O 3.16Å; E147-L280 PolarHBondContact O-N 3.04Å; R149-L280 HydrophobicContact CG-CD1 4.33Å
281	L	91	Very high	73.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.5	176.4	-52	-177	0	0	0	109.3	V103 Y104 I106 M136 L143 A146 V206 L279 L283	V103-L281 CarbonylContact C-O 3.48Å; V103-L281 WeakPolarHBondContact CA-O 3.3Å; Y104-L281 PolarHBondContact N-O 2.97Å; Y104-L281 PolarHBondContact O-N 2.75Å; I106-L281 HydrophobicContact CD1-CD1 3.49Å; I106-L281 VanDerWaalsContact CD1-CD1 3.49Å; I106-L281 HydrophobicContact CD1-CG 4.23Å; I106-L281 HydrophobicContact CG1-CD1 4.42Å; M136-L281 HydrophobicContact CB-CD1 4.33Å; M136-L281 HydrophobicContact CG-CD1 3.95Å; L143-L281 HydrophobicContact CD1-CB 4.08Å; L143-L281 HydrophobicContact CD1-CD2 4.15Å; A146-L281 HydrophobicContact CB-CD2 3.47Å; A146-L281 VanDerWaalsContact CB-CD2 3.47Å; V206-L281 HydrophobicContact CG1-CD2 3.72Å; V206-L281 HydrophobicContact CG2-CD2 4.47Å; L279-L281 HydrophobicContact CB-CD2 4.37Å; L281-L283 HydrophobicContact CB-CD1 3.64Å
282	M	86.6	Confident	72.4	Confident	12 Å²	12	50.8 Å²	50.8	6%	0.059	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	108.2	175.7	-53.6	175.8	-147.6	0	0	107.8	L77 K101 E102 V103 V144 K145 E147	L77-M282 HydrophobicContact CD2-CE 3.85Å; K101-M282 HydrophobicContact CB-CB 4.17Å; K101-M282 HydrophobicContact CD-CB 4.08Å; E102-M282 WeakPolarHBondContact O-CA 3.45Å; V103-M282 HydrophobicContact CG2-CG 4.36Å; V144-M282 PolarHBondContact N-O 3.16Å; K145-M282 HydrophobicContact CB-CB 4.22Å; K145-M282 HydrophobicContact CB-CG 4.47Å; K145-M282 HydrophobicContact CB-SD 4.14Å; K145-M282 HydrophobicContact CD-CE 4.36Å; K145-M282 HydrophobicContact CD-SD 4.4Å; K145-M282 HydrophobicContact CG-CE 4.45Å; K145-M282 PolarHBondContact N-O 2.95Å; K145-M282 PolarHBondContact O-N 3.31Å; E147-M282 HydrophobicContact CG-CE 4.02Å
283	L	84.6	Confident	70.8	Confident	3 Å²	3	57 Å²	57	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	145.3	-178.4	-65.2	96.2	0	0	0	111	K101 E102 Y104 N139 N142 L143 L281	K101-L283 CarbonylContact C-O 3.46Å; K101-L283 WeakPolarHBondContact CA-O 3.41Å; E102-L283 PolarHBondContact N-O 3.47Å; E102-L283 PolarHBondContact O-N 3.23Å; Y104-L283 HydrophobicContact CD2-CD1 3.43Å; Y104-L283 VanDerWaalsContact CD2-CD1 3.43Å; Y104-L283 HydrophobicContact CE2-CD1 3.9Å; Y104-L283 HydrophobicContact CG-CD1 4.35Å; N139-L283 HydrophobicContact CB-CD2 3.56Å; N139-L283 WeakPolarHBondContact O-CD2 3.09Å; N142-L283 HydrophobicContact CB-CB 4.36Å; N142-L283 HydrophobicContact CB-CD2 4.23Å; N142-L283 CarbonylContact O-C 3.54Å; N142-L283 VanDerWaalsContact O-CA 3.26Å; N142-L283 WeakPolarHBondContact O-CA 3.39Å; L143-L283 HydrophobicContact CD1-CG 4.33Å; L281-L283 HydrophobicContact CB-CD1 3.64Å
284	L	77.8	Confident	69.3	Low	30 Å²	30	58 Å²	58	16%	0.157	31%	0.308	C	S	.	.			trans	-77.7	134.5	165.2	-77.9	164.2	0	0	0	109.4	K101 N142 V144 S286	K101-L284 HydrophobicContact CG-CD2 4.44Å; N142-L284 WeakPolarHBondContact CB-O 3.35Å; N142-L284 PolarHBondContact ND2-O 3.22Å; N142-L284 PolarHBondContact O-N 2.71Å; V144-L284 HydrophobicContact CG2-CB 4.25Å; V144-L284 HydrophobicContact CG2-CD1 3.4Å; V144-L284 HydrophobicContact CG2-CG 3.41Å; V144-L284 VanDerWaalsContact CG2-CG 3.41Å; L284-S286 PolarHBondContact O-N 2.82Å
285	P	67.4	Low	67.7	Low	5 Å²	5	61 Å²	61	3%	0.032	32%	0.323	C	S	.	.			trans	-61.8	133.9	173	-15.7	26	0	0	0	110.7	E102 Y287 R288	E102-P285 HydrophobicContact CG-CG 4.3Å; P285-Y287 HydrophobicContact CB-CD1 3.64Å; P285-Y287 HydrophobicContact CB-CD2 4.39Å; P285-Y287 HydrophobicContact CB-CE1 3.13Å; P285-Y287 HydrophobicContact CB-CE2 4Å; P285-Y287 HydrophobicContact CB-CG 4.24Å; P285-Y287 HydrophobicContact CG-CE1 4.06Å; P285-Y287 HydrophobicContact CG-CE2 4.48Å; P285-Y287 PolarHBondContact O-N 2.99Å; P285-Y287 VanDerWaalsContact O-N 3.09Å; P285-R288 PolarHBondContact O-N 3.07Å
286	S	64	Low	65.7	Low	80 Å²	80	69 Å²	69	56%	0.559	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-55	-31.2	-176	46.7	0	0	0	0	113.4	L284 R288	L284-S286 PolarHBondContact O-N 2.82Å; S286-R288 PolarHBondContact O-N 3.03Å; S286-R288 VanDerWaalsContact O-N 3.15Å
287	Y	58.2	Low	63.5	Low	105 Å²	105	77 Å²	77	41%	0.412	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-72.1	2	177.8	63.9	-102.3	0	0	0	115	K49 P285	K49-Y287 HydrophobicContact CD-CD2 4.1Å; K49-Y287 HydrophobicContact CD-CE2 3.68Å; K49-Y287 VanDerWaalsContact NZ-CD2 3.27Å; P285-Y287 HydrophobicContact CB-CD1 3.64Å; P285-Y287 HydrophobicContact CB-CD2 4.39Å; P285-Y287 HydrophobicContact CB-CE1 3.13Å; P285-Y287 HydrophobicContact CB-CE2 4Å; P285-Y287 HydrophobicContact CB-CG 4.24Å; P285-Y287 HydrophobicContact CG-CE1 4.06Å; P285-Y287 HydrophobicContact CG-CE2 4.48Å; P285-Y287 PolarHBondContact O-N 2.99Å; P285-Y287 VanDerWaalsContact O-N 3.09Å
288	R	58.4	Low	61.1	Low	40 Å²	40	85 Å²	85	15%	0.151	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-115.9	-0.9	-178.2	-67.2	-163.7	166.2	134.3	5.9	115	K47 P285 S286 E290	K47-R288 PolarHBondContact O-NH2 2.99Å; P285-R288 PolarHBondContact O-N 3.07Å; S286-R288 PolarHBondContact O-N 3.03Å; S286-R288 VanDerWaalsContact O-N 3.15Å; R288-E290 PolarHBondContact O-N 3.35Å
289	L	53.3	Low	58.6	Low	74 Å²	74	94.3 Å²	94.3	39%	0.387	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-10.5	-177.3	-72.2	161.6	0	0	0	113.7	N142	N142-L289 WeakPolarHBondContact OD1-CD1 3.47Å
290	E	45.1	Very low	56.1	Low	194 Å²	194	103.8 Å²	103.8	91%	0.907	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.6	-174.2	-72	-178.4	158.6	0	0	115.9	R288	R288-E290 PolarHBondContact O-N 3.35Å
291	S	43.8	Very low	54.2	Low	73 Å²	73	105.8 Å²	105.8	51%	0.51	50%	0.504	S	S	.	.			trans	-126.8	69.1	178.7	86.3	0	0	0	0	113.8	Y99	Y99-S291 PolarHBondContact OH-O 3.37Å
292	Q	38.3	Very low	52.3	Low	154 Å²	154	111.5 Å²	111.5	72%	0.72	53%	0.534	S	S	*	.			trans	-101.5	104.3	167.8	-70.7	-172.9	-8.8	0	0	110.3
293	Q	36.3	Very low	50.7	Low	179 Å²	179	115.4 Å²	115.4	84%	0.836	56%	0.555	S	S	*	*			trans	-114.8	128.2	161.5	-79.9	-89.3	-18.9	0	0	107
294	P	36.2	Very low	49.3	Very low	115 Å²	115	115.9 Å²	115.9	75%	0.747	56%	0.559	S	S	*	*			trans	-82.1	132	-180	31	-29.8	0	0	0	110.5
295	S	38.8	Very low	48.2	Very low	97 Å²	97	117.7 Å²	117.7	68%	0.678	58%	0.579	S	S	*	*			trans	-126.3	104.1	174.5	169.6	0	0	0	0	112.3
296	R	42.6	Very low	47.5	Very low	237 Å²	237	123.3 Å²	123.3	89%	0.894	60%	0.6	S	S	*	*			trans	12.3	128.5	157.7	-69.5	-179.4	176.6	178.8	-0.7	120.7
297	R	39.7	Very low	47	Very low	218 Å²	218	120.6 Å²	120.6	82%	0.823	58%	0.581	S	S	*	*			trans	-40.3	140.1	163.9	-93.8	176.8	162.9	145.1	-5.6	115.4	E92	E92-R297 IonicContact OE1-CZ 2.83Å; E92-R297 IonicContact OE1-NE 2.81Å; E92-R297 IonicContact OE1-NH2 3.92Å; E92-R297 PolarHBondContact OE1-NH2 2.88Å
298	K	42.3	Very low	46.8	Very low	167 Å²	167	120.9 Å²	120.9	73%	0.726	58%	0.584	S	S	*	*			trans	-122.8	150	168.7	-81.6	-179.7	178.4	172.9	0	113.1
299	K	41.2	Very low	46.4	Very low	197 Å²	197	129.4 Å²	129.4	86%	0.857	62%	0.617	S	S	*	*			trans	-109.6	163.8	178.5	-81.3	180	176.9	176.4	0	112	Q381	K299-Q381 PolarHBondContact O-NE2 2.96Å
300	R	42.2	Very low	46.2	Very low	198 Å²	198	129.7 Å²	129.7	75%	0.747	62%	0.618	S	S	*	*			trans	-57.6	144.7	-161.7	-57.7	171.8	-164	162.5	2.8	116.6
301	A	51	Low	46.5	Very low	43 Å²	43	127 Å²	127	36%	0.355	62%	0.615	S	S	.	*			trans	-137.5	-175.4	153.9	0	0	0	0	0	111	K410	A301-K410 HydrophobicContact CB-CB 4.06Å
302	L	50.7	Low	47.1	Very low	121 Å²	121	126.4 Å²	126.4	63%	0.634	60%	0.604	S	S	*	*			trans	-69.8	136.2	-165.4	-63.4	166.3	0	0	0	113	S408	L302-S408 WeakPolarHBondContact O-CB 3.32Å
303	D	54.1	Low	48.3	Very low	93 Å²	93	125.2 Å²	125.2	50%	0.497	60%	0.602	S	S	.	*	B	Isolated β-bridge	trans	-85.5	159.5	-173.5	-173.9	21.1	0	0	0	113.3	A305 Y306	D303-A305 PolarHBondContact O-N 3.17Å; D303-A305 VanDerWaalsContact O-N 3.09Å; D303-Y306 PolarHBondContact O-N 2.9Å; D303-Y306 VanDerWaalsContact O-N 3.17Å
304	A	54.3	Low	50	Low	13 Å²	13	118.8 Å²	118.8	11%	0.107	57%	0.574	C	S	.	*	H	α-helix	trans	-50.2	-33.1	-179.3	0	0	0	0	0	114	Y306 C307 F308 L317 K407	A304-Y306 PolarHBondContact O-N 3.5Å; A304-C307 PolarHBondContact O-N 2.89Å; A304-C307 VanDerWaalsContact O-N 3.15Å; A304-F308 HydrophobicContact CB-CD2 4.31Å; A304-F308 HydrophobicContact CB-CE2 3.65Å; A304-F308 HydrophobicContact CB-CZ 4.37Å; A304-F308 WeakPolarHBondContact O-CD2 3.46Å; A304-F308 PolarHBondContact O-N 3.38Å; A304-L317 HydrophobicContact CB-CD2 3.59Å; A304-K407 WeakPolarHBondContact CB-O 2.93Å
305	A	54.3	Low	51.8	Low	69 Å²	69	114.2 Å²	114.2	57%	0.57	55%	0.545	S	S	*	.	H	α-helix	trans	-61.9	-26.3	-178	0	0	0	0	0	114.2	D303	D303-A305 PolarHBondContact O-N 3.17Å; D303-A305 VanDerWaalsContact O-N 3.09Å
306	Y	53.2	Low	53.7	Low	122 Å²	122	109.8 Å²	109.8	48%	0.478	51%	0.514	S	S	.	.	H	α-helix	trans	-80.6	-33.9	177	-173.7	-99.3	0	0	0	112.1	D303 A304	D303-Y306 PolarHBondContact O-N 2.9Å; D303-Y306 VanDerWaalsContact O-N 3.17Å; A304-Y306 PolarHBondContact O-N 3.5Å
307	C	54.3	Low	55.6	Low	23 Å²	23	98.7 Å²	98.7	16%	0.155	47%	0.472	C	S	.	.	H	α-helix	trans	-80	-27.2	-170.2	-98.9	0	0	0	0	114.8	A304 R309 C316 L317	A304-C307 PolarHBondContact O-N 2.89Å; A304-C307 VanDerWaalsContact O-N 3.15Å; C307-R309 VanDerWaalsContact C-N 3.3Å; C307-R309 PolarHBondContact O-N 3.27Å; C307-C316 WeakPolarHBondContact CA-SG 3.5Å; C307-C316 HydrophobicContact CB-CB 4.34Å; C307-C316 WeakPolarHBondContact CB-SG 3.27Å; C307-C316 WeakPolarHBondContact SG-CA 3.47Å; C307-C316 WeakPolarHBondContact SG-CB 3.26Å; C307-C316 CovalentContact SG-SG 2.03Å; C307-C316 PolarHBondContact SG-SG 3.48Å; C307-L317 HydrophobicContact CB-CB 4.15Å; C307-L317 PolarHBondContact SG-N 3.04Å
308	F	52.3	Low	57.7	Low	112 Å²	112	90.1 Å²	90.1	49%	0.491	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-5.6	-178.9	-64	-54.9	0	0	0	114.8	A304 L317 P319	A304-F308 HydrophobicContact CB-CD2 4.31Å; A304-F308 HydrophobicContact CB-CE2 3.65Å; A304-F308 HydrophobicContact CB-CZ 4.37Å; A304-F308 WeakPolarHBondContact O-CD2 3.46Å; A304-F308 PolarHBondContact O-N 3.38Å; F308-L317 HydrophobicContact CE1-CD2 4.39Å; F308-L317 HydrophobicContact CE2-CD2 4.21Å; F308-L317 HydrophobicContact CZ-CD2 3.66Å; F308-L317 HydrophobicContact CZ-CG 4.42Å; F308-P319 HydrophobicContact CE1-CB 4.13Å; F308-P319 HydrophobicContact CE1-CG 4.34Å
309	R	50.1	Low	59.8	Low	219 Å²	219	86.1 Å²	86.1	83%	0.826	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-23.7	-177.6	-72.5	-172.1	175	-160.8	-0.7	114.6	C307	C307-R309 VanDerWaalsContact C-N 3.3Å; C307-R309 PolarHBondContact O-N 3.27Å
310	N	50	Low	62.1	Low	79 Å²	79	77.3 Å²	77.3	42%	0.422	39%	0.393	S	S	.	.			trans	-130.1	122.7	-175.3	-66.4	-29	0	0	0	110.5	Q312	N310-Q312 HydrophobicContact CB-CG 4.26Å; N310-Q312 PolarHBondContact O-N 3.38Å
311	V	51.6	Low	64.4	Low	137 Å²	137	72.3 Å²	72.3	83%	0.83	38%	0.375	S	S	*	.			trans	-75.5	82.9	167.9	-175.6	0	0	0	0	107.5
312	Q	56.3	Low	66.3	Low	62 Å²	62	70.2 Å²	70.2	29%	0.29	36%	0.358	S	S	.	.			trans	-92.1	143	171.1	-81.7	162.9	-15.4	0	0	109.6	N310 N314 R318	N310-Q312 HydrophobicContact CB-CG 4.26Å; N310-Q312 PolarHBondContact O-N 3.38Å; Q312-N314 HydrophobicContact CB-CB 4.46Å; Q312-N314 PolarHBondContact O-N 2.83Å; Q312-R318 PolarHBondContact O-NH2 3.46Å
313	D	63.3	Low	68.3	Low	128 Å²	128	66.3 Å²	66.3	68%	0.684	34%	0.338	S	S	*	.	S	Bend	trans	-69.4	-4.9	172.3	-65.1	-38.1	0	0	0	112.8	G346 A347	D313-G346 WeakPolarHBondContact O-CA 3.32Å; D313-A347 WeakPolarHBondContact O-CB 3.39Å; D313-A347 PolarHBondContact O-N 2.9Å
314	N	70.7	Confident	70.1	Confident	45 Å²	45	62 Å²	62	24%	0.241	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-83.3	163.1	-180	-62.9	-13.8	0	0	0	112.5	Q312 C316 A347 W352	Q312-N314 HydrophobicContact CB-CB 4.46Å; Q312-N314 PolarHBondContact O-N 2.83Å; N314-C316 WeakPolarHBondContact O-CB 3.39Å; N314-C316 PolarHBondContact O-N 2.63Å; N314-C316 VanDerWaalsContact O-N 3.17Å; N314-A347 CarbonylContact C-O 3.53Å; N314-A347 VanDerWaalsContact CA-O 3.25Å; N314-A347 WeakPolarHBondContact CA-O 2.99Å; N314-W352 HydrophobicContact CB-CH2 4.21Å; N314-W352 HydrophobicContact CB-CZ3 3.85Å; N314-W352 WeakPolarHBondContact ND2-CH2 3.47Å
315	C	75.6	Confident	71.8	Confident	19 Å²	19	68.2 Å²	68.2	13%	0.128	34%	0.339	C	S	.	.	S	Bend	trans	-53.9	117.8	179.5	174.8	0	0	0	0	112.4	A347 C348 C378 C411	C315-A347 PolarHBondContact N-O 2.94Å; C315-C348 WeakPolarHBondContact CB-SG 3.47Å; C315-C378 WeakPolarHBondContact CA-SG 3.39Å; C315-C378 HydrophobicContact CB-CB 3.59Å; C315-C378 WeakPolarHBondContact CB-SG 3.02Å; C315-C378 WeakPolarHBondContact SG-CA 3.43Å; C315-C378 WeakPolarHBondContact SG-CB 2.99Å; C315-C378 CovalentContact SG-SG 2.03Å; C315-C378 PolarHBondContact SG-SG 3.3Å; C315-C411 WeakPolarHBondContact CB-SG 3.24Å
316	C	77.9	Confident	73.5	Confident	4 Å²	4	72.9 Å²	72.9	3%	0.027	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	158.2	-171.7	-169.2	0	0	0	0	111.5	C307 N314 A345	C307-C316 WeakPolarHBondContact CA-SG 3.5Å; C307-C316 HydrophobicContact CB-CB 4.34Å; C307-C316 WeakPolarHBondContact CB-SG 3.27Å; C307-C316 WeakPolarHBondContact SG-CA 3.47Å; C307-C316 WeakPolarHBondContact SG-CB 3.26Å; C307-C316 CovalentContact SG-SG 2.03Å; C307-C316 PolarHBondContact SG-SG 3.48Å; N314-C316 WeakPolarHBondContact O-CB 3.39Å; N314-C316 PolarHBondContact O-N 2.63Å; N314-C316 VanDerWaalsContact O-N 3.17Å; C316-A345 PolarHBondContact N-O 3.13Å; C316-A345 VanDerWaalsContact N-O 3.08Å; C316-A345 PolarHBondContact O-N 3.4Å; C316-A345 VanDerWaalsContact O-O 3.13Å
317	L	83.3	Confident	75.1	Confident	4 Å²	4	69.3 Å²	69.3	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	128.4	175.6	-172.4	75.5	0	0	0	110	A304 C307 F308 N342 V406 K407 C409	A304-L317 HydrophobicContact CB-CD2 3.59Å; C307-L317 HydrophobicContact CB-CB 4.15Å; C307-L317 PolarHBondContact SG-N 3.04Å; F308-L317 HydrophobicContact CE1-CD2 4.39Å; F308-L317 HydrophobicContact CE2-CD2 4.21Å; F308-L317 HydrophobicContact CZ-CD2 3.66Å; F308-L317 HydrophobicContact CZ-CG 4.42Å; L317-N342 HydrophobicContact CD1-CB 3.82Å; L317-N342 HydrophobicContact CG-CB 4.23Å; L317-V406 HydrophobicContact CD1-CB 3.81Å; L317-V406 HydrophobicContact CD1-CG1 3.53Å; L317-K407 WeakPolarHBondContact CD2-O 3.43Å; L317-C409 VanDerWaalsContact CA-SG 3.53Å
318	R	84	Confident	76.7	Confident	37 Å²	37	68.2 Å²	68.2	14%	0.14	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.5	178.9	-55.9	-60.1	-178.9	176.4	1.3	110	M29 Q312 L320 N342 F343 A345	M29-R318 HydrophobicContact CE-CB 4.38Å; M29-R318 HydrophobicContact CE-CG 3.86Å; Q312-R318 PolarHBondContact O-NH2 3.46Å; R318-L320 PolarHBondContact O-N 2.77Å; R318-N342 VanDerWaalsContact O-CA 3.28Å; R318-N342 WeakPolarHBondContact O-CA 3.49Å; R318-N342 WeakPolarHBondContact O-CB 3.15Å; R318-F343 HydrophobicContact CB-CD1 3.94Å; R318-F343 HydrophobicContact CB-CD2 4.27Å; R318-F343 HydrophobicContact CB-CE1 3.59Å; R318-F343 HydrophobicContact CB-CE2 3.95Å; R318-F343 HydrophobicContact CB-CG 4.28Å; R318-F343 HydrophobicContact CB-CZ 3.61Å; R318-F343 HydrophobicContact CG-CE2 4.16Å; R318-F343 HydrophobicContact CG-CZ 4.18Å; R318-F343 PolarHBondContact N-O 3.4Å; R318-F343 PolarHBondContact O-N 3.09Å; R318-A345 HydrophobicContact CG-CB 4.11Å
319	P	85.5	Confident	78.4	Confident	84 Å²	84	65.6 Å²	65.6	55%	0.545	33%	0.328	S	S	.	.			trans	-69.3	133.4	179	29.1	-32.5	0	0	0	109.8	F308 N342	F308-P319 HydrophobicContact CE1-CB 4.13Å; F308-P319 HydrophobicContact CE1-CG 4.34Å; P319-N342 WeakPolarHBondContact CA-OD1 3.38Å
320	L	88.6	Confident	80.2	Confident	12 Å²	12	55.8 Å²	55.8	6%	0.063	29%	0.291	C	S	.	.			trans	-143.6	116.2	172.7	174.5	64	0	0	0	108.2	M33 R36 R318 I322 H340 A341 N342 F343	M33-L320 HydrophobicContact CB-CD1 4.32Å; M33-L320 HydrophobicContact CG-CD1 3.99Å; M33-L320 HydrophobicContact SD-CD1 3.84Å; R36-L320 HydrophobicContact CB-CD2 4.11Å; R36-L320 HydrophobicContact CG-CD2 3.74Å; R318-L320 PolarHBondContact O-N 2.77Å; L320-I322 HydrophobicContact CD2-CD1 4.19Å; L320-I322 HydrophobicContact CD2-CG1 4.26Å; L320-I322 HydrophobicContact CG-CD1 4.46Å; L320-I322 HydrophobicContact CG-CG1 4.02Å; L320-H340 CarbonylContact O-C 3.6Å; L320-H340 WeakPolarHBondContact O-CA 3.28Å; L320-A341 PolarHBondContact O-N 2.03Å; L320-N342 PolarHBondContact N-OD1 3.17Å; L320-N342 PolarHBondContact O-N 3.22Å; L320-N342 VanDerWaalsContact O-N 3.17Å; L320-F343 HydrophobicContact CB-CD1 3.65Å; L320-F343 HydrophobicContact CB-CE1 3.93Å; L320-F343 HydrophobicContact CD2-CD1 3.95Å; L320-F343 HydrophobicContact CD2-CE1 4.44Å; L320-F343 HydrophobicContact CG-CD1 4.39Å
321	Y	91.7	Very high	82	Confident	92 Å²	92	57.8 Å²	57.8	36%	0.361	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.5	170.8	-175.3	-96.2	0	0	0	109.1	D323 G338 Y339 H340	Y321-D323 HydrophobicContact CE1-CB 4.14Å; Y321-G338 VanDerWaalsContact OH-CA 3.31Å; Y321-G338 WeakPolarHBondContact OH-CA 3.34Å; Y321-Y339 WeakPolarHBondContact CA-O 3.47Å; Y321-H340 AromaticContact CD2-CD2 3.9Å; Y321-H340 AromaticContact CD2-CE1 3.61Å; Y321-H340 AromaticContact CD2-CG 3.97Å; Y321-H340 AromaticContact CD2-ND1 3.79Å; Y321-H340 AromaticContact CD2-NE2 3.68Å
322	I	91.4	Very high	83.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.5	178	-59.4	-179.8	0	0	0	107.9	I37 I40 L320 D327 L328 G338 Y339 A341	I37-I322 HydrophobicContact CG1-CD1 4.11Å; I37-I322 HydrophobicContact CG1-CG1 4.29Å; I40-I322 HydrophobicContact CB-CD1 4.45Å; I40-I322 HydrophobicContact CD1-CD1 3.23Å; I40-I322 HydrophobicContact CG1-CD1 4.41Å; I40-I322 HydrophobicContact CG2-CD1 4.33Å; L320-I322 HydrophobicContact CD2-CD1 4.19Å; L320-I322 HydrophobicContact CD2-CG1 4.26Å; L320-I322 HydrophobicContact CG-CD1 4.46Å; L320-I322 HydrophobicContact CG-CG1 4.02Å; I322-D327 HydrophobicContact CG2-CB 4.25Å; I322-L328 HydrophobicContact CG2-CD1 3.98Å; I322-L328 HydrophobicContact CG2-CG 4.3Å; I322-G338 CarbonylContact O-C 3.43Å; I322-G338 WeakPolarHBondContact O-CA 3.31Å; I322-Y339 HydrophobicContact CB-CE1 4.45Å; I322-Y339 PolarHBondContact N-O 2.99Å; I322-Y339 PolarHBondContact O-N 3.05Å; I322-A341 HydrophobicContact CD1-CB 3.62Å; I322-A341 HydrophobicContact CG1-CB 4.12Å
323	D	91.6	Very high	85.3	Confident	39 Å²	39	48.7 Å²	48.7	21%	0.209	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.1	170.1	-176.4	-49	0	0	0	108.8	Y321 K325 R326 D327	Y321-D323 HydrophobicContact CE1-CB 4.14Å; D323-K325 VanDerWaalsContact C-N 3.26Å; D323-K325 PolarHBondContact O-N 3.07Å; D323-K325 WeakPolarHBondContact OD1-CA 3.35Å; D323-K325 WeakPolarHBondContact OD1-CB 3.4Å; D323-K325 PolarHBondContact OD1-N 2.96Å; D323-R326 HydrophobicContact CB-CB 3.99Å; D323-R326 PolarHBondContact OD1-N 3.37Å; D323-D327 PolarHBondContact N-OD2 3.34Å; D323-D327 WeakPolarHBondContact O-CB 3.35Å; D323-D327 PolarHBondContact O-N 2.93Å
324	F	91.9	Very high	86.6	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.013	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-36.5	-177.4	-69.5	-65.8	0	0	0	112	I44 L328 G329 W330 I333 P336 K337 Y339 L386	I44-F324 HydrophobicContact CD1-CE1 3.76Å; F324-L328 HydrophobicContact CD1-CD1 3.64Å; F324-L328 HydrophobicContact CE1-CD1 4.08Å; F324-L328 CarbonylContact O-C 3.59Å; F324-L328 WeakPolarHBondContact O-CA 3.12Å; F324-L328 WeakPolarHBondContact O-CB 3.36Å; F324-L328 PolarHBondContact O-N 3.18Å; F324-G329 PolarHBondContact O-N 2.86Å; F324-W330 CarbonylContact C-O 3.6Å; F324-W330 HydrophobicContact CB-CB 4.36Å; F324-W330 HydrophobicContact CD1-CE3 4.04Å; F324-W330 PolarHBondContact O-N 2.82Å; F324-I333 HydrophobicContact CD1-CD1 3.78Å; F324-I333 HydrophobicContact CD2-CB 4.47Å; F324-I333 HydrophobicContact CD2-CG2 4.03Å; F324-I333 HydrophobicContact CE1-CD1 3.75Å; F324-I333 HydrophobicContact CE2-CG2 4.04Å; F324-I333 HydrophobicContact CG-CB 4.44Å; F324-I333 HydrophobicContact CG-CD1 4.27Å; F324-I333 HydrophobicContact CG-CG2 4.47Å; F324-I333 HydrophobicContact CZ-CD1 4.17Å; F324-P336 WeakPolarHBondContact CD2-O 2.76Å; F324-P336 HydrophobicContact CE2-CG 4.23Å; F324-P336 VanDerWaalsContact CE2-O 3.23Å; F324-P336 WeakPolarHBondContact CE2-O 3.5Å; F324-K337 WeakPolarHBondContact CD2-O 3.44Å; F324-K337 PolarHBondContact N-O 3.21Å; F324-Y339 HydrophobicContact CE1-CD1 4.34Å; F324-Y339 HydrophobicContact CE1-CE1 4.04Å; F324-Y339 HydrophobicContact CE2-CD1 4.1Å; F324-Y339 AromaticContact CZ-CD1 3.64Å; F324-Y339 HydrophobicContact CZ-CD1 3.64Å; F324-Y339 AromaticContact CZ-CE1 3.72Å; F324-Y339 HydrophobicContact CZ-CE1 3.72Å; F324-L386 HydrophobicContact CZ-CD2 4.08Å
325	K	89.6	Confident	87.4	Confident	142 Å²	142	43.4 Å²	43.4	62%	0.617	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-47.4	-177.8	-175.3	179.1	179	180	0	111.2	D323 G329 W330 K331	D323-K325 VanDerWaalsContact C-N 3.26Å; D323-K325 PolarHBondContact O-N 3.07Å; D323-K325 WeakPolarHBondContact OD1-CA 3.35Å; D323-K325 WeakPolarHBondContact OD1-CB 3.4Å; D323-K325 PolarHBondContact OD1-N 2.96Å; K325-G329 VanDerWaalsContact O-CA 3.24Å; K325-G329 WeakPolarHBondContact O-CA 3.38Å; K325-G329 PolarHBondContact O-N 2.86Å; K325-W330 WeakPolarHBondContact CA-O 3.45Å; K325-W330 PolarHBondContact N-O 3.34Å; K325-K331 HydrophobicContact CG-CG 4.47Å
326	R	89.6	Confident	88.2	Confident	167 Å²	167	43.4 Å²	43.4	63%	0.63	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-47.2	-175.6	-174.4	-172.3	65.2	-150.5	-9.6	112.5	D323	D323-R326 HydrophobicContact CB-CB 3.99Å; D323-R326 PolarHBondContact OD1-N 3.37Å
327	D	88.3	Confident	88.8	Confident	47 Å²	47	47.7 Å²	47.7	25%	0.251	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-29.4	-167.4	-53.1	-35.7	0	0	0	111.8	I37 I322 D323	I37-D327 HydrophobicContact CD1-CB 4.41Å; I322-D327 HydrophobicContact CG2-CB 4.25Å; D323-D327 PolarHBondContact N-OD2 3.34Å; D323-D327 WeakPolarHBondContact O-CB 3.35Å; D323-D327 PolarHBondContact O-N 2.93Å
328	L	87.6	Confident	89.2	Confident	1 Å²	1	48 Å²	48	1%	0.005	24%	0.236	C	C	.	.	S	Bend	trans	-107.9	-10.3	177.8	-69.2	167.3	0	0	0	114	I37 R41 I322 F324 W330	I37-L328 HydrophobicContact CG2-CD2 3.74Å; I37-L328 HydrophobicContact CG2-CG 4.27Å; R41-L328 HydrophobicContact CB-CD2 3.64Å; R41-L328 HydrophobicContact CG-CD2 3.98Å; R41-L328 PolarHBondContact NH2-O 2.96Å; I322-L328 HydrophobicContact CG2-CD1 3.98Å; I322-L328 HydrophobicContact CG2-CG 4.3Å; F324-L328 HydrophobicContact CD1-CD1 3.64Å; F324-L328 HydrophobicContact CE1-CD1 4.08Å; F324-L328 CarbonylContact O-C 3.59Å; F324-L328 WeakPolarHBondContact O-CA 3.12Å; F324-L328 WeakPolarHBondContact O-CB 3.36Å; F324-L328 PolarHBondContact O-N 3.18Å; L328-W330 HydrophobicContact CB-CB 4.38Å; L328-W330 HydrophobicContact CB-CD2 3.95Å; L328-W330 HydrophobicContact CB-CE3 4.27Å; L328-W330 HydrophobicContact CB-CG 3.97Å; L328-W330 HydrophobicContact CD1-CD2 4.44Å; L328-W330 HydrophobicContact CD1-CE3 3.95Å; L328-W330 HydrophobicContact CD1-CZ3 4.09Å; L328-W330 PolarHBondContact O-N 3.19Å
329	G	86.9	Confident	89.6	Confident	56 Å²	56	46.8 Å²	46.8	58%	0.577	23%	0.231	S	C	*	.			trans	66.9	15.6	-176.1	0	0	0	0	0	113.8	F324 K325	F324-G329 PolarHBondContact O-N 2.86Å; K325-G329 VanDerWaalsContact O-CA 3.24Å; K325-G329 WeakPolarHBondContact O-CA 3.38Å; K325-G329 PolarHBondContact O-N 2.86Å
330	W	89.5	Confident	89.8	Confident	14 Å²	14	48.1 Å²	48.1	5%	0.053	23%	0.23	C	C	.	.			trans	-93.9	126	-174.6	-69.9	-5.3	0	0	0	111.2	R41 I44 L45 F324 K325 L328 W332 I333	R41-W330 HydrophobicContact CB-CH2 4.49Å; R41-W330 HydrophobicContact CB-CZ2 4.4Å; R41-W330 HydrophobicContact CG-CH2 3.92Å; R41-W330 HydrophobicContact CG-CZ2 3.39Å; I44-W330 HydrophobicContact CB-CH2 3.97Å; I44-W330 HydrophobicContact CB-CZ3 3.93Å; I44-W330 HydrophobicContact CD1-CH2 4.41Å; I44-W330 HydrophobicContact CD1-CZ3 3.73Å; I44-W330 HydrophobicContact CG1-CZ3 4.42Å; I44-W330 HydrophobicContact CG2-CH2 4.04Å; I44-W330 HydrophobicContact CG2-CZ3 3.74Å; L45-W330 HydrophobicContact CD1-CZ2 4.06Å; L45-W330 HydrophobicContact CD2-CH2 4.23Å; L45-W330 HydrophobicContact CD2-CZ2 4.11Å; L45-W330 HydrophobicContact CG-CH2 3.95Å; L45-W330 HydrophobicContact CG-CZ2 3.91Å; F324-W330 CarbonylContact C-O 3.6Å; F324-W330 HydrophobicContact CB-CB 4.36Å; F324-W330 HydrophobicContact CD1-CE3 4.04Å; F324-W330 PolarHBondContact O-N 2.82Å; K325-W330 WeakPolarHBondContact CA-O 3.45Å; K325-W330 PolarHBondContact N-O 3.34Å; L328-W330 HydrophobicContact CB-CB 4.38Å; L328-W330 HydrophobicContact CB-CD2 3.95Å; L328-W330 HydrophobicContact CB-CE3 4.27Å; L328-W330 HydrophobicContact CB-CG 3.97Å; L328-W330 HydrophobicContact CD1-CD2 4.44Å; L328-W330 HydrophobicContact CD1-CE3 3.95Å; L328-W330 HydrophobicContact CD1-CZ3 4.09Å; L328-W330 PolarHBondContact O-N 3.19Å; W330-W332 AromaticContact CD1-NE1 3.59Å; W330-W332 AromaticContact CD2-CE2 3.93Å; W330-W332 AromaticContact CD2-CZ2 3.98Å; W330-W332 HydrophobicContact CD2-CZ2 3.98Å; W330-W332 AromaticContact CD2-NE1 3.36Å; W330-W332 AromaticContact CE2-NE1 3.8Å; W330-W332 AromaticContact CE3-CE2 3.99Å; W330-W332 AromaticContact CE3-CZ2 3.67Å; W330-W332 HydrophobicContact CE3-CZ2 3.67Å; W330-W332 AromaticContact CE3-NE1 3.87Å; W330-W332 AromaticContact CG-CD1 3.87Å; W330-W332 AromaticContact CG-NE1 3.19Å; W330-W332 HydrophobicContact CH2-CZ2 4.1Å; W330-W332 HydrophobicContact CZ2-CZ2 4.35Å; W330-W332 AromaticContact CZ3-CZ2 3.75Å; W330-W332 HydrophobicContact CZ3-CZ2 3.75Å; W330-W332 AromaticContact NE1-NE1 3.92Å; W330-I333 HydrophobicContact CE3-CD1 3.63Å; W330-I333 HydrophobicContact CE3-CG1 4.42Å; W330-I333 HydrophobicContact CZ3-CD1 3.93Å
331	K	87.1	Confident	89.8	Confident	120 Å²	120	47.5 Å²	47.5	52%	0.522	23%	0.227	S	C	.	.			trans	-112.5	-7	173.3	-58.2	178.2	-175.6	176.6	0	113.1	Y57 K325	Y57-K331 HydrophobicContact CE2-CB 3.83Å; K325-K331 HydrophobicContact CG-CG 4.47Å
332	W	88	Confident	89.8	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.008	21%	0.213	C	C	.	.	S	Bend	trans	-82.9	-14	-177	65.9	-90.2	0	0	0	113.6	I44 L45 L48 L50 P53 P54 Y57 W330 H334 Y390	I44-W332 HydrophobicContact CG2-CH2 4.26Å; L45-W332 HydrophobicContact CD2-CZ2 4.3Å; L48-W332 HydrophobicContact CD1-CH2 3.5Å; L48-W332 VanDerWaalsContact CD1-CH2 3.5Å; L48-W332 HydrophobicContact CD1-CZ3 3.88Å; L50-W332 HydrophobicContact CD1-CH2 4.38Å; L50-W332 HydrophobicContact CD1-CZ3 4.36Å; P53-W332 HydrophobicContact CB-CG 4.38Å; P54-W332 HydrophobicContact CG-CD2 4.34Å; P54-W332 HydrophobicContact CG-CE3 3.99Å; Y57-W332 HydrophobicContact CD1-CB 3.44Å; Y57-W332 VanDerWaalsContact CD1-CB 3.44Å; Y57-W332 HydrophobicContact CD2-CB 3.98Å; Y57-W332 HydrophobicContact CE1-CB 3.64Å; Y57-W332 HydrophobicContact CE2-CB 4.16Å; Y57-W332 HydrophobicContact CG-CB 3.63Å; W330-W332 AromaticContact CD1-NE1 3.59Å; W330-W332 AromaticContact CD2-CE2 3.93Å; W330-W332 AromaticContact CD2-CZ2 3.98Å; W330-W332 HydrophobicContact CD2-CZ2 3.98Å; W330-W332 AromaticContact CD2-NE1 3.36Å; W330-W332 AromaticContact CE2-NE1 3.8Å; W330-W332 AromaticContact CE3-CE2 3.99Å; W330-W332 AromaticContact CE3-CZ2 3.67Å; W330-W332 HydrophobicContact CE3-CZ2 3.67Å; W330-W332 AromaticContact CE3-NE1 3.87Å; W330-W332 AromaticContact CG-CD1 3.87Å; W330-W332 AromaticContact CG-NE1 3.19Å; W330-W332 HydrophobicContact CH2-CZ2 4.1Å; W330-W332 HydrophobicContact CZ2-CZ2 4.35Å; W330-W332 AromaticContact CZ3-CZ2 3.75Å; W330-W332 HydrophobicContact CZ3-CZ2 3.75Å; W330-W332 AromaticContact NE1-NE1 3.92Å; W332-H334 PolarHBondContact O-CE1 3.06Å; W332-H334 PolarHBondContact O-ND1 2.03Å; W332-Y390 AromaticContact CE3-CD2 3.97Å; W332-Y390 HydrophobicContact CE3-CD2 3.97Å; W332-Y390 HydrophobicContact CE3-CG 4.15Å; W332-Y390 AromaticContact CZ3-CD2 3.66Å; W332-Y390 HydrophobicContact CZ3-CD2 3.66Å; W332-Y390 HydrophobicContact CZ3-CE2 4.39Å; W332-Y390 AromaticContact CZ3-CG 3.77Å; W332-Y390 HydrophobicContact CZ3-CG 3.77Å; W332-Y390 WeakPolarHBondContact O-CB 3.39Å
333	I	89.6	Confident	89.5	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113.1	166.8	-60.2	-177.1	0	0	0	107.2	I44 F324 W330 I388	I44-I333 HydrophobicContact CG2-CD1 4.47Å; F324-I333 HydrophobicContact CD1-CD1 3.78Å; F324-I333 HydrophobicContact CD2-CB 4.47Å; F324-I333 HydrophobicContact CD2-CG2 4.03Å; F324-I333 HydrophobicContact CE1-CD1 3.75Å; F324-I333 HydrophobicContact CE2-CG2 4.04Å; F324-I333 HydrophobicContact CG-CB 4.44Å; F324-I333 HydrophobicContact CG-CD1 4.27Å; F324-I333 HydrophobicContact CG-CG2 4.47Å; F324-I333 HydrophobicContact CZ-CD1 4.17Å; W330-I333 HydrophobicContact CE3-CD1 3.63Å; W330-I333 HydrophobicContact CE3-CG1 4.42Å; W330-I333 HydrophobicContact CZ3-CD1 3.93Å; I333-I388 HydrophobicContact CD1-CD1 4.48Å; I333-I388 HydrophobicContact CG2-CB 4.38Å
334	H	89.3	Confident	89.2	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-45.6	-174.6	-63.9	60.3	0	0	0	110.7	P58 V63 W332 K337 L389 Y391	P58-H334 PolarHBondContact O-CE1 2.93Å; P58-H334 PolarHBondContact O-NE2 2.95Å; V63-H334 HydrophobicContact CG2-CB 4.19Å; V63-H334 WeakPolarHBondContact CG2-CD2 3.35Å; W332-H334 PolarHBondContact O-CE1 3.06Å; W332-H334 PolarHBondContact O-ND1 2.03Å; H334-K337 WeakPolarHBondContact O-CE 3.48Å; H334-K337 PolarHBondContact O-NZ 2.79Å; H334-L389 HydrophobicContact CB-CD2 4.44Å; H334-L389 HydrophobicContact CB-CG 4.28Å; H334-L389 PolarHBondContact N-O 2.9Å; H334-Y391 AromaticContact CE1-CD2 3.63Å; H334-Y391 AromaticContact ND1-CD2 3.92Å; H334-Y391 AromaticContact NE2-CD2 3.84Å
335	E	89.4	Confident	88.8	Confident	61 Å²	61	43.5 Å²	43.5	29%	0.285	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141.3	177.2	-72.3	-61.8	144.7	0	0	111.6	Y71 K337 I388 L389	Y71-E335 HydrophobicContact CD1-CB 3.95Å; Y71-E335 HydrophobicContact CD1-CG 4.33Å; Y71-E335 HydrophobicContact CD2-CB 4.26Å; Y71-E335 HydrophobicContact CE1-CB 3.59Å; Y71-E335 HydrophobicContact CE1-CG 4.15Å; Y71-E335 HydrophobicContact CE2-CB 3.93Å; Y71-E335 HydrophobicContact CG-CB 4.27Å; E335-K337 IonicContact OE1-NZ 3.67Å; E335-I388 CarbonylContact O-C 3.34Å; E335-I388 VanDerWaalsContact O-CA 3.29Å; E335-I388 WeakPolarHBondContact O-CA 3.47Å; E335-L389 HydrophobicContact CB-CB 4.18Å; E335-L389 PolarHBondContact N-O 3.16Å; E335-L389 PolarHBondContact O-N 2.85Å
336	P	92.3	Very high	88.2	Confident	18 Å²	18	37.4 Å²	37.4	12%	0.117	19%	0.191	C	C	.	.			cis	-74	165	-9.7	30.3	-30	0	0	0	111.5	Y71 F324 G338 L386 T387	Y71-P336 WeakPolarHBondContact OH-CB 3.38Å; Y71-P336 WeakPolarHBondContact OH-CD 3.26Å; F324-P336 WeakPolarHBondContact CD2-O 2.76Å; F324-P336 HydrophobicContact CE2-CG 4.23Å; F324-P336 VanDerWaalsContact CE2-O 3.23Å; F324-P336 WeakPolarHBondContact CE2-O 3.5Å; P336-G338 VanDerWaalsContact C-N 3.25Å; P336-G338 PolarHBondContact O-N 3.2Å; P336-L386 HydrophobicContact CG-CD1 4.03Å; P336-T387 WeakPolarHBondContact CD-O 2.99Å
337	K	90	Very high	87.4	Confident	95 Å²	95	31.8 Å²	31.8	41%	0.413	18%	0.18	S	C	.	.	S	Bend	trans	-69	-24.4	173.7	-58.4	-54.4	-179.1	-162.7	0	113.9	F324 H334 E335	F324-K337 WeakPolarHBondContact CD2-O 3.44Å; F324-K337 PolarHBondContact N-O 3.21Å; H334-K337 WeakPolarHBondContact O-CE 3.48Å; H334-K337 PolarHBondContact O-NZ 2.79Å; E335-K337 IonicContact OE1-NZ 3.67Å
338	G	91	Very high	86.5	Confident	10 Å²	10	30.3 Å²	30.3	10%	0.103	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.8	169.5	176.8	0	0	0	0	0	110.5	Y321 I322 P336	Y321-G338 VanDerWaalsContact OH-CA 3.31Å; Y321-G338 WeakPolarHBondContact OH-CA 3.34Å; I322-G338 CarbonylContact O-C 3.43Å; I322-G338 WeakPolarHBondContact O-CA 3.31Å; P336-G338 VanDerWaalsContact C-N 3.25Å; P336-G338 PolarHBondContact O-N 3.2Å
339	Y	93.1	Very high	85.3	Confident	12 Å²	12	32.6 Å²	32.6	5%	0.047	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	159.4	-176.3	75.5	-76	0	0	0	112.3	I40 Y321 I322 F324 A341 L386 M404 I405	I40-Y339 VanDerWaalsContact CG2-OH 3.26Å; I40-Y339 WeakPolarHBondContact CG2-OH 3.39Å; Y321-Y339 WeakPolarHBondContact CA-O 3.47Å; I322-Y339 HydrophobicContact CB-CE1 4.45Å; I322-Y339 PolarHBondContact N-O 2.99Å; I322-Y339 PolarHBondContact O-N 3.05Å; F324-Y339 HydrophobicContact CE1-CD1 4.34Å; F324-Y339 HydrophobicContact CE1-CE1 4.04Å; F324-Y339 HydrophobicContact CE2-CD1 4.1Å; F324-Y339 AromaticContact CZ-CD1 3.64Å; F324-Y339 HydrophobicContact CZ-CD1 3.64Å; F324-Y339 AromaticContact CZ-CE1 3.72Å; F324-Y339 HydrophobicContact CZ-CE1 3.72Å; Y339-A341 HydrophobicContact CD2-CB 4.19Å; Y339-A341 VanDerWaalsContact CE2-CA 3.46Å; Y339-A341 HydrophobicContact CE2-CB 3.48Å; Y339-A341 VanDerWaalsContact CE2-CB 3.48Å; Y339-A341 PolarHBondContact O-N 3.3Å; Y339-L386 HydrophobicContact CD1-CD2 3.59Å; Y339-L386 HydrophobicContact CD2-CD1 4.18Å; Y339-L386 HydrophobicContact CD2-CD2 3.97Å; Y339-L386 HydrophobicContact CE1-CD2 3.67Å; Y339-L386 HydrophobicContact CE2-CD2 4.02Å; Y339-L386 HydrophobicContact CG-CD1 3.96Å; Y339-L386 HydrophobicContact CG-CD2 3.75Å; Y339-L386 HydrophobicContact CG-CG 4.5Å; Y339-M404 HydrophobicContact CE2-CB 4.29Å; Y339-M404 VanDerWaalsContact OH-CE 3.3Å; Y339-M404 WeakPolarHBondContact OH-CE 3.44Å; Y339-I405 HydrophobicContact CD2-CD1 4.36Å; Y339-I405 HydrophobicContact CD2-CG1 3.75Å; Y339-I405 HydrophobicContact CE2-CG1 3.96Å
340	H	90.2	Very high	83.8	Confident	111 Å²	111	31.4 Å²	31.4	51%	0.514	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	91.9	173.6	-70.4	-76.6	0	0	0	110.2	L320 Y321 I405	L320-H340 CarbonylContact O-C 3.6Å; L320-H340 WeakPolarHBondContact O-CA 3.28Å; Y321-H340 AromaticContact CD2-CD2 3.9Å; Y321-H340 AromaticContact CD2-CE1 3.61Å; Y321-H340 AromaticContact CD2-CG 3.97Å; Y321-H340 AromaticContact CD2-ND1 3.79Å; Y321-H340 AromaticContact CD2-NE2 3.68Å; H340-I405 WeakPolarHBondContact O-CG2 2.9Å
341	A	88.7	Confident	81.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.			trans	-70.7	-36.6	177.8	0	0	0	0	0	112.3	I40 L320 I322 Y339 V406	I40-A341 HydrophobicContact CD1-CB 3.57Å; L320-A341 PolarHBondContact O-N 2.03Å; I322-A341 HydrophobicContact CD1-CB 3.62Å; I322-A341 HydrophobicContact CG1-CB 4.12Å; Y339-A341 HydrophobicContact CD2-CB 4.19Å; Y339-A341 VanDerWaalsContact CE2-CA 3.46Å; Y339-A341 HydrophobicContact CE2-CB 3.48Å; Y339-A341 VanDerWaalsContact CE2-CB 3.48Å; Y339-A341 PolarHBondContact O-N 3.3Å; A341-V406 PolarHBondContact O-N 3.15Å
342	N	90.2	Very high	80.2	Confident	13 Å²	13	39.1 Å²	39.1	7%	0.07	20%	0.204	C	C	.	.			trans	54.3	167.5	-171.1	-52.3	-30.7	0	0	0	113.2	R36 L317 R318 P319 L320 V406	R36-N342 PolarHBondContact NE-O 3.25Å; L317-N342 HydrophobicContact CD1-CB 3.82Å; L317-N342 HydrophobicContact CG-CB 4.23Å; R318-N342 VanDerWaalsContact O-CA 3.28Å; R318-N342 WeakPolarHBondContact O-CA 3.49Å; R318-N342 WeakPolarHBondContact O-CB 3.15Å; P319-N342 WeakPolarHBondContact CA-OD1 3.38Å; L320-N342 PolarHBondContact N-OD1 3.17Å; L320-N342 PolarHBondContact O-N 3.22Å; L320-N342 VanDerWaalsContact O-N 3.17Å; N342-V406 HydrophobicContact CB-CB 4.16Å; N342-V406 PolarHBondContact ND2-O 3.01Å
343	F	86.8	Confident	78.3	Confident	10 Å²	10	39.6 Å²	39.6	4%	0.044	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	161.8	173.8	65.6	-77	0	0	0	111.4	M29 F32 M33 R36 R318 L320 A345	M29-F343 HydrophobicContact CE-CE2 3.79Å; M29-F343 HydrophobicContact CE-CZ 3.6Å; F32-F343 HydrophobicContact CB-CE2 4.08Å; M33-F343 HydrophobicContact CG-CE1 3.74Å; M33-F343 HydrophobicContact CG-CZ 3.77Å; M33-F343 HydrophobicContact SD-CE1 4.43Å; R36-F343 HydrophobicContact CG-CB 4.14Å; R318-F343 HydrophobicContact CB-CD1 3.94Å; R318-F343 HydrophobicContact CB-CD2 4.27Å; R318-F343 HydrophobicContact CB-CE1 3.59Å; R318-F343 HydrophobicContact CB-CE2 3.95Å; R318-F343 HydrophobicContact CB-CG 4.28Å; R318-F343 HydrophobicContact CB-CZ 3.61Å; R318-F343 HydrophobicContact CG-CE2 4.16Å; R318-F343 HydrophobicContact CG-CZ 4.18Å; R318-F343 PolarHBondContact N-O 3.4Å; R318-F343 PolarHBondContact O-N 3.09Å; L320-F343 HydrophobicContact CB-CD1 3.65Å; L320-F343 HydrophobicContact CB-CE1 3.93Å; L320-F343 HydrophobicContact CD2-CD1 3.95Å; L320-F343 HydrophobicContact CD2-CE1 4.44Å; L320-F343 HydrophobicContact CG-CD1 4.39Å; F343-A345 HydrophobicContact CD2-CB 3.88Å; F343-A345 HydrophobicContact CE2-CB 3.64Å
344	C	84.1	Confident	76.4	Confident	22 Å²	22	43.5 Å²	43.5	15%	0.149	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.9	175.6	-62.8	0	0	0	0	109.4	S380 C409	C344-S380 VanDerWaalsContact SG-CA 3.56Å; C344-C409 WeakPolarHBondContact CA-SG 3.46Å; C344-C409 HydrophobicContact CB-CB 3.73Å; C344-C409 WeakPolarHBondContact CB-SG 3.44Å; C344-C409 WeakPolarHBondContact SG-CA 3.49Å; C344-C409 WeakPolarHBondContact SG-CB 3.42Å; C344-C409 CovalentContact SG-SG 2.03Å; C344-C409 PolarHBondContact SG-SG 3.37Å
345	A	83.3	Confident	74.7	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.033	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	148	174.9	0	0	0	0	0	111.5	L27 M29 C316 R318 F343	L27-A345 HydrophobicContact CD2-CB 4.29Å; M29-A345 HydrophobicContact CE-CB 4.28Å; M29-A345 HydrophobicContact SD-CB 4.38Å; C316-A345 PolarHBondContact N-O 3.13Å; C316-A345 VanDerWaalsContact N-O 3.08Å; C316-A345 PolarHBondContact O-N 3.4Å; C316-A345 VanDerWaalsContact O-O 3.13Å; R318-A345 HydrophobicContact CG-CB 4.11Å; F343-A345 HydrophobicContact CD2-CB 3.88Å; F343-A345 HydrophobicContact CE2-CB 3.64Å
346	G	77.9	Confident	73.1	Confident	14 Å²	14	49.4 Å²	49.4	14%	0.144	27%	0.272	C	S	.	.	S	Bend	trans	133.9	165.3	179.3	0	0	0	0	0	112.2	D313	D313-G346 WeakPolarHBondContact O-CA 3.32Å
347	A	72.8	Confident	71.3	Confident	49 Å²	49	56.5 Å²	56.5	41%	0.405	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-71.5	142	-179.5	0	0	0	0	0	111.8	D313 N314 C315 P349	D313-A347 WeakPolarHBondContact O-CB 3.39Å; D313-A347 PolarHBondContact O-N 2.9Å; N314-A347 CarbonylContact C-O 3.53Å; N314-A347 VanDerWaalsContact CA-O 3.25Å; N314-A347 WeakPolarHBondContact CA-O 2.99Å; C315-A347 PolarHBondContact N-O 2.94Å; A347-P349 WeakPolarHBondContact O-CD 3.37Å
348	C	68.9	Low	69.7	Low	16 Å²	16	59.2 Å²	59.2	11%	0.108	32%	0.317	C	S	.	.			trans	-112	94.9	172.4	-78.3	0	0	0	0	109.1	C315 P376 C411	C315-C348 WeakPolarHBondContact CB-SG 3.47Å; C348-P376 HydrophobicContact CB-CB 4.08Å; C348-P376 HydrophobicContact CB-CG 3.83Å; C348-P376 VanDerWaalsContact CB-O 3.25Å; C348-P376 WeakPolarHBondContact CB-O 3.47Å; C348-P376 WeakPolarHBondContact O-CG 3.38Å; C348-C411 VanDerWaalsContact CA-SG 3.55Å; C348-C411 HydrophobicContact CB-CB 3.65Å; C348-C411 WeakPolarHBondContact CB-SG 3.36Å; C348-C411 WeakPolarHBondContact SG-CA 3.49Å; C348-C411 WeakPolarHBondContact SG-CB 2.99Å; C348-C411 CovalentContact SG-SG 2.03Å; C348-C411 PolarHBondContact SG-SG 3.2Å
349	P	62.9	Low	67.8	Low	50 Å²	50	59.5 Å²	59.5	33%	0.325	32%	0.317	S	S	.	.			trans	-68	141.8	172	26.4	-31.2	0	0	0	110.4	A347 L351 W352	A347-P349 WeakPolarHBondContact O-CD 3.37Å; P349-L351 PolarHBondContact O-N 2.03Å; P349-W352 HydrophobicContact CG-CD2 4.34Å; P349-W352 HydrophobicContact CG-CG 4.23Å; P349-W352 PolarHBondContact O-N 3.04Å
350	Y	55.3	Low	66.1	Low	30 Å²	30	66.5 Å²	66.5	12%	0.118	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-59.9	-22.2	-173.5	-80.7	-105.1	0	0	0	114.8	W352 S353 L362 N366 S373 A374 S375	Y350-W352 PolarHBondContact O-N 3.45Å; Y350-S353 PolarHBondContact O-N 2.79Å; Y350-S353 PolarHBondContact O-OG 2.03Å; Y350-S353 VanDerWaalsContact O-OG 3.11Å; Y350-L362 HydrophobicContact CE1-CD2 4.32Å; Y350-N366 HydrophobicContact CD1-CB 4.32Å; Y350-N366 WeakPolarHBondContact CD2-ND2 3Å; Y350-N366 HydrophobicContact CE1-CB 4.19Å; Y350-N366 WeakPolarHBondContact CE2-ND2 3.5Å; Y350-N366 VanDerWaalsContact CG-ND2 3.35Å; Y350-N366 VanDerWaalsContact CZ-ND2 3.28Å; Y350-S373 WeakPolarHBondContact CE1-OG 2.97Å; Y350-S373 VanDerWaalsContact OH-CB 3.28Å; Y350-S373 WeakPolarHBondContact OH-CB 3.04Å; Y350-S373 PolarHBondContact OH-O 2.69Å; Y350-S373 PolarHBondContact OH-OG 2.84Å; Y350-A374 WeakPolarHBondContact CE1-O 3.45Å; Y350-A374 VanDerWaalsContact CZ-O 3.29Å; Y350-A374 PolarHBondContact OH-N 3.31Å; Y350-A374 PolarHBondContact OH-O 3.26Å; Y350-S375 WeakPolarHBondContact OH-CA 3.41Å; Y350-S375 PolarHBondContact OH-N 3.31Å; Y350-S375 VanDerWaalsContact OH-N 3.13Å
351	L	49.7	Very low	64.5	Low	162 Å²	162	65.5 Å²	65.5	85%	0.848	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-69.5	-15.1	175.3	-83.6	97.5	0	0	0	113.5	P349	P349-L351 PolarHBondContact O-N 2.03Å
352	W	50.1	Low	62.8	Low	135 Å²	135	69 Å²	69	51%	0.511	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-96	-5.6	-179.3	-71.9	18.1	0	0	0	113.3	N314 P349 Y350	N314-W352 HydrophobicContact CB-CH2 4.21Å; N314-W352 HydrophobicContact CB-CZ3 3.85Å; N314-W352 WeakPolarHBondContact ND2-CH2 3.47Å; P349-W352 HydrophobicContact CG-CD2 4.34Å; P349-W352 HydrophobicContact CG-CG 4.23Å; P349-W352 PolarHBondContact O-N 3.04Å; Y350-W352 PolarHBondContact O-N 3.45Å
353	S	48.5	Very low	61.1	Low	12 Å²	12	70.4 Å²	70.4	8%	0.084	37%	0.374	C	S	.	.			trans	-98.5	71.5	174.8	65.5	0	0	0	0	111.3	Y350 D355 S359	Y350-S353 PolarHBondContact O-N 2.79Å; Y350-S353 PolarHBondContact O-OG 2.03Å; Y350-S353 VanDerWaalsContact O-OG 3.11Å; S353-D355 VanDerWaalsContact C-N 3.27Å; S353-D355 PolarHBondContact O-N 3.08Å; S353-S359 WeakPolarHBondContact O-CB 3.41Å; S353-S359 PolarHBondContact O-OG 3.48Å
354	S	50.7	Low	59.7	Low	87 Å²	87	75.2 Å²	75.2	61%	0.608	40%	0.4	S	S	*	.			trans	-90.9	16.1	176	61.9	0	0	0	0	113.7	T356	S354-T356 PolarHBondContact O-N 2.81Å
355	D	53.2	Low	58.3	Low	112 Å²	112	80.4 Å²	80.4	60%	0.599	42%	0.417	S	S	*	.	S	Bend	trans	-79.5	-15.4	-163.4	-126.9	8.6	0	0	0	114.3	S353 S359 K410	S353-D355 VanDerWaalsContact C-N 3.27Å; S353-D355 PolarHBondContact O-N 3.08Å; D355-S359 PolarHBondContact N-OG 3.17Å; D355-K410 IonicContact OD2-NZ 3.83Å; D355-K410 PolarHBondContact OD2-NZ 3.49Å
356	T	55.4	Low	56.8	Low	76 Å²	76	82 Å²	82	47%	0.466	43%	0.425	S	S	.	.	S	Bend	trans	-142.7	159.2	175.6	64	0	0	0	0	113.4	S354 H358 S359 R360	S354-T356 PolarHBondContact O-N 2.81Å; T356-H358 PolarHBondContact O-N 3.44Å; T356-S359 PolarHBondContact N-OG 2.7Å; T356-S359 VanDerWaalsContact N-OG 3.1Å; T356-S359 PolarHBondContact O-N 2.86Å; T356-S359 VanDerWaalsContact O-N 3.12Å; T356-S359 PolarHBondContact O-OG 2.94Å; T356-S359 PolarHBondContact OG1-N 3.05Å; T356-R360 PolarHBondContact O-N 3.22Å
357	Q	54.8	Low	56	Low	166 Å²	166	87 Å²	87	78%	0.776	45%	0.453	S	S	*	.	H	α-helix	trans	-58.1	-31.5	170.1	-74.1	-176.2	-21.4	0	0	111.7	V361	Q357-V361 WeakPolarHBondContact O-CG2 3.42Å; Q357-V361 PolarHBondContact O-N 3.1Å
358	H	55.9	Low	55.3	Low	153 Å²	153	90.7 Å²	90.7	71%	0.708	47%	0.465	S	S	*	.	H	α-helix	trans	-67.7	-36.9	174.1	-72.4	-75.3	0	0	0	113.3	T356 R360 V361 L362	T356-H358 PolarHBondContact O-N 3.44Å; H358-R360 VanDerWaalsContact C-N 3.33Å; H358-R360 PolarHBondContact O-N 3.13Å; H358-V361 PolarHBondContact O-N 3.42Å; H358-L362 PolarHBondContact O-N 3.5Å
359	S	52	Low	54.5	Low	15 Å²	15	93.9 Å²	93.9	11%	0.105	48%	0.48	C	S	.	.	H	α-helix	trans	-71.2	-28.1	179.5	69.8	0	0	0	0	112.9	S353 D355 T356 S363	S353-S359 WeakPolarHBondContact O-CB 3.41Å; S353-S359 PolarHBondContact O-OG 3.48Å; D355-S359 PolarHBondContact N-OG 3.17Å; T356-S359 PolarHBondContact N-OG 2.7Å; T356-S359 VanDerWaalsContact N-OG 3.1Å; T356-S359 PolarHBondContact O-N 2.86Å; T356-S359 VanDerWaalsContact O-N 3.12Å; T356-S359 PolarHBondContact O-OG 2.94Å; T356-S359 PolarHBondContact OG1-N 3.05Å; S359-S363 WeakPolarHBondContact O-CB 3.35Å; S359-S363 PolarHBondContact O-N 3.11Å; S359-S363 PolarHBondContact O-OG 3.42Å
360	R	56.3	Low	54.2	Low	160 Å²	160	96 Å²	96	60%	0.604	49%	0.494	S	S	*	.	H	α-helix	trans	-66.2	-44.3	169.2	-65.7	-177.9	-177.3	177.7	-0.8	111.8	T356 H358 S363 L364	T356-R360 PolarHBondContact O-N 3.22Å; H358-R360 VanDerWaalsContact C-N 3.33Å; H358-R360 PolarHBondContact O-N 3.13Å; R360-S363 PolarHBondContact O-N 2.9Å; R360-S363 PolarHBondContact O-OG 3.12Å; R360-L364 WeakPolarHBondContact O-CG 2.8Å; R360-L364 PolarHBondContact O-N 3.27Å
361	V	57.1	Low	54	Low	90 Å²	90	102.7 Å²	102.7	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-64.9	-42.3	176.7	176.3	0	0	0	0	110.8	Q357 H358 S363 L364 Y365	Q357-V361 WeakPolarHBondContact O-CG2 3.42Å; Q357-V361 PolarHBondContact O-N 3.1Å; H358-V361 PolarHBondContact O-N 3.42Å; V361-S363 PolarHBondContact O-N 2.88Å; V361-L364 PolarHBondContact O-N 2.76Å; V361-Y365 PolarHBondContact O-N 3.45Å
362	L	53.8	Low	53.7	Low	73 Å²	73	98.4 Å²	98.4	38%	0.382	51%	0.514	S	S	.	.	H	α-helix	trans	-62.1	-42.4	175.2	-120.6	78.5	0	0	0	112.2	Y350 H358 L364 Y365 N366 A374	Y350-L362 HydrophobicContact CE1-CD2 4.32Å; H358-L362 PolarHBondContact O-N 3.5Å; L362-L364 VanDerWaalsContact C-N 3.26Å; L362-L364 PolarHBondContact O-N 3.19Å; L362-Y365 PolarHBondContact O-N 3.36Å; L362-Y365 VanDerWaalsContact O-N 3.16Å; L362-N366 WeakPolarHBondContact O-CB 3.27Å; L362-N366 PolarHBondContact O-N 2.9Å; L362-A374 HydrophobicContact CD2-CB 4.27Å; L362-A374 WeakPolarHBondContact CD2-O 3.39Å
363	S	53.4	Low	53.8	Low	42 Å²	42	93 Å²	93	29%	0.294	50%	0.498	S	S	.	.	H	α-helix	trans	-61.7	-33.4	177.4	69.9	0	0	0	0	113.3	S359 R360 V361	S359-S363 WeakPolarHBondContact O-CB 3.35Å; S359-S363 PolarHBondContact O-N 3.11Å; S359-S363 PolarHBondContact O-OG 3.42Å; R360-S363 PolarHBondContact O-N 2.9Å; R360-S363 PolarHBondContact O-OG 3.12Å; V361-S363 PolarHBondContact O-N 2.88Å
364	L	57.1	Low	54.2	Low	112 Å²	112	95.8 Å²	95.8	59%	0.586	52%	0.521	S	S	*	.	H	α-helix	trans	-75.6	-36.9	174.6	-70.4	167.4	0	0	0	111.7	R360 V361 L362 N366 T367 I368	R360-L364 WeakPolarHBondContact O-CG 2.8Å; R360-L364 PolarHBondContact O-N 3.27Å; V361-L364 PolarHBondContact O-N 2.76Å; L362-L364 VanDerWaalsContact C-N 3.26Å; L362-L364 PolarHBondContact O-N 3.19Å; L364-N366 VanDerWaalsContact C-N 3.25Å; L364-N366 PolarHBondContact O-N 3.43Å; L364-T367 PolarHBondContact O-N 3.15Å; L364-T367 PolarHBondContact O-OG1 3.47Å; L364-I368 WeakPolarHBondContact O-CG1 3.11Å
365	Y	54.3	Low	54.6	Low	131 Å²	131	94.5 Å²	94.5	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-65.1	-32.7	177.1	-141.7	-99.3	0	0	0	112	V361 L362 T367 I368 N369	V361-Y365 PolarHBondContact O-N 3.45Å; L362-Y365 PolarHBondContact O-N 3.36Å; L362-Y365 VanDerWaalsContact O-N 3.16Å; Y365-T367 VanDerWaalsContact C-N 3.34Å; Y365-T367 PolarHBondContact O-N 2.74Å; Y365-I368 CarbonylContact O-C 3.54Å; Y365-I368 PolarHBondContact O-N 3.26Å; Y365-N369 PolarHBondContact O-N 3.36Å
366	N	53.7	Low	55.2	Low	37 Å²	37	90 Å²	90	20%	0.198	49%	0.489	C	S	.	.	H	α-helix	trans	-67.6	-30.9	178.6	-152.4	31.7	0	0	0	113.4	Y350 L362 L364 I368 S373	Y350-N366 HydrophobicContact CD1-CB 4.32Å; Y350-N366 WeakPolarHBondContact CD2-ND2 3Å; Y350-N366 HydrophobicContact CE1-CB 4.19Å; Y350-N366 WeakPolarHBondContact CE2-ND2 3.5Å; Y350-N366 VanDerWaalsContact CG-ND2 3.35Å; Y350-N366 VanDerWaalsContact CZ-ND2 3.28Å; L362-N366 WeakPolarHBondContact O-CB 3.27Å; L362-N366 PolarHBondContact O-N 2.9Å; L364-N366 VanDerWaalsContact C-N 3.25Å; L364-N366 PolarHBondContact O-N 3.43Å; N366-I368 VanDerWaalsContact C-N 3.26Å; N366-I368 PolarHBondContact O-N 3.31Å; N366-S373 WeakPolarHBondContact OD1-CB 3.28Å; N366-S373 PolarHBondContact OD1-OG 3.2Å
367	T	59.4	Low	56	Low	118 Å²	118	90 Å²	90	72%	0.724	49%	0.491	S	S	*	.	H	α-helix	trans	-70.3	-20.9	169.3	17.3	0	0	0	0	113.6	L364 Y365	L364-T367 PolarHBondContact O-N 3.15Å; L364-T367 PolarHBondContact O-OG1 3.47Å; Y365-T367 VanDerWaalsContact C-N 3.34Å; Y365-T367 PolarHBondContact O-N 2.74Å
368	I	59.7	Low	57.1	Low	127 Å²	127	83.3 Å²	83.3	65%	0.651	46%	0.462	S	S	*	.	H	α-helix	trans	-96.9	-35.5	-176.4	-61.1	167.5	0	0	0	110.7	L364 Y365 N366	L364-I368 WeakPolarHBondContact O-CG1 3.11Å; Y365-I368 CarbonylContact O-C 3.54Å; Y365-I368 PolarHBondContact O-N 3.26Å; N366-I368 VanDerWaalsContact C-N 3.26Å; N366-I368 PolarHBondContact O-N 3.31Å
369	N	52	Low	58.3	Low	83 Å²	83	78.4 Å²	78.4	44%	0.444	44%	0.443	S	S	.	.			trans	-151.6	83.8	-178.9	-130.9	-17.2	0	0	0	111.9	Y365 E371 A372	Y365-N369 PolarHBondContact O-N 3.36Å; N369-E371 VanDerWaalsContact C-N 3.26Å; N369-E371 PolarHBondContact O-N 3.46Å; N369-A372 HydrophobicContact CB-CB 4.31Å; N369-A372 PolarHBondContact O-N 2.96Å
370	P	56.5	Low	59.6	Low	94 Å²	94	79.9 Å²	79.9	61%	0.61	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.9	-174.1	22.8	-31	0	0	0	114.1
371	E	50	Low	60.5	Low	171 Å²	171	73.6 Å²	73.6	80%	0.799	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-15.1	177.2	-67	-163.9	150.3	0	0	113.9	N369	N369-E371 VanDerWaalsContact C-N 3.26Å; N369-E371 PolarHBondContact O-N 3.46Å
372	A	44.5	Very low	61.3	Low	72 Å²	72	73.1 Å²	73.1	60%	0.595	43%	0.426	S	S	*	.	S	Bend	trans	-108.8	3.8	-175.4	0	0	0	0	0	114.2	N369	N369-A372 HydrophobicContact CB-CB 4.31Å; N369-A372 PolarHBondContact O-N 2.96Å
373	S	52.4	Low	62.5	Low	23 Å²	23	71.1 Å²	71.1	16%	0.161	42%	0.415	C	S	.	.			trans	-103.5	135.4	-171.8	-172	0	0	0	0	112.9	Y350 N366 S375	Y350-S373 WeakPolarHBondContact CE1-OG 2.97Å; Y350-S373 VanDerWaalsContact OH-CB 3.28Å; Y350-S373 WeakPolarHBondContact OH-CB 3.04Å; Y350-S373 PolarHBondContact OH-O 2.69Å; Y350-S373 PolarHBondContact OH-OG 2.84Å; N366-S373 WeakPolarHBondContact OD1-CB 3.28Å; N366-S373 PolarHBondContact OD1-OG 3.2Å; S373-S375 PolarHBondContact O-N 3.07Å
374	A	56.3	Low	63.7	Low	70 Å²	70	72.2 Å²	72.2	58%	0.579	42%	0.415	S	S	*	.			trans	-77.5	113.3	178.5	0	0	0	0	0	111.7	Y350 L362	Y350-A374 WeakPolarHBondContact CE1-O 3.45Å; Y350-A374 VanDerWaalsContact CZ-O 3.29Å; Y350-A374 PolarHBondContact OH-N 3.31Å; Y350-A374 PolarHBondContact OH-O 3.26Å; L362-A374 HydrophobicContact CD2-CB 4.27Å; L362-A374 WeakPolarHBondContact CD2-O 3.39Å
375	S	58.2	Low	65	Low	60 Å²	60	68.1 Å²	68.1	42%	0.42	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-72.5	137.4	-179.1	53.7	0	0	0	0	112.2	Y350 S373	Y350-S375 WeakPolarHBondContact OH-CA 3.41Å; Y350-S375 PolarHBondContact OH-N 3.31Å; Y350-S375 VanDerWaalsContact OH-N 3.13Å; S373-S375 PolarHBondContact O-N 3.07Å
376	P	66	Low	66.6	Low	16 Å²	16	62.5 Å²	62.5	10%	0.104	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-64.8	144.8	177.4	23.4	-29	0	0	0	110.6	C348 C411	C348-P376 HydrophobicContact CB-CB 4.08Å; C348-P376 HydrophobicContact CB-CG 3.83Å; C348-P376 VanDerWaalsContact CB-O 3.25Å; C348-P376 WeakPolarHBondContact CB-O 3.47Å; C348-P376 WeakPolarHBondContact O-CG 3.38Å; P376-C411 HydrophobicContact CB-CB 4.43Å
377	C	72.9	Confident	68.2	Low	76 Å²	76	61.3 Å²	61.3	51%	0.514	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-102.2	144.9	-177.5	-72.9	0	0	0	0	111.6	V379 C411 S412	C377-V379 HydrophobicContact CB-CG1 4.14Å; C377-V379 PolarHBondContact O-N 2.98Å; C377-C411 WeakPolarHBondContact O-CA 3.45Å; C377-S412 PolarHBondContact N-O 3.08Å; C377-S412 PolarHBondContact O-N 3.03Å
378	C	77.1	Confident	69.7	Low	26 Å²	26	55.7 Å²	55.7	18%	0.176	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	107.3	173.1	-171.1	0	0	0	0	110.2	C315	C315-C378 WeakPolarHBondContact CA-SG 3.39Å; C315-C378 HydrophobicContact CB-CB 3.59Å; C315-C378 WeakPolarHBondContact CB-SG 3.02Å; C315-C378 WeakPolarHBondContact SG-CA 3.43Å; C315-C378 WeakPolarHBondContact SG-CB 2.99Å; C315-C378 CovalentContact SG-SG 2.03Å; C315-C378 PolarHBondContact SG-SG 3.3Å
379	V	81.1	Confident	71.1	Confident	50 Å²	50	49.7 Å²	49.7	30%	0.303	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	155.1	-173.6	-60.6	0	0	0	0	112.4	C377 C409 K410 S412	C377-V379 HydrophobicContact CB-CG1 4.14Å; C377-V379 PolarHBondContact O-N 2.98Å; V379-C409 CarbonylContact O-C 3.59Å; V379-C409 WeakPolarHBondContact O-CA 3.38Å; V379-K410 HydrophobicContact CG2-CG 3.86Å; V379-K410 PolarHBondContact N-O 3.27Å; V379-K410 PolarHBondContact O-N 3.5Å; V379-S412 VanDerWaalsContact CG2-OG 3.28Å; V379-S412 WeakPolarHBondContact CG2-OG 3.29Å
380	S	80.9	Confident	73	Confident	47 Å²	47	45.9 Å²	45.9	33%	0.329	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	134.9	174.7	56.1	0	0	0	0	111.6	C344	C344-S380 VanDerWaalsContact SG-CA 3.56Å
381	Q	73.4	Confident	74.3	Confident	28 Å²	28	41.8 Å²	41.8	13%	0.131	26%	0.255	C	S	.	.			trans	-105.9	-68.9	175.5	169.2	164	-6.7	0	0	111.4	K299 S408 K410	K299-Q381 PolarHBondContact O-NE2 2.96Å; Q381-S408 WeakPolarHBondContact CB-OG 3.49Å; Q381-S408 PolarHBondContact N-O 3Å; Q381-K410 HydrophobicContact CB-CB 4.45Å; Q381-K410 HydrophobicContact CB-CD 4.15Å; Q381-K410 HydrophobicContact CB-CG 4.16Å; Q381-K410 HydrophobicContact CG-CD 4.47Å
382	D	74.1	Confident	75.9	Confident	80 Å²	80	37.2 Å²	37.2	43%	0.428	24%	0.235	S	C	.	.	S	Bend	trans	-93.9	129.7	179.7	-56.3	-43.2	0	0	0	109.1	K407 S408	D382-K407 HydrophobicContact CB-CB 4.06Å; D382-K407 PolarHBondContact O-N 3.27Å; D382-S408 WeakPolarHBondContact CB-OG 3Å; D382-S408 PolarHBondContact N-OG 3.21Å; D382-S408 PolarHBondContact O-N 3.46Å; D382-S408 WeakPolarHBondContact OD2-CB 3.49Å; D382-S408 PolarHBondContact OD2-OG 3.34Å
383	L	80.5	Confident	77.7	Confident	31 Å²	31	35.2 Å²	35.2	16%	0.162	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.2	-178.2	-65.6	148.4	0	0	0	109.6	R93 N403 I405 V406	R93-L383 PolarHBondContact NH1-O 2.81Å; R93-L383 PolarHBondContact NH2-O 2.98Å; R93-L383 VanDerWaalsContact NH2-O 3.16Å; L383-N403 HydrophobicContact CB-CB 4.1Å; L383-N403 HydrophobicContact CD1-CB 3.99Å; L383-N403 HydrophobicContact CG-CB 4.5Å; L383-I405 CarbonylContact C-O 3.51Å; L383-I405 WeakPolarHBondContact CA-O 3.17Å; L383-V406 HydrophobicContact CD2-CB 4.37Å; L383-V406 HydrophobicContact CD2-CG2 3.83Å
384	E	78.2	Confident	79	Confident	64 Å²	64	43.9 Å²	43.9	30%	0.299	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	152.7	174.9	-90.3	-178.8	-167.8	0	0	111.5	M404 I405 K407	E384-M404 PolarHBondContact O-N 3.34Å; E384-I405 HydrophobicContact CB-CB 3.87Å; E384-I405 HydrophobicContact CB-CD1 4.4Å; E384-I405 HydrophobicContact CB-CG2 4.2Å; E384-I405 PolarHBondContact N-O 3.13Å; E384-I405 PolarHBondContact O-N 3.42Å; E384-K407 HydrophobicContact CB-CG 4.48Å; E384-K407 HydrophobicContact CG-CG 4.04Å; E384-K407 WeakPolarHBondContact OE1-CE 3.5Å; E384-K407 IonicContact OE1-NZ 3.81Å; E384-K407 WeakPolarHBondContact OE2-CE 3.32Å; E384-K407 IonicContact OE2-NZ 2.75Å; E384-K407 PolarHBondContact OE2-NZ 3.32Å
385	P	82.9	Confident	80.1	Confident	26 Å²	26	44.2 Å²	44.2	17%	0.169	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	157.1	176.4	34.5	-25.2	0	0	0	110.7	Q400 L401	P385-Q400 HydrophobicContact CB-CG 3.86Å; P385-Q400 HydrophobicContact CG-CG 4.4Å; P385-Q400 VanDerWaalsContact CG-NE2 3.3Å; P385-L401 CarbonylContact C-O 3.58Å; P385-L401 WeakPolarHBondContact CA-O 3.05Å; P385-L401 WeakPolarHBondContact CB-O 3.28Å
386	L	87.9	Confident	81.5	Confident	14 Å²	14	44.2 Å²	44.2	7%	0.073	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120.7	175.1	177.4	69.7	0	0	0	109.6	F324 P336 Y339 I388 L401 M404 I405	F324-L386 HydrophobicContact CZ-CD2 4.08Å; P336-L386 HydrophobicContact CG-CD1 4.03Å; Y339-L386 HydrophobicContact CD1-CD2 3.59Å; Y339-L386 HydrophobicContact CD2-CD1 4.18Å; Y339-L386 HydrophobicContact CD2-CD2 3.97Å; Y339-L386 HydrophobicContact CE1-CD2 3.67Å; Y339-L386 HydrophobicContact CE2-CD2 4.02Å; Y339-L386 HydrophobicContact CG-CD1 3.96Å; Y339-L386 HydrophobicContact CG-CD2 3.75Å; Y339-L386 HydrophobicContact CG-CG 4.5Å; L386-I388 HydrophobicContact CD2-CG2 3.93Å; L386-I388 HydrophobicContact CG-CG2 3.96Å; L386-L401 PolarHBondContact N-O 2.97Å; L386-L401 WeakPolarHBondContact O-CA 3.19Å; L386-L401 WeakPolarHBondContact O-CB 3.49Å; L386-L401 PolarHBondContact O-N 2.81Å; L386-M404 HydrophobicContact CB-CB 3.7Å; L386-M404 HydrophobicContact CB-CG 3.96Å; L386-I405 HydrophobicContact CD1-CD1 4.49Å
387	T	87.9	Confident	82.4	Confident	12 Å²	12	46.2 Å²	46.2	7%	0.074	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.5	171.6	-53.4	0	0	0	0	109.8	Y71 T74 L78 P336 I398 E399	Y71-T387 HydrophobicContact CD2-CG2 4.2Å; Y71-T387 HydrophobicContact CE2-CG2 4.23Å; T74-T387 HydrophobicContact CG2-CG2 3.99Å; L78-T387 WeakPolarHBondContact CD1-OG1 3.44Å; P336-T387 WeakPolarHBondContact CD-O 2.99Å; T387-I398 HydrophobicContact CG2-CG2 3.97Å; T387-E399 WeakPolarHBondContact CA-O 3.37Å
388	I	90.8	Very high	83	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.5	177.2	64.1	163.2	0	0	0	111.4	L48 I333 E335 L386 Y390 I398 E399 L401	L48-I388 HydrophobicContact CD1-CD1 3.88Å; L48-I388 HydrophobicContact CD2-CD1 4.19Å; L48-I388 HydrophobicContact CG-CD1 4.49Å; I333-I388 HydrophobicContact CD1-CD1 4.48Å; I333-I388 HydrophobicContact CG2-CB 4.38Å; E335-I388 CarbonylContact O-C 3.34Å; E335-I388 VanDerWaalsContact O-CA 3.29Å; E335-I388 WeakPolarHBondContact O-CA 3.47Å; L386-I388 HydrophobicContact CD2-CG2 3.93Å; L386-I388 HydrophobicContact CG-CG2 3.96Å; I388-Y390 HydrophobicContact CD1-CD1 4.11Å; I388-Y390 HydrophobicContact CG1-CD1 4.4Å; I388-I398 WeakPolarHBondContact O-CA 3.48Å; I388-E399 PolarHBondContact N-O 3.13Å; I388-E399 PolarHBondContact O-N 3.03Å; I388-L401 HydrophobicContact CD1-CD1 3.71Å; I388-L401 HydrophobicContact CD1-CD2 4.5Å; I388-L401 HydrophobicContact CD1-CG 4.14Å; I388-L401 HydrophobicContact CG1-CD1 4.1Å; I388-L401 HydrophobicContact CG1-CG 4.15Å; I388-L401 HydrophobicContact CG2-CD1 4.15Å
389	L	90.6	Very high	83.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126	170.9	167.7	61.6	0	0	0	108.9	V63 V67 Y71 H334 E335 P396 K397 I398	V63-L389 HydrophobicContact CG1-CD2 3.99Å; V67-L389 HydrophobicContact CG1-CD1 3.36Å; V67-L389 HydrophobicContact CG1-CD2 3.9Å; V67-L389 HydrophobicContact CG1-CG 4.3Å; Y71-L389 HydrophobicContact CD2-CB 4.03Å; Y71-L389 HydrophobicContact CG-CB 4.46Å; H334-L389 HydrophobicContact CB-CD2 4.44Å; H334-L389 HydrophobicContact CB-CG 4.28Å; H334-L389 PolarHBondContact N-O 2.9Å; E335-L389 HydrophobicContact CB-CB 4.18Å; E335-L389 PolarHBondContact N-O 3.16Å; E335-L389 PolarHBondContact O-N 2.85Å; L389-P396 HydrophobicContact CD1-CB 4.5Å; L389-K397 WeakPolarHBondContact CA-O 3.37Å; L389-I398 HydrophobicContact CB-CG1 4.36Å; L389-I398 HydrophobicContact CD1-CD1 4.27Å; L389-I398 HydrophobicContact CD1-CG1 3.6Å
390	Y	89.9	Confident	83.3	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	173.3	177.4	73.6	-75.3	0	0	0	111	L48 L50 W332 I388 I392 K397 E399	L48-Y390 HydrophobicContact CD1-CE1 4.48Å; L48-Y390 HydrophobicContact CD2-CE1 3.82Å; L50-Y390 HydrophobicContact CD1-CE2 4.34Å; W332-Y390 AromaticContact CE3-CD2 3.97Å; W332-Y390 HydrophobicContact CE3-CD2 3.97Å; W332-Y390 HydrophobicContact CE3-CG 4.15Å; W332-Y390 AromaticContact CZ3-CD2 3.66Å; W332-Y390 HydrophobicContact CZ3-CD2 3.66Å; W332-Y390 HydrophobicContact CZ3-CE2 4.39Å; W332-Y390 AromaticContact CZ3-CG 3.77Å; W332-Y390 HydrophobicContact CZ3-CG 3.77Å; W332-Y390 WeakPolarHBondContact O-CB 3.39Å; I388-Y390 HydrophobicContact CD1-CD1 4.11Å; I388-Y390 HydrophobicContact CG1-CD1 4.4Å; Y390-I392 HydrophobicContact CD2-CG1 4.14Å; Y390-I392 HydrophobicContact CE2-CD1 3.75Å; Y390-I392 HydrophobicContact CE2-CG1 3.5Å; Y390-K397 HydrophobicContact CD1-CB 4.05Å; Y390-K397 HydrophobicContact CE1-CB 3.6Å; Y390-K397 HydrophobicContact CE2-CB 4.31Å; Y390-K397 PolarHBondContact N-O 3.25Å; Y390-K397 PolarHBondContact O-N 2.96Å; Y390-E399 HydrophobicContact CE1-CB 4.46Å; Y390-E399 HydrophobicContact CE1-CG 4.24Å; Y390-E399 PolarHBondContact OH-OE1 3.33Å
391	Y	85.2	Confident	83.4	Confident	9 Å²	9	38.4 Å²	38.4	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143	177.9	-81	-101.2	0	0	0	111.6	P58 V63 P64 H334 T395 P396	P58-Y391 VanDerWaalsContact CD-CG 3.47Å; P58-Y391 HydrophobicContact CG-CD1 3.61Å; P58-Y391 HydrophobicContact CG-CD2 3.6Å; P58-Y391 HydrophobicContact CG-CE1 3.82Å; P58-Y391 HydrophobicContact CG-CE2 3.81Å; P58-Y391 HydrophobicContact CG-CG 3.5Å; V63-Y391 HydrophobicContact CG1-CE2 4.32Å; V63-Y391 HydrophobicContact CG2-CE2 4.04Å; P64-Y391 WeakPolarHBondContact CD-OH 3.29Å; H334-Y391 AromaticContact CE1-CD2 3.63Å; H334-Y391 AromaticContact ND1-CD2 3.92Å; H334-Y391 AromaticContact NE2-CD2 3.84Å; Y391-T395 WeakPolarHBondContact CA-O 3.25Å; Y391-P396 HydrophobicContact CD1-CB 4.35Å; Y391-P396 HydrophobicContact CE1-CB 3.74Å; Y391-P396 HydrophobicContact CE1-CG 4.29Å; Y391-P396 HydrophobicContact CE2-CB 4.32Å
392	I	82.5	Confident	83.6	Confident	74 Å²	74	37.2 Å²	37.2	38%	0.379	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	105.9	162.9	-57	177.9	0	0	0	106.4	Y390 K394 T395 K397	Y390-I392 HydrophobicContact CD2-CG1 4.14Å; Y390-I392 HydrophobicContact CE2-CD1 3.75Å; Y390-I392 HydrophobicContact CE2-CG1 3.5Å; I392-K394 PolarHBondContact O-N 3.22Å; I392-T395 PolarHBondContact N-O 3.37Å; I392-T395 VanDerWaalsContact N-O 3.09Å; I392-T395 PolarHBondContact O-N 2.71Å; I392-T395 PolarHBondContact O-OG1 3.01Å; I392-K397 HydrophobicContact CD1-CG 4.45Å
393	G	83	Confident	83.7	Confident	31 Å²	31	34.9 Å²	34.9	32%	0.32	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	-116	-168.6	0	0	0	0	0	110.8
394	K	78.6	Confident	84	Confident	204 Å²	204	33.4 Å²	33.4	89%	0.887	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.3	2.5	177	-62.3	-172.5	-179.4	-177.3	0	114.3	I392	I392-K394 PolarHBondContact O-N 3.22Å
395	T	80.4	Confident	84.5	Confident	78 Å²	78	31.5 Å²	31.5	48%	0.479	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	120	-176.3	60.6	0	0	0	0	111	Y391 I392	Y391-T395 WeakPolarHBondContact CA-O 3.25Å; I392-T395 PolarHBondContact N-O 3.37Å; I392-T395 VanDerWaalsContact N-O 3.09Å; I392-T395 PolarHBondContact O-N 2.71Å; I392-T395 PolarHBondContact O-OG1 3.01Å
396	P	86.9	Confident	84.5	Confident	60 Å²	60	30.3 Å²	30.3	39%	0.39	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	137.5	174.7	28.4	-32.4	0	0	0	110.4	V67 L389 Y391	V67-P396 HydrophobicContact CB-CB 4.36Å; V67-P396 HydrophobicContact CG1-CB 3.61Å; V67-P396 HydrophobicContact CG1-CG 4.39Å; V67-P396 HydrophobicContact CG2-CB 3.75Å; V67-P396 HydrophobicContact CG2-CG 3.65Å; L389-P396 HydrophobicContact CD1-CB 4.5Å; Y391-P396 HydrophobicContact CD1-CB 4.35Å; Y391-P396 HydrophobicContact CE1-CB 3.74Å; Y391-P396 HydrophobicContact CE1-CG 4.29Å; Y391-P396 HydrophobicContact CE2-CB 4.32Å
397	K	84.6	Confident	84.3	Confident	57 Å²	57	33.1 Å²	33.1	25%	0.248	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	127.6	177.5	-72.6	-67	-167.2	168.8	0	110.2	E102 L389 Y390 I392	E102-K397 IonicContact OE1-NZ 3.79Å; E102-K397 PolarHBondContact OE1-NZ 3.43Å; L389-K397 WeakPolarHBondContact CA-O 3.37Å; Y390-K397 HydrophobicContact CD1-CB 4.05Å; Y390-K397 HydrophobicContact CE1-CB 3.6Å; Y390-K397 HydrophobicContact CE2-CB 4.31Å; Y390-K397 PolarHBondContact N-O 3.25Å; Y390-K397 PolarHBondContact O-N 2.96Å; I392-K397 HydrophobicContact CD1-CG 4.45Å
398	I	87.4	Confident	83.8	Confident	14 Å²	14	32.5 Å²	32.5	7%	0.072	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.4	176	-62.8	165.9	0	0	0	107.6	V67 I70 V103 T387 I388 L389	V67-I398 HydrophobicContact CG1-CD1 4.16Å; I70-I398 HydrophobicContact CB-CD1 3.41Å; I70-I398 VanDerWaalsContact CB-CD1 3.41Å; I70-I398 HydrophobicContact CD1-CD1 4.39Å; I70-I398 HydrophobicContact CG1-CD1 4.4Å; I70-I398 HydrophobicContact CG2-CD1 3.41Å; I70-I398 VanDerWaalsContact CG2-CD1 3.41Å; V103-I398 HydrophobicContact CB-CG2 4.47Å; V103-I398 PolarHBondContact N-O 3.22Å; T387-I398 HydrophobicContact CG2-CG2 3.97Å; I388-I398 WeakPolarHBondContact O-CA 3.48Å; L389-I398 HydrophobicContact CB-CG1 4.36Å; L389-I398 HydrophobicContact CD1-CD1 4.27Å; L389-I398 HydrophobicContact CD1-CG1 3.6Å
399	E	83.3	Confident	83.3	Confident	5 Å²	5	33.2 Å²	33.2	2%	0.023	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.1	-174.1	-73	-173.2	-137.2	0	0	111.2	L48 T387 I388 Y390	L48-E399 HydrophobicContact CD2-CB 4.41Å; L48-E399 VanDerWaalsContact CD2-OE2 3.27Å; L48-E399 WeakPolarHBondContact CD2-OE2 3.06Å; T387-E399 WeakPolarHBondContact CA-O 3.37Å; I388-E399 PolarHBondContact N-O 3.13Å; I388-E399 PolarHBondContact O-N 3.03Å; Y390-E399 HydrophobicContact CE1-CB 4.46Å; Y390-E399 HydrophobicContact CE1-CG 4.24Å; Y390-E399 PolarHBondContact OH-OE1 3.33Å
400	Q	81.2	Confident	82.4	Confident	17 Å²	17	34.9 Å²	34.9	8%	0.079	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	102.9	177.4	-172.9	177.8	22.9	0	0	111.2	L78 A100 K101 P385 S402	L78-Q400 VanDerWaalsContact CD1-NE2 3.26Å; L78-Q400 VanDerWaalsContact CD2-NE2 3.34Å; A100-Q400 WeakPolarHBondContact CA-O 3.25Å; A100-Q400 WeakPolarHBondContact CB-O 3.45Å; K101-Q400 PolarHBondContact O-N 3.02Å; P385-Q400 HydrophobicContact CB-CG 3.86Å; P385-Q400 HydrophobicContact CG-CG 4.4Å; P385-Q400 VanDerWaalsContact CG-NE2 3.3Å; Q400-S402 PolarHBondContact O-N 3.38Å
401	L	81.8	Confident	81.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	116.8	178.8	-58.1	179.5	0	0	0	111.6	I44 K47 L48 P385 L386 I388 M404	I44-L401 HydrophobicContact CB-CD1 4.38Å; I44-L401 HydrophobicContact CG1-CD1 3.94Å; I44-L401 HydrophobicContact CG2-CD1 4Å; K47-L401 HydrophobicContact CB-CD2 3.83Å; K47-L401 HydrophobicContact CD-CB 4.41Å; K47-L401 HydrophobicContact CD-CD2 4.47Å; L48-L401 HydrophobicContact CD2-CD2 3.76Å; L48-L401 HydrophobicContact CG-CD2 4.08Å; P385-L401 CarbonylContact C-O 3.58Å; P385-L401 WeakPolarHBondContact CA-O 3.05Å; P385-L401 WeakPolarHBondContact CB-O 3.28Å; L386-L401 PolarHBondContact N-O 2.97Å; L386-L401 WeakPolarHBondContact O-CA 3.19Å; L386-L401 WeakPolarHBondContact O-CB 3.49Å; L386-L401 PolarHBondContact O-N 2.81Å; I388-L401 HydrophobicContact CD1-CD1 3.71Å; I388-L401 HydrophobicContact CD1-CD2 4.5Å; I388-L401 HydrophobicContact CD1-CG 4.14Å; I388-L401 HydrophobicContact CG1-CD1 4.1Å; I388-L401 HydrophobicContact CG1-CG 4.15Å; I388-L401 HydrophobicContact CG2-CD1 4.15Å; L401-M404 HydrophobicContact CB-CG 3.57Å; L401-M404 HydrophobicContact CB-SD 4.23Å; L401-M404 HydrophobicContact CD1-CG 4.48Å; L401-M404 WeakPolarHBondContact O-CG 3.33Å
402	S	77.8	Confident	80.5	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	154.2	176.5	63.2	0	0	0	0	113.2	K47 Y98 Q400 M404	K47-S402 WeakPolarHBondContact CE-O 3.46Å; K47-S402 PolarHBondContact NZ-O 3.17Å; K47-S402 PolarHBondContact NZ-OG 2.68Å; Y98-S402 WeakPolarHBondContact O-CB 3.34Å; Y98-S402 PolarHBondContact O-OG 3.48Å; Q400-S402 PolarHBondContact O-N 3.38Å; S402-M404 PolarHBondContact O-N 3.49Å
403	N	76.6	Confident	80.4	Confident	30 Å²	30	37.9 Å²	37.9	16%	0.16	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.7	39	169.1	-62.4	-24.4	0	0	0	115.7	Q43 Y98 L383	Q43-N403 PolarHBondContact NE2-O 3.25Å; Y98-N403 VanDerWaalsContact CD2-ND2 3.35Å; Y98-N403 WeakPolarHBondContact CD2-ND2 3.39Å; Y98-N403 VanDerWaalsContact CE2-ND2 3.27Å; Y98-N403 WeakPolarHBondContact CE2-ND2 3.42Å; L383-N403 HydrophobicContact CB-CB 4.1Å; L383-N403 HydrophobicContact CD1-CB 3.99Å; L383-N403 HydrophobicContact CG-CB 4.5Å
404	M	86.1	Confident	80.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-30.7	-175.7	-66	-54.1	-57	0	0	113.5	I40 Q43 I44 K47 Y339 E384 L386 L401 S402	I40-M404 HydrophobicContact CG2-CE 3.93Å; Q43-M404 HydrophobicContact CG-SD 3.93Å; I44-M404 HydrophobicContact CD1-CE 3.9Å; I44-M404 HydrophobicContact CG1-CE 3.45Å; I44-M404 VanDerWaalsContact CG1-CE 3.45Å; I44-M404 HydrophobicContact CG1-SD 4.38Å; K47-M404 HydrophobicContact CD-SD 4.09Å; Y339-M404 HydrophobicContact CE2-CB 4.29Å; Y339-M404 VanDerWaalsContact OH-CE 3.3Å; Y339-M404 WeakPolarHBondContact OH-CE 3.44Å; E384-M404 PolarHBondContact O-N 3.34Å; L386-M404 HydrophobicContact CB-CB 3.7Å; L386-M404 HydrophobicContact CB-CG 3.96Å; L401-M404 HydrophobicContact CB-CG 3.57Å; L401-M404 HydrophobicContact CB-SD 4.23Å; L401-M404 HydrophobicContact CD1-CG 4.48Å; L401-M404 WeakPolarHBondContact O-CG 3.33Å; S402-M404 PolarHBondContact O-N 3.49Å
405	I	88.3	Confident	80.3	Confident	24 Å²	24	29 Å²	29	12%	0.123	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.4	-174.8	-64.2	165.9	0	0	0	108.8	Y339 H340 L383 E384 L386 K407	Y339-I405 HydrophobicContact CD2-CD1 4.36Å; Y339-I405 HydrophobicContact CD2-CG1 3.75Å; Y339-I405 HydrophobicContact CE2-CG1 3.96Å; H340-I405 WeakPolarHBondContact O-CG2 2.9Å; L383-I405 CarbonylContact C-O 3.51Å; L383-I405 WeakPolarHBondContact CA-O 3.17Å; E384-I405 HydrophobicContact CB-CB 3.87Å; E384-I405 HydrophobicContact CB-CD1 4.4Å; E384-I405 HydrophobicContact CB-CG2 4.2Å; E384-I405 PolarHBondContact N-O 3.13Å; E384-I405 PolarHBondContact O-N 3.42Å; L386-I405 HydrophobicContact CD1-CD1 4.49Å; I405-K407 HydrophobicContact CG2-CD 4.49Å
406	V	84.6	Confident	80.3	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	129.4	175.8	-167.7	0	0	0	0	110.2	L317 A341 N342 L383	L317-V406 HydrophobicContact CD1-CB 3.81Å; L317-V406 HydrophobicContact CD1-CG1 3.53Å; A341-V406 PolarHBondContact O-N 3.15Å; N342-V406 HydrophobicContact CB-CB 4.16Å; N342-V406 PolarHBondContact ND2-O 3.01Å; L383-V406 HydrophobicContact CD2-CB 4.37Å; L383-V406 HydrophobicContact CD2-CG2 3.83Å
407	K	83.2	Confident	79.9	Confident	73 Å²	73	24 Å²	24	32%	0.317	13%	0.129	S	C	.	.			trans	-109.5	-34.6	176.9	-72.1	-61.3	-166.1	179.4	0	113.9	A304 L317 D382 E384 I405	A304-K407 WeakPolarHBondContact CB-O 2.93Å; L317-K407 WeakPolarHBondContact CD2-O 3.43Å; D382-K407 HydrophobicContact CB-CB 4.06Å; D382-K407 PolarHBondContact O-N 3.27Å; E384-K407 HydrophobicContact CB-CG 4.48Å; E384-K407 HydrophobicContact CG-CG 4.04Å; E384-K407 WeakPolarHBondContact OE1-CE 3.5Å; E384-K407 IonicContact OE1-NZ 3.81Å; E384-K407 WeakPolarHBondContact OE2-CE 3.32Å; E384-K407 IonicContact OE2-NZ 2.75Å; E384-K407 PolarHBondContact OE2-NZ 3.32Å; I405-K407 HydrophobicContact CG2-CD 4.49Å
408	S	76.9	Confident	79.6	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	-141.5	154.9	178.7	67.4	0	0	0	0	111.5	L302 Q381 D382	L302-S408 WeakPolarHBondContact O-CB 3.32Å; Q381-S408 WeakPolarHBondContact CB-OG 3.49Å; Q381-S408 PolarHBondContact N-O 3Å; D382-S408 WeakPolarHBondContact CB-OG 3Å; D382-S408 PolarHBondContact N-OG 3.21Å; D382-S408 PolarHBondContact O-N 3.46Å; D382-S408 WeakPolarHBondContact OD2-CB 3.49Å; D382-S408 PolarHBondContact OD2-OG 3.34Å
409	C	79.8	Confident	79.1	Confident	14 Å²	14	22.4 Å²	22.4	10%	0.095	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	149.8	-178.6	-60.4	0	0	0	0	109.8	L317 C344 V379	L317-C409 VanDerWaalsContact CA-SG 3.53Å; C344-C409 WeakPolarHBondContact CA-SG 3.46Å; C344-C409 HydrophobicContact CB-CB 3.73Å; C344-C409 WeakPolarHBondContact CB-SG 3.44Å; C344-C409 WeakPolarHBondContact SG-CA 3.49Å; C344-C409 WeakPolarHBondContact SG-CB 3.42Å; C344-C409 CovalentContact SG-SG 2.03Å; C344-C409 PolarHBondContact SG-SG 3.37Å; V379-C409 CarbonylContact O-C 3.59Å; V379-C409 WeakPolarHBondContact O-CA 3.38Å
410	K	73.1	Confident	78.7	Confident	35 Å²	35	23.7 Å²	23.7	15%	0.152	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	160.7	174.8	73.4	174.3	-159.5	149.4	0	111.8	A301 D355 V379 Q381	A301-K410 HydrophobicContact CB-CB 4.06Å; D355-K410 IonicContact OD2-NZ 3.83Å; D355-K410 PolarHBondContact OD2-NZ 3.49Å; V379-K410 HydrophobicContact CG2-CG 3.86Å; V379-K410 PolarHBondContact N-O 3.27Å; V379-K410 PolarHBondContact O-N 3.5Å; Q381-K410 HydrophobicContact CB-CB 4.45Å; Q381-K410 HydrophobicContact CB-CD 4.15Å; Q381-K410 HydrophobicContact CB-CG 4.16Å; Q381-K410 HydrophobicContact CG-CD 4.47Å
411	C	70.2	Confident	78.5	Confident	16 Å²	16	24.3 Å²	24.3	11%	0.108	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	126.1	168.4	-65.3	0	0	0	0	109.5	C315 C348 P376 C377	C315-C411 WeakPolarHBondContact CB-SG 3.24Å; C348-C411 VanDerWaalsContact CA-SG 3.55Å; C348-C411 HydrophobicContact CB-CB 3.65Å; C348-C411 WeakPolarHBondContact CB-SG 3.36Å; C348-C411 WeakPolarHBondContact SG-CA 3.49Å; C348-C411 WeakPolarHBondContact SG-CB 2.99Å; C348-C411 CovalentContact SG-SG 2.03Å; C348-C411 PolarHBondContact SG-SG 3.2Å; P376-C411 HydrophobicContact CB-CB 4.43Å; C377-C411 WeakPolarHBondContact O-CA 3.45Å
412	S	64	Low	78.2	Confident	95 Å²	95	26.5 Å²	26.5	66%	0.664	15%	0.15	S	C	*	.			trans	-137.9	0	176.3	69.1	0	0	0	0	113.6	C377 V379	C377-S412 PolarHBondContact N-O 3.08Å; C377-S412 PolarHBondContact O-N 3.03Å; V379-S412 VanDerWaalsContact CG2-OG 3.28Å; V379-S412 WeakPolarHBondContact CG2-OG 3.29Å

Retrieved 412 of 412 residues in 536 ms (Link to these results)

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