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Transforming growth factor beta

Required to maintain the Transforming growth factor beta-1 (TGF-beta-1) chain in a latent state during storage in extracellular matrix. Associates non-covalently with TGF-beta-1 and regulates its activation via interaction with 'milieu molecules', such as LTBP1, LRRC32/GARP and LRRC33/NRROS, that control activation of TGF-beta-1. Interaction with integrins (ITGAV:ITGB6 or ITGAV:ITGB8) results in distortion of the Latency-associated peptide chain and subsequent release of the active TGF-beta-1. Required to maintain the Transforming growth factor beta-3 (TGF-beta-3) chain in a latent state during storage in extracellular matrix. Associates non-covalently with TGF-beta-3 and regulates its activation via interaction with 'milieu molecules', such as LTBP1 and LRRC32/GARP, that control activation of TGF-beta-3. Interaction with integrins results in distortion of the Latency-associated peptide chain and subsequent release of the active TGF-beta-3. Transforming growth factor beta-3 proprotein: Precursor of the Latency-associated peptide (LAP) and Transforming growth factor beta-3 (TGF-beta-3) chains, which constitute the regulatory and active subunit of TGF-beta-3, respectively. Transforming growth factor beta-3: Multifunctional protein that regulates embryogenesis and cell differentiation and is required in various processes such as secondary palate 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-3 (TGF-beta-3) chains remain non-covalently linked rendering TGF-beta-3 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-3 and maintain it in a latent state during storage in extracellular milieus. TGF-beta-3 is released from LAP by integrins: integrin-binding results in distortion of the LAP chain and subsequent release of the active TGF-beta-3. Once activated following release of LAP, TGF-beta-3 acts by binding to TGF-beta receptors (TGFBR1 and TGFBR2), which transduce signal.

AlphaFold DB , UniProt , Accession A0A060WHW8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene tgfb3, Length 409 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	54.9	Low	59.4	Low	207 Å²	207	126 Å²	126	100%	1.02	65%	0.648	S	S	*	*				0	0.5	0	-74.3	170	71.2	0	0	115.2
2	H	55.5	Low	59.1	Low	166 Å²	166	124.1 Å²	124.1	77%	0.769	64%	0.639	S	S	*	*			trans	-97.8	-24.5	-178	-72.3	-76.3	0	0	0	115	A6	H2-A6 PolarHBondContact O-N 3.06Å
3	L	56.1	Low	58.7	Low	146 Å²	146	122 Å²	122	76%	0.764	63%	0.629	S	S	*	*	H	α-helix	trans	-73	-38.4	-178	-144.3	76.4	0	0	0	113	K5 A6 L7	L3-K5 PolarHBondContact O-N 3.15Å; L3-A6 PolarHBondContact O-N 3.37Å; L3-L7 PolarHBondContact O-N 3.46Å; L3-L7 VanDerWaalsContact O-N 3.15Å
4	G	63	Low	58	Low	51 Å²	51	120.4 Å²	120.4	53%	0.526	62%	0.622	S	S	.	*	H	α-helix	trans	-68	-31.7	178.2	0	0	0	0	0	113.7	L8	G4-L8 PolarHBondContact O-N 2.95Å; G4-L8 VanDerWaalsContact O-N 3.15Å
5	K	61.8	Low	57.2	Low	150 Å²	150	117.9 Å²	117.9	65%	0.652	62%	0.618	S	S	*	*	H	α-helix	trans	-72.7	-35.9	175.7	-74	-176	174.7	-178.3	0	112.1	L3 F9	L3-K5 PolarHBondContact O-N 3.15Å; K5-F9 WeakPolarHBondContact O-CB 3.46Å; K5-F9 PolarHBondContact O-N 2.98Å
6	A	62.6	Low	56.3	Low	50 Å²	50	116.9 Å²	116.9	41%	0.413	62%	0.618	S	S	.	*	H	α-helix	trans	-67.6	-41	176	0	0	0	0	0	111.9	H2 L3 F9 F10	H2-A6 PolarHBondContact O-N 3.06Å; L3-A6 PolarHBondContact O-N 3.37Å; A6-F9 PolarHBondContact O-N 3.39Å; A6-F10 PolarHBondContact O-N 3.49Å
7	L	59.6	Low	55.4	Low	111 Å²	111	115.2 Å²	115.2	58%	0.581	61%	0.613	S	S	*	*	H	α-helix	trans	-65.7	-39.7	176.1	-118.2	112.7	0	0	0	112.4	L3 F9 F10 L11	L3-L7 PolarHBondContact O-N 3.46Å; L3-L7 VanDerWaalsContact O-N 3.15Å; L7-F9 VanDerWaalsContact C-N 3.32Å; L7-F9 PolarHBondContact O-N 3.01Å; L7-F10 PolarHBondContact O-N 3.15Å; L7-L11 HydrophobicContact CD2-CD1 4.5Å; L7-L11 WeakPolarHBondContact O-CB 3.45Å; L7-L11 PolarHBondContact O-N 3.36Å
8	L	60.9	Low	54.6	Low	115 Å²	115	117.5 Å²	117.5	60%	0.602	62%	0.622	S	S	*	*	H	α-helix	trans	-64.9	-37.6	175.8	-136.7	98.9	0	0	0	111.8	G4 L11 L12	G4-L8 PolarHBondContact O-N 2.95Å; G4-L8 VanDerWaalsContact O-N 3.15Å; L8-L11 PolarHBondContact O-N 3.06Å; L8-L12 HydrophobicContact CD2-CD1 4.32Å; L8-L12 WeakPolarHBondContact O-CB 3.4Å; L8-L12 VanDerWaalsContact O-CG 3.28Å; L8-L12 WeakPolarHBondContact O-CG 3.48Å; L8-L12 PolarHBondContact O-N 3.3Å
9	F	63.3	Low	54	Low	143 Å²	143	116.9 Å²	116.9	63%	0.627	62%	0.624	S	S	*	*	H	α-helix	trans	-68.5	-40.1	177.4	-154.6	-92.1	0	0	0	111.7	K5 A6 L7 L12 L13	K5-F9 WeakPolarHBondContact O-CB 3.46Å; K5-F9 PolarHBondContact O-N 2.98Å; A6-F9 PolarHBondContact O-N 3.39Å; L7-F9 VanDerWaalsContact C-N 3.32Å; L7-F9 PolarHBondContact O-N 3.01Å; F9-L12 PolarHBondContact O-N 3.47Å; F9-L13 HydrophobicContact CE1-CD1 4.35Å; F9-L13 WeakPolarHBondContact O-CB 3.36Å; F9-L13 PolarHBondContact O-N 3.33Å
10	F	58.5	Low	53.4	Low	139 Å²	139	118.7 Å²	118.7	61%	0.61	63%	0.632	S	S	*	*	H	α-helix	trans	-68.5	-35.3	174.2	-95.3	-77.8	0	0	0	113.3	A6 L7 N14	A6-F10 PolarHBondContact O-N 3.49Å; L7-F10 PolarHBondContact O-N 3.15Å; F10-N14 WeakPolarHBondContact O-CB 3.31Å; F10-N14 PolarHBondContact O-N 3.32Å; F10-N14 PolarHBondContact O-ND2 3.36Å
11	L	56.9	Low	52.6	Low	108 Å²	108	117.2 Å²	117.2	57%	0.565	63%	0.632	S	S	*	*	H	α-helix	trans	-67.6	-40.6	172.8	-90	153.3	0	0	0	111.7	L7 L8 C15	L7-L11 HydrophobicContact CD2-CD1 4.5Å; L7-L11 WeakPolarHBondContact O-CB 3.45Å; L7-L11 PolarHBondContact O-N 3.36Å; L8-L11 PolarHBondContact O-N 3.06Å; L11-C15 WeakPolarHBondContact O-CB 3.37Å; L11-C15 PolarHBondContact O-N 3.41Å; L11-C15 PolarHBondContact O-SG 3.25Å
12	L	56.3	Low	51.8	Low	103 Å²	103	114.8 Å²	114.8	54%	0.539	62%	0.622	S	S	.	*	H	α-helix	trans	-68	-38.1	175	-74.8	166	0	0	0	112.2	L8 F9 C15 V16	L8-L12 HydrophobicContact CD2-CD1 4.32Å; L8-L12 WeakPolarHBondContact O-CB 3.4Å; L8-L12 VanDerWaalsContact O-CG 3.28Å; L8-L12 WeakPolarHBondContact O-CG 3.48Å; L8-L12 PolarHBondContact O-N 3.3Å; F9-L12 PolarHBondContact O-N 3.47Å; L12-C15 PolarHBondContact O-N 2.9Å; L12-V16 VanDerWaalsContact O-CG2 3.31Å; L12-V16 WeakPolarHBondContact O-CG2 3.38Å; L12-V16 PolarHBondContact O-N 3.46Å
13	L	53.8	Low	51	Low	97 Å²	97	110.8 Å²	110.8	51%	0.508	61%	0.613	S	S	.	*	H	α-helix	trans	-68	-38.2	177.8	-146.9	76.7	0	0	0	112	F9 V16 T17	F9-L13 HydrophobicContact CE1-CD1 4.35Å; F9-L13 WeakPolarHBondContact O-CB 3.36Å; F9-L13 PolarHBondContact O-N 3.33Å; L13-V16 PolarHBondContact O-N 3.47Å; L13-T17 PolarHBondContact O-N 3.36Å; L13-T17 PolarHBondContact O-OG1 2.93Å
14	N	48.8	Very low	50.3	Low	100 Å²	100	110.3 Å²	110.3	54%	0.535	62%	0.616	S	S	.	*	H	α-helix	trans	-70.9	-31.2	173.8	-79.2	-53.1	0	0	0	112.9	F10 T17 M18	F10-N14 WeakPolarHBondContact O-CB 3.31Å; F10-N14 PolarHBondContact O-N 3.32Å; F10-N14 PolarHBondContact O-ND2 3.36Å; N14-T17 WeakPolarHBondContact CA-OG1 3.46Å; N14-T17 PolarHBondContact O-N 3.31Å; N14-T17 PolarHBondContact O-OG1 3.01Å; N14-M18 WeakPolarHBondContact O-CG 3.28Å
15	C	46.1	Very low	49.6	Very low	82 Å²	82	112.2 Å²	112.2	55%	0.554	62%	0.62	S	S	*	*	H	α-helix	trans	-69.4	-33.2	171.6	-82.1	0	0	0	0	112.6	L11 L12 T17 M18	L11-C15 WeakPolarHBondContact O-CB 3.37Å; L11-C15 PolarHBondContact O-N 3.41Å; L11-C15 PolarHBondContact O-SG 3.25Å; L12-C15 PolarHBondContact O-N 2.9Å; C15-T17 VanDerWaalsContact C-N 3.32Å; C15-M18 PolarHBondContact O-N 3.01Å
16	V	42.6	Very low	48.9	Very low	102 Å²	102	110 Å²	110	62%	0.618	62%	0.62	S	S	*	*	H	α-helix	trans	-71.4	-27.2	176.1	172.9	0	0	0	0	111.8	L12 L13 M18	L12-V16 VanDerWaalsContact O-CG2 3.31Å; L12-V16 WeakPolarHBondContact O-CG2 3.38Å; L12-V16 PolarHBondContact O-N 3.46Å; L13-V16 PolarHBondContact O-N 3.47Å; V16-M18 VanDerWaalsContact C-N 3.31Å; V16-M18 PolarHBondContact O-N 3.33Å
17	T	41.8	Very low	48.3	Very low	89 Å²	89	114.6 Å²	114.6	55%	0.546	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.9	-4.4	174.9	50.9	0	0	0	0	114.7	L13 N14 C15	L13-T17 PolarHBondContact O-N 3.36Å; L13-T17 PolarHBondContact O-OG1 2.93Å; N14-T17 WeakPolarHBondContact CA-OG1 3.46Å; N14-T17 PolarHBondContact O-N 3.31Å; N14-T17 PolarHBondContact O-OG1 3.01Å; C15-T17 VanDerWaalsContact C-N 3.32Å
18	M	40.5	Very low	48.3	Very low	156 Å²	156	112.5 Å²	112.5	77%	0.768	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	10.6	-177.7	-70.6	-76.1	92.3	0	0	114.6	N14 C15 V16	N14-M18 WeakPolarHBondContact O-CG 3.28Å; C15-M18 PolarHBondContact O-N 3.01Å; V16-M18 VanDerWaalsContact C-N 3.31Å; V16-M18 PolarHBondContact O-N 3.33Å
19	T	43.3	Very low	48.8	Very low	107 Å²	107	111.9 Å²	111.9	66%	0.656	63%	0.632	S	S	*	*	S	Bend	trans	-115.6	14.1	178.2	54.5	0	0	0	0	115.1
20	L	42.6	Very low	49.3	Very low	151 Å²	151	109.6 Å²	109.6	79%	0.791	63%	0.625	S	S	*	*			trans	-103.9	65	165.3	-71.2	166.5	0	0	0	109.7	L22	L20-L22 PolarHBondContact O-N 2.87Å
21	S	35.9	Very low	50.3	Low	89 Å²	89	107.4 Å²	107.4	62%	0.622	62%	0.62	S	S	*	*			trans	-63.2	104.4	156	40	0	0	0	0	107.2	S23	S21-S23 PolarHBondContact O-N 3.49Å
22	L	38.8	Very low	51.5	Low	156 Å²	156	106.3 Å²	106.3	82%	0.817	61%	0.611	S	S	*	*			trans	-66.9	85.6	170.8	-85.2	129.7	0	0	0	108.3	L20 T24	L20-L22 PolarHBondContact O-N 2.87Å; L22-T24 PolarHBondContact O-N 3.41Å
23	S	38.4	Very low	52.5	Low	82 Å²	82	103.5 Å²	103.5	57%	0.573	60%	0.596	S	S	*	*			trans	-64.3	119.4	159	69.1	0	0	0	0	107.1	S21 C25	S21-S23 PolarHBondContact O-N 3.49Å; S23-C25 PolarHBondContact O-N 2.93Å
24	T	41.3	Very low	53.9	Low	135 Å²	135	102.1 Å²	102.1	83%	0.828	59%	0.586	S	S	*	*	S	Bend	trans	-69.6	9.2	177.5	43.2	0	0	0	0	113.4	L22	L22-T24 PolarHBondContact O-N 3.41Å
25	C	48.7	Very low	55.7	Low	91 Å²	91	104.4 Å²	104.4	62%	0.615	59%	0.591	S	S	*	*			trans	-119.1	63.9	168.5	-74.1	0	0	0	0	109.8	S23 T27	S23-C25 PolarHBondContact O-N 2.93Å; C25-T27 PolarHBondContact O-N 3.35Å
26	T	46.8	Very low	57.6	Low	105 Å²	105	106.8 Å²	106.8	64%	0.644	59%	0.592	S	S	*	*			trans	-50.1	134.5	155.1	54.1	0	0	0	0	107.5	V28	T26-V28 WeakPolarHBondContact O-CG2 2.94Å; T26-V28 PolarHBondContact O-N 3.27Å
27	T	49.8	Very low	59.6	Low	146 Å²	146	104.1 Å²	104.1	90%	0.896	57%	0.571	S	S	*	*			trans	-53.3	89	173.1	42.8	0	0	0	0	109	C25 D29	C25-T27 PolarHBondContact O-N 3.35Å; T27-D29 PolarHBondContact O-N 3.28Å
28	V	58.5	Low	61.8	Low	67 Å²	67	100.6 Å²	100.6	41%	0.406	55%	0.55	S	S	.	.			trans	-63	115.4	179.3	-179.6	0	0	0	0	104.7	T26 I30 H32 I33	T26-V28 WeakPolarHBondContact O-CG2 2.94Å; T26-V28 PolarHBondContact O-N 3.27Å; V28-I30 PolarHBondContact O-N 3.07Å; V28-I30 VanDerWaalsContact O-N 3.15Å; V28-H32 HydrophobicContact CG1-CB 4.07Å; V28-I33 HydrophobicContact CB-CD1 4.1Å; V28-I33 HydrophobicContact CB-CG1 3.98Å; V28-I33 HydrophobicContact CG1-CD1 4.26Å; V28-I33 HydrophobicContact CG1-CG1 3.57Å
29	D	71.3	Confident	64	Low	102 Å²	102	97.4 Å²	97.4	55%	0.545	53%	0.533	S	S	.	.			trans	-40.1	123.9	175.7	176.7	5.6	0	0	0	108.9	T27 D31 H32 I33	T27-D29 PolarHBondContact O-N 3.28Å; D29-D31 PolarHBondContact O-N 2.63Å; D29-D31 PolarHBondContact OD1-N 2.97Å; D29-D31 VanDerWaalsContact OD1-N 3.09Å; D29-H32 HydrophobicContact CB-CB 4.12Å; D29-H32 WeakPolarHBondContact O-CA 3.49Å; D29-H32 VanDerWaalsContact O-CB 3.26Å; D29-H32 WeakPolarHBondContact O-CB 3.18Å; D29-H32 PolarHBondContact O-N 3.18Å; D29-I33 PolarHBondContact O-N 3.23Å
30	I	75	Confident	66	Low	94 Å²	94	94.8 Å²	94.8	48%	0.482	52%	0.522	S	S	.	.	H	α-helix	trans	-52.4	-34.9	-177.1	-70.3	176.3	0	0	0	109.5	V28 I33 K34 F340	V28-I30 PolarHBondContact O-N 3.07Å; V28-I30 VanDerWaalsContact O-N 3.15Å; I30-I33 PolarHBondContact O-N 2.76Å; I30-K34 HydrophobicContact CG2-CD 4.36Å; I30-K34 HydrophobicContact CG2-CG 4.43Å; I30-K34 VanDerWaalsContact O-CG 3.31Å; I30-K34 WeakPolarHBondContact O-CG 3.07Å; I30-K34 PolarHBondContact O-N 3.28Å; I30-F340 HydrophobicContact CG2-CZ 4.12Å
31	D	79.3	Confident	68.1	Low	94 Å²	94	87.6 Å²	87.6	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-70.7	-31.9	178.8	-68.8	-20.6	0	0	0	112.7	D29 K34 K35	D29-D31 PolarHBondContact O-N 2.63Å; D29-D31 PolarHBondContact OD1-N 2.97Å; D29-D31 VanDerWaalsContact OD1-N 3.09Å; D31-K34 PolarHBondContact O-N 3.17Å; D31-K34 IonicContact OD1-NZ 3.98Å; D31-K34 PolarHBondContact OD1-NZ 3.12Å; D31-K35 WeakPolarHBondContact O-CB 3.5Å; D31-K35 PolarHBondContact O-N 3.19Å
32	H	81.1	Confident	70.5	Confident	85 Å²	85	86.9 Å²	86.9	39%	0.394	47%	0.468	S	S	.	.	H	α-helix	trans	-66.8	-39.5	170.2	-171	83	0	0	0	112	V28 D29 K35 K36	V28-H32 HydrophobicContact CG1-CB 4.07Å; D29-H32 HydrophobicContact CB-CB 4.12Å; D29-H32 WeakPolarHBondContact O-CA 3.49Å; D29-H32 VanDerWaalsContact O-CB 3.26Å; D29-H32 WeakPolarHBondContact O-CB 3.18Å; D29-H32 PolarHBondContact O-N 3.18Å; H32-K35 PolarHBondContact O-N 2.79Å; H32-K36 WeakPolarHBondContact NE2-CE 3.46Å; H32-K36 PolarHBondContact NE2-NZ 3.36Å; H32-K36 PolarHBondContact O-N 3.2Å
33	I	78.8	Confident	72.7	Confident	43 Å²	43	81.3 Å²	81.3	22%	0.221	45%	0.449	C	S	.	.	H	α-helix	trans	-64.4	-45.9	174.4	-58.1	178.2	0	0	0	110.5	V28 D29 I30 K35 K36 R37 F340	V28-I33 HydrophobicContact CB-CD1 4.1Å; V28-I33 HydrophobicContact CB-CG1 3.98Å; V28-I33 HydrophobicContact CG1-CD1 4.26Å; V28-I33 HydrophobicContact CG1-CG1 3.57Å; D29-I33 PolarHBondContact O-N 3.23Å; I30-I33 PolarHBondContact O-N 2.76Å; I33-K35 VanDerWaalsContact C-N 3.34Å; I33-K35 PolarHBondContact O-N 3.44Å; I33-K36 PolarHBondContact O-N 3.37Å; I33-R37 WeakPolarHBondContact O-CB 3.5Å; I33-R37 PolarHBondContact O-N 3.43Å; I33-F340 HydrophobicContact CB-CE2 4.38Å; I33-F340 HydrophobicContact CG2-CD2 3.63Å; I33-F340 HydrophobicContact CG2-CE2 3.77Å
34	K	82.7	Confident	74.9	Confident	68 Å²	68	79.3 Å²	79.3	30%	0.296	43%	0.43	S	S	.	.	H	α-helix	trans	-57	-47.1	176	-70.9	175.3	-169.8	150.7	0	111	I30 D31 K36 R37 V38 L317 F340	I30-K34 HydrophobicContact CG2-CD 4.36Å; I30-K34 HydrophobicContact CG2-CG 4.43Å; I30-K34 VanDerWaalsContact O-CG 3.31Å; I30-K34 WeakPolarHBondContact O-CG 3.07Å; I30-K34 PolarHBondContact O-N 3.28Å; D31-K34 PolarHBondContact O-N 3.17Å; D31-K34 IonicContact OD1-NZ 3.98Å; D31-K34 PolarHBondContact OD1-NZ 3.12Å; K34-K36 PolarHBondContact O-N 2.99Å; K34-R37 WeakPolarHBondContact O-CB 3.48Å; K34-R37 PolarHBondContact O-N 3.26Å; K34-V38 WeakPolarHBondContact O-CG2 3.19Å; K34-V38 PolarHBondContact O-N 3.17Å; K34-L317 HydrophobicContact CB-CD1 4.24Å; K34-L317 HydrophobicContact CD-CD1 4.12Å; K34-L317 HydrophobicContact CG-CD1 3.92Å; K34-L317 HydrophobicContact CG-CD2 4.48Å; K34-F340 HydrophobicContact CG-CE1 4.08Å; K34-F340 HydrophobicContact CG-CZ 4.14Å
35	K	85.7	Confident	76.9	Confident	148 Å²	148	72.9 Å²	72.9	64%	0.643	39%	0.391	S	S	*	.	H	α-helix	trans	-61.8	-44.5	178.9	-169.5	174.5	-178.4	177.4	0	112.1	D31 H32 I33 R37 V38 E39	D31-K35 WeakPolarHBondContact O-CB 3.5Å; D31-K35 PolarHBondContact O-N 3.19Å; H32-K35 PolarHBondContact O-N 2.79Å; I33-K35 VanDerWaalsContact C-N 3.34Å; I33-K35 PolarHBondContact O-N 3.44Å; K35-R37 VanDerWaalsContact C-N 3.32Å; K35-R37 PolarHBondContact O-N 3.4Å; K35-V38 PolarHBondContact O-N 3.16Å; K35-E39 PolarHBondContact O-N 3.01Å; K35-E39 VanDerWaalsContact O-N 3.12Å
36	K	85.9	Confident	78.6	Confident	132 Å²	132	69.7 Å²	69.7	57%	0.574	37%	0.367	S	S	*	.	H	α-helix	trans	-59.7	-41	173.6	-82.4	178.7	165.5	162.8	0	112.2	H32 I33 K34 E39 A40	H32-K36 WeakPolarHBondContact NE2-CE 3.46Å; H32-K36 PolarHBondContact NE2-NZ 3.36Å; H32-K36 PolarHBondContact O-N 3.2Å; I33-K36 PolarHBondContact O-N 3.37Å; K34-K36 PolarHBondContact O-N 2.99Å; K36-E39 PolarHBondContact O-N 3.31Å; K36-A40 WeakPolarHBondContact O-CB 3.48Å; K36-A40 PolarHBondContact O-N 2.54Å
37	R	86	Confident	80.3	Confident	47 Å²	47	67.6 Å²	67.6	18%	0.177	36%	0.357	C	S	.	.	H	α-helix	trans	-64.8	-41.5	177.2	-176.9	61.8	172.3	157.4	7.3	112	I33 K34 K35 A40 I41 L317 N339 F340	I33-R37 WeakPolarHBondContact O-CB 3.5Å; I33-R37 PolarHBondContact O-N 3.43Å; K34-R37 WeakPolarHBondContact O-CB 3.48Å; K34-R37 PolarHBondContact O-N 3.26Å; K35-R37 VanDerWaalsContact C-N 3.32Å; K35-R37 PolarHBondContact O-N 3.4Å; R37-A40 PolarHBondContact O-N 2.97Å; R37-I41 HydrophobicContact CG-CD1 3.93Å; R37-I41 WeakPolarHBondContact O-CB 3.44Å; R37-I41 WeakPolarHBondContact O-CG1 3.35Å; R37-I41 PolarHBondContact O-N 2.84Å; R37-L317 HydrophobicContact CB-CD2 4.07Å; R37-L317 HydrophobicContact CG-CD2 3.79Å; R37-N339 PolarHBondContact NE-O 2.99Å; R37-F340 HydrophobicContact CG-CB 4.2Å
38	V	87.3	Confident	81.8	Confident	15 Å²	15	60.6 Å²	60.6	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-59.8	-47.2	175.8	171.6	0	0	0	0	110.9	K34 K35 I41 R42 I319 H324 L325	K34-V38 WeakPolarHBondContact O-CG2 3.19Å; K34-V38 PolarHBondContact O-N 3.17Å; K35-V38 PolarHBondContact O-N 3.16Å; V38-I41 PolarHBondContact O-N 2.81Å; V38-R42 PolarHBondContact O-N 2.75Å; V38-I319 HydrophobicContact CG2-CD1 4.1Å; V38-I319 HydrophobicContact CG2-CG1 4.29Å; V38-H324 HydrophobicContact CG1-CB 4.12Å; V38-L325 HydrophobicContact CG1-CD2 3.79Å; V38-L325 HydrophobicContact CG1-CG 4.22Å
39	E	86.8	Confident	82.8	Confident	88 Å²	88	57.7 Å²	57.7	41%	0.411	30%	0.296	S	S	.	.	H	α-helix	trans	-66.7	-37.8	177.3	-67.9	-58.4	154.9	0	0	112.7	K35 K36 I41 R42 G43	K35-E39 PolarHBondContact O-N 3.01Å; K35-E39 VanDerWaalsContact O-N 3.12Å; K36-E39 PolarHBondContact O-N 3.31Å; E39-I41 VanDerWaalsContact C-N 3.31Å; E39-I41 PolarHBondContact O-N 3.4Å; E39-R42 VanDerWaalsContact O-CB 3.28Å; E39-R42 WeakPolarHBondContact O-CB 3.09Å; E39-R42 PolarHBondContact O-N 3.13Å; E39-R42 IonicContact OE1-CZ 3.68Å; E39-R42 IonicContact OE1-NH1 2.79Å; E39-R42 PolarHBondContact OE1-NH1 2.89Å; E39-R42 IonicContact OE2-CZ 3.12Å; E39-R42 IonicContact OE2-NH1 2.74Å; E39-R42 PolarHBondContact OE2-NH1 3.25Å; E39-G43 PolarHBondContact O-N 2.63Å; E39-G43 VanDerWaalsContact O-N 3.16Å
40	A	85.9	Confident	83.3	Confident	52 Å²	52	58.1 Å²	58.1	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-41.7	173.8	0	0	0	0	0	111.7	K36 R37 R42 G43 Q44	K36-A40 WeakPolarHBondContact O-CB 3.48Å; K36-A40 PolarHBondContact O-N 2.54Å; R37-A40 PolarHBondContact O-N 2.97Å; A40-R42 VanDerWaalsContact C-N 3.35Å; A40-G43 PolarHBondContact O-N 3.16Å; A40-Q44 VanDerWaalsContact O-CB 3.28Å; A40-Q44 WeakPolarHBondContact O-CB 3.2Å; A40-Q44 PolarHBondContact O-N 3.49Å
41	I	86.6	Confident	83.5	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.2	-37.7	177.1	-75.5	166.6	0	0	0	111.3	R37 V38 E39 G43 Q44 I45 I319 Y336 A338 M401	R37-I41 HydrophobicContact CG-CD1 3.93Å; R37-I41 WeakPolarHBondContact O-CB 3.44Å; R37-I41 WeakPolarHBondContact O-CG1 3.35Å; R37-I41 PolarHBondContact O-N 2.84Å; V38-I41 PolarHBondContact O-N 2.81Å; E39-I41 VanDerWaalsContact C-N 3.31Å; E39-I41 PolarHBondContact O-N 3.4Å; I41-G43 PolarHBondContact O-N 3.29Å; I41-Q44 PolarHBondContact O-N 2.99Å; I41-I45 HydrophobicContact CG2-CD1 3.69Å; I41-I45 HydrophobicContact CG2-CG1 4.26Å; I41-I45 VanDerWaalsContact O-CG1 3.32Å; I41-I45 WeakPolarHBondContact O-CG1 3.4Å; I41-I45 PolarHBondContact O-N 2.94Å; I41-I319 HydrophobicContact CD1-CD1 3.22Å; I41-I319 HydrophobicContact CG1-CD1 4.43Å; I41-I319 HydrophobicContact CG2-CD1 4.47Å; I41-Y336 VanDerWaalsContact CG2-OH 3.26Å; I41-Y336 WeakPolarHBondContact CG2-OH 3.4Å; I41-A338 HydrophobicContact CD1-CB 3.5Å; I41-A338 VanDerWaalsContact CD1-CB 3.5Å; I41-M401 HydrophobicContact CG2-CE 4Å
42	R	86.6	Confident	83.6	Confident	74 Å²	74	58.4 Å²	58.4	28%	0.279	30%	0.298	S	S	.	.	H	α-helix	trans	-53.4	-53.8	172.5	-170.3	-178	-99.5	147	-4.6	111.1	V38 E39 A40 L46 L325 W327	V38-R42 PolarHBondContact O-N 2.75Å; E39-R42 VanDerWaalsContact O-CB 3.28Å; E39-R42 WeakPolarHBondContact O-CB 3.09Å; E39-R42 PolarHBondContact O-N 3.13Å; E39-R42 IonicContact OE1-CZ 3.68Å; E39-R42 IonicContact OE1-NH1 2.79Å; E39-R42 PolarHBondContact OE1-NH1 2.89Å; E39-R42 IonicContact OE2-CZ 3.12Å; E39-R42 IonicContact OE2-NH1 2.74Å; E39-R42 PolarHBondContact OE2-NH1 3.25Å; A40-R42 VanDerWaalsContact C-N 3.35Å; R42-L46 WeakPolarHBondContact O-CG 3Å; R42-L46 PolarHBondContact O-N 3.1Å; R42-L325 HydrophobicContact CB-CD2 3.6Å; R42-L325 HydrophobicContact CG-CD2 4Å; R42-L325 PolarHBondContact NH2-O 2.75Å; R42-W327 HydrophobicContact CB-CZ2 4.37Å; R42-W327 HydrophobicContact CG-CH2 4.05Å; R42-W327 HydrophobicContact CG-CZ2 3.45Å; R42-W327 VanDerWaalsContact CG-CZ2 3.45Å
43	G	83.6	Confident	83.7	Confident	40 Å²	40	57.4 Å²	57.4	41%	0.412	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-39.3	178.7	0	0	0	0	0	112.7	E39 A40 I41 L46 S47	E39-G43 PolarHBondContact O-N 2.63Å; E39-G43 VanDerWaalsContact O-N 3.16Å; A40-G43 PolarHBondContact O-N 3.16Å; I41-G43 PolarHBondContact O-N 3.29Å; G43-L46 PolarHBondContact O-N 3.37Å; G43-S47 WeakPolarHBondContact O-CB 3.48Å; G43-S47 PolarHBondContact O-N 2.77Å
44	Q	84.3	Confident	83.9	Confident	39 Å²	39	57.6 Å²	57.6	18%	0.182	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-45	-179.9	-171.8	179.9	5.5	0	0	112.3	A40 I41 K48 N400 M401	A40-Q44 VanDerWaalsContact O-CB 3.28Å; A40-Q44 WeakPolarHBondContact O-CB 3.2Å; A40-Q44 PolarHBondContact O-N 3.49Å; I41-Q44 PolarHBondContact O-N 2.99Å; Q44-K48 HydrophobicContact CG-CD 4.04Å; Q44-K48 VanDerWaalsContact NE2-CE 3.34Å; Q44-K48 WeakPolarHBondContact O-CB 3.41Å; Q44-K48 VanDerWaalsContact O-CG 3.28Å; Q44-K48 WeakPolarHBondContact O-CG 3.32Å; Q44-K48 PolarHBondContact O-N 3.36Å; Q44-N400 PolarHBondContact NE2-O 2.66Å; Q44-M401 HydrophobicContact CG-SD 3.94Å
45	I	85.1	Confident	83.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.1	-49.2	179.2	-67	170.5	0	0	0	110.2	I41 S47 K48 L49 F321 W327 W329 L398 M401	I41-I45 HydrophobicContact CG2-CD1 3.69Å; I41-I45 HydrophobicContact CG2-CG1 4.26Å; I41-I45 VanDerWaalsContact O-CG1 3.32Å; I41-I45 WeakPolarHBondContact O-CG1 3.4Å; I41-I45 PolarHBondContact O-N 2.94Å; I45-S47 VanDerWaalsContact C-N 3.35Å; I45-S47 PolarHBondContact O-N 2.91Å; I45-K48 PolarHBondContact O-N 2.73Å; I45-L49 HydrophobicContact CG2-CD1 3.76Å; I45-L49 HydrophobicContact CG2-CG 4.43Å; I45-L49 WeakPolarHBondContact O-CB 3.39Å; I45-L49 VanDerWaalsContact O-CG 3.27Å; I45-L49 WeakPolarHBondContact O-CG 3.21Å; I45-L49 PolarHBondContact O-N 2.85Å; I45-F321 HydrophobicContact CD1-CE1 3.8Å; I45-W327 HydrophobicContact CB-CH2 3.92Å; I45-W327 HydrophobicContact CB-CZ3 3.97Å; I45-W327 HydrophobicContact CD1-CH2 4.3Å; I45-W327 HydrophobicContact CD1-CZ3 3.67Å; I45-W327 HydrophobicContact CG1-CZ3 4.4Å; I45-W327 HydrophobicContact CG2-CH2 4Å; I45-W327 HydrophobicContact CG2-CZ3 3.78Å; I45-W329 HydrophobicContact CG2-CH2 4.29Å; I45-L398 HydrophobicContact CB-CD1 4.4Å; I45-L398 HydrophobicContact CG1-CD1 3.88Å; I45-L398 HydrophobicContact CG2-CD1 4.07Å; I45-M401 HydrophobicContact CD1-CE 3.96Å; I45-M401 HydrophobicContact CG1-CE 3.47Å; I45-M401 VanDerWaalsContact CG1-CE 3.47Å; I45-M401 HydrophobicContact CG1-SD 4.41Å
46	L	84.7	Confident	83.2	Confident	24 Å²	24	57.4 Å²	57.4	13%	0.126	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-44.1	179.4	-70.3	178.6	0	0	0	111.6	R42 G43 L49 R50 L51 P54 W327	R42-L46 WeakPolarHBondContact O-CG 3Å; R42-L46 PolarHBondContact O-N 3.1Å; G43-L46 PolarHBondContact O-N 3.37Å; L46-L49 CarbonylContact O-C 3.6Å; L46-L49 PolarHBondContact O-N 2.84Å; L46-R50 WeakPolarHBondContact O-CA 3.45Å; L46-R50 PolarHBondContact O-N 2.95Å; L46-L51 WeakPolarHBondContact CB-O 3.48Å; L46-L51 HydrophobicContact CD2-CB 4.03Å; L46-L51 PolarHBondContact O-N 2.86Å; L46-P54 HydrophobicContact CD2-CG 4.43Å; L46-W327 HydrophobicContact CD1-CZ2 4.17Å; L46-W327 HydrophobicContact CD2-CH2 4.43Å; L46-W327 HydrophobicContact CD2-CZ2 4.27Å; L46-W327 HydrophobicContact CG-CH2 4.11Å; L46-W327 HydrophobicContact CG-CZ2 4.01Å
47	S	81.3	Confident	82.5	Confident	61 Å²	61	54.2 Å²	54.2	43%	0.427	30%	0.301	S	S	.	.	H	α-helix	trans	-61.8	-46.8	176.4	178.4	0	0	0	0	112.7	G43 I45 L49 R50	G43-S47 WeakPolarHBondContact O-CB 3.48Å; G43-S47 PolarHBondContact O-N 2.77Å; I45-S47 VanDerWaalsContact C-N 3.35Å; I45-S47 PolarHBondContact O-N 2.91Å; S47-L49 VanDerWaalsContact C-N 3.3Å; S47-L49 PolarHBondContact O-N 2.9Å; S47-R50 WeakPolarHBondContact O-CA 3.46Å; S47-R50 PolarHBondContact O-N 2.9Å
48	K	81.4	Confident	81.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.6	-33.3	179	-76.3	177.2	179.1	-76.9	0	113.2	Q44 I45 R50 Y98 L398 S399 M401	Q44-K48 HydrophobicContact CG-CD 4.04Å; Q44-K48 VanDerWaalsContact NE2-CE 3.34Å; Q44-K48 WeakPolarHBondContact O-CB 3.41Å; Q44-K48 VanDerWaalsContact O-CG 3.28Å; Q44-K48 WeakPolarHBondContact O-CG 3.32Å; Q44-K48 PolarHBondContact O-N 3.36Å; I45-K48 PolarHBondContact O-N 2.73Å; K48-R50 VanDerWaalsContact C-N 3.28Å; K48-Y98 HydrophobicContact CG-CE1 4.43Å; K48-Y98 PolarHBondContact NZ-O 3.12Å; K48-L398 HydrophobicContact CB-CD2 4.07Å; K48-L398 HydrophobicContact CD-CB 4.45Å; K48-S399 WeakPolarHBondContact CE-O 2.94Å; K48-S399 PolarHBondContact NZ-O 3.04Å; K48-S399 PolarHBondContact NZ-OG 3.22Å; K48-M401 HydrophobicContact CD-SD 3.98Å
49	L	80.5	Confident	81.1	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-80.4	-11.3	173.3	-64.3	175.3	0	0	0	112.8	I45 L46 S47 L51 A100 R285 W329 I385 Y387 E396 L398	I45-L49 HydrophobicContact CG2-CD1 3.76Å; I45-L49 HydrophobicContact CG2-CG 4.43Å; I45-L49 WeakPolarHBondContact O-CB 3.39Å; I45-L49 VanDerWaalsContact O-CG 3.27Å; I45-L49 WeakPolarHBondContact O-CG 3.21Å; I45-L49 PolarHBondContact O-N 2.85Å; L46-L49 CarbonylContact O-C 3.6Å; L46-L49 PolarHBondContact O-N 2.84Å; S47-L49 VanDerWaalsContact C-N 3.3Å; S47-L49 PolarHBondContact O-N 2.9Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 HydrophobicContact CB-CB 4.49Å; L49-L51 HydrophobicContact CB-CD1 3.89Å; L49-L51 HydrophobicContact CB-CG 3.83Å; L49-L51 HydrophobicContact CD1-CD1 3.97Å; L49-A100 HydrophobicContact CD2-CB 4.13Å; L49-R285 PolarHBondContact O-NH2 2.95Å; L49-W329 HydrophobicContact CD1-CH2 3.65Å; L49-W329 HydrophobicContact CD1-CZ3 4.13Å; L49-I385 HydrophobicContact CD1-CD1 3.92Å; L49-I385 HydrophobicContact CD2-CD1 4.22Å; L49-Y387 HydrophobicContact CD2-CE1 4.08Å; L49-E396 HydrophobicContact CD2-CB 4.35Å; L49-E396 WeakPolarHBondContact CD2-OE2 3.05Å; L49-L398 HydrophobicContact CD2-CD2 3.68Å; L49-L398 HydrophobicContact CG-CD2 3.95Å
50	R	80.2	Confident	80.8	Confident	111 Å²	111	55.4 Å²	55.4	42%	0.419	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	42.2	-169.3	-61	-165.6	176.1	-169.7	-0.2	113	L46 S47 K48 Y99 H284	L46-R50 WeakPolarHBondContact O-CA 3.45Å; L46-R50 PolarHBondContact O-N 2.95Å; S47-R50 WeakPolarHBondContact O-CA 3.46Å; S47-R50 PolarHBondContact O-N 2.9Å; K48-R50 VanDerWaalsContact C-N 3.28Å; R50-Y99 PolarHBondContact NH2-OH 2.87Å; R50-H284 PolarHBondContact NH1-O 2.96Å
51	L	79.4	Confident	80.2	Confident	49 Å²	49	61.1 Å²	61.1	26%	0.257	35%	0.345	S	S	.	.			trans	-102.6	131.4	173.6	-62.5	176.6	0	0	0	109.4	L46 L49	L46-L51 WeakPolarHBondContact CB-O 3.48Å; L46-L51 HydrophobicContact CD2-CB 4.03Å; L46-L51 PolarHBondContact O-N 2.86Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 HydrophobicContact CB-CB 4.49Å; L49-L51 HydrophobicContact CB-CD1 3.89Å; L49-L51 HydrophobicContact CB-CG 3.83Å; L49-L51 HydrophobicContact CD1-CD1 3.97Å
52	T	81.3	Confident	79.9	Confident	146 Å²	146	69 Å²	69	90%	0.896	38%	0.382	S	S	*	.	S	Bend	trans	-76.6	-29.5	174.3	49	0	0	0	0	112
53	S	83.6	Confident	79.7	Confident	63 Å²	63	66.6 Å²	66.6	44%	0.441	38%	0.376	S	S	.	.	S	Bend	trans	-146.4	159.3	175.1	63.3	0	0	0	0	110.7
54	P	83.6	Confident	79.8	Confident	48 Å²	48	67.9 Å²	67.9	31%	0.312	38%	0.376	S	S	.	.			trans	-49.3	140.7	169.4	-30.2	38.2	0	0	0	112.5	L46 Q56 W329	L46-P54 HydrophobicContact CD2-CG 4.43Å; P54-Q56 PolarHBondContact O-N 3.37Å; P54-W329 HydrophobicContact CB-CG 4.47Å
55	P	81.7	Confident	79.6	Confident	24 Å²	24	70.4 Å²	70.4	16%	0.156	39%	0.387	C	S	.	.			trans	-63.5	133.5	176.5	23.1	-28.3	0	0	0	110.3	T57 W329 Y387	P55-T57 VanDerWaalsContact C-N 3.3Å; P55-T57 PolarHBondContact O-N 3.34Å; P55-W329 HydrophobicContact CG-CB 4.13Å; P55-W329 HydrophobicContact CG-CD2 3.82Å; P55-W329 HydrophobicContact CG-CE3 3.55Å; P55-W329 HydrophobicContact CG-CG 4.08Å; P55-W329 HydrophobicContact CG-CZ3 4.25Å; P55-Y387 HydrophobicContact CG-CD2 4.38Å
56	Q	72.1	Confident	79.5	Confident	187 Å²	187	77.5 Å²	77.5	87%	0.874	42%	0.42	S	S	*	.	S	Bend	trans	-72.1	-24.2	-175.3	-64.2	179.2	2.6	0	0	112.8	P54	P54-Q56 PolarHBondContact O-N 3.37Å
57	T	71.3	Confident	79.5	Confident	66 Å²	66	77.3 Å²	77.3	41%	0.405	42%	0.42	S	S	.	.			trans	-87.8	114.9	179.4	55.2	0	0	0	0	110.9	P55 G59 G390	P55-T57 VanDerWaalsContact C-N 3.3Å; P55-T57 PolarHBondContact O-N 3.34Å; T57-G59 PolarHBondContact O-N 2.93Å; T57-G390 WeakPolarHBondContact OG1-CA 3.39Å; T57-G390 PolarHBondContact OG1-N 3.46Å
58	L	70.4	Confident	79.7	Confident	91 Å²	91	76.9 Å²	76.9	48%	0.476	41%	0.413	S	S	.	.			trans	-75	0.5	-178.1	-72.7	155	0	0	0	114.5	R328 W329 H331	L58-R328 VanDerWaalsContact CD2-C 3.5Å; L58-R328 HydrophobicContact CD2-CB 3.45Å; L58-R328 VanDerWaalsContact CD2-CB 3.45Å; L58-R328 WeakPolarHBondContact CD2-O 3.46Å; L58-W329 HydrophobicContact CD2-CB 4.42Å; L58-H331 PolarHBondContact O-CE1 3.12Å; L58-H331 PolarHBondContact O-NE2 3.4Å; L58-H331 VanDerWaalsContact O-NE2 3.13Å
59	G	73.9	Confident	79.9	Confident	26 Å²	26	77.6 Å²	77.6	27%	0.268	42%	0.417	S	S	.	.			trans	62	-173.4	-175.3	0	0	0	0	0	113	T57	T57-G59 PolarHBondContact O-N 2.93Å
60	P	78.8	Confident	80.2	Confident	57 Å²	57	78.5 Å²	78.5	37%	0.37	42%	0.422	S	S	.	.			trans	-69.2	148	174	29.1	-33.4	0	0	0	111.6	Q62 H331 Y388	P60-Q62 VanDerWaalsContact C-N 3.25Å; P60-Q62 PolarHBondContact O-N 2.9Å; P60-H331 PolarHBondContact O-NE2 3Å; P60-H331 VanDerWaalsContact O-NE2 3.13Å; P60-Y388 HydrophobicContact CG-CE1 3.93Å; P60-Y388 HydrophobicContact CG-CE2 4.22Å
61	N	74.3	Confident	80.7	Confident	173 Å²	173	73.9 Å²	73.9	93%	0.925	41%	0.405	S	S	*	.	S	Bend	trans	-61.7	-34.1	177.2	-73.7	-12.1	0	0	0	112.6
62	Q	79.3	Confident	81.2	Confident	165 Å²	165	75 Å²	75	77%	0.771	41%	0.411	S	S	*	.	S	Bend	trans	-112.6	122.2	175.9	-168.4	172.3	9.1	0	0	109.6	P60	P60-Q62 VanDerWaalsContact C-N 3.25Å; P60-Q62 PolarHBondContact O-N 2.9Å
63	V	83	Confident	81.5	Confident	24 Å²	24	68.2 Å²	68.2	15%	0.145	37%	0.37	C	S	.	.			trans	-67.8	131.5	175.7	176.8	0	0	0	0	109.1	F65 V67 L68 H331 L386 Y388	V63-F65 PolarHBondContact O-N 3.5Å; V63-V67 HydrophobicContact CG1-CB 3.86Å; V63-V67 HydrophobicContact CG1-CG1 4.03Å; V63-L68 HydrophobicContact CG1-CB 4.38Å; V63-H331 HydrophobicContact CG2-CB 3.7Å; V63-L386 HydrophobicContact CB-CD2 4.35Å; V63-L386 HydrophobicContact CG1-CD2 3.54Å; V63-L386 HydrophobicContact CG2-CD2 3.93Å; V63-Y388 HydrophobicContact CG2-CE2 4.46Å
64	P	86.3	Confident	81.7	Confident	66 Å²	66	65.2 Å²	65.2	43%	0.429	35%	0.349	S	S	.	.			trans	-56.9	137.4	172.3	-24.1	34.8	0	0	0	111.6	Q66 V67 L68 Y388	P64-Q66 PolarHBondContact O-N 3.33Å; P64-Q66 VanDerWaalsContact O-N 3.07Å; P64-V67 HydrophobicContact CB-CG2 4.35Å; P64-V67 WeakPolarHBondContact O-CB 3.21Å; P64-V67 PolarHBondContact O-N 3.44Å; P64-L68 PolarHBondContact O-N 3.38Å; P64-Y388 WeakPolarHBondContact CD-OH 3.42Å
65	F	80.4	Confident	82	Confident	92 Å²	92	67.6 Å²	67.6	40%	0.404	35%	0.354	S	S	.	.	H	α-helix	trans	-57.2	-30.4	-174.1	-173.1	-105.9	0	0	0	114	V63 V67 L68 S69 Q268 Q271	V63-F65 PolarHBondContact O-N 3.5Å; F65-V67 VanDerWaalsContact C-N 3.35Å; F65-V67 PolarHBondContact O-N 3.46Å; F65-L68 PolarHBondContact O-N 2.74Å; F65-S69 WeakPolarHBondContact O-CB 3.46Å; F65-S69 PolarHBondContact O-N 2.79Å; F65-Q268 HydrophobicContact CD1-CB 4.38Å; F65-Q268 HydrophobicContact CD1-CG 3.68Å; F65-Q268 HydrophobicContact CE1-CB 3.7Å; F65-Q268 HydrophobicContact CE1-CG 3.4Å; F65-Q268 VanDerWaalsContact CE1-CG 3.4Å; F65-Q268 HydrophobicContact CG-CG 4.49Å; F65-Q268 HydrophobicContact CZ-CB 4.3Å; F65-Q268 HydrophobicContact CZ-CG 4.02Å; F65-Q271 HydrophobicContact CE1-CG 4.27Å; F65-Q271 PolarHBondContact O-NE2 3.39Å
66	Q	81.4	Confident	82.3	Confident	150 Å²	150	70.3 Å²	70.3	70%	0.701	37%	0.365	S	S	*	.	H	α-helix	trans	-64.7	-37	175.9	-174.8	176.8	-1.8	0	0	113	P64 S69 L70	P64-Q66 PolarHBondContact O-N 3.33Å; P64-Q66 VanDerWaalsContact O-N 3.07Å; Q66-S69 WeakPolarHBondContact O-CB 3.28Å; Q66-L70 PolarHBondContact O-N 3.03Å
67	V	85.2	Confident	83.1	Confident	20 Å²	20	61.4 Å²	61.4	12%	0.121	32%	0.323	C	S	.	.	H	α-helix	trans	-75.5	-39.1	179	-178.8	0	0	0	0	110.2	V63 P64 F65 S69 L70 Y71 L386 P393 V395	V63-V67 HydrophobicContact CG1-CB 3.86Å; V63-V67 HydrophobicContact CG1-CG1 4.03Å; P64-V67 HydrophobicContact CB-CG2 4.35Å; P64-V67 WeakPolarHBondContact O-CB 3.21Å; P64-V67 PolarHBondContact O-N 3.44Å; F65-V67 VanDerWaalsContact C-N 3.35Å; F65-V67 PolarHBondContact O-N 3.46Å; V67-S69 VanDerWaalsContact C-N 3.29Å; V67-S69 PolarHBondContact O-N 3.35Å; V67-L70 WeakPolarHBondContact O-CB 2.95Å; V67-L70 PolarHBondContact O-N 3.02Å; V67-Y71 PolarHBondContact O-N 3.16Å; V67-L386 HydrophobicContact CG1-CD1 3.35Å; V67-L386 HydrophobicContact CG1-CD2 3.89Å; V67-L386 HydrophobicContact CG1-CG 4.28Å; V67-P393 HydrophobicContact CB-CB 4.44Å; V67-P393 HydrophobicContact CG1-CB 3.76Å; V67-P393 HydrophobicContact CG1-CG 4.46Å; V67-P393 HydrophobicContact CG2-CB 3.8Å; V67-P393 HydrophobicContact CG2-CG 3.65Å; V67-V395 HydrophobicContact CG1-CG2 4.21Å
68	L	86.4	Confident	83.7	Confident	52 Å²	52	59.5 Å²	59.5	27%	0.272	31%	0.31	S	S	.	.	H	α-helix	trans	-63.4	-36.8	174.9	-170.2	65.9	0	0	0	111.7	V63 P64 F65 L70 Y71 N72 E332	V63-L68 HydrophobicContact CG1-CB 4.38Å; P64-L68 PolarHBondContact O-N 3.38Å; F65-L68 PolarHBondContact O-N 2.74Å; L68-L70 VanDerWaalsContact C-N 3.34Å; L68-L70 PolarHBondContact O-N 2.76Å; L68-Y71 HydrophobicContact CD1-CD1 4.36Å; L68-Y71 PolarHBondContact O-N 2.89Å; L68-N72 PolarHBondContact O-N 3.29Å; L68-E332 HydrophobicContact CD1-CG 4.17Å
69	S	85.1	Confident	84.4	Confident	14 Å²	14	59.3 Å²	59.3	10%	0.098	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-44.1	172.5	-171.6	0	0	0	0	113.1	F65 Q66 V67 N72 S73 K105 Q271	F65-S69 WeakPolarHBondContact O-CB 3.46Å; F65-S69 PolarHBondContact O-N 2.79Å; Q66-S69 WeakPolarHBondContact O-CB 3.28Å; V67-S69 VanDerWaalsContact C-N 3.29Å; V67-S69 PolarHBondContact O-N 3.35Å; S69-N72 PolarHBondContact O-N 2.94Å; S69-S73 WeakPolarHBondContact O-CB 3.26Å; S69-S73 PolarHBondContact O-N 3.43Å; S69-K105 PolarHBondContact OG-NZ 3.48Å; S69-Q271 WeakPolarHBondContact OG-CB 3.22Å; S69-Q271 PolarHBondContact OG-OE1 3.34Å
70	L	87.4	Confident	84.9	Confident	25 Å²	25	59.4 Å²	59.4	13%	0.131	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-48.5	175.5	178.1	56.8	0	0	0	110.3	Q66 V67 L68 N72 S73 T74 I103 K105 V395	Q66-L70 PolarHBondContact O-N 3.03Å; V67-L70 WeakPolarHBondContact O-CB 2.95Å; V67-L70 PolarHBondContact O-N 3.02Å; L68-L70 VanDerWaalsContact C-N 3.34Å; L68-L70 PolarHBondContact O-N 2.76Å; L70-N72 PolarHBondContact O-N 2.81Å; L70-S73 PolarHBondContact O-N 3.34Å; L70-T74 HydrophobicContact CD1-CG2 3.93Å; L70-T74 WeakPolarHBondContact O-CB 3.4Å; L70-T74 WeakPolarHBondContact O-CG2 3.36Å; L70-T74 PolarHBondContact O-N 2.89Å; L70-T74 PolarHBondContact O-OG1 3.43Å; L70-I103 HydrophobicContact CD1-CG2 4.12Å; L70-K105 HydrophobicContact CD1-CB 3.4Å; L70-K105 VanDerWaalsContact CD1-CB 3.4Å; L70-K105 HydrophobicContact CD1-CD 4.33Å; L70-K105 HydrophobicContact CD1-CG 4.48Å; L70-V395 HydrophobicContact CB-CG2 4.49Å; L70-V395 HydrophobicContact CD2-CB 4.07Å; L70-V395 HydrophobicContact CD2-CG2 3.82Å; L70-V395 HydrophobicContact CG-CB 4.3Å; L70-V395 HydrophobicContact CG-CG1 4.48Å; L70-V395 HydrophobicContact CG-CG2 4.04Å
71	Y	89.3	Confident	85.1	Confident	14 Å²	14	58.6 Å²	58.6	6%	0.055	29%	0.293	C	S	.	.	H	α-helix	trans	-59.4	-47.6	177.4	174.3	-95.6	0	0	0	112.4	V67 L68 T74 K75 E332 P333 T384 L386	V67-Y71 PolarHBondContact O-N 3.16Å; L68-Y71 HydrophobicContact CD1-CD1 4.36Å; L68-Y71 PolarHBondContact O-N 2.89Å; Y71-T74 WeakPolarHBondContact CA-OG1 3.26Å; Y71-T74 PolarHBondContact O-N 2.86Å; Y71-T74 PolarHBondContact O-OG1 3.12Å; Y71-K75 WeakPolarHBondContact O-CB 3.28Å; Y71-K75 PolarHBondContact O-N 3.27Å; Y71-E332 HydrophobicContact CD1-CB 4.14Å; Y71-E332 HydrophobicContact CD2-CB 4.33Å; Y71-E332 HydrophobicContact CE1-CB 3.8Å; Y71-E332 HydrophobicContact CE1-CG 4.44Å; Y71-E332 HydrophobicContact CE2-CB 4Å; Y71-E332 HydrophobicContact CG-CB 4.39Å; Y71-P333 WeakPolarHBondContact OH-CB 3.39Å; Y71-P333 WeakPolarHBondContact OH-CD 3.41Å; Y71-T384 HydrophobicContact CD2-CG2 3.98Å; Y71-T384 HydrophobicContact CE2-CG2 4.12Å; Y71-L386 HydrophobicContact CD2-CB 4.15Å
72	N	90.1	Very high	85	Confident	71 Å²	71	51.6 Å²	51.6	38%	0.38	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-46.5	179.9	-71.6	-11.8	0	0	0	111.9	L68 S69 L70 T74 K75 E76	L68-N72 PolarHBondContact O-N 3.29Å; S69-N72 PolarHBondContact O-N 2.94Å; L70-N72 PolarHBondContact O-N 2.81Å; N72-T74 VanDerWaalsContact C-N 3.27Å; N72-T74 PolarHBondContact O-N 2.92Å; N72-K75 PolarHBondContact O-N 3.35Å; N72-E76 WeakPolarHBondContact O-CG 3.28Å; N72-E76 PolarHBondContact O-N 2.9Å
73	S	88.4	Confident	85	Confident	5 Å²	5	50.5 Å²	50.5	4%	0.035	25%	0.25	C	S	.	.	H	α-helix	trans	-66.2	-30.6	-179.8	-167.6	0	0	0	0	112.8	S69 L70 L77 H275	S69-S73 WeakPolarHBondContact O-CB 3.26Å; S69-S73 PolarHBondContact O-N 3.43Å; L70-S73 PolarHBondContact O-N 3.34Å; S73-L77 VanDerWaalsContact O-CB 3.31Å; S73-L77 WeakPolarHBondContact O-CB 3.46Å; S73-L77 PolarHBondContact O-N 3.18Å; S73-L77 VanDerWaalsContact O-N 3.12Å; S73-H275 PolarHBondContact OG-CE1 2.87Å; S73-H275 PolarHBondContact OG-NE2 2.84Å
74	T	88.3	Confident	84.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-76.3	-38.5	176.1	51.1	0	0	0	0	111.6	L70 Y71 N72 L77 I78 I103 I277	L70-T74 HydrophobicContact CD1-CG2 3.93Å; L70-T74 WeakPolarHBondContact O-CB 3.4Å; L70-T74 WeakPolarHBondContact O-CG2 3.36Å; L70-T74 PolarHBondContact O-N 2.89Å; L70-T74 PolarHBondContact O-OG1 3.43Å; Y71-T74 WeakPolarHBondContact CA-OG1 3.26Å; Y71-T74 PolarHBondContact O-N 2.86Å; Y71-T74 PolarHBondContact O-OG1 3.12Å; N72-T74 VanDerWaalsContact C-N 3.27Å; N72-T74 PolarHBondContact O-N 2.92Å; T74-L77 PolarHBondContact O-N 2.9Å; T74-I78 WeakPolarHBondContact O-CB 3.43Å; T74-I78 WeakPolarHBondContact O-CD1 3Å; T74-I78 VanDerWaalsContact O-CG1 3.27Å; T74-I78 WeakPolarHBondContact O-CG1 3.4Å; T74-I78 PolarHBondContact O-N 3.24Å; T74-I103 HydrophobicContact CG2-CB 4.27Å; T74-I103 HydrophobicContact CG2-CD1 3.73Å; T74-I103 HydrophobicContact CG2-CG2 3.41Å; T74-I103 VanDerWaalsContact CG2-CG2 3.41Å; T74-I277 HydrophobicContact CG2-CD1 4.07Å; T74-I277 HydrophobicContact CG2-CG2 3.99Å
75	K	88.5	Confident	83.5	Confident	97 Å²	97	54.7 Å²	54.7	42%	0.422	26%	0.26	S	S	.	.	H	α-helix	trans	-58.6	-51.5	172	-177.5	-175.7	171.4	-169.7	0	111.2	Y71 N72 L77 I78 E79	Y71-K75 WeakPolarHBondContact O-CB 3.28Å; Y71-K75 PolarHBondContact O-N 3.27Å; N72-K75 PolarHBondContact O-N 3.35Å; K75-L77 VanDerWaalsContact C-N 3.32Å; K75-L77 PolarHBondContact O-N 3.43Å; K75-I78 PolarHBondContact O-N 3.01Å; K75-E79 WeakPolarHBondContact CE-OE1 3.48Å; K75-E79 WeakPolarHBondContact O-CG 3.05Å; K75-E79 PolarHBondContact O-N 3.3Å
76	E	89.2	Confident	82.6	Confident	82 Å²	82	56.4 Å²	56.4	38%	0.383	27%	0.269	S	S	.	.	H	α-helix	trans	-59.9	-40.6	177.7	-72	174.1	-163.8	0	0	112.2	N72 E79 E80 W197	N72-E76 WeakPolarHBondContact O-CG 3.28Å; N72-E76 PolarHBondContact O-N 2.9Å; E76-E79 PolarHBondContact O-N 3.3Å; E76-E80 WeakPolarHBondContact O-CB 3.45Å; E76-E80 PolarHBondContact O-N 3.07Å; E76-W197 PolarHBondContact OE2-NE1 3.48Å
77	L	87.4	Confident	81.5	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-45.2	175.6	172.9	63.9	0	0	0	112.6	S73 T74 K75 E79 E80 L81 E148 R150 I277 M279	S73-L77 VanDerWaalsContact O-CB 3.31Å; S73-L77 WeakPolarHBondContact O-CB 3.46Å; S73-L77 PolarHBondContact O-N 3.18Å; S73-L77 VanDerWaalsContact O-N 3.12Å; T74-L77 PolarHBondContact O-N 2.9Å; K75-L77 VanDerWaalsContact C-N 3.32Å; K75-L77 PolarHBondContact O-N 3.43Å; L77-E79 VanDerWaalsContact C-N 3.31Å; L77-E79 PolarHBondContact O-N 3.43Å; L77-E80 WeakPolarHBondContact O-CB 3.03Å; L77-E80 PolarHBondContact O-N 3.25Å; L77-L81 HydrophobicContact CD1-CD1 4.03Å; L77-L81 HydrophobicContact CD1-CG 4.06Å; L77-L81 HydrophobicContact CG-CD1 4Å; L77-L81 HydrophobicContact CG-CG 4.43Å; L77-L81 WeakPolarHBondContact O-CG 3.48Å; L77-L81 PolarHBondContact O-N 2.83Å; L77-E148 HydrophobicContact CD1-CB 4.04Å; L77-E148 HydrophobicContact CD1-CG 3.84Å; L77-E148 HydrophobicContact CD2-CB 3.79Å; L77-E148 HydrophobicContact CD2-CG 3.87Å; L77-E148 HydrophobicContact CG-CG 4.42Å; L77-R150 VanDerWaalsContact CA-NH1 3.27Å; L77-R150 VanDerWaalsContact CB-NH1 3.32Å; L77-I277 HydrophobicContact CD2-CB 4.21Å; L77-I277 HydrophobicContact CD2-CD1 3.97Å; L77-I277 HydrophobicContact CD2-CG2 4.06Å; L77-M279 HydrophobicContact CD2-CE 3.71Å; L77-M279 HydrophobicContact CG-CE 4.49Å
78	I	85	Confident	79.9	Confident	25 Å²	25	59.2 Å²	59.2	13%	0.128	29%	0.288	C	S	.	.	H	α-helix	trans	-67.4	-37	-178.9	-70.7	161.8	0	0	0	110.8	T74 K75 E80 G82 P382 T384 Q397	T74-I78 WeakPolarHBondContact O-CB 3.43Å; T74-I78 WeakPolarHBondContact O-CD1 3Å; T74-I78 VanDerWaalsContact O-CG1 3.27Å; T74-I78 WeakPolarHBondContact O-CG1 3.4Å; T74-I78 PolarHBondContact O-N 3.24Å; K75-I78 PolarHBondContact O-N 3.01Å; I78-E80 VanDerWaalsContact C-N 3.35Å; I78-G82 PolarHBondContact O-N 3.49Å; I78-P382 HydrophobicContact CG2-CG 3.92Å; I78-T384 WeakPolarHBondContact CD1-OG1 3.48Å; I78-Q397 HydrophobicContact CD1-CG 3.91Å; I78-Q397 VanDerWaalsContact CD1-NE2 3.35Å
79	E	85.4	Confident	78	Confident	88 Å²	88	63.1 Å²	63.1	41%	0.411	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-41	173	-71.6	175.8	-170.8	0	0	111.8	K75 E76 L77 G82 R83	K75-E79 WeakPolarHBondContact CE-OE1 3.48Å; K75-E79 WeakPolarHBondContact O-CG 3.05Å; K75-E79 PolarHBondContact O-N 3.3Å; E76-E79 PolarHBondContact O-N 3.3Å; L77-E79 VanDerWaalsContact C-N 3.31Å; L77-E79 PolarHBondContact O-N 3.43Å; E79-G82 PolarHBondContact O-N 3.06Å; E79-R83 WeakPolarHBondContact O-CG 3.42Å; E79-R83 PolarHBondContact O-N 3.24Å
80	E	84.5	Confident	76	Confident	27 Å²	27	64.6 Å²	64.6	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-51.4	175.3	-170.9	-178	170.1	0	0	111.6	E76 L77 I78 G82 R83 D84 R150 K187 S199	E76-E80 WeakPolarHBondContact O-CB 3.45Å; E76-E80 PolarHBondContact O-N 3.07Å; L77-E80 WeakPolarHBondContact O-CB 3.03Å; L77-E80 PolarHBondContact O-N 3.25Å; I78-E80 VanDerWaalsContact C-N 3.35Å; E80-G82 PolarHBondContact O-N 2.88Å; E80-R83 WeakPolarHBondContact O-CB 3.48Å; E80-R83 PolarHBondContact O-N 2.83Å; E80-D84 PolarHBondContact O-N 2.99Å; E80-R150 IonicContact OE2-CZ 3.05Å; E80-R150 IonicContact OE2-NH1 3.6Å; E80-R150 PolarHBondContact OE2-NH1 2.98Å; E80-R150 IonicContact OE2-NH2 2.65Å; E80-R150 PolarHBondContact OE2-NH2 2.83Å; E80-K187 IonicContact OE1-NZ 3.99Å; E80-S199 VanDerWaalsContact CD-OG 3.24Å; E80-S199 WeakPolarHBondContact OE1-CB 3.3Å; E80-S199 PolarHBondContact OE1-OG 3.19Å
81	L	81.9	Confident	73.8	Confident	40 Å²	40	70.8 Å²	70.8	21%	0.209	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-34.2	175.9	-69	172.6	0	0	0	112.5	L77 R85	L77-L81 HydrophobicContact CD1-CD1 4.03Å; L77-L81 HydrophobicContact CD1-CG 4.06Å; L77-L81 HydrophobicContact CG-CD1 4Å; L77-L81 HydrophobicContact CG-CG 4.43Å; L77-L81 WeakPolarHBondContact O-CG 3.48Å; L77-L81 PolarHBondContact O-N 2.83Å; L81-R85 VanDerWaalsContact O-CB 3.32Å; L81-R85 WeakPolarHBondContact O-CB 3.22Å; L81-R85 PolarHBondContact O-N 3.09Å
82	G	73.3	Confident	71.5	Confident	26 Å²	26	76 Å²	76	27%	0.268	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-41.1	174.7	0	0	0	0	0	112.8	I78 E79 E80 Q86	I78-G82 PolarHBondContact O-N 3.49Å; E79-G82 PolarHBondContact O-N 3.06Å; E80-G82 PolarHBondContact O-N 2.88Å; G82-Q86 WeakPolarHBondContact O-CG 3.24Å; G82-Q86 PolarHBondContact O-N 2.85Å
83	R	77.9	Confident	69.3	Low	142 Å²	142	79.5 Å²	79.5	54%	0.536	41%	0.412	S	S	.	.	H	α-helix	trans	-68.3	-44	176.5	-65.3	177.2	-149.1	137.3	6.3	111.4	E79 E80 R85 Q86 Q87	E79-R83 WeakPolarHBondContact O-CG 3.42Å; E79-R83 PolarHBondContact O-N 3.24Å; E80-R83 WeakPolarHBondContact O-CB 3.48Å; E80-R83 PolarHBondContact O-N 2.83Å; R83-R85 VanDerWaalsContact C-N 3.32Å; R83-R85 PolarHBondContact O-N 2.03Å; R83-Q86 WeakPolarHBondContact O-CB 3.07Å; R83-Q86 PolarHBondContact O-N 3.15Å; R83-Q86 VanDerWaalsContact O-N 3.16Å; R83-Q87 PolarHBondContact O-N 2.03Å
84	D	70.8	Confident	67.5	Low	67 Å²	67	82 Å²	82	36%	0.358	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-40.9	178.9	-70.8	-4	0	0	0	111	E80 Q86 Q87 S88	E80-D84 PolarHBondContact O-N 2.99Å; D84-Q86 VanDerWaalsContact C-N 3.3Å; D84-Q86 PolarHBondContact O-N 2.73Å; D84-Q87 CarbonylContact O-C 3.54Å; D84-Q87 PolarHBondContact O-N 2.98Å; D84-S88 PolarHBondContact O-N 3.19Å; D84-S88 PolarHBondContact O-OG 3.37Å
85	R	67.1	Low	65.5	Low	111 Å²	111	86 Å²	86	42%	0.419	45%	0.445	S	S	.	.	H	α-helix	trans	-64.2	-30.9	175.7	-168.4	177.9	-174.6	172.9	5.4	113.2	L81 R83 Q87 E97	L81-R85 VanDerWaalsContact O-CB 3.32Å; L81-R85 WeakPolarHBondContact O-CB 3.22Å; L81-R85 PolarHBondContact O-N 3.09Å; R83-R85 VanDerWaalsContact C-N 3.32Å; R83-R85 PolarHBondContact O-N 2.03Å; R85-Q87 VanDerWaalsContact C-N 3.28Å; R85-E97 IonicContact NH1-OE1 3.91Å; R85-E97 PolarHBondContact NH1-OE1 2.76Å
86	Q	61.8	Low	63.6	Low	128 Å²	128	84.6 Å²	84.6	60%	0.598	45%	0.445	S	S	*	.	H	α-helix	trans	-71	-27.3	173.6	-73.5	172.2	-16.3	0	0	112.1	G82 R83 D84	G82-Q86 WeakPolarHBondContact O-CG 3.24Å; G82-Q86 PolarHBondContact O-N 2.85Å; R83-Q86 WeakPolarHBondContact O-CB 3.07Å; R83-Q86 PolarHBondContact O-N 3.15Å; R83-Q86 VanDerWaalsContact O-N 3.16Å; D84-Q86 VanDerWaalsContact C-N 3.3Å; D84-Q86 PolarHBondContact O-N 2.73Å
87	Q	59.2	Low	61.9	Low	164 Å²	164	81.9 Å²	81.9	77%	0.766	43%	0.432	S	S	*	.	H	α-helix	trans	-86.2	-33.8	177.7	-68.5	177.2	0	0	0	112.6	R83 D84 R85	R83-Q87 PolarHBondContact O-N 2.03Å; D84-Q87 CarbonylContact O-C 3.54Å; D84-Q87 PolarHBondContact O-N 2.98Å; R85-Q87 VanDerWaalsContact C-N 3.28Å
88	S	51.6	Low	60.2	Low	65 Å²	65	86.2 Å²	86.2	46%	0.455	45%	0.449	S	S	.	.			trans	-92.9	118.5	176.5	72.1	0	0	0	0	111.4	D84 G90	D84-S88 PolarHBondContact O-N 3.19Å; D84-S88 PolarHBondContact O-OG 3.37Å; S88-G90 PolarHBondContact O-N 3.11Å
89	C	46.3	Very low	59.3	Low	135 Å²	135	87.2 Å²	87.2	91%	0.912	45%	0.452	S	S	*	.			trans	-70.7	28.4	171.7	-70.7	0	0	0	0	113.8
90	G	42.7	Very low	58.6	Low	44 Å²	44	83 Å²	83	45%	0.454	43%	0.432	S	S	.	.			trans	-77.1	132.9	-176.9	0	0	0	0	0	112.7	S88	S88-G90 PolarHBondContact O-N 3.11Å
91	Q	41.9	Very low	58.6	Low	155 Å²	155	81.8 Å²	81.8	72%	0.724	43%	0.426	S	S	*	.			trans	-89.7	108.5	171.1	-74	-176.1	-62.4	0	0	109.6
92	D	40.8	Very low	58.7	Low	124 Å²	124	81.3 Å²	81.3	66%	0.663	42%	0.423	S	S	*	.			trans	-107.2	143.2	168.2	-75.7	-29.2	0	0	0	112.5	T94	D92-T94 PolarHBondContact O-N 2.95Å
93	N	42.7	Very low	59.5	Low	145 Å²	145	80.5 Å²	80.5	78%	0.775	41%	0.413	S	S	*	.			trans	-52.2	117.4	-173.4	-82.4	-27.6	0	0	0	113.6	T96	N93-T96 PolarHBondContact O-OG1 3.18Å
94	T	52.2	Low	60.1	Low	57 Å²	57	76.7 Å²	76.7	35%	0.35	40%	0.399	S	S	.	.	S	Bend	trans	-89	-7.9	-168.6	54.2	0	0	0	0	115.8	D92 E97	D92-T94 PolarHBondContact O-N 2.95Å; T94-E97 VanDerWaalsContact O-CB 3.26Å; T94-E97 WeakPolarHBondContact O-CB 3.16Å
95	E	46.2	Very low	61.1	Low	83 Å²	83	75.7 Å²	75.7	39%	0.388	39%	0.391	S	S	.	.	S	Bend	trans	-86.6	-43.1	-172.6	-76.4	176.8	-146.6	0	0	113	E97 Y98 S290 S291 S292	E95-E97 PolarHBondContact O-N 3.27Å; E95-Y98 PolarHBondContact O-N 2.86Å; E95-S290 VanDerWaalsContact OE2-C 3.28Å; E95-S290 PolarHBondContact OE2-N 2.88Å; E95-S291 WeakPolarHBondContact OE1-CA 3.09Å; E95-S291 PolarHBondContact OE1-N 3.17Å; E95-S292 PolarHBondContact OE1-N 3.43Å
96	T	47.8	Very low	62.2	Low	68 Å²	68	71.7 Å²	71.7	42%	0.417	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-14.3	167	42.7	0	0	0	0	112.3	N93 K101	N93-T96 PolarHBondContact O-OG1 3.18Å; T96-K101 WeakPolarHBondContact O-CE 3.46Å
97	E	53.8	Low	63.5	Low	26 Å²	26	68.7 Å²	68.7	12%	0.121	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-28.4	175.7	-150.2	170.9	-172	0	0	112.2	R85 T94 E95 Y99 K101 S399	R85-E97 IonicContact NH1-OE1 3.91Å; R85-E97 PolarHBondContact NH1-OE1 2.76Å; T94-E97 VanDerWaalsContact O-CB 3.26Å; T94-E97 WeakPolarHBondContact O-CB 3.16Å; E95-E97 PolarHBondContact O-N 3.27Å; E97-Y99 PolarHBondContact O-N 3.15Å; E97-K101 VanDerWaalsContact CA-NZ 3.32Å; E97-K101 PolarHBondContact O-NZ 3.18Å; E97-S399 WeakPolarHBondContact O-CB 3.29Å; E97-S399 PolarHBondContact O-OG 2.94Å
98	Y	52.3	Low	64.9	Low	91 Å²	91	62 Å²	62	36%	0.357	33%	0.334	S	S	.	.	S	Bend	trans	-62.9	-40.9	-167.2	-178.8	-95.9	0	0	0	115.1	K48 E95 S399	K48-Y98 HydrophobicContact CG-CE1 4.43Å; K48-Y98 PolarHBondContact NZ-O 3.12Å; E95-Y98 PolarHBondContact O-N 2.86Å; Y98-S399 VanDerWaalsContact CA-OG 3.22Å; Y98-S399 WeakPolarHBondContact CA-OG 3.22Å; Y98-S399 PolarHBondContact O-OG 3.05Å
99	Y	64.5	Low	66.5	Low	45 Å²	45	62.9 Å²	62.9	18%	0.176	33%	0.332	C	S	.	.	S	Bend	trans	-80.2	155.5	-178.9	-67.4	-68.8	0	0	0	112	R50 E97 K101 R285	R50-Y99 PolarHBondContact NH2-OH 2.87Å; E97-Y99 PolarHBondContact O-N 3.15Å; Y99-K101 WeakPolarHBondContact O-CD 3.38Å; Y99-K101 WeakPolarHBondContact O-CE 3.16Å; Y99-K101 PolarHBondContact O-NZ 3Å; Y99-R285 HydrophobicContact CD2-CB 4.49Å; Y99-R285 HydrophobicContact CG-CB 4.23Å
100	A	70.9	Confident	67.7	Low	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.			trans	-69.8	139.5	174.3	0	0	0	0	0	110.7	L49 R285 E396 Q397 L398	L49-A100 HydrophobicContact CD2-CB 4.13Å; A100-R285 PolarHBondContact O-NH1 3.34Å; A100-E396 HydrophobicContact CB-CB 4.33Å; A100-E396 VanDerWaalsContact CB-OE2 3.29Å; A100-E396 WeakPolarHBondContact CB-OE2 3.24Å; A100-Q397 WeakPolarHBondContact CA-O 3.43Å; A100-L398 HydrophobicContact CB-CD2 3.69Å
101	K	84.8	Confident	68.5	Low	2 Å²	2	61.2 Å²	61.2	1%	0.009	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.4	178.8	-60.5	87.7	177	-178.7	0	109	T96 E97 Y99 F145 M279 M280 L281 E396 Q397	T96-K101 WeakPolarHBondContact O-CE 3.46Å; E97-K101 VanDerWaalsContact CA-NZ 3.32Å; E97-K101 PolarHBondContact O-NZ 3.18Å; Y99-K101 WeakPolarHBondContact O-CD 3.38Å; Y99-K101 WeakPolarHBondContact O-CE 3.16Å; Y99-K101 PolarHBondContact O-NZ 3Å; K101-F145 HydrophobicContact CG-CD1 4.3Å; K101-F145 HydrophobicContact CG-CG 4.42Å; K101-M279 HydrophobicContact CB-CB 4.32Å; K101-M280 CarbonylContact C-O 3.6Å; K101-M280 WeakPolarHBondContact CA-O 2.97Å; K101-L281 HydrophobicContact CG-CD2 4.26Å; K101-L281 HydrophobicContact CG-CG 4.4Å; K101-E396 CarbonylContact O-C 3.55Å; K101-E396 VanDerWaalsContact O-CA 3.24Å; K101-E396 WeakPolarHBondContact O-CA 3.37Å; K101-Q397 PolarHBondContact N-O 2.82Å; K101-Q397 PolarHBondContact O-N 2.86Å
102	E	84.4	Confident	69.1	Low	30 Å²	30	58.2 Å²	58.2	14%	0.14	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	135.2	171.7	-74.3	-173.1	152.6	0	0	109.7	Y104 M280 P282 K394 E396	E102-Y104 HydrophobicContact CB-CD2 4.49Å; E102-Y104 HydrophobicContact CB-CE2 3.68Å; E102-Y104 PolarHBondContact OE2-OH 2.65Å; E102-M280 PolarHBondContact N-O 3.12Å; E102-M280 PolarHBondContact O-N 3.39Å; E102-P282 HydrophobicContact CG-CG 3.78Å; E102-K394 IonicContact OE1-NZ 3.95Å; E102-K394 PolarHBondContact OE1-NZ 2.84Å; E102-K394 IonicContact OE2-NZ 3.44Å; E102-E396 HydrophobicContact CG-CG 4.16Å
103	I	90.1	Very high	69.6	Low	9 Å²	9	58.5 Å²	58.5	5%	0.046	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.9	-177.2	-46.4	177.9	0	0	0	110.9	L70 T74 I277 L278 T384 V395 Q397	L70-I103 HydrophobicContact CD1-CG2 4.12Å; T74-I103 HydrophobicContact CG2-CB 4.27Å; T74-I103 HydrophobicContact CG2-CD1 3.73Å; T74-I103 HydrophobicContact CG2-CG2 3.41Å; T74-I103 VanDerWaalsContact CG2-CG2 3.41Å; I103-I277 HydrophobicContact CG2-CG2 3.49Å; I103-I277 VanDerWaalsContact CG2-CG2 3.49Å; I103-L278 WeakPolarHBondContact CA-O 3.42Å; I103-T384 HydrophobicContact CD1-CG2 4.13Å; I103-V395 HydrophobicContact CB-CG1 4.44Å; I103-V395 HydrophobicContact CD1-CG1 4.02Å; I103-V395 PolarHBondContact N-O 2.71Å; I103-Q397 HydrophobicContact CD1-CB 4.22Å
104	Y	91	Very high	70.2	Confident	61 Å²	61	56.9 Å²	56.9	24%	0.239	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.7	178.9	-63.3	-89.4	0	0	0	110.2	E102 M137 I277 L278 M280	E102-Y104 HydrophobicContact CB-CD2 4.49Å; E102-Y104 HydrophobicContact CB-CE2 3.68Å; E102-Y104 PolarHBondContact OE2-OH 2.65Å; Y104-M137 HydrophobicContact CD1-CE 4.08Å; Y104-M137 HydrophobicContact CD1-SD 3.93Å; Y104-M137 HydrophobicContact CD2-SD 3.99Å; Y104-M137 HydrophobicContact CE1-CE 3.95Å; Y104-M137 HydrophobicContact CE1-SD 4.03Å; Y104-M137 HydrophobicContact CE2-SD 4.11Å; Y104-M137 HydrophobicContact CG-SD 3.91Å; Y104-I277 CarbonylContact O-C 3.47Å; Y104-I277 WeakPolarHBondContact O-CA 3.36Å; Y104-L278 PolarHBondContact N-O 2.93Å; Y104-L278 PolarHBondContact O-N 2.83Å; Y104-M280 HydrophobicContact CD2-CB 4.3Å; Y104-M280 HydrophobicContact CD2-CG 3.73Å; Y104-M280 HydrophobicContact CE2-CB 4.07Å; Y104-M280 HydrophobicContact CE2-CG 3.91Å
105	K	91	Very high	70.1	Confident	46 Å²	46	60.6 Å²	60.6	20%	0.2	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.5	175.6	165.7	172.1	176.7	164.3	0	111.2	S69 L70 N107 Q271 H275 L276	S69-K105 PolarHBondContact OG-NZ 3.48Å; L70-K105 HydrophobicContact CD1-CB 3.4Å; L70-K105 VanDerWaalsContact CD1-CB 3.4Å; L70-K105 HydrophobicContact CD1-CD 4.33Å; L70-K105 HydrophobicContact CD1-CG 4.48Å; K105-N107 WeakPolarHBondContact CE-OD1 3.37Å; K105-Q271 PolarHBondContact NZ-O 3.39Å; K105-H275 HydrophobicContact CG-CB 4.22Å; K105-L276 CarbonylContact C-O 3.55Å; K105-L276 VanDerWaalsContact CA-O 3.29Å; K105-L276 WeakPolarHBondContact CA-O 3.27Å
106	F	91.1	Very high	70.5	Confident	27 Å²	27	58.6 Å²	58.6	12%	0.118	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	112.2	176.8	-60.8	-90.2	0	0	0	109.2	N133 V134 M137 H275 L276 L278	F106-N133 WeakPolarHBondContact CD1-O 3.31Å; F106-V134 HydrophobicContact CD1-CG1 4.28Å; F106-V134 HydrophobicContact CD2-CG1 4.25Å; F106-V134 HydrophobicContact CG-CG1 4.1Å; F106-M137 HydrophobicContact CE1-CG 4.39Å; F106-M137 HydrophobicContact CE2-CG 4.05Å; F106-M137 HydrophobicContact CZ-CG 3.44Å; F106-M137 VanDerWaalsContact CZ-CG 3.44Å; F106-M137 HydrophobicContact CZ-SD 4.32Å; F106-H275 CarbonylContact O-C 3.43Å; F106-H275 WeakPolarHBondContact O-CA 3.33Å; F106-H275 VanDerWaalsContact O-CB 3.26Å; F106-H275 WeakPolarHBondContact O-CB 3.41Å; F106-L276 HydrophobicContact CB-CB 4.32Å; F106-L276 PolarHBondContact N-O 2.7Å; F106-L276 PolarHBondContact O-N 2.59Å; F106-L278 HydrophobicContact CD2-CD1 3.96Å; F106-L278 HydrophobicContact CD2-CD2 4.43Å; F106-L278 HydrophobicContact CE2-CB 4.4Å; F106-L278 HydrophobicContact CE2-CD1 4.21Å; F106-L278 HydrophobicContact CE2-CD2 3.91Å; F106-L278 HydrophobicContact CE2-CG 4.4Å
107	N	89.3	Confident	70.6	Confident	65 Å²	65	59 Å²	59	35%	0.348	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	151.3	176.2	-64.2	-21.5	0	0	0	110.5	K105	K105-N107 WeakPolarHBondContact CE-OD1 3.37Å
108	M	88.6	Confident	70.5	Confident	25 Å²	25	61.4 Å²	61.4	12%	0.123	33%	0.326	C	S	.	.			trans	-57.5	144.3	171.8	-177.1	-174.9	80	0	0	111.2	N110 F130 R131 F132 V251 P274	M108-N110 WeakPolarHBondContact CE-OD1 2.82Å; M108-F130 HydrophobicContact SD-CB 4.37Å; M108-F130 HydrophobicContact SD-CD1 3.56Å; M108-F130 VanDerWaalsContact SD-CD1 3.56Å; M108-F130 HydrophobicContact SD-CE1 4.32Å; M108-F130 HydrophobicContact SD-CG 4.34Å; M108-R131 WeakPolarHBondContact CA-O 3.18Å; M108-F132 HydrophobicContact CB-CE1 3.92Å; M108-F132 HydrophobicContact CB-CZ 4.47Å; M108-V251 HydrophobicContact CE-CG2 4.21Å; M108-V251 HydrophobicContact SD-CG2 4.25Å; M108-P274 HydrophobicContact CB-CB 4.31Å; M108-P274 VanDerWaalsContact CB-O 3.23Å; M108-P274 WeakPolarHBondContact CB-O 3.4Å; M108-P274 PolarHBondContact N-O 3.35Å; M108-P274 HydrophobicContact SD-CB 4.29Å; M108-P274 HydrophobicContact SD-CG 4.05Å
109	I	85.2	Confident	70.5	Confident	82 Å²	82	63.8 Å²	63.8	42%	0.421	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-105.7	132.9	172.4	-58.6	170.8	0	0	0	108	G111 R131 N133	I109-G111 PolarHBondContact O-N 3Å; I109-R131 PolarHBondContact N-O 2.69Å; I109-N133 HydrophobicContact CD1-CB 3.31Å
110	N	69.6	Low	70	Confident	107 Å²	107	71.3 Å²	71.3	57%	0.572	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-72.1	116.1	175.2	-65.6	-7.5	0	0	0	108.9	M108	M108-N110 WeakPolarHBondContact CE-OD1 2.82Å
111	G	60.8	Low	69	Low	38 Å²	38	71.9 Å²	71.9	39%	0.392	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-85.9	170.3	167.9	0	0	0	0	0	111.7	I109	I109-G111 PolarHBondContact O-N 3Å
112	P	54.2	Low	67.5	Low	91 Å²	91	75.7 Å²	75.7	59%	0.591	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-56.7	142.8	165.9	25.9	-32.3	0	0	0	109.5	E114	P112-E114 PolarHBondContact O-N 3.44Å
113	P	51.7	Low	65.9	Low	130 Å²	130	83.5 Å²	83.5	84%	0.844	45%	0.445	S	S	*	.			trans	-64.6	107	174.3	26.9	-32	0	0	0	108.4
114	E	54.5	Low	64.2	Low	111 Å²	111	84 Å²	84	52%	0.519	45%	0.453	S	S	.	.			trans	-81.8	128.5	167.7	-77.3	168.7	-166	0	0	107.8	P112 N116 R131	P112-E114 PolarHBondContact O-N 3.44Å; E114-N116 PolarHBondContact O-N 3.38Å; E114-N116 PolarHBondContact O-OD1 3.43Å; E114-R131 IonicContact OE1-CZ 3.79Å; E114-R131 IonicContact OE1-NH1 2.63Å; E114-R131 IonicContact OE1-NH2 2.85Å; E114-R131 PolarHBondContact OE1-NH2 2.92Å; E114-R131 IonicContact OE2-NH2 3.08Å; E114-R131 PolarHBondContact OE2-NH2 2.03Å; E114-R131 VanDerWaalsContact OE2-NH2 3.17Å
115	N	51.3	Low	63.1	Low	136 Å²	136	85.2 Å²	85.2	73%	0.727	46%	0.462	S	S	*	.			trans	-68.5	111.9	172.9	-104.4	16.5	0	0	0	108	D117	N115-D117 PolarHBondContact ND2-OD2 2.96Å; N115-D117 PolarHBondContact O-N 3.47Å
116	N	54.2	Low	62.3	Low	41 Å²	41	83.5 Å²	83.5	22%	0.219	46%	0.456	C	S	.	.			trans	-79.5	30.5	175.4	-65.3	-17.6	0	0	0	112.1	E114 L118 S127	E114-N116 PolarHBondContact O-N 3.38Å; E114-N116 PolarHBondContact O-OD1 3.43Å; N116-L118 PolarHBondContact O-N 2.88Å; N116-L118 VanDerWaalsContact O-N 3.09Å; N116-S127 PolarHBondContact ND2-O 2.94Å; N116-S127 PolarHBondContact ND2-OG 2.95Å
117	D	48.7	Very low	61.9	Low	75 Å²	75	82.4 Å²	82.4	40%	0.401	45%	0.451	S	S	.	.			trans	-73.9	100.8	177.9	-68.5	-37.3	0	0	0	108.2	N115	N115-D117 PolarHBondContact ND2-OD2 2.96Å; N115-D117 PolarHBondContact O-N 3.47Å
118	L	53.4	Low	61.7	Low	77 Å²	77	81.2 Å²	81.2	40%	0.403	44%	0.443	S	S	.	.			trans	-69.1	134.7	171.9	-71.4	169.7	0	0	0	109.1	N116 Y120 C121 P226	N116-L118 PolarHBondContact O-N 2.88Å; N116-L118 VanDerWaalsContact O-N 3.09Å; L118-Y120 PolarHBondContact O-N 3.04Å; L118-C121 HydrophobicContact CB-CB 4.08Å; L118-C121 PolarHBondContact O-N 3.33Å; L118-P226 HydrophobicContact CD1-CB 4.12Å; L118-P226 HydrophobicContact CD1-CG 3.94Å
119	P	51.2	Low	61.6	Low	142 Å²	142	81.9 Å²	81.9	92%	0.922	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.5	-175.8	21.1	-31.4	0	0	0	114.2
120	Y	55.1	Low	61.8	Low	202 Å²	202	78 Å²	78	79%	0.792	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-9.8	179.6	-165.3	-99.5	0	0	0	113.7	L118	L118-Y120 PolarHBondContact O-N 3.04Å
121	C	49.5	Very low	62.8	Low	12 Å²	12	76.6 Å²	76.6	8%	0.081	42%	0.415	C	S	.	.	S	Bend	trans	-126.3	131.9	-168.6	-39.7	0	0	0	0	109.3	L118 C227	L118-C121 HydrophobicContact CB-CB 4.08Å; L118-C121 PolarHBondContact O-N 3.33Å; C121-C227 HydrophobicContact CB-CB 4.13Å; C121-C227 WeakPolarHBondContact CB-SG 3.36Å; C121-C227 WeakPolarHBondContact SG-CB 3.4Å; C121-C227 CovalentContact SG-SG 2.02Å; C121-C227 PolarHBondContact SG-SG 2.9Å
122	P	53.1	Low	64.3	Low	82 Å²	82	75.1 Å²	75.1	53%	0.532	40%	0.398	S	S	.	.			trans	-64.8	156.9	-171.1	25.4	-33.5	0	0	0	112.8	G124 N241	P122-G124 PolarHBondContact O-N 3.09Å; P122-G124 VanDerWaalsContact O-N 3.17Å; P122-N241 VanDerWaalsContact CD-CG 3.46Å; P122-N241 WeakPolarHBondContact CD-ND2 3.32Å; P122-N241 HydrophobicContact CG-CB 4.26Å; P122-N241 WeakPolarHBondContact CG-ND2 3.3Å
123	K	50	Low	66	Low	194 Å²	194	75 Å²	75	84%	0.843	39%	0.392	S	S	*	.	S	Bend	trans	-47.2	114.6	-174.8	-62	-178.7	179.9	-178.3	0	112.4
124	G	55.8	Low	67.8	Low	21 Å²	21	68.9 Å²	68.9	22%	0.216	35%	0.352	C	S	.	.	S	Bend	trans	176.3	146.3	179	0	0	0	0	0	110.8	P122 T126	P122-G124 PolarHBondContact O-N 3.09Å; P122-G124 VanDerWaalsContact O-N 3.17Å; G124-T126 PolarHBondContact O-N 2.94Å
125	I	67.1	Low	69.3	Low	86 Å²	86	65.8 Å²	65.8	44%	0.441	34%	0.343	S	S	.	.			trans	-77.5	97.6	178.8	-55.1	176.4	0	0	0	108.3	S127 K128 V243 L244	I125-S127 WeakPolarHBondContact CG2-O 3.38Å; I125-K128 HydrophobicContact CG2-CD 3.94Å; I125-V243 WeakPolarHBondContact O-CG1 3.26Å; I125-L244 WeakPolarHBondContact O-CB 3.47Å; I125-L244 PolarHBondContact O-N 2.79Å; I125-L244 VanDerWaalsContact O-N 3.13Å
126	T	74.7	Confident	70.9	Confident	10 Å²	10	62.6 Å²	62.6	6%	0.061	34%	0.336	C	S	.	.			trans	-84.9	-18.1	177.9	52.8	0	0	0	0	112.6	G124 V223 P226	G124-T126 PolarHBondContact O-N 2.94Å; T126-V223 PolarHBondContact O-N 2.77Å; T126-P226 HydrophobicContact CG2-CB 4.06Å
127	S	81.1	Confident	72.4	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	164.4	-178.3	68.2	0	0	0	0	113.5	N116 I125 E220 I221	N116-S127 PolarHBondContact ND2-O 2.94Å; N116-S127 PolarHBondContact ND2-OG 2.95Å; I125-S127 WeakPolarHBondContact CG2-O 3.38Å; S127-E220 WeakPolarHBondContact CB-OE1 3.12Å; S127-E220 PolarHBondContact OG-OE1 2.85Å; S127-I221 CarbonylContact C-O 3.57Å; S127-I221 WeakPolarHBondContact CA-O 3.37Å; S127-I221 WeakPolarHBondContact CB-O 3.35Å
128	K	85.5	Confident	73.9	Confident	41 Å²	41	60.9 Å²	60.9	18%	0.178	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.7	175.7	-69.1	-65.1	-168.3	179.2	0	110	I125 F130 E220 I221 L244 V251	I125-K128 HydrophobicContact CG2-CD 3.94Å; K128-F130 HydrophobicContact CB-CE2 3.91Å; K128-F130 HydrophobicContact CB-CZ 4.08Å; K128-F130 WeakPolarHBondContact O-CD2 3.47Å; K128-F130 VanDerWaalsContact O-CE2 3.23Å; K128-F130 WeakPolarHBondContact O-CE2 3.47Å; K128-E220 CarbonylContact O-C 3.46Å; K128-E220 WeakPolarHBondContact O-CA 3.36Å; K128-I221 PolarHBondContact N-O 2.65Å; K128-I221 PolarHBondContact O-N 3.34Å; K128-L244 HydrophobicContact CB-CD2 4.35Å; K128-L244 HydrophobicContact CG-CD2 3.65Å; K128-V251 HydrophobicContact CB-CG1 4.17Å; K128-V251 HydrophobicContact CD-CG1 3.83Å; K128-V251 HydrophobicContact CG-CG1 4.07Å
129	V	86.9	Confident	74.8	Confident	39 Å²	39	66.9 Å²	66.9	24%	0.236	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.8	-178.7	177.3	0	0	0	0	110.7	R131 I171 L219 E220	V129-R131 HydrophobicContact CG1-CG 4.13Å; V129-I171 HydrophobicContact CB-CD1 4.39Å; V129-I171 HydrophobicContact CG1-CD1 3.54Å; V129-I171 HydrophobicContact CG2-CD1 4.05Å; V129-L219 CarbonylContact C-O 3.51Å; V129-L219 WeakPolarHBondContact CA-O 3.4Å; V129-E220 HydrophobicContact CG2-CG 4.34Å
130	F	89.9	Confident	75.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	118.8	-178.7	-54.8	-98.2	0	0	0	109.1	M108 K128 F132 F149 G218 L219 I221 F248 V251 P274	M108-F130 HydrophobicContact SD-CB 4.37Å; M108-F130 HydrophobicContact SD-CD1 3.56Å; M108-F130 VanDerWaalsContact SD-CD1 3.56Å; M108-F130 HydrophobicContact SD-CE1 4.32Å; M108-F130 HydrophobicContact SD-CG 4.34Å; K128-F130 HydrophobicContact CB-CE2 3.91Å; K128-F130 HydrophobicContact CB-CZ 4.08Å; K128-F130 WeakPolarHBondContact O-CD2 3.47Å; K128-F130 VanDerWaalsContact O-CE2 3.23Å; K128-F130 WeakPolarHBondContact O-CE2 3.47Å; F130-F132 HydrophobicContact CB-CE2 3.76Å; F130-F132 HydrophobicContact CB-CZ 3.86Å; F130-F149 HydrophobicContact CB-CE2 4.39Å; F130-F149 HydrophobicContact CB-CZ 4.46Å; F130-F149 HydrophobicContact CD1-CE2 4.14Å; F130-F149 AromaticContact CD1-CZ 3.85Å; F130-F149 HydrophobicContact CD1-CZ 3.85Å; F130-F149 HydrophobicContact CD2-CZ 4.13Å; F130-F149 HydrophobicContact CE1-CZ 4.04Å; F130-F149 HydrophobicContact CE2-CZ 4.36Å; F130-F149 HydrophobicContact CG-CE2 4.24Å; F130-F149 AromaticContact CG-CZ 3.89Å; F130-F149 HydrophobicContact CG-CZ 3.89Å; F130-F149 HydrophobicContact CZ-CZ 4.31Å; F130-G218 CarbonylContact O-C 3.56Å; F130-G218 WeakPolarHBondContact O-CA 3.5Å; F130-L219 PolarHBondContact N-O 2.95Å; F130-L219 PolarHBondContact O-N 3.22Å; F130-I221 HydrophobicContact CD2-CD1 4.4Å; F130-I221 HydrophobicContact CD2-CG1 4.24Å; F130-I221 HydrophobicContact CE2-CB 3.84Å; F130-I221 HydrophobicContact CE2-CD1 3.49Å; F130-I221 VanDerWaalsContact CE2-CD1 3.49Å; F130-I221 HydrophobicContact CE2-CG1 3.52Å; F130-I221 HydrophobicContact CZ-CD1 3.61Å; F130-I221 HydrophobicContact CZ-CG1 4.17Å; F130-F248 HydrophobicContact CZ-CD2 4.2Å; F130-V251 HydrophobicContact CD1-CG2 4.35Å; F130-V251 HydrophobicContact CE1-CG1 4.47Å; F130-V251 HydrophobicContact CE1-CG2 3.6Å; F130-V251 HydrophobicContact CZ-CG2 4.32Å; F130-P274 HydrophobicContact CD1-CB 3.63Å; F130-P274 HydrophobicContact CD1-CG 3.71Å; F130-P274 HydrophobicContact CE1-CB 3.84Å; F130-P274 HydrophobicContact CE1-CG 3.5Å; F130-P274 VanDerWaalsContact CE1-CG 3.5Å
131	R	89.8	Confident	76.4	Confident	77 Å²	77	54.2 Å²	54.2	29%	0.291	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-112	145	-178.7	-61.9	-175	-178.7	-179.7	4.1	111	M108 I109 E114 V129	M108-R131 WeakPolarHBondContact CA-O 3.18Å; I109-R131 PolarHBondContact N-O 2.69Å; E114-R131 IonicContact OE1-CZ 3.79Å; E114-R131 IonicContact OE1-NH1 2.63Å; E114-R131 IonicContact OE1-NH2 2.85Å; E114-R131 PolarHBondContact OE1-NH2 2.92Å; E114-R131 IonicContact OE2-NH2 3.08Å; E114-R131 PolarHBondContact OE2-NH2 2.03Å; E114-R131 VanDerWaalsContact OE2-NH2 3.17Å; V129-R131 HydrophobicContact CG1-CG 4.13Å
132	F	91.6	Very high	77.5	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.035	32%	0.318	C	S	.	.			trans	-137.5	144.3	-176.6	-55.8	-81	0	0	0	111	M108 F130 F149 W209 N216 L219 L276	M108-F132 HydrophobicContact CB-CE1 3.92Å; M108-F132 HydrophobicContact CB-CZ 4.47Å; F130-F132 HydrophobicContact CB-CE2 3.76Å; F130-F132 HydrophobicContact CB-CZ 3.86Å; F132-F149 HydrophobicContact CE2-CD2 4.25Å; F132-F149 HydrophobicContact CE2-CE2 4.31Å; F132-F149 AromaticContact CZ-CD2 3.79Å; F132-F149 HydrophobicContact CZ-CD2 3.79Å; F132-F149 AromaticContact CZ-CE2 3.68Å; F132-F149 HydrophobicContact CZ-CE2 3.68Å; F132-W209 HydrophobicContact CD2-CH2 4.24Å; F132-W209 HydrophobicContact CD2-CZ3 4.2Å; F132-N216 PolarHBondContact O-ND2 3.36Å; F132-L219 HydrophobicContact CE2-CD1 4.16Å; F132-L276 HydrophobicContact CB-CD1 3.65Å; F132-L276 HydrophobicContact CB-CG 4.47Å; F132-L276 HydrophobicContact CD1-CD1 3.87Å; F132-L276 HydrophobicContact CD1-CG 3.75Å; F132-L276 HydrophobicContact CD2-CD1 3.58Å; F132-L276 HydrophobicContact CD2-CD2 4.39Å; F132-L276 HydrophobicContact CD2-CG 3.9Å; F132-L276 HydrophobicContact CE1-CD1 4.46Å; F132-L276 HydrophobicContact CE1-CG 3.9Å; F132-L276 HydrophobicContact CE2-CD1 4.2Å; F132-L276 HydrophobicContact CE2-CD2 4.2Å; F132-L276 HydrophobicContact CE2-CG 4.04Å; F132-L276 HydrophobicContact CG-CD1 3.39Å; F132-L276 HydrophobicContact CG-CG 3.75Å; F132-L276 HydrophobicContact CZ-CD2 4.34Å; F132-L276 HydrophobicContact CZ-CG 4.04Å
133	N	89.9	Confident	78.8	Confident	87 Å²	87	55.7 Å²	55.7	47%	0.465	29%	0.294	S	S	.	.			trans	-106	102.6	170.9	-176.1	-7.4	0	0	0	109.6	F106 I109 S135	F106-N133 WeakPolarHBondContact CD1-O 3.31Å; I109-N133 HydrophobicContact CD1-CB 3.31Å; N133-S135 VanDerWaalsContact OD1-CB 3.22Å; N133-S135 WeakPolarHBondContact OD1-CB 3.15Å; N133-S135 PolarHBondContact OD1-N 3.02Å; N133-S135 PolarHBondContact OD1-OG 3.22Å
134	V	89.8	Confident	80.5	Confident	2 Å²	2	47 Å²	47	1%	0.012	26%	0.257	C	S	.	.			trans	-101.9	13.2	177.9	-64.4	0	0	0	0	113	F106 A136 M137 W209 L210 L276	F106-V134 HydrophobicContact CD1-CG1 4.28Å; F106-V134 HydrophobicContact CD2-CG1 4.25Å; F106-V134 HydrophobicContact CG-CG1 4.1Å; V134-A136 PolarHBondContact O-N 2.78Å; V134-M137 PolarHBondContact O-N 2.97Å; V134-W209 HydrophobicContact CG2-CB 4.38Å; V134-W209 HydrophobicContact CG2-CE3 4.42Å; V134-L210 HydrophobicContact CB-CD2 4.15Å; V134-L210 HydrophobicContact CG2-CD2 3.96Å; V134-L276 HydrophobicContact CG1-CD1 4.19Å
135	S	86.4	Confident	81.8	Confident	47 Å²	47	49.1 Å²	49.1	33%	0.329	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-55.7	-30.1	-173.8	56.5	0	0	0	0	114.3	N133 M137 E138	N133-S135 VanDerWaalsContact OD1-CB 3.22Å; N133-S135 WeakPolarHBondContact OD1-CB 3.15Å; N133-S135 PolarHBondContact OD1-N 3.02Å; N133-S135 PolarHBondContact OD1-OG 3.22Å; S135-M137 PolarHBondContact O-N 3.4Å; S135-M137 VanDerWaalsContact O-N 3.13Å; S135-E138 WeakPolarHBondContact CA-OE1 3.04Å; S135-E138 WeakPolarHBondContact CB-OE1 3.42Å; S135-E138 WeakPolarHBondContact O-CG 3.18Å; S135-E138 PolarHBondContact O-N 3.47Å
136	A	85.4	Confident	82.8	Confident	69 Å²	69	47.8 Å²	47.8	57%	0.57	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-59.6	-24.3	176.7	0	0	0	0	0	113.5	V134	V134-A136 PolarHBondContact O-N 2.78Å
137	M	84.7	Confident	83.7	Confident	19 Å²	19	47.3 Å²	47.3	9%	0.094	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-102.6	-2.9	-174.3	-59.5	-67.4	100.8	0	0	114	Y104 F106 V134 S135 K139 N140 L210 L278	Y104-M137 HydrophobicContact CD1-CE 4.08Å; Y104-M137 HydrophobicContact CD1-SD 3.93Å; Y104-M137 HydrophobicContact CD2-SD 3.99Å; Y104-M137 HydrophobicContact CE1-CE 3.95Å; Y104-M137 HydrophobicContact CE1-SD 4.03Å; Y104-M137 HydrophobicContact CE2-SD 4.11Å; Y104-M137 HydrophobicContact CG-SD 3.91Å; F106-M137 HydrophobicContact CE1-CG 4.39Å; F106-M137 HydrophobicContact CE2-CG 4.05Å; F106-M137 HydrophobicContact CZ-CG 3.44Å; F106-M137 VanDerWaalsContact CZ-CG 3.44Å; F106-M137 HydrophobicContact CZ-SD 4.32Å; V134-M137 PolarHBondContact O-N 2.97Å; S135-M137 PolarHBondContact O-N 3.4Å; S135-M137 VanDerWaalsContact O-N 3.13Å; M137-K139 PolarHBondContact O-N 2.78Å; M137-N140 PolarHBondContact O-N 2.84Å; M137-L210 HydrophobicContact CB-CD2 3.76Å; M137-L278 HydrophobicContact CG-CD2 4.41Å
138	E	80.3	Confident	84.3	Confident	61 Å²	61	47.4 Å²	47.4	29%	0.285	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-54.8	-38.4	-176.1	-72.6	171.1	-173.7	0	0	112.6	S135 N140 S141 R213	S135-E138 WeakPolarHBondContact CA-OE1 3.04Å; S135-E138 WeakPolarHBondContact CB-OE1 3.42Å; S135-E138 WeakPolarHBondContact O-CG 3.18Å; S135-E138 PolarHBondContact O-N 3.47Å; E138-N140 PolarHBondContact O-N 2.65Å; E138-N140 VanDerWaalsContact O-N 3.11Å; E138-S141 PolarHBondContact O-N 3.36Å; E138-R213 WeakPolarHBondContact OE1-CD 3.39Å; E138-R213 WeakPolarHBondContact OE1-CG 3.49Å
139	K	72.1	Confident	84.8	Confident	202 Å²	202	45.4 Å²	45.4	88%	0.878	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-65.1	-14.5	179	-64.2	-174.5	179.7	-177.4	0	114.3	M137	M137-K139 PolarHBondContact O-N 2.78Å
140	N	69.8	Low	85.2	Confident	54 Å²	54	43.7 Å²	43.7	29%	0.289	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-118.9	26.9	-175.5	-66.1	-42.3	0	0	0	111.7	M137 E138 T142 N143 M280	M137-N140 PolarHBondContact O-N 2.84Å; E138-N140 PolarHBondContact O-N 2.65Å; E138-N140 VanDerWaalsContact O-N 3.11Å; N140-T142 VanDerWaalsContact C-N 3.28Å; N140-T142 PolarHBondContact O-N 3.14Å; N140-N143 HydrophobicContact CB-CB 4.3Å; N140-N143 VanDerWaalsContact O-CB 3.22Å; N140-N143 WeakPolarHBondContact O-CB 3.42Å; N140-N143 PolarHBondContact O-N 3.04Å; N140-M280 HydrophobicContact CB-CE 3.86Å; N140-M280 WeakPolarHBondContact O-CE 3.35Å
141	S	70.6	Confident	85.3	Confident	25 Å²	25	43.7 Å²	43.7	18%	0.175	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-54.9	-36.2	-172.4	61.6	0	0	0	0	114.9	E138 N143	E138-S141 PolarHBondContact O-N 3.36Å; S141-N143 PolarHBondContact O-N 3.06Å
142	T	72.1	Confident	85.4	Confident	117 Å²	117	40.9 Å²	40.9	72%	0.718	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-69.3	-15.1	177.4	54.4	0	0	0	0	114	N140	N140-T142 VanDerWaalsContact C-N 3.28Å; N140-T142 PolarHBondContact O-N 3.14Å
143	N	81.8	Confident	85.4	Confident	7 Å²	7	40.6 Å²	40.6	4%	0.037	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-92.8	-4.1	-172.1	-63.4	-5.9	0	0	0	112.6	N140 S141 F145 M280 L281 I286	N140-N143 HydrophobicContact CB-CB 4.3Å; N140-N143 VanDerWaalsContact O-CB 3.22Å; N140-N143 WeakPolarHBondContact O-CB 3.42Å; N140-N143 PolarHBondContact O-N 3.04Å; S141-N143 PolarHBondContact O-N 3.06Å; N143-F145 PolarHBondContact O-N 3.34Å; N143-F145 VanDerWaalsContact O-N 3.15Å; N143-M280 HydrophobicContact CB-CE 3.93Å; N143-M280 CarbonylContact O-C 3.6Å; N143-M280 WeakPolarHBondContact O-CA 3.36Å; N143-L281 WeakPolarHBondContact CB-O 3.15Å; N143-L281 PolarHBondContact O-N 3.43Å; N143-I286 WeakPolarHBondContact OD1-CD1 3.42Å
144	L	85.3	Confident	85.4	Confident	11 Å²	11	37.9 Å²	37.9	6%	0.058	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	112.5	179.8	-178.2	66.8	0	0	0	110.4	A147 T203 V206 R207 L210 L278 M280	L144-A147 HydrophobicContact CD1-CB 4.22Å; L144-A147 HydrophobicContact CD2-CB 4.42Å; L144-T203 HydrophobicContact CD2-CG2 4.37Å; L144-V206 HydrophobicContact CD2-CB 4.14Å; L144-V206 HydrophobicContact CD2-CG1 3.94Å; L144-R207 HydrophobicContact CD2-CB 4.04Å; L144-L210 HydrophobicContact CB-CD1 4.31Å; L144-L210 HydrophobicContact CD2-CD1 4.19Å; L144-L278 HydrophobicContact CD1-CB 4.18Å; L144-L278 HydrophobicContact CD1-CD2 4.25Å; L144-L278 HydrophobicContact CD1-CG 3.91Å; L144-M280 VanDerWaalsContact CA-SD 3.54Å; L144-M280 HydrophobicContact CB-CE 4.31Å; L144-M280 HydrophobicContact CB-SD 3.85Å; L144-M280 HydrophobicContact CD1-SD 3.48Å; L144-M280 WeakPolarHBondContact CD1-SD 3.49Å; L144-M280 HydrophobicContact CG-SD 4.29Å
145	F	82.8	Confident	85.3	Confident	66 Å²	66	41 Å²	41	29%	0.289	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	-48.5	175.8	177.6	-102	0	0	0	111.3	K101 N143 M279 L281	K101-F145 HydrophobicContact CG-CD1 4.3Å; K101-F145 HydrophobicContact CG-CG 4.42Å; N143-F145 PolarHBondContact O-N 3.34Å; N143-F145 VanDerWaalsContact O-N 3.15Å; F145-M279 WeakPolarHBondContact CA-O 3.32Å; F145-M279 WeakPolarHBondContact CB-O 3.2Å; F145-M279 HydrophobicContact CD1-CB 4.39Å; F145-M279 PolarHBondContact N-O 3.13Å; F145-L281 HydrophobicContact CB-CD1 4.13Å; F145-L281 HydrophobicContact CB-CG 4.3Å; F145-L281 HydrophobicContact CD2-CD1 4.03Å; F145-L281 HydrophobicContact CG-CD1 4.45Å
146	R	88.3	Confident	85.2	Confident	59 Å²	59	39.4 Å²	39.4	22%	0.223	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	143.7	179.7	-169	171.8	-173.3	73.5	4.8	110.7	E148 D201 T203 M279	R146-E148 HydrophobicContact CG-CG 4.31Å; R146-E148 IonicContact CZ-OE1 3.42Å; R146-E148 IonicContact NE-OE1 2.75Å; R146-E148 PolarHBondContact NE-OE1 2.71Å; R146-E148 IonicContact NH2-OE1 3.88Å; R146-E148 PolarHBondContact NH2-OE1 3.07Å; R146-D201 IonicContact CZ-OD2 2.73Å; R146-D201 IonicContact NH1-OD2 2.79Å; R146-D201 PolarHBondContact NH1-OD2 2.62Å; R146-D201 IonicContact NH2-OD2 3.53Å; R146-D201 PolarHBondContact NH2-OD2 2.03Å; R146-T203 WeakPolarHBondContact CA-OG1 3.25Å; R146-M279 HydrophobicContact CB-CB 4.31Å; R146-M279 HydrophobicContact CB-SD 4.2Å; R146-M279 PolarHBondContact N-O 2.77Å; R146-M279 PolarHBondContact O-N 2.92Å
147	A	93.3	Very high	85.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	132.2	169.2	0	0	0	0	0	110.9	L144 V202 T203 V206 I277 L278	L144-A147 HydrophobicContact CD1-CB 4.22Å; L144-A147 HydrophobicContact CD2-CB 4.42Å; A147-V202 HydrophobicContact CB-CG2 4.13Å; A147-V202 PolarHBondContact O-N 3.4Å; A147-T203 PolarHBondContact N-OG1 3.2Å; A147-T203 PolarHBondContact O-N 2.95Å; A147-T203 PolarHBondContact O-OG1 2.79Å; A147-V206 HydrophobicContact CB-CB 3.79Å; A147-V206 HydrophobicContact CB-CG1 4.11Å; A147-V206 HydrophobicContact CB-CG2 3.78Å; A147-I277 WeakPolarHBondContact CA-O 3.26Å; A147-L278 HydrophobicContact CB-CD1 4.2Å; A147-L278 HydrophobicContact CB-CG 4.2Å
148	E	94.8	Very high	85.2	Confident	4 Å²	4	45 Å²	45	2%	0.019	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.8	-177	-73.4	-74.7	176.3	0	0	109.8	L77 R146 F200 D201 L276 I277	L77-E148 HydrophobicContact CD1-CB 4.04Å; L77-E148 HydrophobicContact CD1-CG 3.84Å; L77-E148 HydrophobicContact CD2-CB 3.79Å; L77-E148 HydrophobicContact CD2-CG 3.87Å; L77-E148 HydrophobicContact CG-CG 4.42Å; R146-E148 HydrophobicContact CG-CG 4.31Å; R146-E148 IonicContact CZ-OE1 3.42Å; R146-E148 IonicContact NE-OE1 2.75Å; R146-E148 PolarHBondContact NE-OE1 2.71Å; R146-E148 IonicContact NH2-OE1 3.88Å; R146-E148 PolarHBondContact NH2-OE1 3.07Å; E148-F200 VanDerWaalsContact OE2-O 3.08Å; E148-D201 PolarHBondContact OE2-N 3.3Å; E148-L276 WeakPolarHBondContact O-CA 3.47Å; E148-I277 PolarHBondContact N-O 2.89Å; E148-I277 PolarHBondContact O-N 2.88Å
149	F	95.8	Very high	85.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	127.8	171	168.6	-117.4	0	0	0	109.6	F130 F132 A151 L168 S199 F200 V202 L219 I221 P274 L276	F130-F149 HydrophobicContact CB-CE2 4.39Å; F130-F149 HydrophobicContact CB-CZ 4.46Å; F130-F149 HydrophobicContact CD1-CE2 4.14Å; F130-F149 AromaticContact CD1-CZ 3.85Å; F130-F149 HydrophobicContact CD1-CZ 3.85Å; F130-F149 HydrophobicContact CD2-CZ 4.13Å; F130-F149 HydrophobicContact CE1-CZ 4.04Å; F130-F149 HydrophobicContact CE2-CZ 4.36Å; F130-F149 HydrophobicContact CG-CE2 4.24Å; F130-F149 AromaticContact CG-CZ 3.89Å; F130-F149 HydrophobicContact CG-CZ 3.89Å; F130-F149 HydrophobicContact CZ-CZ 4.31Å; F132-F149 HydrophobicContact CE2-CD2 4.25Å; F132-F149 HydrophobicContact CE2-CE2 4.31Å; F132-F149 AromaticContact CZ-CD2 3.79Å; F132-F149 HydrophobicContact CZ-CD2 3.79Å; F132-F149 AromaticContact CZ-CE2 3.68Å; F132-F149 HydrophobicContact CZ-CE2 3.68Å; F149-A151 HydrophobicContact CE1-CB 4.36Å; F149-A151 HydrophobicContact CZ-CB 3.91Å; F149-L168 HydrophobicContact CD1-CD1 3.97Å; F149-L168 HydrophobicContact CD1-CD2 4.05Å; F149-L168 HydrophobicContact CE1-CD1 3.89Å; F149-S199 CarbonylContact O-C 3.59Å; F149-S199 WeakPolarHBondContact O-CA 3.48Å; F149-F200 HydrophobicContact CD1-CD2 4.07Å; F149-F200 HydrophobicContact CE1-CD2 4.48Å; F149-F200 PolarHBondContact N-O 3.17Å; F149-F200 PolarHBondContact O-N 2.78Å; F149-V202 HydrophobicContact CB-CG1 3.88Å; F149-V202 HydrophobicContact CB-CG2 3.93Å; F149-L219 HydrophobicContact CB-CD1 3.97Å; F149-L219 HydrophobicContact CD1-CD1 4.15Å; F149-L219 HydrophobicContact CD2-CD1 4.09Å; F149-L219 HydrophobicContact CG-CD1 3.79Å; F149-I221 HydrophobicContact CE1-CD1 3.77Å; F149-I221 HydrophobicContact CE1-CG1 4.28Å; F149-I221 HydrophobicContact CZ-CD1 4.16Å; F149-P274 HydrophobicContact CE2-CB 3.88Å; F149-P274 HydrophobicContact CZ-CB 4.3Å; F149-L276 HydrophobicContact CB-CD2 3.7Å; F149-L276 HydrophobicContact CD2-CD2 4Å; F149-L276 HydrophobicContact CG-CD2 4.29Å
150	R	94.1	Very high	85.7	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	132.2	179.4	-65.6	-177.1	74.7	87	-4.8	111	L77 E80 W197 V198 P274 H275	L77-R150 VanDerWaalsContact CA-NH1 3.27Å; L77-R150 VanDerWaalsContact CB-NH1 3.32Å; E80-R150 IonicContact OE2-CZ 3.05Å; E80-R150 IonicContact OE2-NH1 3.6Å; E80-R150 PolarHBondContact OE2-NH1 2.98Å; E80-R150 IonicContact OE2-NH2 2.65Å; E80-R150 PolarHBondContact OE2-NH2 2.83Å; R150-W197 HydrophobicContact CB-CE3 4.09Å; R150-W197 HydrophobicContact CB-CZ3 4.31Å; R150-W197 VanDerWaalsContact NH2-CB 3.31Å; R150-V198 WeakPolarHBondContact CA-O 3.42Å; R150-P274 CarbonylContact O-C 3.51Å; R150-P274 WeakPolarHBondContact O-CA 3.41Å; R150-H275 PolarHBondContact N-O 3.03Å; R150-H275 PolarHBondContact O-N 3.27Å
151	A	92.6	Very high	86.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	133.6	172.4	0	0	0	0	0	110.7	F149 R153 V198 F248 P274	F149-A151 HydrophobicContact CE1-CB 4.36Å; F149-A151 HydrophobicContact CZ-CB 3.91Å; A151-R153 PolarHBondContact O-N 3.09Å; A151-V198 PolarHBondContact N-O 2.85Å; A151-V198 PolarHBondContact O-N 3.16Å; A151-F248 HydrophobicContact CB-CD1 3.63Å; A151-F248 HydrophobicContact CB-CE1 3.89Å; A151-F248 HydrophobicContact CB-CG 4.41Å; A151-P274 HydrophobicContact CB-CB 4.13Å; A151-P274 HydrophobicContact CB-CG 4.22Å
152	L	91.5	Very high	86.8	Confident	19 Å²	19	47.6 Å²	47.6	10%	0.099	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	111.4	178.2	-176.5	68.8	0	0	0	109.8	P195 W197 F248 K249 L272	L152-P195 HydrophobicContact CD1-CB 4.44Å; L152-W197 HydrophobicContact CB-CD2 4.2Å; L152-W197 HydrophobicContact CB-CE3 3.84Å; L152-W197 HydrophobicContact CB-CH2 3.89Å; L152-W197 HydrophobicContact CB-CZ2 4.25Å; L152-W197 HydrophobicContact CB-CZ3 3.69Å; L152-W197 HydrophobicContact CD1-CD2 3.93Å; L152-W197 HydrophobicContact CD1-CE3 4.42Å; L152-W197 HydrophobicContact CD1-CG 4.17Å; L152-W197 HydrophobicContact CD1-CZ2 4.38Å; L152-F248 WeakPolarHBondContact O-CA 3.48Å; L152-K249 HydrophobicContact CB-CB 4.36Å; L152-K249 HydrophobicContact CD2-CB 4.28Å; L152-K249 PolarHBondContact O-N 3.08Å; L152-L272 HydrophobicContact CD2-CB 3.98Å; L152-L272 HydrophobicContact CD2-CD2 3.99Å; L152-L272 HydrophobicContact CD2-CG 4.38Å
153	R	91.3	Very high	87.6	Confident	1 Å²	1	47 Å²	47	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	133.8	170	-177.4	-176.7	66.2	66.2	0.2	109.7	A151 L190 G193 T194 P195 E196 V198 V246 K247	A151-R153 PolarHBondContact O-N 3.09Å; R153-L190 WeakPolarHBondContact CD-O 3.48Å; R153-L190 PolarHBondContact NE-O 3.36Å; R153-L190 VanDerWaalsContact NE-O 3.09Å; R153-L190 PolarHBondContact NH1-O 2.95Å; R153-G193 PolarHBondContact NH1-O 3.29Å; R153-T194 PolarHBondContact NH1-O 3.27Å; R153-T194 PolarHBondContact NH2-O 2.81Å; R153-P195 VanDerWaalsContact O-CA 3.27Å; R153-P195 WeakPolarHBondContact O-CA 3.46Å; R153-E196 WeakPolarHBondContact CB-O 3.31Å; R153-E196 IonicContact CZ-OE2 2.99Å; R153-E196 PolarHBondContact N-O 3.2Å; R153-E196 IonicContact NE-OE2 2.69Å; R153-E196 IonicContact NH2-OE2 3.71Å; R153-E196 PolarHBondContact NH2-OE2 3.37Å; R153-E196 PolarHBondContact O-N 3.03Å; R153-E196 VanDerWaalsContact O-N 3.15Å; R153-V198 HydrophobicContact CB-CG2 4.2Å; R153-V246 HydrophobicContact CG-CG1 3.96Å; R153-K247 WeakPolarHBondContact CA-O 3.15Å
154	V	90.1	Very high	87.8	Confident	30 Å²	30	46.9 Å²	46.9	18%	0.182	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	149.9	174.1	-63.8	0	0	0	0	110.8	N156 K247 K249	V154-N156 PolarHBondContact O-N 3.06Å; V154-K247 HydrophobicContact CG2-CB 3.55Å; V154-K247 PolarHBondContact N-O 3.37Å; V154-K249 HydrophobicContact CG1-CB 3.96Å; V154-K249 HydrophobicContact CG1-CD 4.17Å
155	P	87.6	Confident	88	Confident	67 Å²	67	51.4 Å²	51.4	44%	0.435	26%	0.261	S	S	.	.			trans	-63.5	132.9	179.7	24.1	-33.5	0	0	0	111.3
156	N	86.1	Confident	88.4	Confident	14 Å²	14	48.3 Å²	48.3	8%	0.075	25%	0.247	C	C	.	.			trans	-107.2	99.6	172.8	-173.9	2.7	0	0	0	110.5	V154 S158 A159 T191 K192 Q245 K247	V154-N156 PolarHBondContact O-N 3.06Å; N156-S158 PolarHBondContact O-N 3.32Å; N156-S158 WeakPolarHBondContact OD1-CB 3.45Å; N156-S158 PolarHBondContact OD1-N 3.3Å; N156-S158 VanDerWaalsContact OD1-N 3.12Å; N156-A159 HydrophobicContact CB-CB 4.12Å; N156-A159 WeakPolarHBondContact O-CB 3.4Å; N156-A159 PolarHBondContact O-N 2.81Å; N156-A159 VanDerWaalsContact O-N 3.12Å; N156-T191 PolarHBondContact N-O 2.9Å; N156-K192 VanDerWaalsContact O-CG 3.3Å; N156-K192 WeakPolarHBondContact O-CG 3.27Å; N156-Q245 PolarHBondContact ND2-O 3.41Å; N156-K247 HydrophobicContact CB-CB 4.47Å; N156-K247 HydrophobicContact CB-CD 3.7Å; N156-K247 HydrophobicContact CB-CG 3.82Å
157	S	84.7	Confident	88.6	Confident	106 Å²	106	46 Å²	46	74%	0.741	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-30.2	178	53.9	0	0	0	0	112.8	A159	S157-A159 VanDerWaalsContact C-N 3.3Å; S157-A159 PolarHBondContact O-N 2.86Å
158	S	83.6	Confident	88.6	Confident	100 Å²	100	46 Å²	46	70%	0.699	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-1	179.7	-49.7	0	0	0	0	114.2	N156	N156-S158 PolarHBondContact O-N 3.32Å; N156-S158 WeakPolarHBondContact OD1-CB 3.45Å; N156-S158 PolarHBondContact OD1-N 3.3Å; N156-S158 VanDerWaalsContact OD1-N 3.12Å
159	A	82.5	Confident	88.5	Confident	4 Å²	4	47.4 Å²	47.4	3%	0.033	24%	0.244	C	C	.	.			trans	-66.1	140.4	178.9	0	0	0	0	0	111.8	N156 S157 T191 K192 Q245	N156-A159 HydrophobicContact CB-CB 4.12Å; N156-A159 WeakPolarHBondContact O-CB 3.4Å; N156-A159 PolarHBondContact O-N 2.81Å; N156-A159 VanDerWaalsContact O-N 3.12Å; S157-A159 VanDerWaalsContact C-N 3.3Å; S157-A159 PolarHBondContact O-N 2.86Å; A159-T191 HydrophobicContact CB-CG2 4.28Å; A159-K192 HydrophobicContact CB-CG 4.36Å; A159-K192 WeakPolarHBondContact O-CE 3.45Å; A159-K192 PolarHBondContact O-NZ 2.81Å; A159-Q245 HydrophobicContact CB-CB 4.19Å
160	K	81.5	Confident	88.2	Confident	186 Å²	186	47.4 Å²	47.4	81%	0.809	24%	0.244	S	C	*	.	S	Bend	trans	-83.7	-40.5	178.5	-64.3	-177.7	-179.7	179.2	0	111.5
161	R	79.6	Confident	88	Confident	97 Å²	97	48.7 Å²	48.7	37%	0.366	25%	0.251	S	S	.	.	S	Bend	trans	-97.1	154.5	177.3	-66.6	-179.9	172.9	172.8	-7.7	109.7	T191 F230 E242	R161-T191 PolarHBondContact O-OG1 3Å; R161-F230 PolarHBondContact NH2-O 3.07Å; R161-F230 VanDerWaalsContact NH2-O 3.14Å; R161-E242 VanDerWaalsContact NH1-CD 3.35Å; R161-E242 IonicContact NH1-OE1 3.35Å; R161-E242 PolarHBondContact NH1-OE1 3.04Å; R161-E242 IonicContact NH1-OE2 2.94Å; R161-E242 PolarHBondContact NH1-OE2 3.36Å
162	N	84.3	Confident	87.7	Confident	110 Å²	110	50 Å²	50	59%	0.588	26%	0.258	S	S	*	.	S	Bend	trans	-86.7	-23.6	176.3	-72.8	-15.2	0	0	0	113	L190 T191	N162-L190 CarbonylContact O-C 3.6Å; N162-L190 VanDerWaalsContact O-CA 3.27Å; N162-L190 WeakPolarHBondContact O-CA 3.35Å; N162-T191 WeakPolarHBondContact CA-OG1 3.43Å; N162-T191 PolarHBondContact O-N 3.25Å; N162-T191 PolarHBondContact O-OG1 2.86Å
163	E	87.7	Confident	87.1	Confident	104 Å²	104	55.1 Å²	55.1	49%	0.486	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	144	-179.9	-171.7	179.3	-172.5	0	0	108.8	N188 V189 L190	E163-N188 HydrophobicContact CG-CB 4.28Å; E163-N188 WeakPolarHBondContact OE1-CB 3.46Å; E163-V189 CarbonylContact C-O 3.49Å; E163-V189 WeakPolarHBondContact CA-O 3.41Å; E163-L190 HydrophobicContact CB-CD2 4.29Å; E163-L190 HydrophobicContact CG-CD2 4.5Å
164	Q	87.4	Confident	86	Confident	5 Å²	5	60.3 Å²	60.3	2%	0.023	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	136.4	176	-179.1	164.1	54.6	0	0	109.6	V189 T191 E242 V243 V246	Q164-V189 PolarHBondContact N-O 3.3Å; Q164-V189 WeakPolarHBondContact O-CG2 3.32Å; Q164-V189 PolarHBondContact O-N 3.04Å; Q164-T191 HydrophobicContact CB-CG2 3.89Å; Q164-E242 PolarHBondContact NE2-OE1 3.25Å; Q164-V243 PolarHBondContact NE2-O 3.32Å; Q164-V246 HydrophobicContact CB-CG2 4.08Å; Q164-V246 HydrophobicContact CG-CG2 4.39Å
165	R	89.1	Confident	85.1	Confident	106 Å²	106	63.9 Å²	63.9	40%	0.4	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	122.8	172.4	-176.8	171.4	171.7	167.2	-0.3	109.7	E167 N188 H224	R165-E167 IonicContact CZ-OE1 3.78Å; R165-E167 IonicContact NE-OE1 3.72Å; R165-E167 IonicContact NH2-OE1 3.63Å; R165-N188 VanDerWaalsContact CB-OD1 3.24Å; R165-N188 WeakPolarHBondContact CB-OD1 3.34Å; R165-N188 WeakPolarHBondContact CG-OD1 3.33Å; R165-H224 HydrophobicContact CB-CB 4.15Å; R165-H224 HydrophobicContact CG-CB 4.11Å; R165-H224 PolarHBondContact O-N 2.92Å
166	I	91.5	Very high	83.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	148.6	174.4	59.5	168.6	0	0	0	110	G186 K187 V189 V198 F200 I221 L244 V246 F248	I166-G186 CarbonylContact O-C 3.58Å; I166-G186 WeakPolarHBondContact O-CA 3.43Å; I166-K187 VanDerWaalsContact CG1-O 3.31Å; I166-K187 WeakPolarHBondContact CG1-O 3.49Å; I166-K187 PolarHBondContact N-O 2.73Å; I166-K187 PolarHBondContact O-N 3.32Å; I166-V189 HydrophobicContact CD1-CG1 4.02Å; I166-V189 HydrophobicContact CD1-CG2 4.1Å; I166-V189 HydrophobicContact CG1-CG1 4.25Å; I166-V189 HydrophobicContact CG1-CG2 4.1Å; I166-V189 HydrophobicContact CG2-CG2 4.06Å; I166-V198 HydrophobicContact CD1-CG1 4.16Å; I166-F200 HydrophobicContact CD1-CE2 4.43Å; I166-F200 HydrophobicContact CD1-CZ 4.31Å; I166-F200 HydrophobicContact CG1-CZ 4.5Å; I166-I221 HydrophobicContact CB-CG2 3.92Å; I166-I221 HydrophobicContact CD1-CG2 4.29Å; I166-I221 HydrophobicContact CG2-CG2 4.32Å; I166-L244 HydrophobicContact CG2-CD1 3.94Å; I166-V246 HydrophobicContact CG2-CB 4.27Å; I166-V246 HydrophobicContact CG2-CG2 3.83Å; I166-F248 HydrophobicContact CD1-CZ 4.1Å
167	E	92.1	Very high	82	Confident	12 Å²	12	76.3 Å²	76.3	6%	0.056	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.3	180	-67.5	-179.7	163	0	0	109.7	R165 Y169 Y183 G185 I221 S222 H224	R165-E167 IonicContact CZ-OE1 3.78Å; R165-E167 IonicContact NE-OE1 3.72Å; R165-E167 IonicContact NH2-OE1 3.63Å; E167-Y169 HydrophobicContact CB-CD2 4.27Å; E167-Y169 HydrophobicContact CB-CE2 3.44Å; E167-Y169 VanDerWaalsContact CB-CE2 3.44Å; E167-Y169 PolarHBondContact OE2-OH 2.8Å; E167-Y183 HydrophobicContact CB-CE2 4.15Å; E167-Y183 HydrophobicContact CG-CE2 4.06Å; E167-G185 CarbonylContact C-O 3.41Å; E167-G185 WeakPolarHBondContact CA-O 3.12Å; E167-I221 CarbonylContact O-C 3.49Å; E167-I221 VanDerWaalsContact O-CA 3.31Å; E167-I221 WeakPolarHBondContact O-CA 3.36Å; E167-S222 PolarHBondContact N-O 3.44Å; E167-S222 PolarHBondContact O-N 3.3Å; E167-H224 IonicContact OE1-CE1 3.83Å; E167-H224 IonicContact OE1-CG 3.68Å; E167-H224 IonicContact OE1-ND1 3.03Å; E167-H224 PolarHBondContact OE1-ND1 3.25Å; E167-H224 IonicContact OE2-ND1 2.77Å
168	L	93.7	Very high	81	Confident	0 Å²	0	76 Å²	76	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	133.1	178.2	-173.3	74.4	0	0	0	109.6	F149 I184 G185 F200 V202 L219 E220 I221	F149-L168 HydrophobicContact CD1-CD1 3.97Å; F149-L168 HydrophobicContact CD1-CD2 4.05Å; F149-L168 HydrophobicContact CE1-CD1 3.89Å; L168-I184 HydrophobicContact CB-CB 4.47Å; L168-I184 HydrophobicContact CD2-CB 4.32Å; L168-I184 HydrophobicContact CD2-CD1 4.01Å; L168-I184 HydrophobicContact CD2-CG2 4.23Å; L168-I184 HydrophobicContact CG-CB 4.45Å; L168-I184 HydrophobicContact CG-CD1 4.18Å; L168-I184 WeakPolarHBondContact O-CB 3.47Å; L168-I184 PolarHBondContact O-N 2.76Å; L168-G185 PolarHBondContact N-O 2.97Å; L168-G185 PolarHBondContact O-N 2.78Å; L168-F200 HydrophobicContact CB-CD1 4.05Å; L168-F200 HydrophobicContact CB-CD2 4.34Å; L168-F200 HydrophobicContact CB-CE1 4.1Å; L168-F200 HydrophobicContact CB-CE2 4.37Å; L168-F200 HydrophobicContact CB-CG 4.18Å; L168-F200 HydrophobicContact CB-CZ 4.26Å; L168-F200 HydrophobicContact CD2-CB 3.43Å; L168-F200 VanDerWaalsContact CD2-CB 3.43Å; L168-F200 HydrophobicContact CD2-CD1 4.14Å; L168-F200 HydrophobicContact CD2-CD2 3.95Å; L168-F200 HydrophobicContact CD2-CG 3.6Å; L168-F200 HydrophobicContact CG-CG 4.46Å; L168-V202 HydrophobicContact CD2-CG1 3.69Å; L168-L219 HydrophobicContact CD1-CB 4.02Å; L168-L219 HydrophobicContact CD1-CD1 4.46Å; L168-L219 HydrophobicContact CD2-CD1 4.46Å; L168-E220 CarbonylContact C-O 3.59Å; L168-E220 WeakPolarHBondContact CA-O 3.41Å; L168-I221 HydrophobicContact CD1-CD1 4.45Å; L168-I221 HydrophobicContact CD1-CG1 3.56Å
169	Y	90.9	Very high	80.3	Confident	32 Å²	32	74.5 Å²	74.5	13%	0.125	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	146.5	179	-64.4	-93.1	0	0	0	111.4	E167 Q181 R182 Y183 L219 E220 S222	E167-Y169 HydrophobicContact CB-CD2 4.27Å; E167-Y169 HydrophobicContact CB-CE2 3.44Å; E167-Y169 VanDerWaalsContact CB-CE2 3.44Å; E167-Y169 PolarHBondContact OE2-OH 2.8Å; Y169-Q181 HydrophobicContact CD1-CB 4.16Å; Y169-Q181 HydrophobicContact CD1-CG 3.77Å; Y169-Q181 HydrophobicContact CE1-CG 4.31Å; Y169-Q181 HydrophobicContact CG-CB 4.39Å; Y169-Q181 HydrophobicContact CG-CG 4.29Å; Y169-R182 CarbonylContact C-O 3.52Å; Y169-R182 VanDerWaalsContact CA-O 3.24Å; Y169-R182 WeakPolarHBondContact CA-O 3.17Å; Y169-Y183 HydrophobicContact CD1-CD2 4.48Å; Y169-Y183 AromaticContact CE1-CD2 3.85Å; Y169-Y183 HydrophobicContact CE1-CD2 3.85Å; Y169-Y183 HydrophobicContact CE1-CG 4.35Å; Y169-Y183 AromaticContact CZ-CD2 3.88Å; Y169-L219 CarbonylContact O-C 3.58Å; Y169-L219 WeakPolarHBondContact O-CA 3.48Å; Y169-E220 PolarHBondContact N-O 3.01Å; Y169-E220 PolarHBondContact O-N 2.93Å; Y169-S222 WeakPolarHBondContact CE2-OG 3.24Å
170	Q	91.2	Very high	80	Confident	0 Å²	0	82 Å²	82	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	129.1	163.6	172.5	-177.7	0.8	0	0	108.8	L172 Q181 R182 I184 T205 E208	Q170-L172 HydrophobicContact CG-CD2 4.12Å; Q170-Q181 CarbonylContact O-C 3.58Å; Q170-Q181 VanDerWaalsContact O-CA 3.28Å; Q170-Q181 WeakPolarHBondContact O-CA 3.28Å; Q170-R182 HydrophobicContact CB-CB 4.28Å; Q170-R182 PolarHBondContact N-O 3.41Å; Q170-R182 PolarHBondContact O-N 2.56Å; Q170-I184 HydrophobicContact CB-CD1 4.1Å; Q170-I184 HydrophobicContact CB-CG1 4.45Å; Q170-T205 HydrophobicContact CB-CG2 3.95Å; Q170-T205 HydrophobicContact CG-CG2 3.66Å; Q170-T205 PolarHBondContact OE1-OG1 3.06Å; Q170-E208 PolarHBondContact NE2-OE2 3.33Å
171	I	88.4	Confident	80.2	Confident	30 Å²	30	76.5 Å²	76.5	15%	0.154	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	129.1	175.7	-58.1	172.3	0	0	0	108.8	V129 L217 G218 E220	V129-I171 HydrophobicContact CB-CD1 4.39Å; V129-I171 HydrophobicContact CG1-CD1 3.54Å; V129-I171 HydrophobicContact CG2-CD1 4.05Å; I171-L217 HydrophobicContact CB-CB 3.9Å; I171-L217 HydrophobicContact CG2-CB 3.74Å; I171-L217 HydrophobicContact CG2-CD1 4.14Å; I171-G218 PolarHBondContact N-O 2.85Å; I171-G218 VanDerWaalsContact N-O 3.16Å; I171-E220 HydrophobicContact CD1-CB 4.2Å; I171-E220 HydrophobicContact CG1-CB 4.03Å
172	L	86.7	Confident	80.6	Confident	27 Å²	27	77.4 Å²	77.4	14%	0.141	38%	0.38	C	S	.	.			trans	-108.8	159	177.8	-61.6	-178.7	0	0	0	110.7	Q170 I178 A179 K180 R182 L217	Q170-L172 HydrophobicContact CG-CD2 4.12Å; L172-I178 HydrophobicContact CD1-CG2 4.29Å; L172-A179 WeakPolarHBondContact CD1-O 3.48Å; L172-K180 PolarHBondContact N-O 3.24Å; L172-R182 HydrophobicContact CD1-CB 4.06Å; L172-R182 HydrophobicContact CG-CB 4.42Å; L172-L217 WeakPolarHBondContact O-CD1 3.43Å
173	R	79.8	Confident	80.9	Confident	126 Å²	126	77.5 Å²	77.5	48%	0.475	37%	0.372	S	S	.	.			trans	-62.9	135.1	173.3	-72.3	-178	177.3	-150.5	-18.8	108.5	D175 E214 L217	R173-D175 PolarHBondContact O-N 3Å; R173-E214 VanDerWaalsContact CZ-O 3.24Å; R173-E214 IonicContact CZ-OE2 2.94Å; R173-E214 PolarHBondContact NE-O 3.27Å; R173-E214 IonicContact NH1-OE2 2.71Å; R173-E214 PolarHBondContact NH2-O 2.97Å; R173-E214 IonicContact NH2-OE2 3.98Å; R173-E214 PolarHBondContact NH2-OE2 2.85Å; R173-L217 HydrophobicContact CB-CD1 4.41Å; R173-L217 HydrophobicContact CG-CD1 3.76Å
174	P	68.6	Low	81.1	Confident	110 Å²	110	74.8 Å²	74.8	71%	0.714	36%	0.361	S	S	*	.			trans	-64.3	108.6	170.4	-12	26	0	0	0	107.9
175	D	70.9	Confident	81.2	Confident	105 Å²	105	75.2 Å²	75.2	56%	0.561	37%	0.367	S	S	*	.			trans	-119	140.4	165.1	-153.7	-6.4	0	0	0	105.9	R173 H177 I178	R173-D175 PolarHBondContact O-N 3Å; D175-H177 PolarHBondContact O-N 3.11Å; D175-I178 PolarHBondContact O-N 3.38Å; D175-I178 VanDerWaalsContact O-N 3.11Å
176	D	51	Low	81.4	Confident	156 Å²	156	71.7 Å²	71.7	83%	0.834	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-6.3	-162.5	-76.5	-31.6	0	0	0	114.4
177	H	57.9	Low	81.3	Confident	186 Å²	186	74.8 Å²	74.8	86%	0.861	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	2	-177.6	-58.1	-37.4	0	0	0	115.5	D175	D175-H177 PolarHBondContact O-N 3.11Å
178	I	63.3	Low	81.3	Confident	100 Å²	100	78.8 Å²	78.8	51%	0.513	40%	0.399	S	S	.	.	S	Bend	trans	-115.3	138	-179.3	-59.2	175.3	0	0	0	109.7	L172 D175 K180	L172-I178 HydrophobicContact CD1-CG2 4.29Å; D175-I178 PolarHBondContact O-N 3.38Å; D175-I178 VanDerWaalsContact O-N 3.11Å; I178-K180 PolarHBondContact O-N 3.05Å
179	A	68.3	Low	81.2	Confident	69 Å²	69	79.3 Å²	79.3	57%	0.57	40%	0.402	S	S	*	.			trans	-51.2	130.9	175.1	0	0	0	0	0	110.7	L172 Q181	L172-A179 WeakPolarHBondContact CD1-O 3.48Å; A179-Q181 PolarHBondContact O-N 3.36Å
180	K	76.6	Confident	81.1	Confident	161 Å²	161	81.9 Å²	81.9	70%	0.7	42%	0.417	S	S	*	.	S	Bend	trans	-60.4	-17.5	-179.3	-66.5	-176.7	178.1	-178.2	0	113.7	L172 I178	L172-K180 PolarHBondContact N-O 3.24Å; I178-K180 PolarHBondContact O-N 3.05Å
181	Q	84.7	Confident	80.9	Confident	71 Å²	71	81.9 Å²	81.9	33%	0.332	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	146.5	-175.5	66.8	-176.4	10	0	0	111.2	Y169 Q170 A179	Y169-Q181 HydrophobicContact CD1-CB 4.16Å; Y169-Q181 HydrophobicContact CD1-CG 3.77Å; Y169-Q181 HydrophobicContact CE1-CG 4.31Å; Y169-Q181 HydrophobicContact CG-CB 4.39Å; Y169-Q181 HydrophobicContact CG-CG 4.29Å; Q170-Q181 CarbonylContact O-C 3.58Å; Q170-Q181 VanDerWaalsContact O-CA 3.28Å; Q170-Q181 WeakPolarHBondContact O-CA 3.28Å; A179-Q181 PolarHBondContact O-N 3.36Å
182	R	87.9	Confident	80.8	Confident	115 Å²	115	85 Å²	85	43%	0.434	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.1	175.5	-180	-171.2	-65.9	157.1	-3.8	109.8	Y169 Q170 L172 E208	Y169-R182 CarbonylContact C-O 3.52Å; Y169-R182 VanDerWaalsContact CA-O 3.24Å; Y169-R182 WeakPolarHBondContact CA-O 3.17Å; Q170-R182 HydrophobicContact CB-CB 4.28Å; Q170-R182 PolarHBondContact N-O 3.41Å; Q170-R182 PolarHBondContact O-N 2.56Å; L172-R182 HydrophobicContact CD1-CB 4.06Å; L172-R182 HydrophobicContact CG-CB 4.42Å; R182-E208 IonicContact CZ-OE2 3.78Å; R182-E208 IonicContact NH1-OE2 3.17Å; R182-E208 PolarHBondContact NH1-OE2 2.86Å
183	Y	90.5	Very high	80.7	Confident	112 Å²	112	84.5 Å²	84.5	44%	0.439	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	136	178.3	177.6	-99.4	0	0	0	111.6	E167 Y169 G185 G186	E167-Y183 HydrophobicContact CB-CE2 4.15Å; E167-Y183 HydrophobicContact CG-CE2 4.06Å; Y169-Y183 HydrophobicContact CD1-CD2 4.48Å; Y169-Y183 AromaticContact CE1-CD2 3.85Å; Y169-Y183 HydrophobicContact CE1-CD2 3.85Å; Y169-Y183 HydrophobicContact CE1-CG 4.35Å; Y169-Y183 AromaticContact CZ-CD2 3.88Å; Y183-G185 VanDerWaalsContact CZ-C 3.48Å; Y183-G185 VanDerWaalsContact CZ-CA 3.47Å; Y183-G185 VanDerWaalsContact OH-C 3.22Å; Y183-G185 WeakPolarHBondContact OH-CA 3.32Å; Y183-G186 PolarHBondContact OH-N 2.89Å
184	I	91.7	Very high	81.1	Confident	47 Å²	47	84 Å²	84	24%	0.241	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-51.6	175.6	-59.9	176.7	0	0	0	110.4	L168 Q170 D201 V202 L219	L168-I184 HydrophobicContact CB-CB 4.47Å; L168-I184 HydrophobicContact CD2-CB 4.32Å; L168-I184 HydrophobicContact CD2-CD1 4.01Å; L168-I184 HydrophobicContact CD2-CG2 4.23Å; L168-I184 HydrophobicContact CG-CB 4.45Å; L168-I184 HydrophobicContact CG-CD1 4.18Å; L168-I184 WeakPolarHBondContact O-CB 3.47Å; L168-I184 PolarHBondContact O-N 2.76Å; Q170-I184 HydrophobicContact CB-CD1 4.1Å; Q170-I184 HydrophobicContact CB-CG1 4.45Å; I184-D201 WeakPolarHBondContact CG2-O 3.5Å; I184-V202 HydrophobicContact CD1-CG1 4.14Å; I184-V202 HydrophobicContact CG2-CG1 4.47Å; I184-L219 HydrophobicContact CD1-CD2 3.68Å
185	G	91.3	Very high	82	Confident	15 Å²	15	82.6 Å²	82.6	16%	0.155	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	169.2	-175.4	0	0	0	0	0	112.7	E167 L168 Y183	E167-G185 CarbonylContact C-O 3.41Å; E167-G185 WeakPolarHBondContact CA-O 3.12Å; L168-G185 PolarHBondContact N-O 2.97Å; L168-G185 PolarHBondContact O-N 2.78Å; Y183-G185 VanDerWaalsContact CZ-C 3.48Å; Y183-G185 VanDerWaalsContact CZ-CA 3.47Å; Y183-G185 VanDerWaalsContact OH-C 3.22Å; Y183-G185 WeakPolarHBondContact OH-CA 3.32Å
186	G	91.9	Very high	82.9	Confident	31 Å²	31	82.1 Å²	82.1	32%	0.32	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	147.8	178.1	0	0	0	0	0	112.2	I166 Y183	I166-G186 CarbonylContact O-C 3.58Å; I166-G186 WeakPolarHBondContact O-CA 3.43Å; Y183-G186 PolarHBondContact OH-N 2.89Å
187	K	91.1	Very high	84.8	Confident	65 Å²	65	76.8 Å²	76.8	28%	0.283	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.8	179.1	-72.1	-174.7	170.6	-172.6	0	109.5	E80 I166 V189 V198 S199 F200	E80-K187 IonicContact OE1-NZ 3.99Å; I166-K187 VanDerWaalsContact CG1-O 3.31Å; I166-K187 WeakPolarHBondContact CG1-O 3.49Å; I166-K187 PolarHBondContact N-O 2.73Å; I166-K187 PolarHBondContact O-N 3.32Å; K187-V189 HydrophobicContact CB-CG1 4.45Å; K187-V198 HydrophobicContact CD-CG1 4Å; K187-S199 WeakPolarHBondContact CE-O 3.06Å; K187-S199 PolarHBondContact NZ-O 3.29Å; K187-S199 PolarHBondContact NZ-OG 3.1Å; K187-F200 HydrophobicContact CB-CE1 4.41Å; K187-F200 HydrophobicContact CB-CZ 4.18Å; K187-F200 HydrophobicContact CD-CE1 4.13Å; K187-F200 HydrophobicContact CD-CZ 4.13Å; K187-F200 HydrophobicContact CG-CE1 3.88Å; K187-F200 HydrophobicContact CG-CZ 4.04Å
188	N	90.6	Very high	86.5	Confident	97 Å²	97	68.1 Å²	68.1	52%	0.519	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	131.2	167.4	-63.9	-8.7	0	0	0	108.9	E163 R165	E163-N188 HydrophobicContact CG-CB 4.28Å; E163-N188 WeakPolarHBondContact OE1-CB 3.46Å; R165-N188 VanDerWaalsContact CB-OD1 3.24Å; R165-N188 WeakPolarHBondContact CB-OD1 3.34Å; R165-N188 WeakPolarHBondContact CG-OD1 3.33Å
189	V	91.3	Very high	87.9	Confident	10 Å²	10	63.6 Å²	63.6	6%	0.061	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145.7	-176.2	-64	0	0	0	0	111.3	E163 Q164 I166 K187 V198 V246	E163-V189 CarbonylContact C-O 3.49Å; E163-V189 WeakPolarHBondContact CA-O 3.41Å; Q164-V189 PolarHBondContact N-O 3.3Å; Q164-V189 WeakPolarHBondContact O-CG2 3.32Å; Q164-V189 PolarHBondContact O-N 3.04Å; I166-V189 HydrophobicContact CD1-CG1 4.02Å; I166-V189 HydrophobicContact CD1-CG2 4.1Å; I166-V189 HydrophobicContact CG1-CG1 4.25Å; I166-V189 HydrophobicContact CG1-CG2 4.1Å; I166-V189 HydrophobicContact CG2-CG2 4.06Å; K187-V189 HydrophobicContact CB-CG1 4.45Å; V189-V198 HydrophobicContact CG1-CG2 3.99Å; V189-V246 HydrophobicContact CG2-CB 4.44Å; V189-V246 HydrophobicContact CG2-CG1 4.08Å; V189-V246 HydrophobicContact CG2-CG2 3.46Å; V189-V246 VanDerWaalsContact CG2-CG2 3.46Å
190	L	90.4	Very high	89.1	Confident	86 Å²	86	60.9 Å²	60.9	45%	0.45	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	128.6	175.6	-63	177.5	0	0	0	110.6	R153 N162 E163	R153-L190 WeakPolarHBondContact CD-O 3.48Å; R153-L190 PolarHBondContact NE-O 3.36Å; R153-L190 VanDerWaalsContact NE-O 3.09Å; R153-L190 PolarHBondContact NH1-O 2.95Å; N162-L190 CarbonylContact O-C 3.6Å; N162-L190 VanDerWaalsContact O-CA 3.27Å; N162-L190 WeakPolarHBondContact O-CA 3.35Å; E163-L190 HydrophobicContact CB-CD2 4.29Å; E163-L190 HydrophobicContact CG-CD2 4.5Å
191	T	86.4	Confident	89.9	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	29%	0.292	C	S	.	.	S	Bend	trans	-76.5	-35.3	179.7	58.5	0	0	0	0	112.3	N156 A159 R161 N162 Q164 Q245 V246	N156-T191 PolarHBondContact N-O 2.9Å; A159-T191 HydrophobicContact CB-CG2 4.28Å; R161-T191 PolarHBondContact O-OG1 3Å; N162-T191 WeakPolarHBondContact CA-OG1 3.43Å; N162-T191 PolarHBondContact O-N 3.25Å; N162-T191 PolarHBondContact O-OG1 2.86Å; Q164-T191 HydrophobicContact CB-CG2 3.89Å; T191-Q245 HydrophobicContact CG2-CB 4.4Å; T191-V246 HydrophobicContact CG2-CG2 4.37Å
192	K	86.7	Confident	90.4	Very high	94 Å²	94	53 Å²	53	41%	0.409	28%	0.277	S	S	.	.	S	Bend	trans	-107.3	-0.2	-177	-70.4	178.6	-176.9	172.9	0	114.2	N156 A159	N156-K192 VanDerWaalsContact O-CG 3.3Å; N156-K192 WeakPolarHBondContact O-CG 3.27Å; A159-K192 HydrophobicContact CB-CG 4.36Å; A159-K192 WeakPolarHBondContact O-CE 3.45Å; A159-K192 PolarHBondContact O-NZ 2.81Å
193	G	83.7	Confident	90.5	Very high	18 Å²	18	48 Å²	48	19%	0.186	26%	0.259	C	S	.	.	S	Bend	trans	-69.2	170.8	-178.5	0	0	0	0	0	113.4	R153	R153-G193 PolarHBondContact NH1-O 3.29Å
194	T	88	Confident	90.5	Very high	114 Å²	114	48.3 Å²	48.3	70%	0.699	27%	0.268	S	S	*	.	S	Bend	trans	-52.2	148.5	173.4	49.8	0	0	0	0	111.8	R153 E196	R153-T194 PolarHBondContact NH1-O 3.27Å; R153-T194 PolarHBondContact NH2-O 2.81Å; T194-E196 PolarHBondContact O-N 2.9Å
195	P	88.7	Confident	90.5	Very high	81 Å²	81	46.4 Å²	46.4	53%	0.526	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-53.7	137.3	177	-23.7	32.2	0	0	0	112.2	L152 R153	L152-P195 HydrophobicContact CD1-CB 4.44Å; R153-P195 VanDerWaalsContact O-CA 3.27Å; R153-P195 WeakPolarHBondContact O-CA 3.46Å
196	E	89.8	Confident	90.6	Very high	96 Å²	96	45.7 Å²	45.7	45%	0.449	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	139.9	-170.3	-176.7	178.4	-161	0	0	111	R153 T194	R153-E196 WeakPolarHBondContact CB-O 3.31Å; R153-E196 IonicContact CZ-OE2 2.99Å; R153-E196 PolarHBondContact N-O 3.2Å; R153-E196 IonicContact NE-OE2 2.69Å; R153-E196 IonicContact NH2-OE2 3.71Å; R153-E196 PolarHBondContact NH2-OE2 3.37Å; R153-E196 PolarHBondContact O-N 3.03Å; R153-E196 VanDerWaalsContact O-N 3.15Å; T194-E196 PolarHBondContact O-N 2.9Å
197	W	91.1	Very high	90.5	Very high	43 Å²	43	48.1 Å²	48.1	16%	0.163	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	126.8	173.4	-73.4	109.6	0	0	0	110.4	E76 R150 L152 L272 H275	E76-W197 PolarHBondContact OE2-NE1 3.48Å; R150-W197 HydrophobicContact CB-CE3 4.09Å; R150-W197 HydrophobicContact CB-CZ3 4.31Å; R150-W197 VanDerWaalsContact NH2-CB 3.31Å; L152-W197 HydrophobicContact CB-CD2 4.2Å; L152-W197 HydrophobicContact CB-CE3 3.84Å; L152-W197 HydrophobicContact CB-CH2 3.89Å; L152-W197 HydrophobicContact CB-CZ2 4.25Å; L152-W197 HydrophobicContact CB-CZ3 3.69Å; L152-W197 HydrophobicContact CD1-CD2 3.93Å; L152-W197 HydrophobicContact CD1-CE3 4.42Å; L152-W197 HydrophobicContact CD1-CG 4.17Å; L152-W197 HydrophobicContact CD1-CZ2 4.38Å; W197-L272 HydrophobicContact CZ2-CD2 4.28Å; W197-H275 AromaticContact CH2-CE1 3.72Å; W197-H275 AromaticContact CZ3-CE1 3.74Å
198	V	92	Very high	90.4	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.03	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.8	169.2	-173.9	0	0	0	0	107.9	R150 A151 R153 I166 K187 V189 F200	R150-V198 WeakPolarHBondContact CA-O 3.42Å; A151-V198 PolarHBondContact N-O 2.85Å; A151-V198 PolarHBondContact O-N 3.16Å; R153-V198 HydrophobicContact CB-CG2 4.2Å; I166-V198 HydrophobicContact CD1-CG1 4.16Å; K187-V198 HydrophobicContact CD-CG1 4Å; V189-V198 HydrophobicContact CG1-CG2 3.99Å; V198-F200 HydrophobicContact CG1-CD2 4.15Å; V198-F200 HydrophobicContact CG1-CE2 3.46Å; V198-F200 VanDerWaalsContact CG1-CE2 3.46Å; V198-F200 HydrophobicContact CG1-CZ 4.02Å
199	S	93.6	Very high	90.5	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.028	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	149.5	177.6	66	0	0	0	0	112.3	E80 F149 K187	E80-S199 VanDerWaalsContact CD-OG 3.24Å; E80-S199 WeakPolarHBondContact OE1-CB 3.3Å; E80-S199 PolarHBondContact OE1-OG 3.19Å; F149-S199 CarbonylContact O-C 3.59Å; F149-S199 WeakPolarHBondContact O-CA 3.48Å; K187-S199 WeakPolarHBondContact CE-O 3.06Å; K187-S199 PolarHBondContact NZ-O 3.29Å; K187-S199 PolarHBondContact NZ-OG 3.1Å
200	F	94	Very high	90.4	Very high	12 Å²	12	42.6 Å²	42.6	5%	0.053	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	134.1	169.7	-68.9	-87.8	0	0	0	110.5	E148 F149 I166 L168 K187 V198 V202	E148-F200 VanDerWaalsContact OE2-O 3.08Å; F149-F200 HydrophobicContact CD1-CD2 4.07Å; F149-F200 HydrophobicContact CE1-CD2 4.48Å; F149-F200 PolarHBondContact N-O 3.17Å; F149-F200 PolarHBondContact O-N 2.78Å; I166-F200 HydrophobicContact CD1-CE2 4.43Å; I166-F200 HydrophobicContact CD1-CZ 4.31Å; I166-F200 HydrophobicContact CG1-CZ 4.5Å; L168-F200 HydrophobicContact CB-CD1 4.05Å; L168-F200 HydrophobicContact CB-CD2 4.34Å; L168-F200 HydrophobicContact CB-CE1 4.1Å; L168-F200 HydrophobicContact CB-CE2 4.37Å; L168-F200 HydrophobicContact CB-CG 4.18Å; L168-F200 HydrophobicContact CB-CZ 4.26Å; L168-F200 HydrophobicContact CD2-CB 3.43Å; L168-F200 VanDerWaalsContact CD2-CB 3.43Å; L168-F200 HydrophobicContact CD2-CD1 4.14Å; L168-F200 HydrophobicContact CD2-CD2 3.95Å; L168-F200 HydrophobicContact CD2-CG 3.6Å; L168-F200 HydrophobicContact CG-CG 4.46Å; K187-F200 HydrophobicContact CB-CE1 4.41Å; K187-F200 HydrophobicContact CB-CZ 4.18Å; K187-F200 HydrophobicContact CD-CE1 4.13Å; K187-F200 HydrophobicContact CD-CZ 4.13Å; K187-F200 HydrophobicContact CG-CE1 3.88Å; K187-F200 HydrophobicContact CG-CZ 4.04Å; V198-F200 HydrophobicContact CG1-CD2 4.15Å; V198-F200 HydrophobicContact CG1-CE2 3.46Å; V198-F200 VanDerWaalsContact CG1-CE2 3.46Å; V198-F200 HydrophobicContact CG1-CZ 4.02Å; F200-V202 HydrophobicContact CB-CG1 4.4Å; F200-V202 PolarHBondContact O-N 2.92Å
201	D	92.6	Very high	90.2	Very high	67 Å²	67	43.2 Å²	43.2	36%	0.358	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	113.8	170.9	-169.3	-15.3	0	0	0	109.2	R146 E148 I184 T203	R146-D201 IonicContact CZ-OD2 2.73Å; R146-D201 IonicContact NH1-OD2 2.79Å; R146-D201 PolarHBondContact NH1-OD2 2.62Å; R146-D201 IonicContact NH2-OD2 3.53Å; R146-D201 PolarHBondContact NH2-OD2 2.03Å; E148-D201 PolarHBondContact OE2-N 3.3Å; I184-D201 WeakPolarHBondContact CG2-O 3.5Å; D201-T203 WeakPolarHBondContact OD1-CB 3Å; D201-T203 PolarHBondContact OD1-N 2.62Å; D201-T203 PolarHBondContact OD1-OG1 2.63Å
202	V	94.6	Very high	90.3	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	25%	0.252	C	S	.	.			trans	-119.9	23.8	179.7	-64.5	0	0	0	0	110.5	A147 F149 L168 I184 F200 D204 T205 V206 L219 L276	A147-V202 HydrophobicContact CB-CG2 4.13Å; A147-V202 PolarHBondContact O-N 3.4Å; F149-V202 HydrophobicContact CB-CG1 3.88Å; F149-V202 HydrophobicContact CB-CG2 3.93Å; L168-V202 HydrophobicContact CD2-CG1 3.69Å; I184-V202 HydrophobicContact CD1-CG1 4.14Å; I184-V202 HydrophobicContact CG2-CG1 4.47Å; F200-V202 HydrophobicContact CB-CG1 4.4Å; F200-V202 PolarHBondContact O-N 2.92Å; V202-D204 PolarHBondContact O-N 3.03Å; V202-T205 PolarHBondContact O-N 3.27Å; V202-V206 HydrophobicContact CB-CG2 4.39Å; V202-V206 HydrophobicContact CG2-CG2 3.85Å; V202-V206 WeakPolarHBondContact O-CG2 3.42Å; V202-V206 PolarHBondContact O-N 3.04Å; V202-L219 HydrophobicContact CG1-CD1 4Å; V202-L219 HydrophobicContact CG1-CD2 4.42Å; V202-L276 HydrophobicContact CG2-CD2 3.93Å
203	T	91	Very high	90.2	Very high	10 Å²	10	54.1 Å²	54.1	6%	0.061	26%	0.264	C	S	.	.	H	α-helix	trans	-55.8	-48	-173.7	-58.8	0	0	0	0	112	L144 R146 A147 D201 R207	L144-T203 HydrophobicContact CD2-CG2 4.37Å; R146-T203 WeakPolarHBondContact CA-OG1 3.25Å; A147-T203 PolarHBondContact N-OG1 3.2Å; A147-T203 PolarHBondContact O-N 2.95Å; A147-T203 PolarHBondContact O-OG1 2.79Å; D201-T203 WeakPolarHBondContact OD1-CB 3Å; D201-T203 PolarHBondContact OD1-N 2.62Å; D201-T203 PolarHBondContact OD1-OG1 2.63Å; T203-R207 WeakPolarHBondContact O-CB 3.5Å; T203-R207 PolarHBondContact O-N 2.83Å
204	D	89.9	Confident	90.3	Very high	117 Å²	117	59 Å²	59	63%	0.626	28%	0.282	S	S	*	.	H	α-helix	trans	-68.4	-40.8	-178.4	-63.7	-32.6	0	0	0	112	V202 R207 E208	V202-D204 PolarHBondContact O-N 3.03Å; D204-R207 WeakPolarHBondContact O-CB 3.38Å; D204-R207 PolarHBondContact O-N 3.23Å; D204-R207 IonicContact OD1-CZ 3.73Å; D204-R207 IonicContact OD1-NH1 3.67Å; D204-R207 PolarHBondContact OD1-NH1 3.13Å; D204-R207 IonicContact OD1-NH2 3.87Å; D204-E208 PolarHBondContact O-N 3.13Å
205	T	92.2	Very high	90.1	Very high	8 Å²	8	55 Å²	55	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-61.9	-47.1	176.7	-57.2	0	0	0	0	111.8	Q170 V202 R207 E208 W209 L219	Q170-T205 HydrophobicContact CB-CG2 3.95Å; Q170-T205 HydrophobicContact CG-CG2 3.66Å; Q170-T205 PolarHBondContact OE1-OG1 3.06Å; V202-T205 PolarHBondContact O-N 3.27Å; T205-R207 VanDerWaalsContact C-N 3.33Å; T205-E208 WeakPolarHBondContact O-CB 3.5Å; T205-E208 PolarHBondContact O-N 3.01Å; T205-W209 HydrophobicContact CG2-CD2 4.41Å; T205-W209 HydrophobicContact CG2-CH2 4.43Å; T205-W209 HydrophobicContact CG2-CZ2 3.64Å; T205-W209 VanDerWaalsContact O-CD1 3.22Å; T205-W209 VanDerWaalsContact O-CG 3.31Å; T205-W209 PolarHBondContact O-N 2.88Å; T205-W209 VanDerWaalsContact O-N 3.09Å; T205-L219 HydrophobicContact CG2-CD2 4.04Å
206	V	92.9	Very high	90.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68.5	-35.5	177.8	175.4	0	0	0	0	110.7	L144 A147 V202 E208 W209 L210 L276 L278	L144-V206 HydrophobicContact CD2-CB 4.14Å; L144-V206 HydrophobicContact CD2-CG1 3.94Å; A147-V206 HydrophobicContact CB-CB 3.79Å; A147-V206 HydrophobicContact CB-CG1 4.11Å; A147-V206 HydrophobicContact CB-CG2 3.78Å; V202-V206 HydrophobicContact CB-CG2 4.39Å; V202-V206 HydrophobicContact CG2-CG2 3.85Å; V202-V206 WeakPolarHBondContact O-CG2 3.42Å; V202-V206 PolarHBondContact O-N 3.04Å; V206-E208 VanDerWaalsContact C-N 3.31Å; V206-E208 PolarHBondContact O-N 3Å; V206-W209 HydrophobicContact CG2-CE3 4.08Å; V206-W209 HydrophobicContact CG2-CZ3 4.18Å; V206-W209 WeakPolarHBondContact O-CB 3.5Å; V206-W209 PolarHBondContact O-N 3.04Å; V206-L210 HydrophobicContact CG1-CD1 4.26Å; V206-L210 HydrophobicContact CG1-CG 4.28Å; V206-L210 VanDerWaalsContact O-CG 3.31Å; V206-L210 WeakPolarHBondContact O-CG 3.35Å; V206-L210 PolarHBondContact O-N 3.46Å; V206-L276 HydrophobicContact CG2-CD1 4.35Å; V206-L278 HydrophobicContact CG1-CD1 4.2Å; V206-L278 HydrophobicContact CG1-CD2 3.85Å; V206-L278 HydrophobicContact CG1-CG 4.09Å
207	R	90	Very high	89.8	Confident	81 Å²	81	51.3 Å²	51.3	31%	0.306	24%	0.236	S	C	.	.	H	α-helix	trans	-58.6	-44.7	173.6	-167.8	-178.8	-61.9	117.2	1.3	111.2	L144 T203 D204 T205 L210 M211	L144-R207 HydrophobicContact CD2-CB 4.04Å; T203-R207 WeakPolarHBondContact O-CB 3.5Å; T203-R207 PolarHBondContact O-N 2.83Å; D204-R207 WeakPolarHBondContact O-CB 3.38Å; D204-R207 PolarHBondContact O-N 3.23Å; D204-R207 IonicContact OD1-CZ 3.73Å; D204-R207 IonicContact OD1-NH1 3.67Å; D204-R207 PolarHBondContact OD1-NH1 3.13Å; D204-R207 IonicContact OD1-NH2 3.87Å; T205-R207 VanDerWaalsContact C-N 3.33Å; R207-L210 PolarHBondContact O-N 2.87Å; R207-M211 HydrophobicContact CG-CE 4.03Å; R207-M211 WeakPolarHBondContact O-CG 3.22Å; R207-M211 PolarHBondContact O-N 2.78Å; R207-M211 VanDerWaalsContact O-N 3.08Å
208	E	89.6	Confident	89.7	Confident	49 Å²	49	49.3 Å²	49.3	23%	0.229	23%	0.228	C	C	.	.	H	α-helix	trans	-59	-46.2	174.9	-168.5	178.3	179.7	0	0	111.1	Q170 R182 D204 T205 V206 L210 M211 Y212 T215	Q170-E208 PolarHBondContact NE2-OE2 3.33Å; R182-E208 IonicContact CZ-OE2 3.78Å; R182-E208 IonicContact NH1-OE2 3.17Å; R182-E208 PolarHBondContact NH1-OE2 2.86Å; D204-E208 PolarHBondContact O-N 3.13Å; T205-E208 WeakPolarHBondContact O-CB 3.5Å; T205-E208 PolarHBondContact O-N 3.01Å; V206-E208 VanDerWaalsContact C-N 3.31Å; V206-E208 PolarHBondContact O-N 3Å; E208-L210 VanDerWaalsContact C-N 3.32Å; E208-L210 PolarHBondContact O-N 3.01Å; E208-M211 PolarHBondContact O-N 2.89Å; E208-M211 VanDerWaalsContact O-N 3.16Å; E208-Y212 PolarHBondContact O-N 2.89Å; E208-T215 HydrophobicContact CG-CG2 4.43Å
209	W	91.7	Very high	89.7	Confident	1 Å²	1	49 Å²	49	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-35.2	177.5	-62.2	-6	0	0	0	114.1	F132 V134 T205 V206 Y212 T215 N216 L219 L276	F132-W209 HydrophobicContact CD2-CH2 4.24Å; F132-W209 HydrophobicContact CD2-CZ3 4.2Å; V134-W209 HydrophobicContact CG2-CB 4.38Å; V134-W209 HydrophobicContact CG2-CE3 4.42Å; T205-W209 HydrophobicContact CG2-CD2 4.41Å; T205-W209 HydrophobicContact CG2-CH2 4.43Å; T205-W209 HydrophobicContact CG2-CZ2 3.64Å; T205-W209 VanDerWaalsContact O-CD1 3.22Å; T205-W209 VanDerWaalsContact O-CG 3.31Å; T205-W209 PolarHBondContact O-N 2.88Å; T205-W209 VanDerWaalsContact O-N 3.09Å; V206-W209 HydrophobicContact CG2-CE3 4.08Å; V206-W209 HydrophobicContact CG2-CZ3 4.18Å; V206-W209 WeakPolarHBondContact O-CB 3.5Å; V206-W209 PolarHBondContact O-N 3.04Å; W209-Y212 CarbonylContact O-C 3.49Å; W209-T215 PolarHBondContact NE1-O 3.27Å; W209-N216 HydrophobicContact CB-CB 4.06Å; W209-N216 HydrophobicContact CD2-CB 4.09Å; W209-N216 HydrophobicContact CG-CB 3.82Å; W209-L219 HydrophobicContact CH2-CD1 4.44Å; W209-L219 HydrophobicContact CH2-CD2 4.16Å; W209-L219 HydrophobicContact CH2-CG 3.88Å; W209-L219 HydrophobicContact CZ2-CD2 4.11Å; W209-L219 HydrophobicContact CZ2-CG 4.25Å; W209-L276 HydrophobicContact CZ3-CD1 3.9Å
210	L	89.8	Confident	89.6	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-74.8	-27.6	177.3	-65.5	178.9	0	0	0	112.3	V134 M137 L144 V206 R207 E208	V134-L210 HydrophobicContact CB-CD2 4.15Å; V134-L210 HydrophobicContact CG2-CD2 3.96Å; M137-L210 HydrophobicContact CB-CD2 3.76Å; L144-L210 HydrophobicContact CB-CD1 4.31Å; L144-L210 HydrophobicContact CD2-CD1 4.19Å; V206-L210 HydrophobicContact CG1-CD1 4.26Å; V206-L210 HydrophobicContact CG1-CG 4.28Å; V206-L210 VanDerWaalsContact O-CG 3.31Å; V206-L210 WeakPolarHBondContact O-CG 3.35Å; V206-L210 PolarHBondContact O-N 3.46Å; R207-L210 PolarHBondContact O-N 2.87Å; E208-L210 VanDerWaalsContact C-N 3.32Å; E208-L210 PolarHBondContact O-N 3.01Å
211	M	86.6	Confident	89.4	Confident	99 Å²	99	49.9 Å²	49.9	49%	0.488	23%	0.231	S	C	.	.	H	α-helix	trans	-80	-42.1	174.3	-70.6	-177.1	175.7	0	0	111.8	R207 E208	R207-M211 HydrophobicContact CG-CE 4.03Å; R207-M211 WeakPolarHBondContact O-CG 3.22Å; R207-M211 PolarHBondContact O-N 2.78Å; R207-M211 VanDerWaalsContact O-N 3.08Å; E208-M211 PolarHBondContact O-N 2.89Å; E208-M211 VanDerWaalsContact O-N 3.16Å
212	Y	88.1	Confident	89.2	Confident	152 Å²	152	47 Å²	47	60%	0.596	22%	0.215	S	C	*	.			trans	-129.1	97.3	-176.5	-54.6	-72.4	0	0	0	110	E208 W209 E214 T215	E208-Y212 PolarHBondContact O-N 2.89Å; W209-Y212 CarbonylContact O-C 3.49Å; Y212-E214 PolarHBondContact O-N 3.43Å; Y212-T215 PolarHBondContact O-N 2.85Å; Y212-T215 PolarHBondContact O-OG1 2.75Å
213	R	84.8	Confident	88.7	Confident	172 Å²	172	46.9 Å²	46.9	65%	0.649	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-51.9	-35.5	179.9	178.8	177.2	171.3	-178.8	-3.3	113.4	E138 T215 N216	E138-R213 WeakPolarHBondContact OE1-CD 3.39Å; E138-R213 WeakPolarHBondContact OE1-CG 3.49Å; R213-T215 PolarHBondContact O-N 3.34Å; R213-N216 WeakPolarHBondContact O-CB 3.42Å; R213-N216 PolarHBondContact O-N 3.06Å
214	E	84.3	Confident	88	Confident	120 Å²	120	49.5 Å²	49.5	56%	0.561	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-62.8	-22.5	-179	-65.7	-58.6	154	0	0	113.7	R173 Y212	R173-E214 VanDerWaalsContact CZ-O 3.24Å; R173-E214 IonicContact CZ-OE2 2.94Å; R173-E214 PolarHBondContact NE-O 3.27Å; R173-E214 IonicContact NH1-OE2 2.71Å; R173-E214 PolarHBondContact NH2-O 2.97Å; R173-E214 IonicContact NH2-OE2 3.98Å; R173-E214 PolarHBondContact NH2-OE2 2.85Å; Y212-E214 PolarHBondContact O-N 3.43Å
215	T	85.4	Confident	87.1	Confident	31 Å²	31	46 Å²	46	19%	0.19	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-86.3	-6.4	179.6	63.1	0	0	0	0	113.3	E208 W209 Y212 R213 L217	E208-T215 HydrophobicContact CG-CG2 4.43Å; W209-T215 PolarHBondContact NE1-O 3.27Å; Y212-T215 PolarHBondContact O-N 2.85Å; Y212-T215 PolarHBondContact O-OG1 2.75Å; R213-T215 PolarHBondContact O-N 3.34Å; T215-L217 PolarHBondContact O-N 2.97Å
216	N	87.3	Confident	85.7	Confident	43 Å²	43	47.2 Å²	47.2	23%	0.23	22%	0.219	C	C	.	.			trans	-79.7	83.5	179.1	-177	9.2	0	0	0	111.3	F132 W209 R213	F132-N216 PolarHBondContact O-ND2 3.36Å; W209-N216 HydrophobicContact CB-CB 4.06Å; W209-N216 HydrophobicContact CD2-CB 4.09Å; W209-N216 HydrophobicContact CG-CB 3.82Å; R213-N216 WeakPolarHBondContact O-CB 3.42Å; R213-N216 PolarHBondContact O-N 3.06Å
217	L	84.8	Confident	84.3	Confident	56 Å²	56	48.3 Å²	48.3	29%	0.293	23%	0.226	S	C	.	.			trans	-100.6	-7.8	175.4	-60.4	177.1	0	0	0	113.2	I171 L172 R173 T215	I171-L217 HydrophobicContact CB-CB 3.9Å; I171-L217 HydrophobicContact CG2-CB 3.74Å; I171-L217 HydrophobicContact CG2-CD1 4.14Å; L172-L217 WeakPolarHBondContact O-CD1 3.43Å; R173-L217 HydrophobicContact CB-CD1 4.41Å; R173-L217 HydrophobicContact CG-CD1 3.76Å; T215-L217 PolarHBondContact O-N 2.97Å
218	G	89.1	Confident	83.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.226	C	C	.	.			trans	102.4	-175.7	-179.1	0	0	0	0	0	113.9	F130 I171	F130-G218 CarbonylContact O-C 3.56Å; F130-G218 WeakPolarHBondContact O-CA 3.5Å; I171-G218 PolarHBondContact N-O 2.85Å; I171-G218 VanDerWaalsContact N-O 3.16Å
219	L	92.1	Very high	81.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	152.3	177.3	-61.7	170.5	0	0	0	109.6	V129 F130 F132 F149 L168 Y169 I184 V202 T205 W209 L276	V129-L219 CarbonylContact C-O 3.51Å; V129-L219 WeakPolarHBondContact CA-O 3.4Å; F130-L219 PolarHBondContact N-O 2.95Å; F130-L219 PolarHBondContact O-N 3.22Å; F132-L219 HydrophobicContact CE2-CD1 4.16Å; F149-L219 HydrophobicContact CB-CD1 3.97Å; F149-L219 HydrophobicContact CD1-CD1 4.15Å; F149-L219 HydrophobicContact CD2-CD1 4.09Å; F149-L219 HydrophobicContact CG-CD1 3.79Å; L168-L219 HydrophobicContact CD1-CB 4.02Å; L168-L219 HydrophobicContact CD1-CD1 4.46Å; L168-L219 HydrophobicContact CD2-CD1 4.46Å; Y169-L219 CarbonylContact O-C 3.58Å; Y169-L219 WeakPolarHBondContact O-CA 3.48Å; I184-L219 HydrophobicContact CD1-CD2 3.68Å; V202-L219 HydrophobicContact CG1-CD1 4Å; V202-L219 HydrophobicContact CG1-CD2 4.42Å; T205-L219 HydrophobicContact CG2-CD2 4.04Å; W209-L219 HydrophobicContact CH2-CD1 4.44Å; W209-L219 HydrophobicContact CH2-CD2 4.16Å; W209-L219 HydrophobicContact CH2-CG 3.88Å; W209-L219 HydrophobicContact CZ2-CD2 4.11Å; W209-L219 HydrophobicContact CZ2-CG 4.25Å; L219-L276 HydrophobicContact CD1-CD2 4.4Å
220	E	90.4	Very high	80.5	Confident	33 Å²	33	49 Å²	49	15%	0.154	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.7	175.8	-177.2	173	-177	0	0	109.6	S127 K128 V129 L168 Y169 I171	S127-E220 WeakPolarHBondContact CB-OE1 3.12Å; S127-E220 PolarHBondContact OG-OE1 2.85Å; K128-E220 CarbonylContact O-C 3.46Å; K128-E220 WeakPolarHBondContact O-CA 3.36Å; V129-E220 HydrophobicContact CG2-CG 4.34Å; L168-E220 CarbonylContact C-O 3.59Å; L168-E220 WeakPolarHBondContact CA-O 3.41Å; Y169-E220 PolarHBondContact N-O 3.01Å; Y169-E220 PolarHBondContact O-N 2.93Å; I171-E220 HydrophobicContact CD1-CB 4.2Å; I171-E220 HydrophobicContact CG1-CB 4.03Å
221	I	90.8	Very high	79.1	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122	166	-62.6	174.2	0	0	0	107.5	S127 K128 F130 F149 I166 E167 L168 F248	S127-I221 CarbonylContact C-O 3.57Å; S127-I221 WeakPolarHBondContact CA-O 3.37Å; S127-I221 WeakPolarHBondContact CB-O 3.35Å; K128-I221 PolarHBondContact N-O 2.65Å; K128-I221 PolarHBondContact O-N 3.34Å; F130-I221 HydrophobicContact CD2-CD1 4.4Å; F130-I221 HydrophobicContact CD2-CG1 4.24Å; F130-I221 HydrophobicContact CE2-CB 3.84Å; F130-I221 HydrophobicContact CE2-CD1 3.49Å; F130-I221 VanDerWaalsContact CE2-CD1 3.49Å; F130-I221 HydrophobicContact CE2-CG1 3.52Å; F130-I221 HydrophobicContact CZ-CD1 3.61Å; F130-I221 HydrophobicContact CZ-CG1 4.17Å; F149-I221 HydrophobicContact CE1-CD1 3.77Å; F149-I221 HydrophobicContact CE1-CG1 4.28Å; F149-I221 HydrophobicContact CZ-CD1 4.16Å; I166-I221 HydrophobicContact CB-CG2 3.92Å; I166-I221 HydrophobicContact CD1-CG2 4.29Å; I166-I221 HydrophobicContact CG2-CG2 4.32Å; E167-I221 CarbonylContact O-C 3.49Å; E167-I221 VanDerWaalsContact O-CA 3.31Å; E167-I221 WeakPolarHBondContact O-CA 3.36Å; L168-I221 HydrophobicContact CD1-CD1 4.45Å; L168-I221 HydrophobicContact CD1-CG1 3.56Å; I221-F248 HydrophobicContact CD1-CE1 4.32Å; I221-F248 HydrophobicContact CD1-CE2 3.86Å; I221-F248 HydrophobicContact CD1-CZ 3.67Å; I221-F248 HydrophobicContact CG2-CE2 4.24Å; I221-F248 HydrophobicContact CG2-CZ 4.38Å
222	S	87.3	Confident	77.9	Confident	5 Å²	5	53.9 Å²	53.9	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	165.2	174.9	75	0	0	0	0	111.5	E167 Y169	E167-S222 PolarHBondContact N-O 3.44Å; E167-S222 PolarHBondContact O-N 3.3Å; Y169-S222 WeakPolarHBondContact CE2-OG 3.24Å
223	V	85.2	Confident	76.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	155.9	166.3	-62.5	0	0	0	0	110.9	T126 C225 P226 E242 L244	T126-V223 PolarHBondContact O-N 2.77Å; V223-C225 PolarHBondContact O-N 2.91Å; V223-P226 HydrophobicContact CG2-CB 4.06Å; V223-E242 HydrophobicContact CB-CG 4.08Å; V223-E242 HydrophobicContact CG1-CG 4.11Å; V223-E242 HydrophobicContact CG2-CB 4.35Å; V223-E242 HydrophobicContact CG2-CG 4.34Å; V223-L244 HydrophobicContact CG1-CB 3.88Å; V223-L244 HydrophobicContact CG1-CD1 3.77Å; V223-L244 HydrophobicContact CG1-CG 4.45Å
224	H	75.8	Confident	75.8	Confident	64 Å²	64	47 Å²	47	30%	0.296	26%	0.264	S	S	.	.	S	Bend	trans	-64.3	112.3	168.9	-178.8	68.2	0	0	0	109.7	R165 E167	R165-H224 HydrophobicContact CB-CB 4.15Å; R165-H224 HydrophobicContact CG-CB 4.11Å; R165-H224 PolarHBondContact O-N 2.92Å; E167-H224 IonicContact OE1-CE1 3.83Å; E167-H224 IonicContact OE1-CG 3.68Å; E167-H224 IonicContact OE1-ND1 3.03Å; E167-H224 PolarHBondContact OE1-ND1 3.25Å; E167-H224 IonicContact OE2-ND1 2.77Å
225	C	71.4	Confident	75	Confident	43 Å²	43	46 Å²	46	29%	0.291	26%	0.262	S	S	.	.	S	Bend	trans	55	91.6	-175.8	-156.3	0	0	0	0	114.5	V223 C227 H228 F230	V223-C225 PolarHBondContact O-N 2.91Å; C225-C227 PolarHBondContact O-N 2.97Å; C225-H228 PolarHBondContact O-N 3.44Å; C225-H228 VanDerWaalsContact SG-CD2 3.59Å; C225-F230 HydrophobicContact CB-CE2 4.09Å
226	P	63.1	Low	74	Confident	35 Å²	35	48.7 Å²	48.7	23%	0.227	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-7.8	-170.7	25.3	-34.2	0	0	0	116.3	L118 T126 V223	L118-P226 HydrophobicContact CD1-CB 4.12Å; L118-P226 HydrophobicContact CD1-CG 3.94Å; T126-P226 HydrophobicContact CG2-CB 4.06Å; V223-P226 HydrophobicContact CG2-CB 4.06Å
227	C	63	Low	72.9	Confident	23 Å²	23	49.9 Å²	49.9	16%	0.155	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	7.4	-170	-51.2	0	0	0	0	114.1	C121 C225 N241	C121-C227 HydrophobicContact CB-CB 4.13Å; C121-C227 WeakPolarHBondContact CB-SG 3.36Å; C121-C227 WeakPolarHBondContact SG-CB 3.4Å; C121-C227 CovalentContact SG-SG 2.02Å; C121-C227 PolarHBondContact SG-SG 2.9Å; C225-C227 PolarHBondContact O-N 2.97Å; C227-N241 WeakPolarHBondContact CA-OD1 3.28Å
228	H	64.7	Low	71.7	Confident	65 Å²	65	54.5 Å²	54.5	30%	0.301	30%	0.301	S	S	.	.			trans	-138.5	123	178.1	-65.5	-55.1	0	0	0	110	C225 F230 I236	C225-H228 PolarHBondContact O-N 3.44Å; C225-H228 VanDerWaalsContact SG-CD2 3.59Å; H228-F230 HydrophobicContact CB-CE2 4.45Å; H228-F230 HydrophobicContact CB-CZ 4.38Å; H228-I236 HydrophobicContact CB-CG2 3.89Å
229	T	63.6	Low	70.1	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.043	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.8	170.6	-59.9	0	0	0	0	109.6	I237 V240 E242	T229-I237 PolarHBondContact O-N 3.4Å; T229-V240 VanDerWaalsContact CB-O 3.29Å; T229-V240 WeakPolarHBondContact CB-O 3.41Å; T229-V240 HydrophobicContact CG2-CG1 4.44Å; T229-V240 PolarHBondContact N-O 3.03Å; T229-V240 PolarHBondContact OG1-O 2.69Å; T229-E242 PolarHBondContact OG1-N 2.86Å
230	F	62.7	Low	68.7	Low	73 Å²	73	65.4 Å²	65.4	32%	0.32	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	137.7	174.4	-59.4	-85.2	0	0	0	111.2	R161 C225 H228 I236	R161-F230 PolarHBondContact NH2-O 3.07Å; R161-F230 VanDerWaalsContact NH2-O 3.14Å; C225-F230 HydrophobicContact CB-CE2 4.09Å; H228-F230 HydrophobicContact CB-CE2 4.45Å; H228-F230 HydrophobicContact CB-CZ 4.38Å; F230-I236 HydrophobicContact CD1-CG1 3.98Å; F230-I236 HydrophobicContact CE1-CD1 4.21Å; F230-I236 HydrophobicContact CE1-CG1 3.69Å
231	N	60.8	Low	67.5	Low	72 Å²	72	65.6 Å²	65.6	39%	0.385	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-82	163.2	168.4	-160.9	10.3	0	0	0	110.7	N233 G234 D235 I237	N231-N233 PolarHBondContact O-N 3.21Å; N231-G234 PolarHBondContact O-N 3.05Å; N231-D235 HydrophobicContact CB-CB 4.37Å; N231-D235 PolarHBondContact N-O 3.23Å; N231-I237 HydrophobicContact CB-CD1 4.48Å
232	T	61.9	Low	66.6	Low	136 Å²	136	66.5 Å²	66.5	83%	0.834	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.9	175.7	43.1	0	0	0	0	113.6
233	N	65.1	Low	66.3	Low	126 Å²	126	69 Å²	69	67%	0.674	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-0.8	179.7	-57.6	-5.5	0	0	0	113.3	N231	N231-N233 PolarHBondContact O-N 3.21Å
234	G	63.8	Low	66.1	Low	53 Å²	53	70 Å²	70	55%	0.546	39%	0.388	S	S	.	.	S	Bend	trans	92	-5.3	-178.9	0	0	0	0	0	115.5	N231	N231-G234 PolarHBondContact O-N 3.05Å
235	D	66.6	Low	66.5	Low	99 Å²	99	68.6 Å²	68.6	53%	0.529	38%	0.381	S	S	.	.			trans	-71.3	141.2	178.2	-56.6	-42.8	0	0	0	112.2	N231	N231-D235 HydrophobicContact CB-CB 4.37Å; N231-D235 PolarHBondContact N-O 3.23Å
236	I	64.5	Low	67.2	Low	89 Å²	89	66.8 Å²	66.8	46%	0.456	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	123.4	176.9	-61.7	169.6	0	0	0	109.5	H228 F230 E238	H228-I236 HydrophobicContact CB-CG2 3.89Å; F230-I236 HydrophobicContact CD1-CG1 3.98Å; F230-I236 HydrophobicContact CE1-CD1 4.21Å; F230-I236 HydrophobicContact CE1-CG1 3.69Å; I236-E238 HydrophobicContact CG2-CG 4.25Å
237	I	65.2	Low	68.4	Low	67 Å²	67	68.4 Å²	68.4	34%	0.344	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	103	172.9	-53.2	171.8	0	0	0	108.1	T229 N231 N239 V240	T229-I237 PolarHBondContact O-N 3.4Å; N231-I237 HydrophobicContact CB-CD1 4.48Å; I237-N239 VanDerWaalsContact C-N 3.29Å; I237-N239 PolarHBondContact O-N 3.25Å; I237-V240 HydrophobicContact CG2-CB 3.91Å; I237-V240 HydrophobicContact CG2-CG2 3.75Å
238	E	57.9	Low	69.6	Low	154 Å²	154	67.4 Å²	67.4	72%	0.72	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-19.1	-174.3	-62.8	-179.5	164.9	0	0	114.1	I236	I236-E238 HydrophobicContact CG2-CG 4.25Å
239	N	56.6	Low	70.6	Confident	153 Å²	153	67.9 Å²	67.9	82%	0.818	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	0.6	-175.7	-71.2	-34	0	0	0	114.7	I237	I237-N239 VanDerWaalsContact C-N 3.29Å; I237-N239 PolarHBondContact O-N 3.25Å
240	V	61.7	Low	71.3	Confident	76 Å²	76	68.7 Å²	68.7	46%	0.461	38%	0.376	S	S	.	.			trans	-121.7	127.5	176.6	-177.9	0	0	0	0	107.1	T229 I237	T229-V240 VanDerWaalsContact CB-O 3.29Å; T229-V240 WeakPolarHBondContact CB-O 3.41Å; T229-V240 HydrophobicContact CG2-CG1 4.44Å; T229-V240 PolarHBondContact N-O 3.03Å; T229-V240 PolarHBondContact OG1-O 2.69Å; I237-V240 HydrophobicContact CG2-CB 3.91Å; I237-V240 HydrophobicContact CG2-CG2 3.75Å
241	N	65.5	Low	72	Confident	36 Å²	36	66.5 Å²	66.5	19%	0.193	37%	0.369	C	S	.	.			trans	-103.3	139.2	179.7	-68.2	-84.3	0	0	0	109.7	P122 C227 V243	P122-N241 VanDerWaalsContact CD-CG 3.46Å; P122-N241 WeakPolarHBondContact CD-ND2 3.32Å; P122-N241 HydrophobicContact CG-CB 4.26Å; P122-N241 WeakPolarHBondContact CG-ND2 3.3Å; C227-N241 WeakPolarHBondContact CA-OD1 3.28Å; N241-V243 PolarHBondContact O-N 3.16Å
242	E	73.1	Confident	72.3	Confident	20 Å²	20	65.4 Å²	65.4	9%	0.093	36%	0.361	C	S	.	.			trans	-76.3	115.7	174.2	-172	151.2	-178.3	0	0	108.7	R161 Q164 V223 T229	R161-E242 VanDerWaalsContact NH1-CD 3.35Å; R161-E242 IonicContact NH1-OE1 3.35Å; R161-E242 PolarHBondContact NH1-OE1 3.04Å; R161-E242 IonicContact NH1-OE2 2.94Å; R161-E242 PolarHBondContact NH1-OE2 3.36Å; Q164-E242 PolarHBondContact NE2-OE1 3.25Å; V223-E242 HydrophobicContact CB-CG 4.08Å; V223-E242 HydrophobicContact CG1-CG 4.11Å; V223-E242 HydrophobicContact CG2-CB 4.35Å; V223-E242 HydrophobicContact CG2-CG 4.34Å; T229-E242 PolarHBondContact OG1-N 2.86Å
243	V	79.3	Confident	72	Confident	59 Å²	59	62 Å²	62	36%	0.358	35%	0.354	S	S	.	.			trans	-95.4	146	175.3	-178.8	0	0	0	0	108.1	I125 Q164 N241 Q245	I125-V243 WeakPolarHBondContact O-CG1 3.26Å; Q164-V243 PolarHBondContact NE2-O 3.32Å; N241-V243 PolarHBondContact O-N 3.16Å; V243-Q245 PolarHBondContact O-N 3.11Å
244	L	82.6	Confident	71.3	Confident	19 Å²	19	62.2 Å²	62.2	10%	0.099	36%	0.355	C	S	.	.			trans	-67	104.8	173.8	-171.8	69	0	0	0	109.1	I125 K128 I166 V223 V246	I125-L244 WeakPolarHBondContact O-CB 3.47Å; I125-L244 PolarHBondContact O-N 2.79Å; I125-L244 VanDerWaalsContact O-N 3.13Å; K128-L244 HydrophobicContact CB-CD2 4.35Å; K128-L244 HydrophobicContact CG-CD2 3.65Å; I166-L244 HydrophobicContact CG2-CD1 3.94Å; V223-L244 HydrophobicContact CG1-CB 3.88Å; V223-L244 HydrophobicContact CG1-CD1 3.77Å; V223-L244 HydrophobicContact CG1-CG 4.45Å; L244-V246 HydrophobicContact CD1-CB 4.2Å
245	Q	84.2	Confident	70.5	Confident	35 Å²	35	69 Å²	69	16%	0.164	37%	0.365	C	S	.	.			trans	-92.8	-16.1	177.6	-67.2	178.4	14.7	0	0	111.4	N156 A159 T191 V243 K247	N156-Q245 PolarHBondContact ND2-O 3.41Å; A159-Q245 HydrophobicContact CB-CB 4.19Å; T191-Q245 HydrophobicContact CG2-CB 4.4Å; V243-Q245 PolarHBondContact O-N 3.11Å; Q245-K247 PolarHBondContact O-N 2.98Å
246	V	86.4	Confident	69.4	Low	5 Å²	5	68.9 Å²	68.9	3%	0.03	37%	0.365	C	S	.	.			trans	-67.8	128.8	174.3	-178.9	0	0	0	0	109.6	R153 Q164 I166 V189 T191 L244 F248	R153-V246 HydrophobicContact CG-CG1 3.96Å; Q164-V246 HydrophobicContact CB-CG2 4.08Å; Q164-V246 HydrophobicContact CG-CG2 4.39Å; I166-V246 HydrophobicContact CG2-CB 4.27Å; I166-V246 HydrophobicContact CG2-CG2 3.83Å; V189-V246 HydrophobicContact CG2-CB 4.44Å; V189-V246 HydrophobicContact CG2-CG1 4.08Å; V189-V246 HydrophobicContact CG2-CG2 3.46Å; V189-V246 VanDerWaalsContact CG2-CG2 3.46Å; T191-V246 HydrophobicContact CG2-CG2 4.37Å; L244-V246 HydrophobicContact CD1-CB 4.2Å; V246-F248 HydrophobicContact CG1-CE1 4.15Å; V246-F248 HydrophobicContact CG1-CE2 3.88Å; V246-F248 HydrophobicContact CG1-CZ 3.66Å
247	K	87.4	Confident	68.4	Low	69 Å²	69	73.7 Å²	73.7	30%	0.3	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.1	-178.1	-70.4	-168.3	158.9	-139.4	0	111	R153 V154 N156 Q245 E252	R153-K247 WeakPolarHBondContact CA-O 3.15Å; V154-K247 HydrophobicContact CG2-CB 3.55Å; V154-K247 PolarHBondContact N-O 3.37Å; N156-K247 HydrophobicContact CB-CB 4.47Å; N156-K247 HydrophobicContact CB-CD 3.7Å; N156-K247 HydrophobicContact CB-CG 3.82Å; Q245-K247 PolarHBondContact O-N 2.98Å; K247-E252 WeakPolarHBondContact CA-OE1 3.42Å; K247-E252 WeakPolarHBondContact CB-OE1 3.38Å; K247-E252 WeakPolarHBondContact CD-OE2 3.4Å; K247-E252 WeakPolarHBondContact CE-OE2 2.99Å; K247-E252 WeakPolarHBondContact CG-OE1 3.39Å; K247-E252 WeakPolarHBondContact CG-OE2 3.47Å; K247-E252 IonicContact NZ-OE2 2.77Å; K247-E252 PolarHBondContact NZ-OE2 2.86Å
248	F	87.9	Confident	67.4	Low	3 Å²	3	74 Å²	74	1%	0.013	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134	179.6	-63.7	-75.6	0	0	0	110.9	F130 A151 L152 I166 I221 V246 G250 V251 E252	F130-F248 HydrophobicContact CZ-CD2 4.2Å; A151-F248 HydrophobicContact CB-CD1 3.63Å; A151-F248 HydrophobicContact CB-CE1 3.89Å; A151-F248 HydrophobicContact CB-CG 4.41Å; L152-F248 WeakPolarHBondContact O-CA 3.48Å; I166-F248 HydrophobicContact CD1-CZ 4.1Å; I221-F248 HydrophobicContact CD1-CE1 4.32Å; I221-F248 HydrophobicContact CD1-CE2 3.86Å; I221-F248 HydrophobicContact CD1-CZ 3.67Å; I221-F248 HydrophobicContact CG2-CE2 4.24Å; I221-F248 HydrophobicContact CG2-CZ 4.38Å; V246-F248 HydrophobicContact CG1-CE1 4.15Å; V246-F248 HydrophobicContact CG1-CE2 3.88Å; V246-F248 HydrophobicContact CG1-CZ 3.66Å; F248-G250 PolarHBondContact O-N 3.42Å; F248-V251 HydrophobicContact CB-CB 4.15Å; F248-V251 HydrophobicContact CB-CG2 3.76Å; F248-V251 PolarHBondContact O-N 3.05Å; F248-E252 PolarHBondContact N-OE1 3.34Å
249	K	85.4	Confident	67	Low	75 Å²	75	77 Å²	77	33%	0.326	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	126.6	-178.1	-168	69.1	-177.3	172.7	0	110.6	L152 V154 L272 F273 P274	L152-K249 HydrophobicContact CB-CB 4.36Å; L152-K249 HydrophobicContact CD2-CB 4.28Å; L152-K249 PolarHBondContact O-N 3.08Å; V154-K249 HydrophobicContact CG1-CB 3.96Å; V154-K249 HydrophobicContact CG1-CD 4.17Å; K249-L272 HydrophobicContact CG-CB 4.06Å; K249-F273 HydrophobicContact CG-CD1 4.41Å; K249-F273 HydrophobicContact CG-CE1 4.47Å; K249-P274 WeakPolarHBondContact O-CD 3.04Å
250	G	78.4	Confident	66.5	Low	23 Å²	23	82 Å²	82	24%	0.237	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	2.5	176.5	0	0	0	0	0	115.9	F248	F248-G250 PolarHBondContact O-N 3.42Å
251	V	76.9	Confident	65.8	Low	28 Å²	28	85.4 Å²	85.4	17%	0.17	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-31.8	178.6	-177.2	0	0	0	0	111.6	M108 K128 F130 F248 P274	M108-V251 HydrophobicContact CE-CG2 4.21Å; M108-V251 HydrophobicContact SD-CG2 4.25Å; K128-V251 HydrophobicContact CB-CG1 4.17Å; K128-V251 HydrophobicContact CD-CG1 3.83Å; K128-V251 HydrophobicContact CG-CG1 4.07Å; F130-V251 HydrophobicContact CD1-CG2 4.35Å; F130-V251 HydrophobicContact CE1-CG1 4.47Å; F130-V251 HydrophobicContact CE1-CG2 3.6Å; F130-V251 HydrophobicContact CZ-CG2 4.32Å; F248-V251 HydrophobicContact CB-CB 4.15Å; F248-V251 HydrophobicContact CB-CG2 3.76Å; F248-V251 PolarHBondContact O-N 3.05Å; V251-P274 HydrophobicContact CG2-CG 3.56Å
252	E	68	Low	65.4	Low	48 Å²	48	89.1 Å²	89.1	22%	0.224	44%	0.441	C	S	.	.	S	Bend	trans	-75.2	139.6	168	-78.2	148.6	-125.4	0	0	109.2	K247 F248 D254	K247-E252 WeakPolarHBondContact CA-OE1 3.42Å; K247-E252 WeakPolarHBondContact CB-OE1 3.38Å; K247-E252 WeakPolarHBondContact CD-OE2 3.4Å; K247-E252 WeakPolarHBondContact CE-OE2 2.99Å; K247-E252 WeakPolarHBondContact CG-OE1 3.39Å; K247-E252 WeakPolarHBondContact CG-OE2 3.47Å; K247-E252 IonicContact NZ-OE2 2.77Å; K247-E252 PolarHBondContact NZ-OE2 2.86Å; F248-E252 PolarHBondContact N-OE1 3.34Å; E252-D254 PolarHBondContact O-N 2.9Å
253	G	55.6	Low	64.7	Low	66 Å²	66	90.6 Å²	90.6	68%	0.68	46%	0.461	S	S	*	.			trans	-65.8	34.6	174.8	0	0	0	0	0	113.7	Y255	G253-Y255 WeakPolarHBondContact O-CD2 3.27Å; G253-Y255 PolarHBondContact O-N 2.84Å
254	D	50.5	Low	63.6	Low	130 Å²	130	98.3 Å²	98.3	70%	0.695	48%	0.484	S	S	*	.			trans	-70.4	65.9	164.7	-138.1	24.9	0	0	0	106.6	E252 D256	E252-D254 PolarHBondContact O-N 2.9Å; D254-D256 PolarHBondContact O-N 3.31Å
255	Y	46.6	Very low	62.4	Low	195 Å²	195	101.3 Å²	101.3	77%	0.765	50%	0.5	S	S	*	.			trans	-62.1	89.8	156.8	-69.1	-82.1	0	0	0	104.4	G253 E257	G253-Y255 WeakPolarHBondContact O-CD2 3.27Å; G253-Y255 PolarHBondContact O-N 2.84Å; Y255-E257 PolarHBondContact O-N 3.43Å
256	D	44.5	Very low	61.3	Low	96 Å²	96	105.9 Å²	105.9	51%	0.513	52%	0.519	S	S	.	.			trans	-55	93.3	163.1	-160.9	-14.5	0	0	0	104.7	D254 S258 K269	D254-D256 PolarHBondContact O-N 3.31Å; D256-S258 VanDerWaalsContact CG-OG 3.25Å; D256-S258 PolarHBondContact O-N 3.48Å; D256-S258 PolarHBondContact O-OG 3.22Å; D256-S258 PolarHBondContact OD1-OG 3.04Å; D256-K269 IonicContact OD2-NZ 2.68Å; D256-K269 PolarHBondContact OD2-NZ 3.46Å
257	E	42.5	Very low	60.1	Low	191 Å²	191	112.9 Å²	112.9	89%	0.893	55%	0.549	S	S	*	.			trans	-70.6	32.6	-177.9	-153.1	177.7	-161.3	0	0	110	Y255 R259	Y255-E257 PolarHBondContact O-N 3.43Å; E257-R259 PolarHBondContact O-N 3.5Å; E257-R259 VanDerWaalsContact O-N 3.09Å
258	S	45.3	Very low	58.8	Low	73 Å²	73	114 Å²	114	51%	0.51	56%	0.555	S	S	.	*			trans	-79.8	92.2	173.6	36.5	0	0	0	0	108.5	D256	D256-S258 VanDerWaalsContact CG-OG 3.25Å; D256-S258 PolarHBondContact O-N 3.48Å; D256-S258 PolarHBondContact O-OG 3.22Å; D256-S258 PolarHBondContact OD1-OG 3.04Å
259	R	47.9	Very low	57.8	Low	217 Å²	217	117.3 Å²	117.3	82%	0.819	57%	0.57	S	S	*	*			trans	38.8	116.2	154.1	-92.1	176.6	167.8	144.7	-3.8	116.3	E257 D261	E257-R259 PolarHBondContact O-N 3.5Å; E257-R259 VanDerWaalsContact O-N 3.09Å; R259-D261 PolarHBondContact O-N 2.72Å
260	W	46.5	Very low	57	Low	257 Å²	257	117 Å²	117	97%	0.973	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.8	7.1	176.7	-63.2	100.5	0	0	0	119.3
261	D	48.4	Very low	56.5	Low	149 Å²	149	117.1 Å²	117.1	80%	0.797	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	5.4	-168.9	-84.5	-26.4	0	0	0	116.8	R259	R259-D261 PolarHBondContact O-N 2.72Å
262	L	55.3	Low	56.6	Low	113 Å²	113	119.2 Å²	119.2	59%	0.592	57%	0.574	S	S	*	*			trans	-126	60.3	-176.6	-68	168.7	0	0	0	114	R264 L265 K266	L262-R264 PolarHBondContact O-N 3.01Å; L262-L265 HydrophobicContact CB-CB 4.19Å; L262-L265 PolarHBondContact O-N 2.94Å; L262-K266 PolarHBondContact O-N 2.85Å
263	G	58.4	Low	57.6	Low	51 Å²	51	119.2 Å²	119.2	53%	0.526	57%	0.573	S	S	.	*	H	α-helix	trans	-54.1	-23.6	176.8	0	0	0	0	0	115.2	K267	G263-K267 PolarHBondContact O-N 3.11Å
264	R	57.4	Low	59.3	Low	222 Å²	222	116.1 Å²	116.1	84%	0.838	54%	0.541	S	S	*	.	H	α-helix	trans	-73.6	-39.9	175.4	-148.4	-178.7	-157.7	-154.4	6.1	112.6	L262 Q268	L262-R264 PolarHBondContact O-N 3.01Å; R264-Q268 PolarHBondContact O-N 3.49Å
265	L	57.3	Low	61.4	Low	82 Å²	82	109.9 Å²	109.9	43%	0.429	51%	0.508	S	S	.	.	H	α-helix	trans	-69.8	-37.2	176.7	-115.4	101.9	0	0	0	111.3	L262 K267 Q268 K269	L262-L265 HydrophobicContact CB-CB 4.19Å; L262-L265 PolarHBondContact O-N 2.94Å; L265-K267 PolarHBondContact O-N 2.83Å; L265-Q268 PolarHBondContact O-N 2.94Å; L265-Q268 VanDerWaalsContact O-N 3.12Å; L265-K269 PolarHBondContact O-N 3.16Å
266	K	61.3	Low	63.6	Low	130 Å²	130	100.6 Å²	100.6	57%	0.565	47%	0.471	S	S	*	.	H	α-helix	trans	-58.9	-47.8	177.1	-169.7	176.6	178.2	176.4	0	111.7	L262 Q268 K269 E270	L262-K266 PolarHBondContact O-N 2.85Å; K266-Q268 PolarHBondContact O-N 2.98Å; K266-K269 PolarHBondContact O-N 2.91Å; K266-K269 VanDerWaalsContact O-N 3.14Å; K266-E270 WeakPolarHBondContact CE-OE1 2.98Å; K266-E270 WeakPolarHBondContact O-CG 3.5Å; K266-E270 PolarHBondContact O-N 2.79Å
267	K	60.5	Low	66	Low	153 Å²	153	96 Å²	96	67%	0.665	45%	0.447	S	S	*	.	H	α-helix	trans	-63.9	-23.8	175.5	-75.3	-174.5	178.7	-177.4	0	114.1	G263 L265	G263-K267 PolarHBondContact O-N 3.11Å; L265-K267 PolarHBondContact O-N 2.83Å
268	Q	60.5	Low	68.4	Low	91 Å²	91	87 Å²	87	43%	0.425	40%	0.404	S	S	.	.	H	α-helix	trans	-77.6	-41.4	172.4	-64.1	-167.3	-58.1	0	0	111.8	F65 R264 L265 K266 Q271	F65-Q268 HydrophobicContact CD1-CB 4.38Å; F65-Q268 HydrophobicContact CD1-CG 3.68Å; F65-Q268 HydrophobicContact CE1-CB 3.7Å; F65-Q268 HydrophobicContact CE1-CG 3.4Å; F65-Q268 VanDerWaalsContact CE1-CG 3.4Å; F65-Q268 HydrophobicContact CG-CG 4.49Å; F65-Q268 HydrophobicContact CZ-CB 4.3Å; F65-Q268 HydrophobicContact CZ-CG 4.02Å; R264-Q268 PolarHBondContact O-N 3.49Å; L265-Q268 PolarHBondContact O-N 2.94Å; L265-Q268 VanDerWaalsContact O-N 3.12Å; K266-Q268 PolarHBondContact O-N 2.98Å; Q268-Q271 WeakPolarHBondContact O-CB 3.33Å; Q268-Q271 PolarHBondContact O-N 3.46Å
269	K	65.6	Low	70.5	Confident	74 Å²	74	83.7 Å²	83.7	32%	0.322	38%	0.381	S	S	.	.	H	α-helix	trans	-66.4	-36	178.6	-72.9	-177.4	176.3	179.1	0	112.7	D256 L265 K266 Q271 L272	D256-K269 IonicContact OD2-NZ 2.68Å; D256-K269 PolarHBondContact OD2-NZ 3.46Å; L265-K269 PolarHBondContact O-N 3.16Å; K266-K269 PolarHBondContact O-N 2.91Å; K266-K269 VanDerWaalsContact O-N 3.14Å; K269-Q271 PolarHBondContact O-N 2.94Å; K269-Q271 VanDerWaalsContact O-N 3.13Å; K269-L272 PolarHBondContact O-N 3.5Å
270	E	69.1	Low	72.2	Confident	67 Å²	67	73.6 Å²	73.6	31%	0.313	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-62.4	-16	177.7	-76.1	171	-172.7	0	0	113.9	K266 L272 F273	K266-E270 WeakPolarHBondContact CE-OE1 2.98Å; K266-E270 WeakPolarHBondContact O-CG 3.5Å; K266-E270 PolarHBondContact O-N 2.79Å; E270-L272 VanDerWaalsContact C-N 3.33Å; E270-F273 HydrophobicContact CB-CD2 4.36Å; E270-F273 HydrophobicContact CB-CE2 4.38Å; E270-F273 HydrophobicContact CG-CD2 4.28Å; E270-F273 HydrophobicContact CG-CE2 3.87Å; E270-F273 HydrophobicContact CG-CZ 4.3Å; E270-F273 VanDerWaalsContact O-CB 3.3Å; E270-F273 WeakPolarHBondContact O-CB 3.38Å; E270-F273 WeakPolarHBondContact O-CG 3.33Å; E270-F273 PolarHBondContact O-N 2.85Å
271	Q	67.6	Low	73.8	Confident	27 Å²	27	62.6 Å²	62.6	13%	0.126	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-75.8	-24.4	180	-63.9	-171.2	-8.6	0	0	114.3	F65 S69 K105 Q268 K269	F65-Q271 HydrophobicContact CE1-CG 4.27Å; F65-Q271 PolarHBondContact O-NE2 3.39Å; S69-Q271 WeakPolarHBondContact OG-CB 3.22Å; S69-Q271 PolarHBondContact OG-OE1 3.34Å; K105-Q271 PolarHBondContact NZ-O 3.39Å; Q268-Q271 WeakPolarHBondContact O-CB 3.33Å; Q268-Q271 PolarHBondContact O-N 3.46Å; K269-Q271 PolarHBondContact O-N 2.94Å; K269-Q271 VanDerWaalsContact O-N 3.13Å
272	L	80.3	Confident	74.8	Confident	72 Å²	72	56.3 Å²	56.3	38%	0.377	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-81.1	-3.9	177	-59.6	171.8	0	0	0	111.3	L152 W197 K249 K269 E270	L152-L272 HydrophobicContact CD2-CB 3.98Å; L152-L272 HydrophobicContact CD2-CD2 3.99Å; L152-L272 HydrophobicContact CD2-CG 4.38Å; W197-L272 HydrophobicContact CZ2-CD2 4.28Å; K249-L272 HydrophobicContact CG-CB 4.06Å; K269-L272 PolarHBondContact O-N 3.5Å; E270-L272 VanDerWaalsContact C-N 3.33Å
273	F	88.3	Confident	75.2	Confident	48 Å²	48	54.1 Å²	54.1	21%	0.211	26%	0.263	C	S	.	.	S	Bend	trans	-73.3	158.9	179	-67.5	5.2	0	0	0	110.3	K249 E270 H275	K249-F273 HydrophobicContact CG-CD1 4.41Å; K249-F273 HydrophobicContact CG-CE1 4.47Å; E270-F273 HydrophobicContact CB-CD2 4.36Å; E270-F273 HydrophobicContact CB-CE2 4.38Å; E270-F273 HydrophobicContact CG-CD2 4.28Å; E270-F273 HydrophobicContact CG-CE2 3.87Å; E270-F273 HydrophobicContact CG-CZ 4.3Å; E270-F273 VanDerWaalsContact O-CB 3.3Å; E270-F273 WeakPolarHBondContact O-CB 3.38Å; E270-F273 WeakPolarHBondContact O-CG 3.33Å; E270-F273 PolarHBondContact O-N 2.85Å; F273-H275 PolarHBondContact O-N 3.31Å; F273-H275 PolarHBondContact O-ND1 2.8Å
274	P	92	Very high	75.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	27%	0.272	C	S	.	.			trans	-56.2	137.9	176.6	-20.3	30	0	0	0	110.8	M108 F130 F149 R150 A151 K249 V251	M108-P274 HydrophobicContact CB-CB 4.31Å; M108-P274 VanDerWaalsContact CB-O 3.23Å; M108-P274 WeakPolarHBondContact CB-O 3.4Å; M108-P274 PolarHBondContact N-O 3.35Å; M108-P274 HydrophobicContact SD-CB 4.29Å; M108-P274 HydrophobicContact SD-CG 4.05Å; F130-P274 HydrophobicContact CD1-CB 3.63Å; F130-P274 HydrophobicContact CD1-CG 3.71Å; F130-P274 HydrophobicContact CE1-CB 3.84Å; F130-P274 HydrophobicContact CE1-CG 3.5Å; F130-P274 VanDerWaalsContact CE1-CG 3.5Å; F149-P274 HydrophobicContact CE2-CB 3.88Å; F149-P274 HydrophobicContact CZ-CB 4.3Å; R150-P274 CarbonylContact O-C 3.51Å; R150-P274 WeakPolarHBondContact O-CA 3.41Å; A151-P274 HydrophobicContact CB-CB 4.13Å; A151-P274 HydrophobicContact CB-CG 4.22Å; K249-P274 WeakPolarHBondContact O-CD 3.04Å; V251-P274 HydrophobicContact CG2-CG 3.56Å
275	H	93.7	Very high	75.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	158	-177.6	61.2	-84.6	0	0	0	111.3	S73 K105 F106 R150 W197 F273	S73-H275 PolarHBondContact OG-CE1 2.87Å; S73-H275 PolarHBondContact OG-NE2 2.84Å; K105-H275 HydrophobicContact CG-CB 4.22Å; F106-H275 CarbonylContact O-C 3.43Å; F106-H275 WeakPolarHBondContact O-CA 3.33Å; F106-H275 VanDerWaalsContact O-CB 3.26Å; F106-H275 WeakPolarHBondContact O-CB 3.41Å; R150-H275 PolarHBondContact N-O 3.03Å; R150-H275 PolarHBondContact O-N 3.27Å; W197-H275 AromaticContact CH2-CE1 3.72Å; W197-H275 AromaticContact CZ3-CE1 3.74Å; F273-H275 PolarHBondContact O-N 3.31Å; F273-H275 PolarHBondContact O-ND1 2.8Å
276	L	94.3	Very high	75.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	138.6	170.1	-63	174.3	0	0	0	109.9	K105 F106 F132 V134 E148 F149 V202 V206 W209 L219 L278	K105-L276 CarbonylContact C-O 3.55Å; K105-L276 VanDerWaalsContact CA-O 3.29Å; K105-L276 WeakPolarHBondContact CA-O 3.27Å; F106-L276 HydrophobicContact CB-CB 4.32Å; F106-L276 PolarHBondContact N-O 2.7Å; F106-L276 PolarHBondContact O-N 2.59Å; F132-L276 HydrophobicContact CB-CD1 3.65Å; F132-L276 HydrophobicContact CB-CG 4.47Å; F132-L276 HydrophobicContact CD1-CD1 3.87Å; F132-L276 HydrophobicContact CD1-CG 3.75Å; F132-L276 HydrophobicContact CD2-CD1 3.58Å; F132-L276 HydrophobicContact CD2-CD2 4.39Å; F132-L276 HydrophobicContact CD2-CG 3.9Å; F132-L276 HydrophobicContact CE1-CD1 4.46Å; F132-L276 HydrophobicContact CE1-CG 3.9Å; F132-L276 HydrophobicContact CE2-CD1 4.2Å; F132-L276 HydrophobicContact CE2-CD2 4.2Å; F132-L276 HydrophobicContact CE2-CG 4.04Å; F132-L276 HydrophobicContact CG-CD1 3.39Å; F132-L276 HydrophobicContact CG-CG 3.75Å; F132-L276 HydrophobicContact CZ-CD2 4.34Å; F132-L276 HydrophobicContact CZ-CG 4.04Å; V134-L276 HydrophobicContact CG1-CD1 4.19Å; E148-L276 WeakPolarHBondContact O-CA 3.47Å; F149-L276 HydrophobicContact CB-CD2 3.7Å; F149-L276 HydrophobicContact CD2-CD2 4Å; F149-L276 HydrophobicContact CG-CD2 4.29Å; V202-L276 HydrophobicContact CG2-CD2 3.93Å; V206-L276 HydrophobicContact CG2-CD1 4.35Å; W209-L276 HydrophobicContact CZ3-CD1 3.9Å; L219-L276 HydrophobicContact CD1-CD2 4.4Å; L276-L278 HydrophobicContact CB-CD1 3.81Å
277	I	93.8	Very high	74.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	116.2	168.1	-61.8	-175.9	0	0	0	107.6	T74 L77 I103 Y104 A147 E148	T74-I277 HydrophobicContact CG2-CD1 4.07Å; T74-I277 HydrophobicContact CG2-CG2 3.99Å; L77-I277 HydrophobicContact CD2-CB 4.21Å; L77-I277 HydrophobicContact CD2-CD1 3.97Å; L77-I277 HydrophobicContact CD2-CG2 4.06Å; I103-I277 HydrophobicContact CG2-CG2 3.49Å; I103-I277 VanDerWaalsContact CG2-CG2 3.49Å; Y104-I277 CarbonylContact O-C 3.47Å; Y104-I277 WeakPolarHBondContact O-CA 3.36Å; A147-I277 WeakPolarHBondContact CA-O 3.26Å; E148-I277 PolarHBondContact N-O 2.89Å; E148-I277 PolarHBondContact O-N 2.88Å
278	L	92.8	Very high	73.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.6	175	-83.7	62.9	0	0	0	109.1	I103 Y104 F106 M137 L144 A147 V206 L276 M280	I103-L278 WeakPolarHBondContact CA-O 3.42Å; Y104-L278 PolarHBondContact N-O 2.93Å; Y104-L278 PolarHBondContact O-N 2.83Å; F106-L278 HydrophobicContact CD2-CD1 3.96Å; F106-L278 HydrophobicContact CD2-CD2 4.43Å; F106-L278 HydrophobicContact CE2-CB 4.4Å; F106-L278 HydrophobicContact CE2-CD1 4.21Å; F106-L278 HydrophobicContact CE2-CD2 3.91Å; F106-L278 HydrophobicContact CE2-CG 4.4Å; M137-L278 HydrophobicContact CG-CD2 4.41Å; L144-L278 HydrophobicContact CD1-CB 4.18Å; L144-L278 HydrophobicContact CD1-CD2 4.25Å; L144-L278 HydrophobicContact CD1-CG 3.91Å; A147-L278 HydrophobicContact CB-CD1 4.2Å; A147-L278 HydrophobicContact CB-CG 4.2Å; V206-L278 HydrophobicContact CG1-CD1 4.2Å; V206-L278 HydrophobicContact CG1-CD2 3.85Å; V206-L278 HydrophobicContact CG1-CG 4.09Å; L276-L278 HydrophobicContact CB-CD1 3.81Å; L278-M280 HydrophobicContact CB-CG 4.49Å; L278-M280 HydrophobicContact CB-SD 4.43Å; L278-M280 HydrophobicContact CD2-SD 4.49Å
279	M	88.6	Confident	72.8	Confident	4 Å²	4	51 Å²	51	2%	0.02	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	114	171.2	-57.2	-179.3	-171.1	0	0	107.9	L77 K101 F145 R146	L77-M279 HydrophobicContact CD2-CE 3.71Å; L77-M279 HydrophobicContact CG-CE 4.49Å; K101-M279 HydrophobicContact CB-CB 4.32Å; F145-M279 WeakPolarHBondContact CA-O 3.32Å; F145-M279 WeakPolarHBondContact CB-O 3.2Å; F145-M279 HydrophobicContact CD1-CB 4.39Å; F145-M279 PolarHBondContact N-O 3.13Å; R146-M279 HydrophobicContact CB-CB 4.31Å; R146-M279 HydrophobicContact CB-SD 4.2Å; R146-M279 PolarHBondContact N-O 2.77Å; R146-M279 PolarHBondContact O-N 2.92Å
280	M	85.1	Confident	71.4	Confident	5 Å²	5	52 Å²	52	3%	0.025	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.9	-175.4	-56.5	-66	-74	0	0	110.4	K101 E102 Y104 N140 N143 L144 L278 P282	K101-M280 CarbonylContact C-O 3.6Å; K101-M280 WeakPolarHBondContact CA-O 2.97Å; E102-M280 PolarHBondContact N-O 3.12Å; E102-M280 PolarHBondContact O-N 3.39Å; Y104-M280 HydrophobicContact CD2-CB 4.3Å; Y104-M280 HydrophobicContact CD2-CG 3.73Å; Y104-M280 HydrophobicContact CE2-CB 4.07Å; Y104-M280 HydrophobicContact CE2-CG 3.91Å; N140-M280 HydrophobicContact CB-CE 3.86Å; N140-M280 WeakPolarHBondContact O-CE 3.35Å; N143-M280 HydrophobicContact CB-CE 3.93Å; N143-M280 CarbonylContact O-C 3.6Å; N143-M280 WeakPolarHBondContact O-CA 3.36Å; L144-M280 VanDerWaalsContact CA-SD 3.54Å; L144-M280 HydrophobicContact CB-CE 4.31Å; L144-M280 HydrophobicContact CB-SD 3.85Å; L144-M280 HydrophobicContact CD1-SD 3.48Å; L144-M280 WeakPolarHBondContact CD1-SD 3.49Å; L144-M280 HydrophobicContact CG-SD 4.29Å; L278-M280 HydrophobicContact CB-CG 4.49Å; L278-M280 HydrophobicContact CB-SD 4.43Å; L278-M280 HydrophobicContact CD2-SD 4.49Å; M280-P282 WeakPolarHBondContact O-CD 3.26Å
281	L	78.9	Confident	69.7	Low	26 Å²	26	53.9 Å²	53.9	14%	0.136	30%	0.301	C	S	.	.			trans	-88.5	115.4	169	-79	156.6	0	0	0	109.2	K101 N143 F145	K101-L281 HydrophobicContact CG-CD2 4.26Å; K101-L281 HydrophobicContact CG-CG 4.4Å; N143-L281 WeakPolarHBondContact CB-O 3.15Å; N143-L281 PolarHBondContact O-N 3.43Å; F145-L281 HydrophobicContact CB-CD1 4.13Å; F145-L281 HydrophobicContact CB-CG 4.3Å; F145-L281 HydrophobicContact CD2-CD1 4.03Å; F145-L281 HydrophobicContact CG-CD1 4.45Å
282	P	69.8	Low	68.2	Low	18 Å²	18	57.3 Å²	57.3	12%	0.117	33%	0.328	C	S	.	.			trans	-55.1	137.6	178.5	-26.9	35.1	0	0	0	111.4	E102 M280 H284 R285	E102-P282 HydrophobicContact CG-CG 3.78Å; M280-P282 WeakPolarHBondContact O-CD 3.26Å; P282-H284 PolarHBondContact O-N 3.27Å; P282-R285 HydrophobicContact CB-CG 4.23Å; P282-R285 WeakPolarHBondContact O-CB 3.19Å; P282-R285 PolarHBondContact O-N 3.4Å
283	P	63.9	Low	66.5	Low	66 Å²	66	65.1 Å²	65.1	43%	0.429	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-59.7	-27.5	-171.9	19.9	-29.9	0	0	0	112.9	R285	P283-R285 PolarHBondContact O-N 2.96Å
284	H	61.6	Low	64.1	Low	156 Å²	156	73.6 Å²	73.6	72%	0.722	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-70	-13.3	178.3	-59	20.2	0	0	0	112.4	R50 P282	R50-H284 PolarHBondContact NH1-O 2.96Å; P282-H284 PolarHBondContact O-N 3.27Å
285	R	64.1	Low	62.1	Low	20 Å²	20	79 Å²	79	8%	0.075	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-99.1	6.1	-174.3	-59.1	-172.7	-179.8	155.4	-1.9	114.5	L49 Y99 A100 P282 P283 E396	L49-R285 PolarHBondContact O-NH2 2.95Å; Y99-R285 HydrophobicContact CD2-CB 4.49Å; Y99-R285 HydrophobicContact CG-CB 4.23Å; A100-R285 PolarHBondContact O-NH1 3.34Å; P282-R285 HydrophobicContact CB-CG 4.23Å; P282-R285 WeakPolarHBondContact O-CB 3.19Å; P282-R285 PolarHBondContact O-N 3.4Å; P283-R285 PolarHBondContact O-N 2.96Å; R285-E396 IonicContact CZ-OE2 3.5Å; R285-E396 IonicContact NH1-OE2 2.86Å; R285-E396 PolarHBondContact NH1-OE2 2.8Å; R285-E396 IonicContact NH2-OE1 2.77Å; R285-E396 IonicContact NH2-OE2 3.76Å; R285-E396 PolarHBondContact NH2-OE2 3.32Å; R285-E396 VanDerWaalsContact NH2-OE2 3.12Å
286	I	56.3	Low	59.5	Low	86 Å²	86	85.5 Å²	85.5	44%	0.441	43%	0.432	S	S	.	.			trans	-85.7	-16.9	-166.7	-61.7	178.7	0	0	0	114.2	N143 A288	N143-I286 WeakPolarHBondContact OD1-CD1 3.42Å; I286-A288 PolarHBondContact O-N 3.48Å; I286-A288 VanDerWaalsContact O-N 3.16Å
287	D	44.9	Very low	57.1	Low	149 Å²	149	97.2 Å²	97.2	80%	0.797	48%	0.476	S	S	*	.			trans	-85.6	88.2	179.7	-64.8	-32.8	0	0	0	112.6
288	A	41.7	Very low	55.3	Low	72 Å²	72	99 Å²	99	60%	0.595	49%	0.49	S	S	*	.			trans	-179.2	103.8	150.8	0	0	0	0	0	109.8	I286	I286-A288 PolarHBondContact O-N 3.48Å; I286-A288 VanDerWaalsContact O-N 3.16Å
289	Q	35.9	Very low	53.7	Low	182 Å²	182	103.1 Å²	103.1	85%	0.85	51%	0.512	S	S	*	.			trans	-110.2	124.8	171.2	-66.1	-177.1	-1.3	0	0	109.4
290	S	36.1	Very low	52.7	Low	95 Å²	95	105.6 Å²	105.6	66%	0.664	53%	0.525	S	S	*	.			trans	175.3	128.1	144	63.9	0	0	0	0	115.8	E95	E95-S290 VanDerWaalsContact OE2-C 3.28Å; E95-S290 PolarHBondContact OE2-N 2.88Å
291	S	34.2	Very low	52.1	Low	105 Å²	105	105.9 Å²	105.9	73%	0.734	53%	0.528	S	S	*	.			trans	77.8	117.7	142.5	81.2	0	0	0	0	122.1	E95	E95-S291 WeakPolarHBondContact OE1-CA 3.09Å; E95-S291 PolarHBondContact OE1-N 3.17Å
292	S	36.3	Very low	51.7	Low	99 Å²	99	110.3 Å²	110.3	69%	0.692	55%	0.552	S	S	*	*			trans	-83.3	148	-178.6	174.6	0	0	0	0	115.1	E95	E95-S292 PolarHBondContact OE1-N 3.43Å
293	R	44.3	Very low	51.8	Low	236 Å²	236	114.2 Å²	114.2	89%	0.891	57%	0.565	S	S	*	*			trans	-127.9	135.5	162.1	-71.6	-176.3	-175	174.3	2.1	110.6
294	R	38.9	Very low	52.4	Low	226 Å²	226	111.5 Å²	111.5	85%	0.853	55%	0.547	S	S	*	.			trans	-67.9	142.2	176.7	-95	180	178.3	137.8	-0	112.6
295	R	48.1	Very low	53.2	Low	113 Å²	113	108.6 Å²	108.6	43%	0.426	53%	0.532	S	S	.	.			trans	-98.8	144.7	175.1	-67.5	-174	-178	-177.3	7.1	112	D379	R295-D379 IonicContact CZ-OD1 3.92Å; R295-D379 IonicContact NH1-OD1 2.65Å; R295-D379 PolarHBondContact NH1-OD1 2.53Å
296	K	39.4	Very low	53.6	Low	137 Å²	137	112.3 Å²	112.3	60%	0.596	56%	0.562	S	S	*	*			trans	-118.7	152.4	165.2	-83.2	-172	172.8	-172.8	0	108.3	D352 Q378	K296-D352 IonicContact NZ-OD2 2.84Å; K296-D352 PolarHBondContact NZ-OD2 3.02Å; K296-Q378 PolarHBondContact O-NE2 2.74Å; K296-Q378 PolarHBondContact O-OE1 3.25Å; K296-Q378 VanDerWaalsContact O-OE1 3.09Å
297	R	45.2	Very low	54.3	Low	246 Å²	246	111.9 Å²	111.9	93%	0.928	56%	0.56	S	S	*	*			trans	-68.8	143.5	-172.2	-62.3	178.4	-133.3	160	4	112.9
298	A	54.2	Low	55.4	Low	37 Å²	37	114.1 Å²	114.1	31%	0.306	56%	0.559	S	S	.	*			trans	-135.6	175.4	175	0	0	0	0	0	111.4	C406 K407	A298-C406 WeakPolarHBondContact CB-O 3.29Å; A298-K407 HydrophobicContact CB-CB 4.05Å
299	L	59.8	Low	56.7	Low	88 Å²	88	112.7 Å²	112.7	46%	0.461	54%	0.54	S	S	.	.			trans	-69.6	134.2	-174.9	-62.2	169.3	0	0	0	111.9	Y303 S405	L299-Y303 HydrophobicContact CB-CD1 4.49Å; L299-Y303 HydrophobicContact CD1-CD1 4.29Å; L299-Y303 HydrophobicContact CD1-CE1 4.2Å; L299-Y303 HydrophobicContact CD2-CD1 4.2Å; L299-Y303 HydrophobicContact CD2-CE1 4.44Å; L299-S405 WeakPolarHBondContact O-CA 3.49Å; L299-S405 WeakPolarHBondContact O-CB 3.08Å
300	D	67.3	Low	58.3	Low	55 Å²	55	110.5 Å²	110.5	29%	0.294	53%	0.529	S	S	.	.			trans	-96.2	168	-172.9	-174.8	30.6	0	0	0	113.4	N302 Y303 C304	D300-N302 PolarHBondContact O-N 3.49Å; D300-Y303 PolarHBondContact O-N 3.45Å; D300-Y303 VanDerWaalsContact O-N 3.1Å; D300-C304 PolarHBondContact O-N 3.04Å
301	T	72.5	Confident	60.2	Low	12 Å²	12	109.2 Å²	109.2	7%	0.074	52%	0.515	C	S	.	.	H	α-helix	trans	-51.8	-38.5	179.4	56.5	0	0	0	0	113.2	Y303 C304 F305 V314 K404	T301-Y303 VanDerWaalsContact C-N 3.25Å; T301-Y303 PolarHBondContact O-N 3.07Å; T301-C304 PolarHBondContact O-N 3.47Å; T301-F305 HydrophobicContact CG2-CE2 4.21Å; T301-F305 HydrophobicContact CG2-CZ 4.27Å; T301-F305 WeakPolarHBondContact O-CB 3.41Å; T301-F305 VanDerWaalsContact O-CG 3.26Å; T301-F305 WeakPolarHBondContact O-CG 3.37Å; T301-F305 PolarHBondContact O-N 3.21Å; T301-V314 HydrophobicContact CG2-CG1 4.13Å; T301-K404 HydrophobicContact CG2-CB 4.34Å; T301-K404 HydrophobicContact CG2-CD 4.01Å; T301-K404 WeakPolarHBondContact CG2-O 3.37Å; T301-K404 PolarHBondContact N-O 2.59Å
302	N	70.8	Confident	62.3	Low	119 Å²	119	104.9 Å²	104.9	64%	0.636	49%	0.485	S	S	*	.	H	α-helix	trans	-63.9	-33.1	-176.3	-65.8	-16.2	0	0	0	112	D300 S306	D300-N302 PolarHBondContact O-N 3.49Å; N302-S306 WeakPolarHBondContact O-CB 3.39Å; N302-S306 PolarHBondContact O-OG 3.06Å; N302-S306 VanDerWaalsContact O-OG 3.11Å
303	Y	73	Confident	64.6	Low	100 Å²	100	100.2 Å²	100.2	39%	0.392	45%	0.452	S	S	.	.	H	α-helix	trans	-78.8	-48	177.2	-178.1	-96.1	0	0	0	111.5	L299 D300 T301 F305 S306 N307	L299-Y303 HydrophobicContact CB-CD1 4.49Å; L299-Y303 HydrophobicContact CD1-CD1 4.29Å; L299-Y303 HydrophobicContact CD1-CE1 4.2Å; L299-Y303 HydrophobicContact CD2-CD1 4.2Å; L299-Y303 HydrophobicContact CD2-CE1 4.44Å; D300-Y303 PolarHBondContact O-N 3.45Å; D300-Y303 VanDerWaalsContact O-N 3.1Å; T301-Y303 VanDerWaalsContact C-N 3.25Å; T301-Y303 PolarHBondContact O-N 3.07Å; Y303-F305 VanDerWaalsContact C-N 3.31Å; Y303-F305 PolarHBondContact O-N 2.94Å; Y303-S306 PolarHBondContact O-N 3.17Å; Y303-N307 WeakPolarHBondContact CD2-ND2 3.19Å; Y303-N307 VanDerWaalsContact CE2-ND2 3.25Å; Y303-N307 WeakPolarHBondContact CE2-ND2 3.45Å; Y303-N307 PolarHBondContact O-N 2.73Å; Y303-N307 PolarHBondContact O-ND2 2.86Å
304	C	76.1	Confident	66.6	Low	8 Å²	8	89 Å²	89	5%	0.054	41%	0.41	C	S	.	.	H	α-helix	trans	-69.9	-23.1	-175.7	-70.4	0	0	0	0	114.5	D300 T301 C313 V314	D300-C304 PolarHBondContact O-N 3.04Å; T301-C304 PolarHBondContact O-N 3.47Å; C304-C313 VanDerWaalsContact CA-SG 3.51Å; C304-C313 HydrophobicContact CB-CB 3.87Å; C304-C313 WeakPolarHBondContact CB-SG 3.28Å; C304-C313 VanDerWaalsContact SG-CA 3.58Å; C304-C313 WeakPolarHBondContact SG-CB 3.24Å; C304-C313 CovalentContact SG-SG 2.03Å; C304-C313 PolarHBondContact SG-SG 2.85Å; C304-V314 HydrophobicContact CB-CG1 3.46Å; C304-V314 VanDerWaalsContact CB-CG1 3.46Å; C304-V314 WeakPolarHBondContact CB-O 3.21Å; C304-V314 PolarHBondContact SG-N 2.94Å; C304-V314 VanDerWaalsContact SG-N 3.4Å
305	F	78.1	Confident	68.9	Low	95 Å²	95	80.8 Å²	80.8	42%	0.417	38%	0.379	S	S	.	.	H	α-helix	trans	-90.3	-25.1	177.8	-64.9	-11.1	0	0	0	112.9	T301 Y303 V314 P316	T301-F305 HydrophobicContact CG2-CE2 4.21Å; T301-F305 HydrophobicContact CG2-CZ 4.27Å; T301-F305 WeakPolarHBondContact O-CB 3.41Å; T301-F305 VanDerWaalsContact O-CG 3.26Å; T301-F305 WeakPolarHBondContact O-CG 3.37Å; T301-F305 PolarHBondContact O-N 3.21Å; Y303-F305 VanDerWaalsContact C-N 3.31Å; Y303-F305 PolarHBondContact O-N 2.94Å; F305-V314 HydrophobicContact CE1-CG1 3.96Å; F305-V314 HydrophobicContact CE1-CG2 4.32Å; F305-V314 HydrophobicContact CZ-CG1 4.43Å; F305-V314 HydrophobicContact CZ-CG2 4.42Å; F305-P316 HydrophobicContact CE1-CB 4.22Å; F305-P316 HydrophobicContact CE1-CG 4.42Å; F305-P316 HydrophobicContact CZ-CB 4.24Å
306	S	72.8	Confident	70.9	Confident	99 Å²	99	79.1 Å²	79.1	69%	0.692	38%	0.383	S	S	*	.	H	α-helix	trans	-86.3	-28.8	177	-64.8	0	0	0	0	113	N302 Y303	N302-S306 WeakPolarHBondContact O-CB 3.39Å; N302-S306 PolarHBondContact O-OG 3.06Å; N302-S306 VanDerWaalsContact O-OG 3.11Å; Y303-S306 PolarHBondContact O-N 3.17Å
307	N	69.9	Low	73.3	Confident	76 Å²	76	73.3 Å²	73.3	41%	0.406	36%	0.358	S	S	.	.	S	Bend	trans	-112.5	136.8	-179.4	-61.1	-51	0	0	0	110.9	Y303 E309	Y303-N307 WeakPolarHBondContact CD2-ND2 3.19Å; Y303-N307 VanDerWaalsContact CE2-ND2 3.25Å; Y303-N307 WeakPolarHBondContact CE2-ND2 3.45Å; Y303-N307 PolarHBondContact O-N 2.73Å; Y303-N307 PolarHBondContact O-ND2 2.86Å; N307-E309 VanDerWaalsContact C-N 3.26Å; N307-E309 PolarHBondContact O-N 2.92Å
308	Y	69.1	Low	75.5	Confident	197 Å²	197	66.2 Å²	66.2	77%	0.773	33%	0.332	S	S	*	.			trans	-75.9	84.5	168.2	-171.9	-96.6	0	0	0	108.9	E310	Y308-E310 HydrophobicContact CD1-CG 4.24Å; Y308-E310 HydrophobicContact CE1-CG 3.72Å
309	E	68.4	Low	77.3	Confident	41 Å²	41	64.5 Å²	64.5	19%	0.192	32%	0.317	C	S	.	.			trans	-83.6	130.8	172.9	-174.3	57.7	-117.4	0	0	108.7	N307 N311 C313 R315	N307-E309 VanDerWaalsContact C-N 3.26Å; N307-E309 PolarHBondContact O-N 2.92Å; E309-N311 HydrophobicContact CG-CB 4.09Å; E309-N311 WeakPolarHBondContact OE1-CB 3.36Å; E309-N311 PolarHBondContact OE1-N 2.9Å; E309-N311 PolarHBondContact OE1-ND2 3.22Å; E309-C313 HydrophobicContact CB-CB 4.2Å; E309-C313 HydrophobicContact CG-CB 4.31Å; E309-R315 PolarHBondContact O-NH1 3.42Å; E309-R315 PolarHBondContact O-NH2 3.02Å
310	E	69.8	Low	78.9	Confident	136 Å²	136	61.4 Å²	61.4	64%	0.636	30%	0.301	S	S	*	.			trans	-85.9	-28.6	174.6	-70.7	-171.7	171.1	0	0	111.5	Y308 P344	Y308-E310 HydrophobicContact CD1-CG 4.24Å; Y308-E310 HydrophobicContact CE1-CG 3.72Å; E310-P344 WeakPolarHBondContact O-CD 3.38Å
311	N	75.9	Confident	80.1	Confident	68 Å²	68	58.9 Å²	58.9	36%	0.364	29%	0.288	S	S	.	.	S	Bend	trans	-70	179.6	177.1	-62.1	-58.3	0	0	0	113	E309 C313	E309-N311 HydrophobicContact CG-CB 4.09Å; E309-N311 WeakPolarHBondContact OE1-CB 3.36Å; E309-N311 PolarHBondContact OE1-N 2.9Å; E309-N311 PolarHBondContact OE1-ND2 3.22Å; N311-C313 PolarHBondContact O-N 2.97Å
312	C	79.5	Confident	80.9	Confident	15 Å²	15	65 Å²	65	10%	0.101	31%	0.31	C	S	.	.	S	Bend	trans	-51.2	108.9	177.4	175.8	0	0	0	0	112.7	P344 C345 C375 C408	C312-P344 PolarHBondContact N-O 3.39Å; C312-C345 WeakPolarHBondContact CB-SG 3.42Å; C312-C375 WeakPolarHBondContact CA-SG 3.16Å; C312-C375 HydrophobicContact CB-CB 3.72Å; C312-C375 WeakPolarHBondContact CB-SG 3.23Å; C312-C375 WeakPolarHBondContact SG-CA 2.93Å; C312-C375 WeakPolarHBondContact SG-CB 3.41Å; C312-C375 CovalentContact SG-SG 2.03Å; C312-C375 PolarHBondContact SG-SG 2.66Å; C312-C408 VanDerWaalsContact CB-SG 3.52Å
313	C	83.2	Confident	81.8	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	164.5	178.2	-122.6	0	0	0	0	110.6	C304 E309 N311 S342	C304-C313 VanDerWaalsContact CA-SG 3.51Å; C304-C313 HydrophobicContact CB-CB 3.87Å; C304-C313 WeakPolarHBondContact CB-SG 3.28Å; C304-C313 VanDerWaalsContact SG-CA 3.58Å; C304-C313 WeakPolarHBondContact SG-CB 3.24Å; C304-C313 CovalentContact SG-SG 2.03Å; C304-C313 PolarHBondContact SG-SG 2.85Å; E309-C313 HydrophobicContact CB-CB 4.2Å; E309-C313 HydrophobicContact CG-CB 4.31Å; N311-C313 PolarHBondContact O-N 2.97Å; C313-S342 PolarHBondContact N-O 2.76Å; C313-S342 PolarHBondContact O-N 2.82Å; C313-S342 VanDerWaalsContact O-O 3.09Å
314	V	87.2	Confident	82.6	Confident	0 Å²	0	66 Å²	66	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.5	170	61.4	0	0	0	0	110	T301 C304 F305 N339 V403 C406	T301-V314 HydrophobicContact CG2-CG1 4.13Å; C304-V314 HydrophobicContact CB-CG1 3.46Å; C304-V314 VanDerWaalsContact CB-CG1 3.46Å; C304-V314 WeakPolarHBondContact CB-O 3.21Å; C304-V314 PolarHBondContact SG-N 2.94Å; C304-V314 VanDerWaalsContact SG-N 3.4Å; F305-V314 HydrophobicContact CE1-CG1 3.96Å; F305-V314 HydrophobicContact CE1-CG2 4.32Å; F305-V314 HydrophobicContact CZ-CG1 4.43Å; F305-V314 HydrophobicContact CZ-CG2 4.42Å; V314-N339 HydrophobicContact CG2-CB 3.69Å; V314-V403 HydrophobicContact CG2-CB 4.42Å; V314-V403 HydrophobicContact CG2-CG1 4.09Å; V314-C406 VanDerWaalsContact CA-SG 3.56Å
315	R	87.6	Confident	83.1	Confident	54 Å²	54	65.7 Å²	65.7	20%	0.204	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.4	178	-55.6	-56.9	178.8	172.1	4	110.1	E309 L317 N339 F340 S342	E309-R315 PolarHBondContact O-NH1 3.42Å; E309-R315 PolarHBondContact O-NH2 3.02Å; R315-L317 PolarHBondContact O-N 3.5Å; R315-N339 VanDerWaalsContact O-CA 3.3Å; R315-N339 WeakPolarHBondContact O-CA 3.04Å; R315-N339 WeakPolarHBondContact O-CB 3.44Å; R315-F340 HydrophobicContact CB-CD1 4.02Å; R315-F340 HydrophobicContact CB-CD2 4.47Å; R315-F340 HydrophobicContact CB-CE1 3.56Å; R315-F340 HydrophobicContact CB-CE2 4.07Å; R315-F340 HydrophobicContact CB-CG 4.45Å; R315-F340 HydrophobicContact CB-CZ 3.6Å; R315-F340 HydrophobicContact CG-CE2 4.28Å; R315-F340 HydrophobicContact CG-CZ 4.16Å; R315-F340 PolarHBondContact N-O 2.56Å; R315-F340 PolarHBondContact O-N 2.89Å; R315-S342 PolarHBondContact NE-O 3.41Å
316	P	88.9	Confident	83.5	Confident	78 Å²	78	63.8 Å²	63.8	51%	0.506	32%	0.319	S	S	.	.			trans	-68.8	133.1	-179.2	28.4	-33.6	0	0	0	110.4	F305 N339	F305-P316 HydrophobicContact CE1-CB 4.22Å; F305-P316 HydrophobicContact CE1-CG 4.42Å; F305-P316 HydrophobicContact CZ-CB 4.24Å; P316-N339 WeakPolarHBondContact CA-OD1 3.37Å
317	L	90	Very high	84.3	Confident	15 Å²	15	59.7 Å²	59.7	8%	0.079	29%	0.288	C	S	.	.			trans	-144.2	111.3	172.8	175	62.2	0	0	0	109.4	K34 R37 R315 I319 Y337 A338 N339 F340	K34-L317 HydrophobicContact CB-CD1 4.24Å; K34-L317 HydrophobicContact CD-CD1 4.12Å; K34-L317 HydrophobicContact CG-CD1 3.92Å; K34-L317 HydrophobicContact CG-CD2 4.48Å; R37-L317 HydrophobicContact CB-CD2 4.07Å; R37-L317 HydrophobicContact CG-CD2 3.79Å; R315-L317 PolarHBondContact O-N 3.5Å; L317-I319 HydrophobicContact CD2-CD1 4.3Å; L317-I319 HydrophobicContact CD2-CG1 4.39Å; L317-I319 HydrophobicContact CG-CD1 4.49Å; L317-I319 HydrophobicContact CG-CG1 4.08Å; L317-Y337 CarbonylContact O-C 3.54Å; L317-Y337 WeakPolarHBondContact O-CA 3.31Å; L317-A338 PolarHBondContact O-N 3.35Å; L317-N339 PolarHBondContact N-OD1 3.04Å; L317-N339 PolarHBondContact O-N 3Å; L317-F340 HydrophobicContact CB-CD1 3.62Å; L317-F340 HydrophobicContact CB-CE1 3.95Å; L317-F340 HydrophobicContact CD2-CD1 3.96Å; L317-F340 HydrophobicContact CG-CD1 4.39Å
318	Y	92.3	Very high	85.1	Confident	97 Å²	97	65 Å²	65	38%	0.38	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.4	172.3	-174.6	-101.4	0	0	0	110.4	D320 G335 Y337	Y318-D320 HydrophobicContact CE1-CB 4.09Å; Y318-G335 WeakPolarHBondContact OH-CA 3.5Å; Y318-Y337 HydrophobicContact CD2-CD1 4.17Å; Y318-Y337 AromaticContact CD2-CD2 3.94Å; Y318-Y337 HydrophobicContact CD2-CD2 3.94Å; Y318-Y337 HydrophobicContact CD2-CE1 4.06Å; Y318-Y337 AromaticContact CD2-CE2 3.82Å; Y318-Y337 HydrophobicContact CD2-CE2 3.82Å; Y318-Y337 HydrophobicContact CD2-CG 4.11Å; Y318-Y337 AromaticContact CD2-CZ 3.88Å; Y318-Y337 HydrophobicContact CE2-CE2 4.36Å; Y318-Y337 HydrophobicContact CG-CE1 4.33Å
319	I	91.4	Very high	86.1	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	113.9	177.7	-58.7	-179.1	0	0	0	108.7	V38 I41 L317 H324 L325 G335 Y336 A338	V38-I319 HydrophobicContact CG2-CD1 4.1Å; V38-I319 HydrophobicContact CG2-CG1 4.29Å; I41-I319 HydrophobicContact CD1-CD1 3.22Å; I41-I319 HydrophobicContact CG1-CD1 4.43Å; I41-I319 HydrophobicContact CG2-CD1 4.47Å; L317-I319 HydrophobicContact CD2-CD1 4.3Å; L317-I319 HydrophobicContact CD2-CG1 4.39Å; L317-I319 HydrophobicContact CG-CD1 4.49Å; L317-I319 HydrophobicContact CG-CG1 4.08Å; I319-H324 HydrophobicContact CG2-CB 4.29Å; I319-L325 HydrophobicContact CG2-CD1 4.04Å; I319-L325 HydrophobicContact CG2-CG 4.42Å; I319-G335 CarbonylContact O-C 3.59Å; I319-G335 WeakPolarHBondContact O-CA 3.46Å; I319-Y336 PolarHBondContact N-O 3.23Å; I319-Y336 PolarHBondContact O-N 3.36Å; I319-A338 HydrophobicContact CD1-CB 3.62Å; I319-A338 HydrophobicContact CG1-CB 4.16Å
320	D	92.4	Very high	87.1	Confident	23 Å²	23	54.4 Å²	54.4	12%	0.123	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	124.7	167.7	-173.1	-53.8	0	0	0	109.4	Y318 R322 Q323 H324	Y318-D320 HydrophobicContact CE1-CB 4.09Å; D320-R322 VanDerWaalsContact C-N 3.26Å; D320-R322 PolarHBondContact O-N 2.99Å; D320-R322 WeakPolarHBondContact OD1-CA 3.12Å; D320-R322 WeakPolarHBondContact OD1-CB 3.42Å; D320-R322 PolarHBondContact OD1-N 2.61Å; D320-Q323 HydrophobicContact CB-CB 4.04Å; D320-Q323 HydrophobicContact CB-CG 4.19Å; D320-Q323 PolarHBondContact OD1-N 2.79Å; D320-H324 PolarHBondContact N-ND1 2.9Å; D320-H324 WeakPolarHBondContact O-CB 3.5Å; D320-H324 PolarHBondContact O-N 2.87Å
321	F	92.4	Very high	88.1	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.009	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-34.7	-178.5	-69.6	-64.6	0	0	0	112.3	I45 L325 G326 W327 I330 P333 K334 Y336 L383	I45-F321 HydrophobicContact CD1-CE1 3.8Å; F321-L325 HydrophobicContact CD1-CD1 3.65Å; F321-L325 HydrophobicContact CE1-CD1 4.13Å; F321-L325 CarbonylContact O-C 3.59Å; F321-L325 WeakPolarHBondContact O-CB 3.45Å; F321-L325 PolarHBondContact O-N 2.89Å; F321-G326 PolarHBondContact O-N 3.42Å; F321-G326 VanDerWaalsContact O-N 3.11Å; F321-W327 CarbonylContact C-O 3.56Å; F321-W327 HydrophobicContact CB-CB 4.34Å; F321-W327 AromaticContact CD1-CE3 3.99Å; F321-W327 HydrophobicContact CD1-CE3 3.99Å; F321-W327 PolarHBondContact O-N 2.91Å; F321-I330 HydrophobicContact CD1-CD1 3.74Å; F321-I330 HydrophobicContact CD2-CB 4.46Å; F321-I330 HydrophobicContact CD2-CD1 4.44Å; F321-I330 HydrophobicContact CD2-CG2 4.06Å; F321-I330 HydrophobicContact CE1-CD1 3.71Å; F321-I330 HydrophobicContact CE2-CD1 4.39Å; F321-I330 HydrophobicContact CE2-CG2 4.07Å; F321-I330 HydrophobicContact CG-CD1 4.14Å; F321-I330 HydrophobicContact CZ-CD1 4.05Å; F321-P333 WeakPolarHBondContact CD2-O 3.46Å; F321-P333 HydrophobicContact CE2-CG 4.2Å; F321-P333 VanDerWaalsContact CE2-O 3.28Å; F321-P333 WeakPolarHBondContact CE2-O 3.47Å; F321-K334 WeakPolarHBondContact CD2-O 3.47Å; F321-K334 PolarHBondContact N-O 2.97Å; F321-Y336 HydrophobicContact CE1-CD1 4.33Å; F321-Y336 AromaticContact CE1-CE1 3.97Å; F321-Y336 HydrophobicContact CE1-CE1 3.97Å; F321-Y336 HydrophobicContact CE2-CD1 4.11Å; F321-Y336 AromaticContact CZ-CD1 3.64Å; F321-Y336 HydrophobicContact CZ-CD1 3.64Å; F321-Y336 AromaticContact CZ-CE1 3.66Å; F321-Y336 HydrophobicContact CZ-CE1 3.66Å; F321-L383 HydrophobicContact CZ-CD2 4.24Å
322	R	90.4	Very high	88.8	Confident	142 Å²	142	47.9 Å²	47.9	54%	0.536	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-48.4	179.8	-73.9	-169.9	-81.2	-166.8	-3.2	111.6	D320 G326 W327 R328	D320-R322 VanDerWaalsContact C-N 3.26Å; D320-R322 PolarHBondContact O-N 2.99Å; D320-R322 WeakPolarHBondContact OD1-CA 3.12Å; D320-R322 WeakPolarHBondContact OD1-CB 3.42Å; D320-R322 PolarHBondContact OD1-N 2.61Å; R322-G326 VanDerWaalsContact O-CA 3.28Å; R322-G326 WeakPolarHBondContact O-CA 3.47Å; R322-G326 PolarHBondContact O-N 2.88Å; R322-W327 VanDerWaalsContact CG-O 3.27Å; R322-W327 WeakPolarHBondContact CG-O 3.19Å; R322-R328 HydrophobicContact CG-CG 4.38Å
323	Q	89.1	Confident	89.5	Confident	152 Å²	152	48 Å²	48	71%	0.71	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-45	-173.4	-58.8	-178.3	0.8	0	0	112.4	D320	D320-Q323 HydrophobicContact CB-CB 4.04Å; D320-Q323 HydrophobicContact CB-CG 4.19Å; D320-Q323 PolarHBondContact OD1-N 2.79Å
324	H	89.1	Confident	89.9	Confident	86 Å²	86	51.8 Å²	51.8	40%	0.398	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-34.1	-172.8	-58.7	148.5	0	0	0	113.1	V38 I319 D320	V38-H324 HydrophobicContact CG1-CB 4.12Å; I319-H324 HydrophobicContact CG2-CB 4.29Å; D320-H324 PolarHBondContact N-ND1 2.9Å; D320-H324 WeakPolarHBondContact O-CB 3.5Å; D320-H324 PolarHBondContact O-N 2.87Å
325	L	87.4	Confident	90.1	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.016	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-11.8	-177.9	-68.9	166.4	0	0	0	113.5	V38 R42 I319 F321 W327	V38-L325 HydrophobicContact CG1-CD2 3.79Å; V38-L325 HydrophobicContact CG1-CG 4.22Å; R42-L325 HydrophobicContact CB-CD2 3.6Å; R42-L325 HydrophobicContact CG-CD2 4Å; R42-L325 PolarHBondContact NH2-O 2.75Å; I319-L325 HydrophobicContact CG2-CD1 4.04Å; I319-L325 HydrophobicContact CG2-CG 4.42Å; F321-L325 HydrophobicContact CD1-CD1 3.65Å; F321-L325 HydrophobicContact CE1-CD1 4.13Å; F321-L325 CarbonylContact O-C 3.59Å; F321-L325 WeakPolarHBondContact O-CB 3.45Å; F321-L325 PolarHBondContact O-N 2.89Å; L325-W327 HydrophobicContact CB-CB 4.33Å; L325-W327 HydrophobicContact CB-CD2 3.92Å; L325-W327 HydrophobicContact CB-CE3 4.27Å; L325-W327 HydrophobicContact CB-CG 3.92Å; L325-W327 HydrophobicContact CD1-CD2 4.4Å; L325-W327 HydrophobicContact CD1-CE3 3.94Å; L325-W327 HydrophobicContact CD1-CZ3 4.08Å; L325-W327 PolarHBondContact O-N 3.26Å
326	G	87.3	Confident	90.4	Very high	55 Å²	55	50.3 Å²	50.3	57%	0.567	24%	0.242	S	C	*	.			trans	67.5	14.4	-174.9	0	0	0	0	0	113.4	F321 R322	F321-G326 PolarHBondContact O-N 3.42Å; F321-G326 VanDerWaalsContact O-N 3.11Å; R322-G326 VanDerWaalsContact O-CA 3.28Å; R322-G326 WeakPolarHBondContact O-CA 3.47Å; R322-G326 PolarHBondContact O-N 2.88Å
327	W	89.4	Confident	90.5	Very high	13 Å²	13	53.5 Å²	53.5	5%	0.049	25%	0.245	C	C	.	.			trans	-90	125.1	-173.7	-71.7	-3.5	0	0	0	111.4	R42 I45 L46 F321 R322 L325 W329 I330	R42-W327 HydrophobicContact CB-CZ2 4.37Å; R42-W327 HydrophobicContact CG-CH2 4.05Å; R42-W327 HydrophobicContact CG-CZ2 3.45Å; R42-W327 VanDerWaalsContact CG-CZ2 3.45Å; I45-W327 HydrophobicContact CB-CH2 3.92Å; I45-W327 HydrophobicContact CB-CZ3 3.97Å; I45-W327 HydrophobicContact CD1-CH2 4.3Å; I45-W327 HydrophobicContact CD1-CZ3 3.67Å; I45-W327 HydrophobicContact CG1-CZ3 4.4Å; I45-W327 HydrophobicContact CG2-CH2 4Å; I45-W327 HydrophobicContact CG2-CZ3 3.78Å; L46-W327 HydrophobicContact CD1-CZ2 4.17Å; L46-W327 HydrophobicContact CD2-CH2 4.43Å; L46-W327 HydrophobicContact CD2-CZ2 4.27Å; L46-W327 HydrophobicContact CG-CH2 4.11Å; L46-W327 HydrophobicContact CG-CZ2 4.01Å; F321-W327 CarbonylContact C-O 3.56Å; F321-W327 HydrophobicContact CB-CB 4.34Å; F321-W327 AromaticContact CD1-CE3 3.99Å; F321-W327 HydrophobicContact CD1-CE3 3.99Å; F321-W327 PolarHBondContact O-N 2.91Å; R322-W327 VanDerWaalsContact CG-O 3.27Å; R322-W327 WeakPolarHBondContact CG-O 3.19Å; L325-W327 HydrophobicContact CB-CB 4.33Å; L325-W327 HydrophobicContact CB-CD2 3.92Å; L325-W327 HydrophobicContact CB-CE3 4.27Å; L325-W327 HydrophobicContact CB-CG 3.92Å; L325-W327 HydrophobicContact CD1-CD2 4.4Å; L325-W327 HydrophobicContact CD1-CE3 3.94Å; L325-W327 HydrophobicContact CD1-CZ3 4.08Å; L325-W327 PolarHBondContact O-N 3.26Å; W327-W329 AromaticContact CD1-NE1 3.64Å; W327-W329 AromaticContact CD2-CE2 3.95Å; W327-W329 HydrophobicContact CD2-CZ2 4.02Å; W327-W329 AromaticContact CD2-NE1 3.35Å; W327-W329 VanDerWaalsContact CD2-NE1 3.35Å; W327-W329 AromaticContact CE2-NE1 3.81Å; W327-W329 AromaticContact CE3-CE2 3.98Å; W327-W329 AromaticContact CE3-CZ2 3.69Å; W327-W329 HydrophobicContact CE3-CZ2 3.69Å; W327-W329 AromaticContact CE3-NE1 3.84Å; W327-W329 AromaticContact CG-CD1 3.89Å; W327-W329 AromaticContact CG-NE1 3.21Å; W327-W329 HydrophobicContact CH2-CZ2 4.13Å; W327-W329 HydrophobicContact CZ2-CZ2 4.41Å; W327-W329 AromaticContact CZ3-CZ2 3.76Å; W327-W329 HydrophobicContact CZ3-CZ2 3.76Å; W327-W329 AromaticContact NE1-NE1 3.95Å; W327-I330 HydrophobicContact CE3-CD1 3.67Å; W327-I330 HydrophobicContact CE3-CG1 4.5Å; W327-I330 HydrophobicContact CZ3-CD1 4.01Å
328	R	86.9	Confident	90.5	Very high	188 Å²	188	52.8 Å²	52.8	71%	0.709	24%	0.241	S	C	*	.			trans	-113.4	-3.8	176	-62.2	179.2	-178.6	-175.7	0.1	113.2	L58 R322	L58-R328 VanDerWaalsContact CD2-C 3.5Å; L58-R328 HydrophobicContact CD2-CB 3.45Å; L58-R328 VanDerWaalsContact CD2-CB 3.45Å; L58-R328 WeakPolarHBondContact CD2-O 3.46Å; R322-R328 HydrophobicContact CG-CG 4.38Å
329	W	88.8	Confident	90.5	Very high	8 Å²	8	48.6 Å²	48.6	3%	0.03	23%	0.225	C	C	.	.	S	Bend	trans	-87.4	-17	-175.6	64.2	-90	0	0	0	113.4	I45 L49 P54 P55 L58 W327 H331 Y387	I45-W329 HydrophobicContact CG2-CH2 4.29Å; L49-W329 HydrophobicContact CD1-CH2 3.65Å; L49-W329 HydrophobicContact CD1-CZ3 4.13Å; P54-W329 HydrophobicContact CB-CG 4.47Å; P55-W329 HydrophobicContact CG-CB 4.13Å; P55-W329 HydrophobicContact CG-CD2 3.82Å; P55-W329 HydrophobicContact CG-CE3 3.55Å; P55-W329 HydrophobicContact CG-CG 4.08Å; P55-W329 HydrophobicContact CG-CZ3 4.25Å; L58-W329 HydrophobicContact CD2-CB 4.42Å; W327-W329 AromaticContact CD1-NE1 3.64Å; W327-W329 AromaticContact CD2-CE2 3.95Å; W327-W329 HydrophobicContact CD2-CZ2 4.02Å; W327-W329 AromaticContact CD2-NE1 3.35Å; W327-W329 VanDerWaalsContact CD2-NE1 3.35Å; W327-W329 AromaticContact CE2-NE1 3.81Å; W327-W329 AromaticContact CE3-CE2 3.98Å; W327-W329 AromaticContact CE3-CZ2 3.69Å; W327-W329 HydrophobicContact CE3-CZ2 3.69Å; W327-W329 AromaticContact CE3-NE1 3.84Å; W327-W329 AromaticContact CG-CD1 3.89Å; W327-W329 AromaticContact CG-NE1 3.21Å; W327-W329 HydrophobicContact CH2-CZ2 4.13Å; W327-W329 HydrophobicContact CZ2-CZ2 4.41Å; W327-W329 AromaticContact CZ3-CZ2 3.76Å; W327-W329 HydrophobicContact CZ3-CZ2 3.76Å; W327-W329 AromaticContact NE1-NE1 3.95Å; W329-H331 PolarHBondContact O-ND1 3.25Å; W329-Y387 AromaticContact CE3-CD2 3.91Å; W329-Y387 HydrophobicContact CE3-CD2 3.91Å; W329-Y387 AromaticContact CE3-CG 3.96Å; W329-Y387 HydrophobicContact CE3-CG 3.96Å; W329-Y387 HydrophobicContact CZ3-CD1 4.26Å; W329-Y387 AromaticContact CZ3-CD2 3.69Å; W329-Y387 HydrophobicContact CZ3-CD2 3.69Å; W329-Y387 HydrophobicContact CZ3-CE2 4.34Å; W329-Y387 AromaticContact CZ3-CG 3.63Å; W329-Y387 HydrophobicContact CZ3-CG 3.63Å; W329-Y387 WeakPolarHBondContact O-CB 3.17Å
330	I	90.6	Very high	90.4	Very high	7 Å²	7	49 Å²	49	4%	0.036	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	118.1	168.5	-60	-179.2	0	0	0	107.6	F321 W327	F321-I330 HydrophobicContact CD1-CD1 3.74Å; F321-I330 HydrophobicContact CD2-CB 4.46Å; F321-I330 HydrophobicContact CD2-CD1 4.44Å; F321-I330 HydrophobicContact CD2-CG2 4.06Å; F321-I330 HydrophobicContact CE1-CD1 3.71Å; F321-I330 HydrophobicContact CE2-CD1 4.39Å; F321-I330 HydrophobicContact CE2-CG2 4.07Å; F321-I330 HydrophobicContact CG-CD1 4.14Å; F321-I330 HydrophobicContact CZ-CD1 4.05Å; W327-I330 HydrophobicContact CE3-CD1 3.67Å; W327-I330 HydrophobicContact CE3-CG1 4.5Å; W327-I330 HydrophobicContact CZ3-CD1 4.01Å
331	H	90.3	Very high	90.1	Very high	13 Å²	13	49 Å²	49	6%	0.06	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-45.9	-179.9	-67.6	71.5	0	0	0	111.1	L58 P60 V63 W329 K334 L386 Y388	L58-H331 PolarHBondContact O-CE1 3.12Å; L58-H331 PolarHBondContact O-NE2 3.4Å; L58-H331 VanDerWaalsContact O-NE2 3.13Å; P60-H331 PolarHBondContact O-NE2 3Å; P60-H331 VanDerWaalsContact O-NE2 3.13Å; V63-H331 HydrophobicContact CG2-CB 3.7Å; W329-H331 PolarHBondContact O-ND1 3.25Å; H331-K334 WeakPolarHBondContact O-CE 3.46Å; H331-K334 PolarHBondContact O-NZ 3.13Å; H331-L386 HydrophobicContact CB-CD2 4.39Å; H331-L386 HydrophobicContact CB-CG 4.31Å; H331-L386 PolarHBondContact N-O 3.14Å; H331-Y388 AromaticContact CE1-CD2 3.42Å; H331-Y388 VanDerWaalsContact CE1-CD2 3.42Å; H331-Y388 WeakPolarHBondContact CE1-CD2 3.06Å; H331-Y388 AromaticContact CE1-CE2 3.96Å; H331-Y388 AromaticContact ND1-CD2 3.62Å
332	E	91.2	Very high	89.8	Confident	54 Å²	54	50 Å²	50	25%	0.252	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	142.6	177.1	-66.9	-58	149.2	0	0	111.6	L68 Y71 K334 I385 L386	L68-E332 HydrophobicContact CD1-CG 4.17Å; Y71-E332 HydrophobicContact CD1-CB 4.14Å; Y71-E332 HydrophobicContact CD2-CB 4.33Å; Y71-E332 HydrophobicContact CE1-CB 3.8Å; Y71-E332 HydrophobicContact CE1-CG 4.44Å; Y71-E332 HydrophobicContact CE2-CB 4Å; Y71-E332 HydrophobicContact CG-CB 4.39Å; E332-K334 IonicContact OE1-NZ 2.73Å; E332-I385 CarbonylContact O-C 3.45Å; E332-I385 WeakPolarHBondContact O-CA 3.39Å; E332-L386 HydrophobicContact CB-CB 4.23Å; E332-L386 PolarHBondContact N-O 2.89Å; E332-L386 PolarHBondContact O-N 2.81Å
333	P	93.8	Very high	89.3	Confident	18 Å²	18	44.4 Å²	44.4	12%	0.117	22%	0.223	C	C	.	.			cis	-73.3	167.1	-10.9	30.1	-30.4	0	0	0	111.6	Y71 F321 G335 L383 T384	Y71-P333 WeakPolarHBondContact OH-CB 3.39Å; Y71-P333 WeakPolarHBondContact OH-CD 3.41Å; F321-P333 WeakPolarHBondContact CD2-O 3.46Å; F321-P333 HydrophobicContact CE2-CG 4.2Å; F321-P333 VanDerWaalsContact CE2-O 3.28Å; F321-P333 WeakPolarHBondContact CE2-O 3.47Å; P333-G335 VanDerWaalsContact C-N 3.29Å; P333-L383 HydrophobicContact CG-CD1 4.1Å; P333-T384 WeakPolarHBondContact CD-O 3.5Å
334	K	91.6	Very high	88.7	Confident	80 Å²	80	41 Å²	41	35%	0.348	21%	0.213	S	C	.	.	S	Bend	trans	-72.1	-25.1	173.5	-59	-53.3	-177.7	-163.7	0	113.5	F321 H331 E332	F321-K334 WeakPolarHBondContact CD2-O 3.47Å; F321-K334 PolarHBondContact N-O 2.97Å; H331-K334 WeakPolarHBondContact O-CE 3.46Å; H331-K334 PolarHBondContact O-NZ 3.13Å; E332-K334 IonicContact OE1-NZ 2.73Å
335	G	91.8	Very high	87.9	Confident	11 Å²	11	37.6 Å²	37.6	11%	0.113	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	171.5	174.8	0	0	0	0	0	110.3	Y318 I319 P333	Y318-G335 WeakPolarHBondContact OH-CA 3.5Å; I319-G335 CarbonylContact O-C 3.59Å; I319-G335 WeakPolarHBondContact O-CA 3.46Å; P333-G335 VanDerWaalsContact C-N 3.29Å
336	Y	93.8	Very high	86.9	Confident	12 Å²	12	40.4 Å²	40.4	5%	0.047	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	160.4	-177.9	74.1	-76	0	0	0	111.6	I41 I319 F321 A338 L383 M401 I402	I41-Y336 VanDerWaalsContact CG2-OH 3.26Å; I41-Y336 WeakPolarHBondContact CG2-OH 3.4Å; I319-Y336 PolarHBondContact N-O 3.23Å; I319-Y336 PolarHBondContact O-N 3.36Å; F321-Y336 HydrophobicContact CE1-CD1 4.33Å; F321-Y336 AromaticContact CE1-CE1 3.97Å; F321-Y336 HydrophobicContact CE1-CE1 3.97Å; F321-Y336 HydrophobicContact CE2-CD1 4.11Å; F321-Y336 AromaticContact CZ-CD1 3.64Å; F321-Y336 HydrophobicContact CZ-CD1 3.64Å; F321-Y336 AromaticContact CZ-CE1 3.66Å; F321-Y336 HydrophobicContact CZ-CE1 3.66Å; Y336-A338 HydrophobicContact CD2-CB 4.17Å; Y336-A338 VanDerWaalsContact CE2-CA 3.47Å; Y336-A338 HydrophobicContact CE2-CB 3.45Å; Y336-A338 VanDerWaalsContact CE2-CB 3.45Å; Y336-A338 PolarHBondContact O-N 3.48Å; Y336-L383 HydrophobicContact CD1-CD2 3.66Å; Y336-L383 HydrophobicContact CD2-CD1 4.27Å; Y336-L383 HydrophobicContact CD2-CD2 3.98Å; Y336-L383 HydrophobicContact CE1-CD2 3.68Å; Y336-L383 HydrophobicContact CE2-CD2 3.97Å; Y336-L383 HydrophobicContact CG-CD1 4.09Å; Y336-L383 HydrophobicContact CG-CD2 3.82Å; Y336-M401 HydrophobicContact CE2-CB 4.39Å; Y336-M401 VanDerWaalsContact OH-CE 3.3Å; Y336-M401 WeakPolarHBondContact OH-CE 3.27Å; Y336-I402 HydrophobicContact CD2-CD1 4.35Å; Y336-I402 HydrophobicContact CD2-CG1 3.8Å; Y336-I402 HydrophobicContact CE2-CG1 4Å
337	Y	91.6	Very high	85.6	Confident	144 Å²	144	41.4 Å²	41.4	57%	0.565	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	96	172.5	-71.5	-83.3	0	0	0	109.5	L317 Y318 I402	L317-Y337 CarbonylContact O-C 3.54Å; L317-Y337 WeakPolarHBondContact O-CA 3.31Å; Y318-Y337 HydrophobicContact CD2-CD1 4.17Å; Y318-Y337 AromaticContact CD2-CD2 3.94Å; Y318-Y337 HydrophobicContact CD2-CD2 3.94Å; Y318-Y337 HydrophobicContact CD2-CE1 4.06Å; Y318-Y337 AromaticContact CD2-CE2 3.82Å; Y318-Y337 HydrophobicContact CD2-CE2 3.82Å; Y318-Y337 HydrophobicContact CD2-CG 4.11Å; Y318-Y337 AromaticContact CD2-CZ 3.88Å; Y318-Y337 HydrophobicContact CE2-CE2 4.36Å; Y318-Y337 HydrophobicContact CG-CE1 4.33Å; Y337-I402 WeakPolarHBondContact O-CG2 3.23Å
338	A	89.9	Confident	83.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.234	C	C	.	.			trans	-74.9	-31.8	177.1	0	0	0	0	0	112.1	I41 L317 I319 Y336 V403	I41-A338 HydrophobicContact CD1-CB 3.5Å; I41-A338 VanDerWaalsContact CD1-CB 3.5Å; L317-A338 PolarHBondContact O-N 3.35Å; I319-A338 HydrophobicContact CD1-CB 3.62Å; I319-A338 HydrophobicContact CG1-CB 4.16Å; Y336-A338 HydrophobicContact CD2-CB 4.17Å; Y336-A338 VanDerWaalsContact CE2-CA 3.47Å; Y336-A338 HydrophobicContact CE2-CB 3.45Å; Y336-A338 VanDerWaalsContact CE2-CB 3.45Å; Y336-A338 PolarHBondContact O-N 3.48Å; A338-V403 PolarHBondContact O-N 3.12Å
339	N	91.8	Very high	81.7	Confident	9 Å²	9	48.6 Å²	48.6	5%	0.048	24%	0.241	C	C	.	.			trans	55.2	169	-172.5	-55.4	-25.3	0	0	0	112.8	R37 V314 R315 P316 L317 V403	R37-N339 PolarHBondContact NE-O 2.99Å; V314-N339 HydrophobicContact CG2-CB 3.69Å; R315-N339 VanDerWaalsContact O-CA 3.3Å; R315-N339 WeakPolarHBondContact O-CA 3.04Å; R315-N339 WeakPolarHBondContact O-CB 3.44Å; P316-N339 WeakPolarHBondContact CA-OD1 3.37Å; L317-N339 PolarHBondContact N-OD1 3.04Å; L317-N339 PolarHBondContact O-N 3Å; N339-V403 HydrophobicContact CB-CB 4Å; N339-V403 PolarHBondContact ND2-O 3.45Å
340	F	88.5	Confident	79.4	Confident	10 Å²	10	51.6 Å²	51.6	4%	0.044	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	155.1	174.4	66.3	-74.9	0	0	0	110.7	I30 I33 K34 R37 R315 L317	I30-F340 HydrophobicContact CG2-CZ 4.12Å; I33-F340 HydrophobicContact CB-CE2 4.38Å; I33-F340 HydrophobicContact CG2-CD2 3.63Å; I33-F340 HydrophobicContact CG2-CE2 3.77Å; K34-F340 HydrophobicContact CG-CE1 4.08Å; K34-F340 HydrophobicContact CG-CZ 4.14Å; R37-F340 HydrophobicContact CG-CB 4.2Å; R315-F340 HydrophobicContact CB-CD1 4.02Å; R315-F340 HydrophobicContact CB-CD2 4.47Å; R315-F340 HydrophobicContact CB-CE1 3.56Å; R315-F340 HydrophobicContact CB-CE2 4.07Å; R315-F340 HydrophobicContact CB-CG 4.45Å; R315-F340 HydrophobicContact CB-CZ 3.6Å; R315-F340 HydrophobicContact CG-CE2 4.28Å; R315-F340 HydrophobicContact CG-CZ 4.16Å; R315-F340 PolarHBondContact N-O 2.56Å; R315-F340 PolarHBondContact O-N 2.89Å; L317-F340 HydrophobicContact CB-CD1 3.62Å; L317-F340 HydrophobicContact CB-CE1 3.95Å; L317-F340 HydrophobicContact CD2-CD1 3.96Å; L317-F340 HydrophobicContact CG-CD1 4.39Å
341	C	86.1	Confident	77.3	Confident	21 Å²	21	56 Å²	56	14%	0.142	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.6	174	-62.5	0	0	0	0	109.7	V376 P377 C406	C341-V376 VanDerWaalsContact SG-C 3.6Å; C341-P377 WeakPolarHBondContact SG-CA 3.31Å; C341-P377 VanDerWaalsContact SG-N 3.4Å; C341-C406 WeakPolarHBondContact CA-SG 3.48Å; C341-C406 HydrophobicContact CB-CB 3.79Å; C341-C406 WeakPolarHBondContact CB-SG 3.48Å; C341-C406 WeakPolarHBondContact SG-CB 2.95Å; C341-C406 CovalentContact SG-SG 2.03Å; C341-C406 PolarHBondContact SG-SG 2.86Å
342	S	85.7	Confident	75.2	Confident	25 Å²	25	61 Å²	61	18%	0.175	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	140.4	174.6	-174.6	0	0	0	0	111.2	C313 R315	C313-S342 PolarHBondContact N-O 2.76Å; C313-S342 PolarHBondContact O-N 2.82Å; C313-S342 VanDerWaalsContact O-O 3.09Å; R315-S342 PolarHBondContact NE-O 3.41Å
343	G	80.8	Confident	73.3	Confident	24 Å²	24	62.2 Å²	62.2	25%	0.247	34%	0.339	C	S	.	.	S	Bend	trans	144.2	154.4	178.5	0	0	0	0	0	110.5
344	P	76.3	Confident	71.4	Confident	79 Å²	79	67.4 Å²	67.4	51%	0.513	37%	0.371	S	S	.	.			trans	-63.9	141.6	172.3	29.9	-31.2	0	0	0	109.8	E310 C312 P346	E310-P344 WeakPolarHBondContact O-CD 3.38Å; C312-P344 PolarHBondContact N-O 3.39Å; P344-P346 VanDerWaalsContact O-CD 3.24Å; P344-P346 WeakPolarHBondContact O-CD 3.22Å
345	C	72.1	Confident	69.6	Low	16 Å²	16	70.6 Å²	70.6	11%	0.108	39%	0.386	C	S	.	.			trans	-104.4	90.7	168.1	-78.6	0	0	0	0	107.3	C312 P373 C408	C312-C345 WeakPolarHBondContact CB-SG 3.42Å; C345-P373 HydrophobicContact CB-CB 4.08Å; C345-P373 HydrophobicContact CB-CG 3.74Å; C345-P373 VanDerWaalsContact CB-O 3.32Å; C345-P373 WeakPolarHBondContact CB-O 3.46Å; C345-P373 WeakPolarHBondContact O-CG 3.36Å; C345-C408 VanDerWaalsContact CA-SG 3.55Å; C345-C408 HydrophobicContact CB-CB 3.63Å; C345-C408 WeakPolarHBondContact CB-SG 3.33Å; C345-C408 WeakPolarHBondContact SG-CA 3.33Å; C345-C408 WeakPolarHBondContact SG-CB 3.41Å; C345-C408 CovalentContact SG-SG 2.03Å; C345-C408 PolarHBondContact SG-SG 2.73Å
346	P	67.4	Low	67.6	Low	62 Å²	62	71.1 Å²	71.1	40%	0.403	39%	0.388	S	S	.	.			trans	-61.3	143	172.4	26.7	-33.5	0	0	0	109.1	P344 L348	P344-P346 VanDerWaalsContact O-CD 3.24Å; P344-P346 WeakPolarHBondContact O-CD 3.22Å; P346-L348 HydrophobicContact CB-CD1 4.38Å; P346-L348 HydrophobicContact CB-CG 4.32Å; P346-L348 HydrophobicContact CG-CD1 3.68Å; P346-L348 HydrophobicContact CG-CG 4.15Å; P346-L348 PolarHBondContact O-N 2.81Å
347	Y	58.3	Low	65.7	Low	75 Å²	75	73.5 Å²	73.5	29%	0.294	41%	0.407	S	S	.	.			trans	-69.5	74.9	168.9	-72.7	-86.8	0	0	0	109.7	L359 N363 S370 A371 S372 P373	Y347-L359 HydrophobicContact CE1-CD2 4.43Å; Y347-N363 WeakPolarHBondContact CD1-ND2 3.16Å; Y347-N363 WeakPolarHBondContact CE1-ND2 3.15Å; Y347-N363 WeakPolarHBondContact CE2-ND2 3.47Å; Y347-N363 WeakPolarHBondContact CE2-OD1 3.42Å; Y347-N363 VanDerWaalsContact CZ-CG 3.47Å; Y347-N363 VanDerWaalsContact CZ-OD1 3.28Å; Y347-N363 PolarHBondContact OH-ND2 2.99Å; Y347-N363 PolarHBondContact OH-OD1 3.09Å; Y347-N363 VanDerWaalsContact OH-OD1 3.12Å; Y347-S370 PolarHBondContact OH-OG 2.96Å; Y347-A371 PolarHBondContact OH-O 3.09Å; Y347-S372 WeakPolarHBondContact OH-CA 3.3Å; Y347-S372 PolarHBondContact OH-N 3.44Å; Y347-S372 VanDerWaalsContact OH-N 3.13Å; Y347-P373 HydrophobicContact CD1-CG 4.16Å; Y347-P373 HydrophobicContact CE1-CG 4.19Å; Y347-P373 HydrophobicContact CG-CG 4.42Å
348	L	51.1	Low	63.8	Low	128 Å²	128	73.8 Å²	73.8	67%	0.67	42%	0.415	S	S	*	.			trans	-81.2	130	169.9	-77.2	157.3	0	0	0	107.9	P346 S350	P346-L348 HydrophobicContact CB-CD1 4.38Å; P346-L348 HydrophobicContact CB-CG 4.32Å; P346-L348 HydrophobicContact CG-CD1 3.68Å; P346-L348 HydrophobicContact CG-CG 4.15Å; P346-L348 PolarHBondContact O-N 2.81Å; L348-S350 VanDerWaalsContact C-N 3.33Å; L348-S350 PolarHBondContact O-N 3.04Å; L348-S350 PolarHBondContact O-OG 2.89Å
349	R	44.8	Very low	62	Low	225 Å²	225	77.3 Å²	77.3	85%	0.849	43%	0.433	S	S	*	.			trans	-36.2	94	172.4	-79.7	-179.6	179.6	151.4	-0.9	110	A351	R349-A351 VanDerWaalsContact C-N 3.26Å; R349-A351 PolarHBondContact O-N 3.17Å
350	S	40.8	Very low	60.1	Low	71 Å²	71	78.3 Å²	78.3	50%	0.497	44%	0.441	S	S	.	.			trans	-72.7	96.6	168.6	-26.5	0	0	0	0	104.2	L348 D352 S356	L348-S350 VanDerWaalsContact C-N 3.33Å; L348-S350 PolarHBondContact O-N 3.04Å; L348-S350 PolarHBondContact O-OG 2.89Å; S350-D352 PolarHBondContact O-N 3.22Å; S350-S356 PolarHBondContact O-OG 2.99Å
351	A	44.7	Very low	58.5	Low	99 Å²	99	83.1 Å²	83.1	82%	0.818	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	6.3	-179.9	0	0	0	0	0	113.3	R349	R349-A351 VanDerWaalsContact C-N 3.26Å; R349-A351 PolarHBondContact O-N 3.17Å
352	D	47.8	Very low	57	Low	118 Å²	118	89 Å²	89	63%	0.631	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-10.2	-163.9	-99.5	29.7	0	0	0	114.5	K296 S350	K296-D352 IonicContact NZ-OD2 2.84Å; K296-D352 PolarHBondContact NZ-OD2 3.02Å; S350-D352 PolarHBondContact O-N 3.22Å
353	T	50.9	Low	55.3	Low	79 Å²	79	88.8 Å²	88.8	49%	0.485	48%	0.484	S	S	.	.			trans	-146.8	143.1	173	67.4	0	0	0	0	112.5	H355 S356	T353-H355 PolarHBondContact O-N 2.96Å; T353-S356 PolarHBondContact O-N 2.91Å; T353-S356 PolarHBondContact O-OG 3Å; T353-S356 WeakPolarHBondContact OG1-CB 3.33Å; T353-S356 PolarHBondContact OG1-N 3.42Å; T353-S356 PolarHBondContact OG1-OG 3.15Å
354	T	52.8	Low	54.2	Low	128 Å²	128	93 Å²	93	79%	0.785	51%	0.505	S	S	*	.	H	α-helix	trans	-62.9	-24.8	177.8	49.7	0	0	0	0	113.3	S357	T354-S357 VanDerWaalsContact C-OG 3.31Å; T354-S357 WeakPolarHBondContact CA-OG 3.31Å; T354-S357 PolarHBondContact O-OG 3.49Å
355	H	53.8	Low	53.3	Low	146 Å²	146	95.6 Å²	95.6	68%	0.676	51%	0.514	S	S	*	.	H	α-helix	trans	-76.1	-33.5	178.1	-163.7	-88.1	0	0	0	112.9	T353 L359	T353-H355 PolarHBondContact O-N 2.96Å; H355-L359 PolarHBondContact O-N 3.35Å
356	S	50.6	Low	52.4	Low	23 Å²	23	99.1 Å²	99.1	16%	0.161	53%	0.531	C	S	.	.	H	α-helix	trans	-72	-29.8	176.6	48.3	0	0	0	0	112.8	S350 T353 S360	S350-S356 PolarHBondContact O-OG 2.99Å; T353-S356 PolarHBondContact O-N 2.91Å; T353-S356 PolarHBondContact O-OG 3Å; T353-S356 WeakPolarHBondContact OG1-CB 3.33Å; T353-S356 PolarHBondContact OG1-N 3.42Å; T353-S356 PolarHBondContact OG1-OG 3.15Å; S356-S360 WeakPolarHBondContact O-CB 3.45Å; S356-S360 PolarHBondContact O-N 3.02Å; S356-S360 VanDerWaalsContact O-N 3.16Å
357	S	53.4	Low	51.8	Low	61 Å²	61	100.9 Å²	100.9	43%	0.427	54%	0.543	S	S	.	.	H	α-helix	trans	-68.1	-40.9	173.6	35.3	0	0	0	0	113.4	T354 L361	T354-S357 VanDerWaalsContact C-OG 3.31Å; T354-S357 WeakPolarHBondContact CA-OG 3.31Å; T354-S357 PolarHBondContact O-OG 3.49Å; S357-L361 PolarHBondContact O-N 3.01Å
358	M	51.6	Low	51.4	Low	151 Å²	151	105.4 Å²	105.4	74%	0.744	57%	0.567	S	S	*	*	H	α-helix	trans	-68.4	-41.4	177.6	-92.5	-158	171.1	0	0	112.2	S360 L361 Y362	M358-S360 VanDerWaalsContact C-N 3.31Å; M358-S360 PolarHBondContact O-N 3.22Å; M358-L361 PolarHBondContact O-N 3.28Å; M358-Y362 PolarHBondContact O-N 3.38Å
359	L	52.2	Low	51.2	Low	73 Å²	73	102.8 Å²	102.8	38%	0.382	56%	0.564	S	S	.	*	H	α-helix	trans	-66.2	-35.1	178.6	-156.9	72.1	0	0	0	111.7	Y347 H355 Y362 N363	Y347-L359 HydrophobicContact CE1-CD2 4.43Å; H355-L359 PolarHBondContact O-N 3.35Å; L359-Y362 PolarHBondContact O-N 3.5Å; L359-N363 PolarHBondContact O-N 3.14Å; L359-N363 PolarHBondContact O-ND2 3.03Å
360	S	52.7	Low	51.6	Low	31 Å²	31	93.1 Å²	93.1	22%	0.217	53%	0.531	C	S	.	.	H	α-helix	trans	-66.2	-36.9	174.6	177.9	0	0	0	0	113.2	S356 M358 T364	S356-S360 WeakPolarHBondContact O-CB 3.45Å; S356-S360 PolarHBondContact O-N 3.02Å; S356-S360 VanDerWaalsContact O-N 3.16Å; M358-S360 VanDerWaalsContact C-N 3.31Å; M358-S360 PolarHBondContact O-N 3.22Å; S360-T364 PolarHBondContact O-OG1 3.02Å
361	L	55.4	Low	52.4	Low	110 Å²	110	93.4 Å²	93.4	58%	0.576	54%	0.537	S	S	*	.	H	α-helix	trans	-69.9	-37.1	173	-95.1	149.9	0	0	0	112.3	S357 M358 N363 T364 L365	S357-L361 PolarHBondContact O-N 3.01Å; M358-L361 PolarHBondContact O-N 3.28Å; L361-N363 VanDerWaalsContact C-N 3.29Å; L361-N363 PolarHBondContact O-N 3.28Å; L361-T364 WeakPolarHBondContact CA-OG1 3.34Å; L361-T364 PolarHBondContact O-N 3.04Å; L361-T364 PolarHBondContact O-OG1 3.03Å; L361-L365 WeakPolarHBondContact O-CG 3.37Å; L361-L365 PolarHBondContact O-N 3.13Å
362	Y	53.2	Low	53.2	Low	145 Å²	145	91.4 Å²	91.4	57%	0.569	52%	0.517	S	S	*	.	H	α-helix	trans	-65.7	-33.6	178.7	-143.7	-96.3	0	0	0	112.2	M358 L359 L365 N366	M358-Y362 PolarHBondContact O-N 3.38Å; L359-Y362 PolarHBondContact O-N 3.5Å; Y362-L365 PolarHBondContact O-N 3.18Å; Y362-N366 PolarHBondContact O-N 3.29Å
363	N	51.4	Low	54.2	Low	21 Å²	21	87.1 Å²	87.1	11%	0.112	50%	0.496	C	S	.	.	H	α-helix	trans	-64.5	-38	173.4	-84.6	-71.5	0	0	0	114.2	Y347 L359 L361 L365 P367 S370	Y347-N363 WeakPolarHBondContact CD1-ND2 3.16Å; Y347-N363 WeakPolarHBondContact CE1-ND2 3.15Å; Y347-N363 WeakPolarHBondContact CE2-ND2 3.47Å; Y347-N363 WeakPolarHBondContact CE2-OD1 3.42Å; Y347-N363 VanDerWaalsContact CZ-CG 3.47Å; Y347-N363 VanDerWaalsContact CZ-OD1 3.28Å; Y347-N363 PolarHBondContact OH-ND2 2.99Å; Y347-N363 PolarHBondContact OH-OD1 3.09Å; Y347-N363 VanDerWaalsContact OH-OD1 3.12Å; L359-N363 PolarHBondContact O-N 3.14Å; L359-N363 PolarHBondContact O-ND2 3.03Å; L361-N363 VanDerWaalsContact C-N 3.29Å; L361-N363 PolarHBondContact O-N 3.28Å; N363-L365 PolarHBondContact O-N 3.34Å; N363-P367 WeakPolarHBondContact O-CD 3.45Å; N363-S370 PolarHBondContact ND2-OG 3.46Å; N363-S370 WeakPolarHBondContact OD1-CB 3.48Å; N363-S370 PolarHBondContact OD1-OG 3.43Å
364	T	57.9	Low	55.4	Low	113 Å²	113	87 Å²	87	69%	0.693	50%	0.497	S	S	*	.	H	α-helix	trans	-70.7	-23.8	178.6	12.9	0	0	0	0	111.7	S360 L361	S360-T364 PolarHBondContact O-OG1 3.02Å; L361-T364 WeakPolarHBondContact CA-OG1 3.34Å; L361-T364 PolarHBondContact O-N 3.04Å; L361-T364 PolarHBondContact O-OG1 3.03Å
365	L	57.3	Low	56.7	Low	132 Å²	132	82.2 Å²	82.2	69%	0.691	47%	0.469	S	S	*	.	H	α-helix	trans	-89.3	-32	177.9	-65.5	168.2	0	0	0	112.9	L361 Y362 N363	L361-L365 WeakPolarHBondContact O-CG 3.37Å; L361-L365 PolarHBondContact O-N 3.13Å; Y362-L365 PolarHBondContact O-N 3.18Å; N363-L365 PolarHBondContact O-N 3.34Å
366	N	51.6	Low	58	Low	90 Å²	90	77.3 Å²	77.3	48%	0.481	45%	0.449	S	S	.	.			trans	-152.3	84	-179.7	-117	-26.7	0	0	0	112.1	Y362 E368 A369	Y362-N366 PolarHBondContact O-N 3.29Å; N366-E368 VanDerWaalsContact C-N 3.28Å; N366-E368 PolarHBondContact O-N 2.93Å; N366-A369 HydrophobicContact CB-CB 4.22Å; N366-A369 PolarHBondContact O-N 2.02Å
367	P	55.5	Low	59.5	Low	99 Å²	99	78.9 Å²	78.9	64%	0.643	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-64.7	-29	-177.5	-12.1	20.9	0	0	0	113.7	N363	N363-P367 WeakPolarHBondContact O-CD 3.45Å
368	E	49.9	Very low	60.5	Low	171 Å²	171	76.8 Å²	76.8	80%	0.799	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-77.3	-19.2	-179.6	-69.4	-165.6	155.2	0	0	113.6	N366	N366-E368 VanDerWaalsContact C-N 3.28Å; N366-E368 PolarHBondContact O-N 2.93Å
369	A	47.8	Very low	61.7	Low	73 Å²	73	72.3 Å²	72.3	60%	0.603	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-105.4	6.6	-175	0	0	0	0	0	113.7	N366	N366-A369 HydrophobicContact CB-CB 4.22Å; N366-A369 PolarHBondContact O-N 2.02Å
370	S	53.3	Low	63.1	Low	22 Å²	22	70.6 Å²	70.6	15%	0.154	41%	0.412	C	S	.	.	S	Bend	trans	-112.5	140.2	-169.4	-175.4	0	0	0	0	113.6	Y347 N363 S372	Y347-S370 PolarHBondContact OH-OG 2.96Å; N363-S370 PolarHBondContact ND2-OG 3.46Å; N363-S370 WeakPolarHBondContact OD1-CB 3.48Å; N363-S370 PolarHBondContact OD1-OG 3.43Å; S370-S372 PolarHBondContact O-N 2.97Å
371	A	57.1	Low	64.6	Low	77 Å²	77	71.9 Å²	71.9	64%	0.636	42%	0.415	S	S	*	.			trans	-82.7	102.2	-173.2	0	0	0	0	0	112.1	Y347	Y347-A371 PolarHBondContact OH-O 3.09Å
372	S	60.7	Low	66.1	Low	57 Å²	57	68 Å²	68	40%	0.399	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-65.3	137	-176.8	56.7	0	0	0	0	113	Y347 S370	Y347-S372 WeakPolarHBondContact OH-CA 3.3Å; Y347-S372 PolarHBondContact OH-N 3.44Å; Y347-S372 VanDerWaalsContact OH-N 3.13Å; S370-S372 PolarHBondContact O-N 2.97Å
373	P	69.8	Low	67.8	Low	28 Å²	28	61.7 Å²	61.7	18%	0.182	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-65.1	140.2	178.3	26.7	-34.3	0	0	0	109.6	C345 Y347 C408	C345-P373 HydrophobicContact CB-CB 4.08Å; C345-P373 HydrophobicContact CB-CG 3.74Å; C345-P373 VanDerWaalsContact CB-O 3.32Å; C345-P373 WeakPolarHBondContact CB-O 3.46Å; C345-P373 WeakPolarHBondContact O-CG 3.36Å; Y347-P373 HydrophobicContact CD1-CG 4.16Å; Y347-P373 HydrophobicContact CE1-CG 4.19Å; Y347-P373 HydrophobicContact CG-CG 4.42Å; P373-C408 HydrophobicContact CB-CB 4.33Å
374	C	75.6	Confident	69.7	Low	75 Å²	75	61.2 Å²	61.2	51%	0.507	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-99.2	142.8	-178.4	-71.9	0	0	0	0	110.8	V376 C408 S409	C374-V376 HydrophobicContact CB-CG1 4.01Å; C374-V376 PolarHBondContact O-N 3.05Å; C374-C408 WeakPolarHBondContact O-CA 3.29Å; C374-S409 PolarHBondContact N-O 2.81Å; C374-S409 PolarHBondContact O-N 3.44Å; C374-S409 VanDerWaalsContact O-N 3.1Å
375	C	79.5	Confident	71.4	Confident	29 Å²	29	55.8 Å²	55.8	20%	0.196	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	102.2	172.3	-171.8	0	0	0	0	109.7	C312 K407	C312-C375 WeakPolarHBondContact CA-SG 3.16Å; C312-C375 HydrophobicContact CB-CB 3.72Å; C312-C375 WeakPolarHBondContact CB-SG 3.23Å; C312-C375 WeakPolarHBondContact SG-CA 2.93Å; C312-C375 WeakPolarHBondContact SG-CB 3.41Å; C312-C375 CovalentContact SG-SG 2.03Å; C312-C375 PolarHBondContact SG-SG 2.66Å; C375-K407 CarbonylContact C-O 3.5Å; C375-K407 WeakPolarHBondContact CA-O 3.3Å
376	V	81.2	Confident	73.1	Confident	43 Å²	43	49.5 Å²	49.5	26%	0.261	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.5	-173.7	-61	0	0	0	0	111.9	C341 C374 C406 K407 S409	C341-V376 VanDerWaalsContact SG-C 3.6Å; C374-V376 HydrophobicContact CB-CG1 4.01Å; C374-V376 PolarHBondContact O-N 3.05Å; V376-C406 CarbonylContact O-C 3.59Å; V376-C406 WeakPolarHBondContact O-CA 3.42Å; V376-K407 HydrophobicContact CG2-CG 3.87Å; V376-K407 PolarHBondContact N-O 2.88Å; V376-K407 PolarHBondContact O-N 2.94Å; V376-S409 WeakPolarHBondContact CG2-OG 2.92Å
377	P	81.6	Confident	74.9	Confident	56 Å²	56	45.5 Å²	45.5	36%	0.364	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	139.8	174.8	26.6	-33.9	0	0	0	111.3	C341 L380 V403	C341-P377 WeakPolarHBondContact SG-CA 3.31Å; C341-P377 VanDerWaalsContact SG-N 3.4Å; P377-L380 HydrophobicContact CB-CD1 4.39Å; P377-L380 HydrophobicContact CB-CD2 3.85Å; P377-L380 HydrophobicContact CB-CG 4.26Å; P377-V403 HydrophobicContact CB-CG1 3.89Å; P377-V403 HydrophobicContact CB-CG2 4.24Å
378	Q	74.7	Confident	76.4	Confident	17 Å²	17	41.1 Å²	41.1	8%	0.079	25%	0.253	C	S	.	.			trans	-107.6	-62.8	175.5	172.6	177.6	-48.5	0	0	111.2	K296 S405 K407	K296-Q378 PolarHBondContact O-NE2 2.74Å; K296-Q378 PolarHBondContact O-OE1 3.25Å; K296-Q378 VanDerWaalsContact O-OE1 3.09Å; Q378-S405 WeakPolarHBondContact CB-OG 3.35Å; Q378-S405 PolarHBondContact N-O 3.39Å; Q378-K407 HydrophobicContact CB-CB 4.38Å; Q378-K407 HydrophobicContact CB-CD 4.15Å; Q378-K407 HydrophobicContact CB-CG 4.09Å; Q378-K407 HydrophobicContact CG-CD 4.41Å
379	D	76.8	Confident	78.1	Confident	56 Å²	56	36.1 Å²	36.1	30%	0.299	23%	0.234	S	C	.	.			trans	-101.8	129.1	179.7	-57.1	-51.3	0	0	0	109.6	R295 K404 S405	R295-D379 IonicContact CZ-OD1 3.92Å; R295-D379 IonicContact NH1-OD1 2.65Å; R295-D379 PolarHBondContact NH1-OD1 2.53Å; D379-K404 HydrophobicContact CB-CB 4.38Å; D379-K404 PolarHBondContact O-N 2.85Å; D379-S405 WeakPolarHBondContact CB-OG 3.03Å; D379-S405 PolarHBondContact N-OG 3.35Å; D379-S405 PolarHBondContact O-N 3.35Å; D379-S405 PolarHBondContact OD2-OG 3.09Å
380	L	83	Confident	79.8	Confident	37 Å²	37	34.2 Å²	34.2	19%	0.194	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.7	-175.2	-63.6	156.7	0	0	0	108.9	P377 N400 I402 V403	P377-L380 HydrophobicContact CB-CD1 4.39Å; P377-L380 HydrophobicContact CB-CD2 3.85Å; P377-L380 HydrophobicContact CB-CG 4.26Å; L380-N400 HydrophobicContact CB-CB 4.01Å; L380-N400 HydrophobicContact CD1-CB 3.87Å; L380-N400 HydrophobicContact CG-CB 4.49Å; L380-I402 CarbonylContact C-O 3.53Å; L380-I402 WeakPolarHBondContact CA-O 3.22Å; L380-V403 HydrophobicContact CD2-CB 4.17Å; L380-V403 HydrophobicContact CD2-CG2 3.74Å
381	E	82.6	Confident	81.2	Confident	59 Å²	59	44.8 Å²	44.8	28%	0.276	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	148.2	176.1	-83.7	173.1	-173	0	0	111.2	M401 I402 K404	E381-M401 PolarHBondContact O-N 3.23Å; E381-I402 HydrophobicContact CB-CB 3.97Å; E381-I402 HydrophobicContact CB-CG2 4.33Å; E381-I402 PolarHBondContact N-O 2.89Å; E381-I402 PolarHBondContact O-N 2.85Å; E381-K404 HydrophobicContact CB-CG 4.3Å; E381-K404 VanDerWaalsContact CD-CD 3.43Å; E381-K404 HydrophobicContact CG-CD 4.2Å; E381-K404 HydrophobicContact CG-CG 3.73Å; E381-K404 WeakPolarHBondContact OE1-CD 3.46Å; E381-K404 WeakPolarHBondContact OE1-CE 3.24Å; E381-K404 IonicContact OE1-NZ 2.81Å; E381-K404 PolarHBondContact OE1-NZ 2.53Å; E381-K404 WeakPolarHBondContact OE2-CD 3.13Å; E381-K404 IonicContact OE2-NZ 3.89Å; E381-K404 PolarHBondContact OE2-NZ 3.19Å
382	P	86.8	Confident	82.4	Confident	27 Å²	27	44.9 Å²	44.9	18%	0.175	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	158.9	173.5	32.1	-34.7	0	0	0	111.9	I78 Q397 L398	I78-P382 HydrophobicContact CG2-CG 3.92Å; P382-Q397 HydrophobicContact CB-CG 3.9Å; P382-Q397 VanDerWaalsContact CG-NE2 3.3Å; P382-L398 CarbonylContact C-O 3.46Å; P382-L398 WeakPolarHBondContact CA-O 3.27Å; P382-L398 WeakPolarHBondContact CB-O 3.41Å
383	L	90.2	Very high	83.8	Confident	14 Å²	14	44.8 Å²	44.8	7%	0.073	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.7	174.6	176.9	69.7	0	0	0	109.7	F321 P333 Y336 I385 L398 M401 I402	F321-L383 HydrophobicContact CZ-CD2 4.24Å; P333-L383 HydrophobicContact CG-CD1 4.1Å; Y336-L383 HydrophobicContact CD1-CD2 3.66Å; Y336-L383 HydrophobicContact CD2-CD1 4.27Å; Y336-L383 HydrophobicContact CD2-CD2 3.98Å; Y336-L383 HydrophobicContact CE1-CD2 3.68Å; Y336-L383 HydrophobicContact CE2-CD2 3.97Å; Y336-L383 HydrophobicContact CG-CD1 4.09Å; Y336-L383 HydrophobicContact CG-CD2 3.82Å; L383-I385 HydrophobicContact CD2-CG2 4Å; L383-I385 HydrophobicContact CG-CG2 4.05Å; L383-L398 PolarHBondContact N-O 3.12Å; L383-L398 WeakPolarHBondContact O-CB 3.13Å; L383-L398 PolarHBondContact O-N 2.77Å; L383-M401 HydrophobicContact CB-CB 3.71Å; L383-M401 HydrophobicContact CB-CG 3.97Å; L383-I402 HydrophobicContact CD1-CD1 4.46Å
384	T	91.4	Very high	84.6	Confident	10 Å²	10	46.2 Å²	46.2	6%	0.061	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135.1	170.5	-51.7	0	0	0	0	110	Y71 I78 I103 P333 V395 E396	Y71-T384 HydrophobicContact CD2-CG2 3.98Å; Y71-T384 HydrophobicContact CE2-CG2 4.12Å; I78-T384 WeakPolarHBondContact CD1-OG1 3.48Å; I103-T384 HydrophobicContact CD1-CG2 4.13Å; P333-T384 WeakPolarHBondContact CD-O 3.5Å; T384-V395 HydrophobicContact CG2-CG1 3.74Å; T384-E396 WeakPolarHBondContact CA-O 3.4Å
385	I	92.8	Very high	85.3	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	152.6	175.6	64.6	162.2	0	0	0	111.3	L49 E332 L383 Y387 V395 E396 L398	L49-I385 HydrophobicContact CD1-CD1 3.92Å; L49-I385 HydrophobicContact CD2-CD1 4.22Å; E332-I385 CarbonylContact O-C 3.45Å; E332-I385 WeakPolarHBondContact O-CA 3.39Å; L383-I385 HydrophobicContact CD2-CG2 4Å; L383-I385 HydrophobicContact CG-CG2 4.05Å; I385-Y387 HydrophobicContact CD1-CD1 4.01Å; I385-Y387 HydrophobicContact CD1-CE1 4.3Å; I385-Y387 HydrophobicContact CG1-CD1 4.38Å; I385-V395 WeakPolarHBondContact O-CA 3.09Å; I385-E396 PolarHBondContact N-O 3.17Å; I385-E396 PolarHBondContact O-N 2.68Å; I385-L398 HydrophobicContact CD1-CD1 3.99Å; I385-L398 HydrophobicContact CD1-CD2 4.33Å; I385-L398 HydrophobicContact CD1-CG 4.21Å; I385-L398 HydrophobicContact CG1-CD1 4.28Å; I385-L398 HydrophobicContact CG1-CG 4.19Å; I385-L398 HydrophobicContact CG2-CD1 4.01Å; I385-L398 HydrophobicContact CG2-CG 4.49Å
386	L	92.5	Very high	85.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.3	172	167.3	62.5	0	0	0	109.9	V63 V67 Y71 H331 E332 P393 K394 V395	V63-L386 HydrophobicContact CB-CD2 4.35Å; V63-L386 HydrophobicContact CG1-CD2 3.54Å; V63-L386 HydrophobicContact CG2-CD2 3.93Å; V67-L386 HydrophobicContact CG1-CD1 3.35Å; V67-L386 HydrophobicContact CG1-CD2 3.89Å; V67-L386 HydrophobicContact CG1-CG 4.28Å; Y71-L386 HydrophobicContact CD2-CB 4.15Å; H331-L386 HydrophobicContact CB-CD2 4.39Å; H331-L386 HydrophobicContact CB-CG 4.31Å; H331-L386 PolarHBondContact N-O 3.14Å; E332-L386 HydrophobicContact CB-CB 4.23Å; E332-L386 PolarHBondContact N-O 2.89Å; E332-L386 PolarHBondContact O-N 2.81Å; L386-P393 HydrophobicContact CD1-CB 4.45Å; L386-K394 WeakPolarHBondContact CA-O 3.07Å; L386-K394 WeakPolarHBondContact CD1-O 2.99Å; L386-V395 HydrophobicContact CD1-CG2 3.84Å
387	Y	91.4	Very high	86.1	Confident	6 Å²	6	40.5 Å²	40.5	2%	0.024	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	175.6	175.5	71.2	-76.5	0	0	0	111.9	L49 P55 W329 I385 V389 K394 E396	L49-Y387 HydrophobicContact CD2-CE1 4.08Å; P55-Y387 HydrophobicContact CG-CD2 4.38Å; W329-Y387 AromaticContact CE3-CD2 3.91Å; W329-Y387 HydrophobicContact CE3-CD2 3.91Å; W329-Y387 AromaticContact CE3-CG 3.96Å; W329-Y387 HydrophobicContact CE3-CG 3.96Å; W329-Y387 HydrophobicContact CZ3-CD1 4.26Å; W329-Y387 AromaticContact CZ3-CD2 3.69Å; W329-Y387 HydrophobicContact CZ3-CD2 3.69Å; W329-Y387 HydrophobicContact CZ3-CE2 4.34Å; W329-Y387 AromaticContact CZ3-CG 3.63Å; W329-Y387 HydrophobicContact CZ3-CG 3.63Å; W329-Y387 WeakPolarHBondContact O-CB 3.17Å; I385-Y387 HydrophobicContact CD1-CD1 4.01Å; I385-Y387 HydrophobicContact CD1-CE1 4.3Å; I385-Y387 HydrophobicContact CG1-CD1 4.38Å; Y387-V389 HydrophobicContact CD2-CG2 4.05Å; Y387-V389 HydrophobicContact CE2-CG2 3.4Å; Y387-V389 VanDerWaalsContact CE2-CG2 3.4Å; Y387-K394 HydrophobicContact CD1-CB 4.22Å; Y387-K394 HydrophobicContact CE1-CB 3.83Å; Y387-K394 HydrophobicContact CE2-CB 4.42Å; Y387-K394 PolarHBondContact N-O 2.81Å; Y387-K394 PolarHBondContact O-N 2.95Å; Y387-E396 HydrophobicContact CE1-CB 4.47Å; Y387-E396 HydrophobicContact CE1-CG 4.18Å; Y387-E396 PolarHBondContact OH-OE1 2.77Å; Y387-E396 VanDerWaalsContact OH-OE1 3.05Å
388	Y	86.6	Confident	86.3	Confident	6 Å²	6	37.8 Å²	37.8	2%	0.024	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.6	177.2	-76.8	-101.5	0	0	0	111.6	P60 V63 P64 H331 P393	P60-Y388 HydrophobicContact CG-CE1 3.93Å; P60-Y388 HydrophobicContact CG-CE2 4.22Å; V63-Y388 HydrophobicContact CG2-CE2 4.46Å; P64-Y388 WeakPolarHBondContact CD-OH 3.42Å; H331-Y388 AromaticContact CE1-CD2 3.42Å; H331-Y388 VanDerWaalsContact CE1-CD2 3.42Å; H331-Y388 WeakPolarHBondContact CE1-CD2 3.06Å; H331-Y388 AromaticContact CE1-CE2 3.96Å; H331-Y388 AromaticContact ND1-CD2 3.62Å; Y388-P393 HydrophobicContact CD1-CB 4.26Å; Y388-P393 HydrophobicContact CE1-CB 3.71Å; Y388-P393 HydrophobicContact CE1-CG 4.29Å; Y388-P393 HydrophobicContact CE2-CB 4.45Å
389	V	84.7	Confident	86.6	Confident	66 Å²	66	37 Å²	37	40%	0.4	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	107.2	163.5	-176.5	0	0	0	0	106.7	Y387 R391 T392 K394	Y387-V389 HydrophobicContact CD2-CG2 4.05Å; Y387-V389 HydrophobicContact CE2-CG2 3.4Å; Y387-V389 VanDerWaalsContact CE2-CG2 3.4Å; V389-R391 PolarHBondContact O-N 3.04Å; V389-R391 VanDerWaalsContact O-N 3.14Å; V389-T392 PolarHBondContact N-O 3.01Å; V389-T392 VanDerWaalsContact N-O 3.07Å; V389-T392 PolarHBondContact O-N 2.7Å; V389-T392 PolarHBondContact O-OG1 2.79Å; V389-K394 HydrophobicContact CG2-CG 4.34Å
390	G	84.3	Confident	86.8	Confident	34 Å²	34	35.9 Å²	35.9	35%	0.351	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	-114.7	-170.4	0	0	0	0	0	111.7	T57	T57-G390 WeakPolarHBondContact OG1-CA 3.39Å; T57-G390 PolarHBondContact OG1-N 3.46Å
391	R	81.5	Confident	87	Confident	244 Å²	244	34.1 Å²	34.1	92%	0.921	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-4	176	-67.1	-172.7	178.8	132.1	0	113.8	V389	V389-R391 PolarHBondContact O-N 3.04Å; V389-R391 VanDerWaalsContact O-N 3.14Å
392	T	83.7	Confident	87.3	Confident	78 Å²	78	32.7 Å²	32.7	48%	0.479	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	120.8	-177.5	54.9	0	0	0	0	110.6	V389	V389-T392 PolarHBondContact N-O 3.01Å; V389-T392 VanDerWaalsContact N-O 3.07Å; V389-T392 PolarHBondContact O-N 2.7Å; V389-T392 PolarHBondContact O-OG1 2.79Å
393	P	88.9	Confident	87.3	Confident	55 Å²	55	31.5 Å²	31.5	36%	0.357	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	139.9	171.3	28.4	-32	0	0	0	110.3	V67 L386 Y388	V67-P393 HydrophobicContact CB-CB 4.44Å; V67-P393 HydrophobicContact CG1-CB 3.76Å; V67-P393 HydrophobicContact CG1-CG 4.46Å; V67-P393 HydrophobicContact CG2-CB 3.8Å; V67-P393 HydrophobicContact CG2-CG 3.65Å; L386-P393 HydrophobicContact CD1-CB 4.45Å; Y388-P393 HydrophobicContact CD1-CB 4.26Å; Y388-P393 HydrophobicContact CE1-CB 3.71Å; Y388-P393 HydrophobicContact CE1-CG 4.29Å; Y388-P393 HydrophobicContact CE2-CB 4.45Å
394	K	88.1	Confident	87.1	Confident	58 Å²	58	33 Å²	33	25%	0.252	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122.4	177.5	-70	-70.9	-172.6	166.5	0	109.4	E102 L386 Y387 V389	E102-K394 IonicContact OE1-NZ 3.95Å; E102-K394 PolarHBondContact OE1-NZ 2.84Å; E102-K394 IonicContact OE2-NZ 3.44Å; L386-K394 WeakPolarHBondContact CA-O 3.07Å; L386-K394 WeakPolarHBondContact CD1-O 2.99Å; Y387-K394 HydrophobicContact CD1-CB 4.22Å; Y387-K394 HydrophobicContact CE1-CB 3.83Å; Y387-K394 HydrophobicContact CE2-CB 4.42Å; Y387-K394 PolarHBondContact N-O 2.81Å; Y387-K394 PolarHBondContact O-N 2.95Å; V389-K394 HydrophobicContact CG2-CG 4.34Å
395	V	90.4	Very high	86.6	Confident	8 Å²	8	32.6 Å²	32.6	5%	0.048	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	115.9	169.6	-177	0	0	0	0	106.9	V67 L70 I103 T384 I385 L386	V67-V395 HydrophobicContact CG1-CG2 4.21Å; L70-V395 HydrophobicContact CB-CG2 4.49Å; L70-V395 HydrophobicContact CD2-CB 4.07Å; L70-V395 HydrophobicContact CD2-CG2 3.82Å; L70-V395 HydrophobicContact CG-CB 4.3Å; L70-V395 HydrophobicContact CG-CG1 4.48Å; L70-V395 HydrophobicContact CG-CG2 4.04Å; I103-V395 HydrophobicContact CB-CG1 4.44Å; I103-V395 HydrophobicContact CD1-CG1 4.02Å; I103-V395 PolarHBondContact N-O 2.71Å; T384-V395 HydrophobicContact CG2-CG1 3.74Å; I385-V395 WeakPolarHBondContact O-CA 3.09Å; L386-V395 HydrophobicContact CD1-CG2 3.84Å
396	E	88.4	Confident	86	Confident	3 Å²	3	32.9 Å²	32.9	1%	0.014	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	144.5	-178.6	-67.5	-164	-161.2	0	0	111.3	L49 A100 K101 E102 R285 T384 I385 Y387	L49-E396 HydrophobicContact CD2-CB 4.35Å; L49-E396 WeakPolarHBondContact CD2-OE2 3.05Å; A100-E396 HydrophobicContact CB-CB 4.33Å; A100-E396 VanDerWaalsContact CB-OE2 3.29Å; A100-E396 WeakPolarHBondContact CB-OE2 3.24Å; K101-E396 CarbonylContact O-C 3.55Å; K101-E396 VanDerWaalsContact O-CA 3.24Å; K101-E396 WeakPolarHBondContact O-CA 3.37Å; E102-E396 HydrophobicContact CG-CG 4.16Å; R285-E396 IonicContact CZ-OE2 3.5Å; R285-E396 IonicContact NH1-OE2 2.86Å; R285-E396 PolarHBondContact NH1-OE2 2.8Å; R285-E396 IonicContact NH2-OE1 2.77Å; R285-E396 IonicContact NH2-OE2 3.76Å; R285-E396 PolarHBondContact NH2-OE2 3.32Å; R285-E396 VanDerWaalsContact NH2-OE2 3.12Å; T384-E396 WeakPolarHBondContact CA-O 3.4Å; I385-E396 PolarHBondContact N-O 3.17Å; I385-E396 PolarHBondContact O-N 2.68Å; Y387-E396 HydrophobicContact CE1-CB 4.47Å; Y387-E396 HydrophobicContact CE1-CG 4.18Å; Y387-E396 PolarHBondContact OH-OE1 2.77Å; Y387-E396 VanDerWaalsContact OH-OE1 3.05Å
397	Q	87.2	Confident	85.2	Confident	16 Å²	16	36.7 Å²	36.7	8%	0.075	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	111.4	174.7	-172.3	-172.4	17	0	0	110.4	I78 A100 K101 I103 P382	I78-Q397 HydrophobicContact CD1-CG 3.91Å; I78-Q397 VanDerWaalsContact CD1-NE2 3.35Å; A100-Q397 WeakPolarHBondContact CA-O 3.43Å; K101-Q397 PolarHBondContact N-O 2.82Å; K101-Q397 PolarHBondContact O-N 2.86Å; I103-Q397 HydrophobicContact CD1-CB 4.22Å; P382-Q397 HydrophobicContact CB-CG 3.9Å; P382-Q397 VanDerWaalsContact CG-NE2 3.3Å
398	L	85.9	Confident	84.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	125.3	173.9	-55	179.9	0	0	0	110.1	I45 K48 L49 A100 P382 L383 I385 M401	I45-L398 HydrophobicContact CB-CD1 4.4Å; I45-L398 HydrophobicContact CG1-CD1 3.88Å; I45-L398 HydrophobicContact CG2-CD1 4.07Å; K48-L398 HydrophobicContact CB-CD2 4.07Å; K48-L398 HydrophobicContact CD-CB 4.45Å; L49-L398 HydrophobicContact CD2-CD2 3.68Å; L49-L398 HydrophobicContact CG-CD2 3.95Å; A100-L398 HydrophobicContact CB-CD2 3.69Å; P382-L398 CarbonylContact C-O 3.46Å; P382-L398 WeakPolarHBondContact CA-O 3.27Å; P382-L398 WeakPolarHBondContact CB-O 3.41Å; L383-L398 PolarHBondContact N-O 3.12Å; L383-L398 WeakPolarHBondContact O-CB 3.13Å; L383-L398 PolarHBondContact O-N 2.77Å; I385-L398 HydrophobicContact CD1-CD1 3.99Å; I385-L398 HydrophobicContact CD1-CD2 4.33Å; I385-L398 HydrophobicContact CD1-CG 4.21Å; I385-L398 HydrophobicContact CG1-CD1 4.28Å; I385-L398 HydrophobicContact CG1-CG 4.19Å; I385-L398 HydrophobicContact CG2-CD1 4.01Å; I385-L398 HydrophobicContact CG2-CG 4.49Å; L398-M401 HydrophobicContact CB-CG 3.54Å; L398-M401 HydrophobicContact CB-SD 4.2Å; L398-M401 HydrophobicContact CD1-CG 4.25Å; L398-M401 HydrophobicContact CD1-SD 4.36Å
399	S	82.5	Confident	83.3	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	159.6	174.6	58.8	0	0	0	0	113.8	K48 E97 Y98 M401	K48-S399 WeakPolarHBondContact CE-O 2.94Å; K48-S399 PolarHBondContact NZ-O 3.04Å; K48-S399 PolarHBondContact NZ-OG 3.22Å; E97-S399 WeakPolarHBondContact O-CB 3.29Å; E97-S399 PolarHBondContact O-OG 2.94Å; Y98-S399 VanDerWaalsContact CA-OG 3.22Å; Y98-S399 WeakPolarHBondContact CA-OG 3.22Å; Y98-S399 PolarHBondContact O-OG 3.05Å; S399-M401 VanDerWaalsContact C-N 3.33Å; S399-M401 PolarHBondContact O-N 2.88Å
400	N	80.3	Confident	83.2	Confident	32 Å²	32	42.9 Å²	42.9	17%	0.171	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58	40.2	167.9	-63	-22.9	0	0	0	114.1	Q44 L380	Q44-N400 PolarHBondContact NE2-O 2.66Å; L380-N400 HydrophobicContact CB-CB 4.01Å; L380-N400 HydrophobicContact CD1-CB 3.87Å; L380-N400 HydrophobicContact CG-CB 4.49Å
401	M	87.2	Confident	83.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-30.6	-174.3	-67.4	-54.1	-56.9	0	0	113.2	I41 Q44 I45 K48 Y336 E381 L383 L398 S399	I41-M401 HydrophobicContact CG2-CE 4Å; Q44-M401 HydrophobicContact CG-SD 3.94Å; I45-M401 HydrophobicContact CD1-CE 3.96Å; I45-M401 HydrophobicContact CG1-CE 3.47Å; I45-M401 VanDerWaalsContact CG1-CE 3.47Å; I45-M401 HydrophobicContact CG1-SD 4.41Å; K48-M401 HydrophobicContact CD-SD 3.98Å; Y336-M401 HydrophobicContact CE2-CB 4.39Å; Y336-M401 VanDerWaalsContact OH-CE 3.3Å; Y336-M401 WeakPolarHBondContact OH-CE 3.27Å; E381-M401 PolarHBondContact O-N 3.23Å; L383-M401 HydrophobicContact CB-CB 3.71Å; L383-M401 HydrophobicContact CB-CG 3.97Å; L398-M401 HydrophobicContact CB-CG 3.54Å; L398-M401 HydrophobicContact CB-SD 4.2Å; L398-M401 HydrophobicContact CD1-CG 4.25Å; L398-M401 HydrophobicContact CD1-SD 4.36Å; S399-M401 VanDerWaalsContact C-N 3.33Å; S399-M401 PolarHBondContact O-N 2.88Å
402	I	89.4	Confident	83.3	Confident	30 Å²	30	32.2 Å²	32.2	15%	0.154	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.1	-174.7	-62.9	169.2	0	0	0	108.9	Y336 Y337 L380 E381 L383 K404	Y336-I402 HydrophobicContact CD2-CD1 4.35Å; Y336-I402 HydrophobicContact CD2-CG1 3.8Å; Y336-I402 HydrophobicContact CE2-CG1 4Å; Y337-I402 WeakPolarHBondContact O-CG2 3.23Å; L380-I402 CarbonylContact C-O 3.53Å; L380-I402 WeakPolarHBondContact CA-O 3.22Å; E381-I402 HydrophobicContact CB-CB 3.97Å; E381-I402 HydrophobicContact CB-CG2 4.33Å; E381-I402 PolarHBondContact N-O 2.89Å; E381-I402 PolarHBondContact O-N 2.85Å; L383-I402 HydrophobicContact CD1-CD1 4.46Å; I402-K404 HydrophobicContact CG2-CD 4.37Å
403	V	86.9	Confident	83.2	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.012	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	124.4	176.7	-174.3	0	0	0	0	110	V314 A338 N339 P377 L380	V314-V403 HydrophobicContact CG2-CB 4.42Å; V314-V403 HydrophobicContact CG2-CG1 4.09Å; A338-V403 PolarHBondContact O-N 3.12Å; N339-V403 HydrophobicContact CB-CB 4Å; N339-V403 PolarHBondContact ND2-O 3.45Å; P377-V403 HydrophobicContact CB-CG1 3.89Å; P377-V403 HydrophobicContact CB-CG2 4.24Å; L380-V403 HydrophobicContact CD2-CB 4.17Å; L380-V403 HydrophobicContact CD2-CG2 3.74Å
404	K	84.8	Confident	82.9	Confident	45 Å²	45	27.9 Å²	27.9	20%	0.196	15%	0.154	C	C	.	.			trans	-103.9	-47.9	174.6	-64	-67.8	-78.6	-129.4	0	112.5	T301 D379 E381 I402	T301-K404 HydrophobicContact CG2-CB 4.34Å; T301-K404 HydrophobicContact CG2-CD 4.01Å; T301-K404 WeakPolarHBondContact CG2-O 3.37Å; T301-K404 PolarHBondContact N-O 2.59Å; D379-K404 HydrophobicContact CB-CB 4.38Å; D379-K404 PolarHBondContact O-N 2.85Å; E381-K404 HydrophobicContact CB-CG 4.3Å; E381-K404 VanDerWaalsContact CD-CD 3.43Å; E381-K404 HydrophobicContact CG-CD 4.2Å; E381-K404 HydrophobicContact CG-CG 3.73Å; E381-K404 WeakPolarHBondContact OE1-CD 3.46Å; E381-K404 WeakPolarHBondContact OE1-CE 3.24Å; E381-K404 IonicContact OE1-NZ 2.81Å; E381-K404 PolarHBondContact OE1-NZ 2.53Å; E381-K404 WeakPolarHBondContact OE2-CD 3.13Å; E381-K404 IonicContact OE2-NZ 3.89Å; E381-K404 PolarHBondContact OE2-NZ 3.19Å; I402-K404 HydrophobicContact CG2-CD 4.37Å
405	S	80.5	Confident	82.5	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.007	15%	0.147	C	C	.	.			trans	-127.7	152.6	-180	68.6	0	0	0	0	111.6	L299 Q378 D379	L299-S405 WeakPolarHBondContact O-CA 3.49Å; L299-S405 WeakPolarHBondContact O-CB 3.08Å; Q378-S405 WeakPolarHBondContact CB-OG 3.35Å; Q378-S405 PolarHBondContact N-O 3.39Å; D379-S405 WeakPolarHBondContact CB-OG 3.03Å; D379-S405 PolarHBondContact N-OG 3.35Å; D379-S405 PolarHBondContact O-N 3.35Å; D379-S405 PolarHBondContact OD2-OG 3.09Å
406	C	81.4	Confident	82	Confident	6 Å²	6	27.2 Å²	27.2	4%	0.041	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	149.9	177.4	-61.2	0	0	0	0	109.9	A298 V314 C341 V376	A298-C406 WeakPolarHBondContact CB-O 3.29Å; V314-C406 VanDerWaalsContact CA-SG 3.56Å; C341-C406 WeakPolarHBondContact CA-SG 3.48Å; C341-C406 HydrophobicContact CB-CB 3.79Å; C341-C406 WeakPolarHBondContact CB-SG 3.48Å; C341-C406 WeakPolarHBondContact SG-CB 2.95Å; C341-C406 CovalentContact SG-SG 2.03Å; C341-C406 PolarHBondContact SG-SG 2.86Å; V376-C406 CarbonylContact O-C 3.59Å; V376-C406 WeakPolarHBondContact O-CA 3.42Å
407	K	74.8	Confident	81.5	Confident	80 Å²	80	29.1 Å²	29.1	35%	0.348	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	161.8	175.2	70.2	172.6	-178.5	175.4	0	111.1	A298 C375 V376 Q378	A298-K407 HydrophobicContact CB-CB 4.05Å; C375-K407 CarbonylContact C-O 3.5Å; C375-K407 WeakPolarHBondContact CA-O 3.3Å; V376-K407 HydrophobicContact CG2-CG 3.87Å; V376-K407 PolarHBondContact N-O 2.88Å; V376-K407 PolarHBondContact O-N 2.94Å; Q378-K407 HydrophobicContact CB-CB 4.38Å; Q378-K407 HydrophobicContact CB-CD 4.15Å; Q378-K407 HydrophobicContact CB-CG 4.09Å; Q378-K407 HydrophobicContact CG-CD 4.41Å
408	C	72.4	Confident	81	Confident	62 Å²	62	30.2 Å²	30.2	42%	0.419	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.7	167	-62.1	0	0	0	0	109.5	C312 C345 P373 C374	C312-C408 VanDerWaalsContact CB-SG 3.52Å; C345-C408 VanDerWaalsContact CA-SG 3.55Å; C345-C408 HydrophobicContact CB-CB 3.63Å; C345-C408 WeakPolarHBondContact CB-SG 3.33Å; C345-C408 WeakPolarHBondContact SG-CA 3.33Å; C345-C408 WeakPolarHBondContact SG-CB 3.41Å; C345-C408 CovalentContact SG-SG 2.03Å; C345-C408 PolarHBondContact SG-SG 2.73Å; P373-C408 HydrophobicContact CB-CB 4.33Å; C374-C408 WeakPolarHBondContact O-CA 3.29Å
409	S	65.7	Low	80.5	Confident	104 Å²	104	32.9 Å²	32.9	73%	0.727	19%	0.189	S	C	*	.			trans	-143.3	0	177.2	69.3	0	0	0	0	113.9	C374 V376	C374-S409 PolarHBondContact N-O 2.81Å; C374-S409 PolarHBondContact O-N 3.44Å; C374-S409 VanDerWaalsContact O-N 3.1Å; V376-S409 WeakPolarHBondContact CG2-OG 2.92Å

Retrieved 409 of 409 residues in 111.3 ms (Link to these results)

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