A0A087Y9X2_POEFO Loading...

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 A0A087Y9X2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 408 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	54.7	Low	54.6	Low	218 Å²	218	128.6 Å²	128.6	100%	1.074	67%	0.67	S	S	*	*				0	3.2	0	-112.6	151.1	68.9	0	0	115.3
2	N	55.5	Low	54.3	Low	135 Å²	135	126.9 Å²	126.9	72%	0.722	66%	0.662	S	S	*	*			trans	-112.5	-5.7	-173.6	-66.8	-16.8	0	0	0	115.4
3	L	51.8	Low	53.8	Low	146 Å²	146	123.8 Å²	123.8	76%	0.764	66%	0.657	S	S	*	*	H	α-helix	trans	-83.2	-36	177.7	-131.5	79.9	0	0	0	112.8	K5 A6 L7	L3-K5 PolarHBondContact O-N 3.47Å; L3-A6 PolarHBondContact O-N 3.32Å; L3-L7 PolarHBondContact O-N 2.87Å
4	G	54	Low	53.1	Low	52 Å²	52	123 Å²	123	54%	0.536	65%	0.653	S	S	.	*	H	α-helix	trans	-70.5	-29.5	180	0	0	0	0	0	114.1	L8	G4-L8 PolarHBondContact O-N 3.23Å
5	K	55.1	Low	52.5	Low	155 Å²	155	121.9 Å²	121.9	67%	0.674	66%	0.658	S	S	*	*	H	α-helix	trans	-74.6	-31.7	176.2	-73.5	-176.4	175.3	-179.4	0	112.5	L3 F9	L3-K5 PolarHBondContact O-N 3.47Å; K5-F9 PolarHBondContact O-N 3.12Å
6	A	55.2	Low	51.8	Low	53 Å²	53	121.2 Å²	121.2	44%	0.438	66%	0.658	S	S	.	*	H	α-helix	trans	-71.7	-38.3	176.8	0	0	0	0	0	112	L3 F9 F10	L3-A6 PolarHBondContact O-N 3.32Å; A6-F9 PolarHBondContact O-N 3.44Å; A6-F10 PolarHBondContact O-N 3.1Å
7	L	55.6	Low	51.2	Low	110 Å²	110	120.6 Å²	120.6	58%	0.576	66%	0.66	S	S	*	*	H	α-helix	trans	-67.5	-37.3	175.1	-107.7	109.3	0	0	0	112.8	L3 F10 L11	L3-L7 PolarHBondContact O-N 2.87Å; L7-F10 PolarHBondContact O-N 2.91Å; L7-L11 WeakPolarHBondContact O-CB 3.12Å; L7-L11 WeakPolarHBondContact O-CG 3.39Å; L7-L11 PolarHBondContact O-N 3.36Å
8	L	56.4	Low	50.5	Low	115 Å²	115	121.9 Å²	121.9	60%	0.602	66%	0.663	S	S	*	*	H	α-helix	trans	-66.9	-37.3	175.7	-118	112	0	0	0	112.1	G4 L11 L12	G4-L8 PolarHBondContact O-N 3.23Å; L8-L11 PolarHBondContact O-N 3.43Å; L8-L12 HydrophobicContact CD2-CD1 4.27Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 WeakPolarHBondContact O-CD1 3.38Å; L8-L12 WeakPolarHBondContact O-CG 3.38Å; L8-L12 PolarHBondContact O-N 3.41Å
9	F	56	Low	50	Low	163 Å²	163	122.1 Å²	122.1	72%	0.715	67%	0.668	S	S	*	*	H	α-helix	trans	-67.8	-37.4	174.8	-113.7	-87.8	0	0	0	112.3	K5 A6 S13	K5-F9 PolarHBondContact O-N 3.12Å; A6-F9 PolarHBondContact O-N 3.44Å; F9-S13 WeakPolarHBondContact O-CB 3.42Å; F9-S13 PolarHBondContact O-N 3.36Å
10	F	54.1	Low	49.4	Very low	152 Å²	152	125.1 Å²	125.1	67%	0.667	68%	0.675	S	S	*	*	H	α-helix	trans	-71.5	-33.7	175.2	-103.3	-82.5	0	0	0	113.3	A6 L7 N14	A6-F10 PolarHBondContact O-N 3.1Å; L7-F10 PolarHBondContact O-N 2.91Å; F10-N14 PolarHBondContact O-N 3.48Å; F10-N14 PolarHBondContact O-ND2 3.36Å
11	L	52.7	Low	48.8	Very low	116 Å²	116	123.8 Å²	123.8	61%	0.607	68%	0.675	S	S	*	*	H	α-helix	trans	-73.2	-35.8	174.3	-79.1	160.7	0	0	0	112.1	L7 L8 C15	L7-L11 WeakPolarHBondContact O-CB 3.12Å; L7-L11 WeakPolarHBondContact O-CG 3.39Å; L7-L11 PolarHBondContact O-N 3.36Å; L8-L11 PolarHBondContact O-N 3.43Å; L11-C15 PolarHBondContact O-N 3.13Å
12	L	50.8	Low	48	Very low	108 Å²	108	120.6 Å²	120.6	57%	0.565	66%	0.662	S	S	*	*	H	α-helix	trans	-73.5	-33.7	174	-75.2	163.6	0	0	0	112.6	L8 C15	L8-L12 HydrophobicContact CD2-CD1 4.27Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 WeakPolarHBondContact O-CD1 3.38Å; L8-L12 WeakPolarHBondContact O-CG 3.38Å; L8-L12 PolarHBondContact O-N 3.41Å; L12-C15 PolarHBondContact O-N 3.42Å
13	S	48.1	Very low	47	Very low	86 Å²	86	118.6 Å²	118.6	60%	0.601	66%	0.658	S	S	*	*	H	α-helix	trans	-68.1	-33.1	176.5	-167.6	0	0	0	0	112.6	F9 C15	F9-S13 WeakPolarHBondContact O-CB 3.42Å; F9-S13 PolarHBondContact O-N 3.36Å; S13-C15 VanDerWaalsContact C-N 3.3Å; S13-C15 PolarHBondContact O-N 3.35Å
14	N	43.4	Very low	46.2	Very low	113 Å²	113	117.4 Å²	117.4	60%	0.604	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-8.6	173.7	-77.9	-57.4	0	0	0	114.2	F10	F10-N14 PolarHBondContact O-N 3.48Å; F10-N14 PolarHBondContact O-ND2 3.36Å
15	C	43.9	Very low	45.5	Very low	107 Å²	107	119.9 Å²	119.9	72%	0.723	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	0.6	173.5	-84	0	0	0	0	113.6	L11 L12 S13	L11-C15 PolarHBondContact O-N 3.13Å; L12-C15 PolarHBondContact O-N 3.42Å; S13-C15 VanDerWaalsContact C-N 3.3Å; S13-C15 PolarHBondContact O-N 3.35Å
16	V	42.1	Very low	45	Very low	110 Å²	110	118.2 Å²	118.2	67%	0.667	67%	0.668	S	S	*	*			trans	-109.4	24.2	175.7	-167.7	0	0	0	0	111.6	M18	V16-M18 PolarHBondContact O-N 2.99Å
17	T	41.7	Very low	44.7	Very low	112 Å²	112	121.6 Å²	121.6	69%	0.687	68%	0.684	S	S	*	*			trans	-76.5	82.4	145.1	56.9	0	0	0	0	106.2	T19	T17-T19 PolarHBondContact O-N 2.86Å
18	M	37.8	Very low	44.9	Very low	143 Å²	143	120.7 Å²	120.7	70%	0.704	68%	0.682	S	S	*	*			trans	-42	112.4	154.3	-77.6	-78.9	-166.7	0	0	105.8	V16 F20	V16-M18 PolarHBondContact O-N 2.99Å; M18-F20 HydrophobicContact CB-CD2 4.35Å; M18-F20 HydrophobicContact CB-CE2 4.31Å; M18-F20 PolarHBondContact O-N 3.22Å
19	T	41.8	Very low	45.7	Very low	125 Å²	125	119.4 Å²	119.4	77%	0.767	68%	0.676	S	S	*	*			trans	-55.5	89.4	154	38.4	0	0	0	0	105.2	T17 S21	T17-T19 PolarHBondContact O-N 2.86Å; T19-S21 PolarHBondContact O-N 3.32Å
20	F	38	Very low	46.6	Very low	182 Å²	182	116.7 Å²	116.7	80%	0.798	67%	0.668	S	S	*	*			trans	-63.2	82.5	144	-72.3	-77.2	0	0	0	104	M18 L22	M18-F20 HydrophobicContact CB-CD2 4.35Å; M18-F20 HydrophobicContact CB-CE2 4.31Å; M18-F20 PolarHBondContact O-N 3.22Å; F20-L22 PolarHBondContact O-N 3.43Å
21	S	35.7	Very low	47.7	Very low	98 Å²	98	115.2 Å²	115.2	69%	0.685	67%	0.667	S	S	*	*			trans	-52.5	92.4	142.4	37.1	0	0	0	0	104.2	T19 S23	T19-S21 PolarHBondContact O-N 3.32Å; S21-S23 PolarHBondContact O-N 3.4Å
22	L	37.9	Very low	49.1	Very low	151 Å²	151	114.1 Å²	114.1	79%	0.791	66%	0.659	S	S	*	*			trans	-57.5	89.6	152.7	-84.6	152.6	0	0	0	103.4	F20 T24	F20-L22 PolarHBondContact O-N 3.43Å; L22-T24 PolarHBondContact O-N 2.91Å
23	S	35.3	Very low	50.5	Low	93 Å²	93	111 Å²	111	65%	0.65	64%	0.642	S	S	*	*			trans	-63.1	88.8	163.3	60.5	0	0	0	0	104.5	S21 C25	S21-S23 PolarHBondContact O-N 3.4Å; S23-C25 PolarHBondContact O-N 3.39Å
24	T	35.3	Very low	52.1	Low	122 Å²	122	109.8 Å²	109.8	75%	0.748	63%	0.626	S	S	*	*			trans	-70.6	48.2	157.4	48.5	0	0	0	0	108.5	L22 T26	L22-T24 PolarHBondContact O-N 2.91Å; T24-T26 PolarHBondContact O-N 2.63Å
25	C	39.7	Very low	54.2	Low	103 Å²	103	111.2 Å²	111.2	70%	0.696	63%	0.627	S	S	*	*			trans	-65.5	93.1	146.2	-79.2	0	0	0	0	103.4	S23 T27	S23-C25 PolarHBondContact O-N 3.39Å; C25-T27 PolarHBondContact O-N 3.37Å
26	T	44.6	Very low	56.2	Low	121 Å²	121	112.4 Å²	112.4	74%	0.742	62%	0.62	S	S	*	*			trans	-55.6	92.7	164	51.1	0	0	0	0	105.4	T24 V28	T24-T26 PolarHBondContact O-N 2.63Å; T26-V28 VanDerWaalsContact C-N 3.3Å; T26-V28 PolarHBondContact O-N 3.37Å
27	T	48.8	Very low	58.3	Low	124 Å²	124	109.3 Å²	109.3	76%	0.761	60%	0.596	S	S	*	*			trans	-55	110.8	158.9	45.6	0	0	0	0	102.9	C25 D29	C25-T27 PolarHBondContact O-N 3.37Å; T27-D29 VanDerWaalsContact C-N 3.32Å; T27-D29 PolarHBondContact O-N 3.4Å
28	V	59.3	Low	60.4	Low	90 Å²	90	104.3 Å²	104.3	55%	0.545	57%	0.565	S	S	.	*			trans	-53.3	107.9	173.8	171.9	0	0	0	0	104.8	T26 I30 I33	T26-V28 VanDerWaalsContact C-N 3.3Å; T26-V28 PolarHBondContact O-N 3.37Å; V28-I30 VanDerWaalsContact C-N 3.32Å; V28-I30 WeakPolarHBondContact O-CG1 3.43Å; V28-I30 PolarHBondContact O-N 2.91Å; V28-I33 HydrophobicContact CG1-CD1 3.2Å; V28-I33 HydrophobicContact CG1-CG1 4.19Å
29	D	72.4	Confident	62.8	Low	89 Å²	89	101.9 Å²	101.9	48%	0.476	55%	0.552	S	S	.	*			trans	-64	97.7	-172.7	179.4	-2.6	0	0	0	107.7	T27 D31 H32 I33	T27-D29 VanDerWaalsContact C-N 3.32Å; T27-D29 PolarHBondContact O-N 3.4Å; D29-D31 PolarHBondContact O-N 2.94Å; D29-D31 WeakPolarHBondContact OD1-CB 3.5Å; D29-D31 PolarHBondContact OD1-N 2.96Å; D29-H32 HydrophobicContact CB-CB 3.83Å; D29-H32 WeakPolarHBondContact O-CB 3.29Å; D29-H32 PolarHBondContact O-N 3.41Å; D29-H32 VanDerWaalsContact O-N 3.08Å; D29-H32 PolarHBondContact OD1-N 2.66Å; D29-H32 WeakPolarHBondContact OD2-CB 3.14Å; D29-I33 PolarHBondContact O-N 3.04Å
30	I	74.8	Confident	64.9	Low	106 Å²	106	98.3 Å²	98.3	54%	0.544	54%	0.535	S	S	.	.	H	α-helix	trans	-59.1	-33.3	-176.6	-60.5	177.5	0	0	0	108.9	V28 I33 K34	V28-I30 VanDerWaalsContact C-N 3.32Å; V28-I30 WeakPolarHBondContact O-CG1 3.43Å; V28-I30 PolarHBondContact O-N 2.91Å; I30-I33 PolarHBondContact O-N 3.05Å; I30-K34 WeakPolarHBondContact O-CB 3.09Å; I30-K34 PolarHBondContact O-N 3.1Å
31	D	77.9	Confident	67.2	Low	121 Å²	121	89.6 Å²	89.6	65%	0.647	50%	0.497	S	S	*	.	H	α-helix	trans	-70.8	-38.3	178.8	-66.8	-30.9	0	0	0	111.3	D29 K34 K35	D29-D31 PolarHBondContact O-N 2.94Å; D29-D31 WeakPolarHBondContact OD1-CB 3.5Å; D29-D31 PolarHBondContact OD1-N 2.96Å; D31-K34 PolarHBondContact O-N 2.65Å; D31-K35 VanDerWaalsContact O-CB 3.31Å; D31-K35 WeakPolarHBondContact O-CB 3.25Å; D31-K35 PolarHBondContact O-N 2.99Å
32	H	82.4	Confident	69.6	Low	93 Å²	93	88.3 Å²	88.3	43%	0.431	48%	0.477	S	S	.	.	H	α-helix	trans	-65.5	-42.6	172.9	-173.7	55.9	0	0	0	112.6	D29 K35 K36	D29-H32 HydrophobicContact CB-CB 3.83Å; D29-H32 WeakPolarHBondContact O-CB 3.29Å; D29-H32 PolarHBondContact O-N 3.41Å; D29-H32 VanDerWaalsContact O-N 3.08Å; D29-H32 PolarHBondContact OD1-N 2.66Å; D29-H32 WeakPolarHBondContact OD2-CB 3.14Å; H32-K35 PolarHBondContact O-N 3.29Å; H32-K36 WeakPolarHBondContact NE2-CE 3.39Å; H32-K36 WeakPolarHBondContact O-CG 3.4Å; H32-K36 PolarHBondContact O-N 2.82Å
33	I	80.3	Confident	71.8	Confident	41 Å²	41	83.1 Å²	83.1	21%	0.21	46%	0.46	C	S	.	.	H	α-helix	trans	-64.4	-45.2	174.9	-67.1	-172.3	0	0	0	110.7	V28 D29 I30 K35 K36 R37 Y339	V28-I33 HydrophobicContact CG1-CD1 3.2Å; V28-I33 HydrophobicContact CG1-CG1 4.19Å; D29-I33 PolarHBondContact O-N 3.04Å; I30-I33 PolarHBondContact O-N 3.05Å; I33-K35 VanDerWaalsContact C-N 3.32Å; I33-K35 PolarHBondContact O-N 3.35Å; I33-K36 PolarHBondContact O-N 3Å; I33-R37 WeakPolarHBondContact O-CB 3.16Å; I33-R37 PolarHBondContact O-N 3.26Å; I33-Y339 HydrophobicContact CD1-CE2 4.36Å; I33-Y339 HydrophobicContact CG2-CD2 3.71Å; I33-Y339 HydrophobicContact CG2-CE2 3.6Å; I33-Y339 HydrophobicContact CG2-CG 4.3Å
34	K	81.9	Confident	74.1	Confident	61 Å²	61	80.5 Å²	80.5	27%	0.265	44%	0.438	S	S	.	.	H	α-helix	trans	-56.1	-48.9	175.8	176	172.7	-177.4	-162.3	0	110.1	I30 D31 K36 R37 V38 L316 D323	I30-K34 WeakPolarHBondContact O-CB 3.09Å; I30-K34 PolarHBondContact O-N 3.1Å; D31-K34 PolarHBondContact O-N 2.65Å; K34-K36 PolarHBondContact O-N 3.11Å; K34-R37 PolarHBondContact O-N 3.05Å; K34-V38 HydrophobicContact CG-CG2 4.25Å; K34-V38 WeakPolarHBondContact O-CB 3.39Å; K34-V38 VanDerWaalsContact O-CG2 3.22Å; K34-V38 WeakPolarHBondContact O-CG2 3.32Å; K34-V38 PolarHBondContact O-N 2.96Å; K34-L316 HydrophobicContact CB-CD1 4.1Å; K34-L316 HydrophobicContact CD-CD1 4.01Å; K34-L316 HydrophobicContact CG-CD1 3.86Å; K34-D323 WeakPolarHBondContact CE-OD1 3.37Å; K34-D323 IonicContact NZ-OD1 2.68Å; K34-D323 PolarHBondContact NZ-OD1 3.15Å; K34-D323 IonicContact NZ-OD2 3.53Å
35	K	85.9	Confident	76.5	Confident	144 Å²	144	74.7 Å²	74.7	63%	0.626	40%	0.402	S	S	*	.	H	α-helix	trans	-59	-46.6	178.4	-171	175.3	-178.2	177.4	0	112.2	D31 H32 I33 R37 V38 E39	D31-K35 VanDerWaalsContact O-CB 3.31Å; D31-K35 WeakPolarHBondContact O-CB 3.25Å; D31-K35 PolarHBondContact O-N 2.99Å; H32-K35 PolarHBondContact O-N 3.29Å; I33-K35 VanDerWaalsContact C-N 3.32Å; I33-K35 PolarHBondContact O-N 3.35Å; K35-R37 PolarHBondContact O-N 3.04Å; K35-V38 PolarHBondContact O-N 3.26Å; K35-E39 PolarHBondContact O-N 3.31Å
36	K	86.1	Confident	78.6	Confident	132 Å²	132	70.8 Å²	70.8	57%	0.574	37%	0.374	S	S	*	.	H	α-helix	trans	-59.8	-43.6	175.5	-76	-178.1	176.4	179.5	0	112.3	H32 I33 K34 E39 A40	H32-K36 WeakPolarHBondContact NE2-CE 3.39Å; H32-K36 WeakPolarHBondContact O-CG 3.4Å; H32-K36 PolarHBondContact O-N 2.82Å; I33-K36 PolarHBondContact O-N 3Å; K34-K36 PolarHBondContact O-N 3.11Å; K36-E39 PolarHBondContact O-N 2.94Å; K36-A40 WeakPolarHBondContact O-CB 3.4Å; K36-A40 PolarHBondContact O-N 3.06Å
37	R	85.9	Confident	80.4	Confident	45 Å²	45	68 Å²	68	17%	0.17	36%	0.359	C	S	.	.	H	α-helix	trans	-67.7	-39.6	179.5	-174.2	59	171.5	150.4	7.2	111.7	I33 K34 K35 A40 V41 L316 I318 N338	I33-R37 WeakPolarHBondContact O-CB 3.16Å; I33-R37 PolarHBondContact O-N 3.26Å; K34-R37 PolarHBondContact O-N 3.05Å; K35-R37 PolarHBondContact O-N 3.04Å; R37-A40 PolarHBondContact O-N 3.05Å; R37-V41 WeakPolarHBondContact O-CB 3.01Å; R37-V41 WeakPolarHBondContact O-CG2 3.32Å; R37-V41 PolarHBondContact O-N 3.49Å; R37-L316 HydrophobicContact CB-CD2 3.88Å; R37-L316 HydrophobicContact CG-CD2 3.69Å; R37-I318 HydrophobicContact CG-CD1 4.35Å; R37-N338 PolarHBondContact NE-O 3.03Å
38	V	87.2	Confident	81.9	Confident	7 Å²	7	62 Å²	62	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-60.4	-46.3	175.3	168.8	0	0	0	0	110.9	K34 K35 A40 V41 R42 I318 D323 L324	K34-V38 HydrophobicContact CG-CG2 4.25Å; K34-V38 WeakPolarHBondContact O-CB 3.39Å; K34-V38 VanDerWaalsContact O-CG2 3.22Å; K34-V38 WeakPolarHBondContact O-CG2 3.32Å; K34-V38 PolarHBondContact O-N 2.96Å; K35-V38 PolarHBondContact O-N 3.26Å; V38-A40 PolarHBondContact O-N 3.42Å; V38-V41 PolarHBondContact O-N 3.19Å; V38-R42 PolarHBondContact O-N 3.2Å; V38-I318 HydrophobicContact CG2-CD1 4.13Å; V38-I318 HydrophobicContact CG2-CG1 4.24Å; V38-I318 HydrophobicContact CG2-CG2 4.29Å; V38-D323 HydrophobicContact CG1-CB 4.3Å; V38-D323 HydrophobicContact CG2-CB 4.06Å; V38-L324 HydrophobicContact CG1-CD2 3.64Å; V38-L324 HydrophobicContact CG1-CG 3.96Å
39	E	86.9	Confident	83	Confident	91 Å²	91	58 Å²	58	43%	0.425	30%	0.299	S	S	.	.	H	α-helix	trans	-65.4	-38	176.2	-67.1	-56.8	152.9	0	0	112.6	K35 K36 R42 G43	K35-E39 PolarHBondContact O-N 3.31Å; K36-E39 PolarHBondContact O-N 2.94Å; E39-R42 WeakPolarHBondContact O-CB 3.45Å; E39-R42 PolarHBondContact O-N 2.99Å; E39-R42 IonicContact OE1-CZ 3.71Å; E39-R42 IonicContact OE1-NH1 2.71Å; E39-R42 PolarHBondContact OE1-NH1 3.32Å; E39-R42 IonicContact OE2-CZ 3.71Å; E39-R42 IonicContact OE2-NH1 2.76Å; E39-R42 PolarHBondContact OE2-NH1 2.83Å; E39-G43 PolarHBondContact O-N 3.09Å; E39-G43 VanDerWaalsContact O-N 3.1Å
40	A	85.9	Confident	83.3	Confident	50 Å²	50	58.7 Å²	58.7	41%	0.413	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-43.9	173.9	0	0	0	0	0	111.8	K36 R37 V38 R42 G43 Q44	K36-A40 WeakPolarHBondContact O-CB 3.4Å; K36-A40 PolarHBondContact O-N 3.06Å; R37-A40 PolarHBondContact O-N 3.05Å; V38-A40 PolarHBondContact O-N 3.42Å; A40-R42 VanDerWaalsContact C-N 3.34Å; A40-G43 PolarHBondContact O-N 2.92Å; A40-Q44 VanDerWaalsContact O-CB 3.24Å; A40-Q44 WeakPolarHBondContact O-CB 3.25Å; A40-Q44 PolarHBondContact O-N 2.84Å
41	V	86.6	Confident	83.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-40.7	176.2	165.8	0	0	0	0	111	R37 V38 G43 Q44 I45 I318 L324 Y335 M400	R37-V41 WeakPolarHBondContact O-CB 3.01Å; R37-V41 WeakPolarHBondContact O-CG2 3.32Å; R37-V41 PolarHBondContact O-N 3.49Å; V38-V41 PolarHBondContact O-N 3.19Å; V41-G43 PolarHBondContact O-N 3.43Å; V41-Q44 PolarHBondContact O-N 3.16Å; V41-I45 HydrophobicContact CG1-CD1 3.64Å; V41-I45 HydrophobicContact CG1-CG1 4.28Å; V41-I45 WeakPolarHBondContact O-CG1 3.32Å; V41-I45 PolarHBondContact O-N 3.26Å; V41-I318 HydrophobicContact CB-CD1 4.33Å; V41-I318 HydrophobicContact CG2-CD1 3.86Å; V41-L324 HydrophobicContact CG1-CD1 4.32Å; V41-Y335 HydrophobicContact CG1-CE1 4.43Å; V41-Y335 VanDerWaalsContact CG1-OH 3.25Å; V41-Y335 WeakPolarHBondContact CG1-OH 3.49Å; V41-Y335 WeakPolarHBondContact CG2-OH 2.95Å; V41-M400 HydrophobicContact CG1-CE 4.1Å
42	R	86.4	Confident	83.7	Confident	70 Å²	70	57 Å²	57	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-54.4	-55	174.8	-174.7	178.7	-83.6	150.9	-3.4	111.2	V38 E39 A40 Q44 L46 L324 W326	V38-R42 PolarHBondContact O-N 3.2Å; E39-R42 WeakPolarHBondContact O-CB 3.45Å; E39-R42 PolarHBondContact O-N 2.99Å; E39-R42 IonicContact OE1-CZ 3.71Å; E39-R42 IonicContact OE1-NH1 2.71Å; E39-R42 PolarHBondContact OE1-NH1 3.32Å; E39-R42 IonicContact OE2-CZ 3.71Å; E39-R42 IonicContact OE2-NH1 2.76Å; E39-R42 PolarHBondContact OE2-NH1 2.83Å; A40-R42 VanDerWaalsContact C-N 3.34Å; R42-Q44 VanDerWaalsContact C-N 3.34Å; R42-Q44 PolarHBondContact O-N 3.01Å; R42-L46 HydrophobicContact CG-CD1 4.47Å; R42-L46 WeakPolarHBondContact O-CG 3.37Å; R42-L46 PolarHBondContact O-N 3.12Å; R42-L324 HydrophobicContact CB-CD2 3.62Å; R42-L324 HydrophobicContact CG-CD2 4.14Å; R42-L324 PolarHBondContact NH2-O 2.63Å; R42-W326 HydrophobicContact CB-CZ2 4.37Å; R42-W326 HydrophobicContact CG-CH2 4.14Å; R42-W326 HydrophobicContact CG-CZ2 3.56Å
43	G	83.4	Confident	83.8	Confident	42 Å²	42	55.9 Å²	55.9	43%	0.433	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-38.8	179	0	0	0	0	0	112.6	E39 A40 V41 S47	E39-G43 PolarHBondContact O-N 3.09Å; E39-G43 VanDerWaalsContact O-N 3.1Å; A40-G43 PolarHBondContact O-N 2.92Å; V41-G43 PolarHBondContact O-N 3.43Å; G43-S47 WeakPolarHBondContact O-CB 3.47Å; G43-S47 PolarHBondContact O-N 3Å
44	Q	84.1	Confident	83.9	Confident	38 Å²	38	56.1 Å²	56.1	18%	0.178	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-44.8	-179.7	-173.1	176.9	4.9	0	0	112.5	A40 V41 R42 K48 N399 M400	A40-Q44 VanDerWaalsContact O-CB 3.24Å; A40-Q44 WeakPolarHBondContact O-CB 3.25Å; A40-Q44 PolarHBondContact O-N 2.84Å; V41-Q44 PolarHBondContact O-N 3.16Å; R42-Q44 VanDerWaalsContact C-N 3.34Å; R42-Q44 PolarHBondContact O-N 3.01Å; Q44-K48 HydrophobicContact CG-CD 4.04Å; Q44-K48 WeakPolarHBondContact O-CB 3.49Å; Q44-K48 VanDerWaalsContact O-CG 3.27Å; Q44-K48 WeakPolarHBondContact O-CG 3.48Å; Q44-K48 PolarHBondContact O-N 2.84Å; Q44-N399 PolarHBondContact NE2-O 3.47Å; Q44-M400 VanDerWaalsContact CD-SD 3.59Å; Q44-M400 HydrophobicContact CG-SD 3.86Å
45	I	85.1	Confident	83.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.3	-49.7	179.3	-67.9	170.7	0	0	0	110.2	V41 S47 K48 L49 F320 W326 W328 L397 M400	V41-I45 HydrophobicContact CG1-CD1 3.64Å; V41-I45 HydrophobicContact CG1-CG1 4.28Å; V41-I45 WeakPolarHBondContact O-CG1 3.32Å; V41-I45 PolarHBondContact O-N 3.26Å; I45-S47 VanDerWaalsContact C-N 3.35Å; I45-S47 PolarHBondContact O-N 2.82Å; I45-K48 PolarHBondContact O-N 2.03Å; I45-L49 HydrophobicContact CG2-CD1 3.81Å; I45-L49 HydrophobicContact CG2-CG 4.44Å; I45-L49 WeakPolarHBondContact O-CB 3.16Å; I45-L49 VanDerWaalsContact O-CG 3.3Å; I45-L49 WeakPolarHBondContact O-CG 3.38Å; I45-L49 PolarHBondContact O-N 2.93Å; I45-F320 HydrophobicContact CD1-CE1 3.76Å; I45-F320 HydrophobicContact CD1-CZ 4.49Å; I45-W326 HydrophobicContact CB-CH2 3.96Å; I45-W326 HydrophobicContact CB-CZ3 4.01Å; I45-W326 HydrophobicContact CD1-CH2 4.29Å; I45-W326 HydrophobicContact CD1-CZ3 3.65Å; I45-W326 HydrophobicContact CG1-CZ3 4.41Å; I45-W326 HydrophobicContact CG2-CH2 4.01Å; I45-W326 HydrophobicContact CG2-CZ3 3.82Å; I45-W328 HydrophobicContact CG2-CH2 4.21Å; I45-L397 HydrophobicContact CB-CD1 4.38Å; I45-L397 HydrophobicContact CG1-CD1 3.83Å; I45-L397 HydrophobicContact CG2-CD1 4.09Å; I45-M400 HydrophobicContact CD1-CE 3.89Å; I45-M400 HydrophobicContact CG1-CE 3.45Å; I45-M400 VanDerWaalsContact CG1-CE 3.45Å; I45-M400 HydrophobicContact CG1-SD 4.39Å
46	L	84.8	Confident	83.2	Confident	22 Å²	22	57.1 Å²	57.1	12%	0.115	31%	0.308	C	S	.	.	H	α-helix	trans	-61.6	-43.5	-179.9	-68.8	177.6	0	0	0	111.6	R42 L49 R50 M51 P54 W326	R42-L46 HydrophobicContact CG-CD1 4.47Å; R42-L46 WeakPolarHBondContact O-CG 3.37Å; R42-L46 PolarHBondContact O-N 3.12Å; L46-L49 PolarHBondContact O-N 2.03Å; L46-R50 PolarHBondContact O-N 2.91Å; L46-M51 CarbonylContact C-O 3.58Å; L46-M51 WeakPolarHBondContact CB-O 3.37Å; L46-M51 HydrophobicContact CD2-CB 4.14Å; L46-M51 PolarHBondContact O-N 2.75Å; L46-P54 HydrophobicContact CD2-CG 4.46Å; L46-W326 HydrophobicContact CD1-CZ2 4.25Å; L46-W326 HydrophobicContact CD2-CH2 4.46Å; L46-W326 HydrophobicContact CD2-CZ2 4.34Å; L46-W326 HydrophobicContact CG-CH2 4.18Å; L46-W326 HydrophobicContact CG-CZ2 4.13Å
47	S	81.9	Confident	82.5	Confident	61 Å²	61	53.1 Å²	53.1	43%	0.427	30%	0.299	S	S	.	.	H	α-helix	trans	-60.5	-47.4	175.6	178.1	0	0	0	0	112.5	G43 I45 L49 R50	G43-S47 WeakPolarHBondContact O-CB 3.47Å; G43-S47 PolarHBondContact O-N 3Å; I45-S47 VanDerWaalsContact C-N 3.35Å; I45-S47 PolarHBondContact O-N 2.82Å; S47-L49 VanDerWaalsContact C-N 3.3Å; S47-L49 PolarHBondContact O-N 3.03Å; S47-R50 WeakPolarHBondContact O-CA 3.49Å; S47-R50 PolarHBondContact O-N 2.87Å
48	K	81.8	Confident	81.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-32.5	179.5	-75.7	175.6	-179.4	-76.2	0	113.4	Q44 I45 R50 Y98 L397 S398 M400	Q44-K48 HydrophobicContact CG-CD 4.04Å; Q44-K48 WeakPolarHBondContact O-CB 3.49Å; Q44-K48 VanDerWaalsContact O-CG 3.27Å; Q44-K48 WeakPolarHBondContact O-CG 3.48Å; Q44-K48 PolarHBondContact O-N 2.84Å; I45-K48 PolarHBondContact O-N 2.03Å; K48-R50 VanDerWaalsContact C-N 3.27Å; K48-Y98 HydrophobicContact CG-CE1 4.32Å; K48-Y98 PolarHBondContact NZ-O 3.28Å; K48-L397 HydrophobicContact CB-CD2 4.17Å; K48-L397 HydrophobicContact CD-CB 4.42Å; K48-S398 WeakPolarHBondContact CE-O 3.2Å; K48-S398 PolarHBondContact NZ-O 3Å; K48-S398 PolarHBondContact NZ-OG 2.53Å; K48-M400 HydrophobicContact CD-SD 4.05Å
49	L	81	Confident	81.2	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-79	-11.1	173.6	-66	176.3	0	0	0	112.9	I45 L46 S47 M51 A100 R284 W328 I384 Y386 E395 L397	I45-L49 HydrophobicContact CG2-CD1 3.81Å; I45-L49 HydrophobicContact CG2-CG 4.44Å; I45-L49 WeakPolarHBondContact O-CB 3.16Å; I45-L49 VanDerWaalsContact O-CG 3.3Å; I45-L49 WeakPolarHBondContact O-CG 3.38Å; I45-L49 PolarHBondContact O-N 2.93Å; L46-L49 PolarHBondContact O-N 2.03Å; S47-L49 VanDerWaalsContact C-N 3.3Å; S47-L49 PolarHBondContact O-N 3.03Å; L49-M51 VanDerWaalsContact C-N 3.35Å; L49-M51 HydrophobicContact CB-CB 4.5Å; L49-M51 HydrophobicContact CB-CE 4.31Å; L49-M51 HydrophobicContact CB-CG 3.9Å; L49-M51 HydrophobicContact CB-SD 4.14Å; L49-M51 HydrophobicContact CD1-SD 4.24Å; L49-A100 HydrophobicContact CD2-CB 4.13Å; L49-R284 PolarHBondContact O-NH2 3.26Å; L49-W328 HydrophobicContact CD1-CH2 3.67Å; L49-W328 HydrophobicContact CD1-CZ3 4.11Å; L49-I384 HydrophobicContact CD1-CD1 4.14Å; L49-I384 HydrophobicContact CD2-CD1 4.36Å; L49-Y386 HydrophobicContact CD2-CE1 4.16Å; L49-E395 VanDerWaalsContact CD2-OE2 3.24Å; L49-E395 WeakPolarHBondContact CD2-OE2 3.31Å; L49-L397 HydrophobicContact CD2-CD2 3.79Å; L49-L397 HydrophobicContact CG-CD2 4.09Å
50	R	79.9	Confident	80.8	Confident	103 Å²	103	54 Å²	54	39%	0.389	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	44.7	-168.2	-63.1	-163	178.3	-161.6	-9.5	112.7	L46 S47 K48 Y99 H283 R284	L46-R50 PolarHBondContact O-N 2.91Å; S47-R50 WeakPolarHBondContact O-CA 3.49Å; S47-R50 PolarHBondContact O-N 2.87Å; K48-R50 VanDerWaalsContact C-N 3.27Å; R50-Y99 VanDerWaalsContact NH2-CZ 3.32Å; R50-Y99 PolarHBondContact NH2-OH 2.79Å; R50-Y99 VanDerWaalsContact NH2-OH 3.09Å; R50-H283 PolarHBondContact NH1-O 3.33Å; R50-R284 HydrophobicContact CG-CG 4.3Å; R50-R284 VanDerWaalsContact CZ-CA 3.47Å; R50-R284 PolarHBondContact NH2-O 3.39Å
51	M	79.7	Confident	80.4	Confident	45 Å²	45	57.5 Å²	57.5	22%	0.222	34%	0.344	C	S	.	.			trans	-110.9	138	175.9	-62.8	-174.7	179	0	0	110.7	L46 L49 Y386 V388	L46-M51 CarbonylContact C-O 3.58Å; L46-M51 WeakPolarHBondContact CB-O 3.37Å; L46-M51 HydrophobicContact CD2-CB 4.14Å; L46-M51 PolarHBondContact O-N 2.75Å; L49-M51 VanDerWaalsContact C-N 3.35Å; L49-M51 HydrophobicContact CB-CB 4.5Å; L49-M51 HydrophobicContact CB-CE 4.31Å; L49-M51 HydrophobicContact CB-CG 3.9Å; L49-M51 HydrophobicContact CB-SD 4.14Å; L49-M51 HydrophobicContact CD1-SD 4.24Å; M51-Y386 HydrophobicContact CE-CE2 3.59Å; M51-Y386 WeakPolarHBondContact CE-OH 3.48Å; M51-V388 HydrophobicContact CE-CG2 4.35Å
52	T	80.6	Confident	80.1	Confident	147 Å²	147	65.3 Å²	65.3	90%	0.902	38%	0.381	S	S	*	.	S	Bend	trans	-82.7	-29.1	174.5	46.3	0	0	0	0	112.2
53	S	83.9	Confident	80	Confident	69 Å²	69	63 Å²	63	48%	0.483	38%	0.375	S	S	.	.	S	Bend	trans	-146.6	159.6	176.2	63.4	0	0	0	0	110.8
54	P	83.5	Confident	80.2	Confident	45 Å²	45	64.1 Å²	64.1	29%	0.292	37%	0.374	S	S	.	.			trans	-51.2	146.8	169.4	-28.7	37.3	0	0	0	112.8	L46 W326 W328	L46-P54 HydrophobicContact CD2-CG 4.46Å; P54-W326 HydrophobicContact CG-CZ2 4.47Å; P54-W328 HydrophobicContact CB-CG 4.46Å
55	P	81.4	Confident	80.2	Confident	28 Å²	28	68.3 Å²	68.3	18%	0.182	40%	0.397	C	S	.	.			trans	-62.7	137.1	175.6	24.9	-31.9	0	0	0	110.9	A57 W328	P55-A57 VanDerWaalsContact C-N 3.31Å; P55-A57 PolarHBondContact O-N 2.79Å; P55-W328 HydrophobicContact CG-CB 4.03Å; P55-W328 HydrophobicContact CG-CD2 3.87Å; P55-W328 HydrophobicContact CG-CE3 3.66Å; P55-W328 HydrophobicContact CG-CG 4.04Å; P55-W328 HydrophobicContact CG-CZ3 4.42Å
56	Q	70.3	Confident	80	Confident	199 Å²	199	74 Å²	74	93%	0.93	42%	0.424	S	S	*	.	S	Bend	trans	-68.6	-27.3	-175.8	-67	-179	-8.6	0	0	113.3
57	A	71.9	Confident	80	Confident	47 Å²	47	73.7 Å²	73.7	39%	0.388	42%	0.423	S	S	.	.			trans	-99.3	121.2	177.8	0	0	0	0	0	110.5	P55 G59	P55-A57 VanDerWaalsContact C-N 3.31Å; P55-A57 PolarHBondContact O-N 2.79Å; A57-G59 PolarHBondContact O-N 2.81Å
58	T	70.3	Confident	80.3	Confident	74 Å²	74	72.9 Å²	72.9	45%	0.454	41%	0.413	S	S	.	.			trans	-80.1	10.8	179.9	52.4	0	0	0	0	113.8	R327 W328 H330	T58-R327 HydrophobicContact CG2-CB 4.21Å; T58-W328 HydrophobicContact CG2-CB 4.39Å; T58-H330 PolarHBondContact O-CE1 3.37Å; T58-H330 PolarHBondContact O-NE2 2.99Å; T58-H330 VanDerWaalsContact O-NE2 3.15Å
59	G	75.3	Confident	80.5	Confident	28 Å²	28	74.3 Å²	74.3	29%	0.289	43%	0.425	S	S	.	.			trans	62.8	-170.9	-176.7	0	0	0	0	0	113.9	A57	A57-G59 PolarHBondContact O-N 2.81Å
60	P	79.8	Confident	80.8	Confident	59 Å²	59	75.3 Å²	75.3	38%	0.383	43%	0.43	S	S	.	.			trans	-67.1	154.5	174.8	29.3	-34	0	0	0	111.8	H330 Y387	P60-H330 PolarHBondContact O-NE2 3.46Å; P60-Y387 HydrophobicContact CG-CE1 3.86Å; P60-Y387 HydrophobicContact CG-CE2 4.15Å
61	S	76	Confident	81.3	Confident	124 Å²	124	70.7 Å²	70.7	87%	0.867	41%	0.413	S	S	*	.	S	Bend	trans	-68.9	-34.1	178.6	54.7	0	0	0	0	112.9
62	Q	80.1	Confident	81.8	Confident	164 Å²	164	71.6 Å²	71.6	77%	0.766	42%	0.419	S	S	*	.	S	Bend	trans	-111.5	130.1	173.9	-70.1	-178.3	-8.5	0	0	109.7
63	V	84.7	Confident	82.2	Confident	23 Å²	23	65 Å²	65	14%	0.139	38%	0.379	C	S	.	.			trans	-78.5	132.5	175.6	-179	0	0	0	0	108.7	V67 L68 H330 L385 Y387	V63-V67 HydrophobicContact CG1-CB 3.79Å; V63-V67 HydrophobicContact CG1-CG1 3.9Å; V63-L68 HydrophobicContact CB-CD1 4.19Å; V63-L68 HydrophobicContact CB-CD2 4.05Å; V63-L68 HydrophobicContact CB-CG 3.9Å; V63-L68 HydrophobicContact CG1-CD1 4.46Å; V63-L68 HydrophobicContact CG1-CD2 3.97Å; V63-L68 HydrophobicContact CG1-CG 3.69Å; V63-H330 HydrophobicContact CG2-CB 3.66Å; V63-L385 HydrophobicContact CB-CD2 4.4Å; V63-L385 HydrophobicContact CG1-CD2 3.56Å; V63-L385 HydrophobicContact CG2-CD2 4.05Å; V63-Y387 HydrophobicContact CG2-CE2 4.38Å
64	P	87.6	Confident	82.5	Confident	64 Å²	64	61.7 Å²	61.7	42%	0.416	36%	0.356	S	S	.	.			trans	-55.6	142	172.8	-24.6	34.9	0	0	0	112.3	Q66 V67 L68 Y387	P64-Q66 PolarHBondContact O-N 2.74Å; P64-Q66 VanDerWaalsContact O-N 3.15Å; P64-V67 HydrophobicContact CB-CG2 4.36Å; P64-V67 PolarHBondContact O-N 3.47Å; P64-L68 PolarHBondContact O-N 2.9Å; P64-Y387 WeakPolarHBondContact CD-OH 3.23Å
65	L	84	Confident	82.8	Confident	126 Å²	126	64.4 Å²	64.4	66%	0.66	36%	0.36	S	S	*	.	H	α-helix	trans	-53.9	-37	-178.5	-73.5	168.2	0	0	0	112.8	V67 L68 A69	L65-V67 VanDerWaalsContact C-N 3.34Å; L65-V67 PolarHBondContact O-N 3.23Å; L65-L68 PolarHBondContact O-N 2.93Å; L65-A69 WeakPolarHBondContact O-CB 3.04Å; L65-A69 PolarHBondContact O-N 3.48Å
66	Q	81.6	Confident	83.2	Confident	120 Å²	120	66.4 Å²	66.4	56%	0.561	37%	0.367	S	S	*	.	H	α-helix	trans	-58.6	-42.3	177.4	179.6	164.6	46.3	0	0	113.8	P64 A69 L70 E269	P64-Q66 PolarHBondContact O-N 2.74Å; P64-Q66 VanDerWaalsContact O-N 3.15Å; Q66-A69 PolarHBondContact O-N 2.92Å; Q66-L70 PolarHBondContact O-N 2.93Å; Q66-L70 VanDerWaalsContact O-N 3.07Å; Q66-E269 WeakPolarHBondContact CA-OE1 3.3Å; Q66-E269 WeakPolarHBondContact CA-OE2 3.48Å; Q66-E269 WeakPolarHBondContact CB-OE1 3.39Å; Q66-E269 WeakPolarHBondContact CG-OE1 3.45Å; Q66-E269 PolarHBondContact NE2-OE1 3.03Å
67	V	85.3	Confident	84	Confident	16 Å²	16	56.9 Å²	56.9	10%	0.097	32%	0.322	C	S	.	.	H	α-helix	trans	-75.2	-36.4	-178.9	-179.2	0	0	0	0	110.1	V63 P64 L65 L70 Y71 L385 P392 V394	V63-V67 HydrophobicContact CG1-CB 3.79Å; V63-V67 HydrophobicContact CG1-CG1 3.9Å; P64-V67 HydrophobicContact CB-CG2 4.36Å; P64-V67 PolarHBondContact O-N 3.47Å; L65-V67 VanDerWaalsContact C-N 3.34Å; L65-V67 PolarHBondContact O-N 3.23Å; V67-L70 WeakPolarHBondContact O-CB 3.03Å; V67-L70 PolarHBondContact O-N 3.37Å; V67-Y71 PolarHBondContact O-N 3.49Å; V67-L385 HydrophobicContact CG1-CD1 3.33Å; V67-L385 HydrophobicContact CG1-CD2 3.81Å; V67-L385 HydrophobicContact CG1-CG 4.23Å; V67-P392 HydrophobicContact CB-CB 4.42Å; V67-P392 HydrophobicContact CG1-CB 3.72Å; V67-P392 HydrophobicContact CG1-CG 4.46Å; V67-P392 HydrophobicContact CG2-CB 3.8Å; V67-P392 HydrophobicContact CG2-CG 3.67Å; V67-V394 HydrophobicContact CG1-CG2 4.34Å
68	L	87.1	Confident	84.7	Confident	43 Å²	43	55.9 Å²	55.9	23%	0.225	31%	0.31	C	S	.	.	H	α-helix	trans	-65.1	-39.5	172.1	-71.9	172.3	0	0	0	111.9	V63 P64 L65 L70 Y71 N72 Q331 L385	V63-L68 HydrophobicContact CB-CD1 4.19Å; V63-L68 HydrophobicContact CB-CD2 4.05Å; V63-L68 HydrophobicContact CB-CG 3.9Å; V63-L68 HydrophobicContact CG1-CD1 4.46Å; V63-L68 HydrophobicContact CG1-CD2 3.97Å; V63-L68 HydrophobicContact CG1-CG 3.69Å; P64-L68 PolarHBondContact O-N 2.9Å; L65-L68 PolarHBondContact O-N 2.93Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-Y71 PolarHBondContact O-N 3.29Å; L68-N72 WeakPolarHBondContact O-CB 3.49Å; L68-N72 VanDerWaalsContact O-CG 3.32Å; L68-N72 PolarHBondContact O-N 3.21Å; L68-N72 PolarHBondContact O-ND2 3.21Å; L68-Q331 HydrophobicContact CD2-CG 3.96Å; L68-L385 HydrophobicContact CD2-CD2 4.35Å
69	A	85.6	Confident	85.4	Confident	31 Å²	31	56.8 Å²	56.8	26%	0.256	31%	0.309	S	S	.	.	H	α-helix	trans	-63.9	-39.7	176	0	0	0	0	0	111.6	L65 Q66 S73 E269	L65-A69 WeakPolarHBondContact O-CB 3.04Å; L65-A69 PolarHBondContact O-N 3.48Å; Q66-A69 PolarHBondContact O-N 2.92Å; A69-S73 WeakPolarHBondContact O-CB 3.1Å; A69-S73 PolarHBondContact O-N 2.85Å; A69-E269 WeakPolarHBondContact CB-OE2 3.07Å
70	L	87.7	Confident	85.9	Confident	26 Å²	26	57.1 Å²	57.1	14%	0.136	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-53.7	170.2	178.2	56.7	0	0	0	111	Q66 V67 L68 N72 S73 T74 I103 K105 V394	Q66-L70 PolarHBondContact O-N 2.93Å; Q66-L70 VanDerWaalsContact O-N 3.07Å; V67-L70 WeakPolarHBondContact O-CB 3.03Å; V67-L70 PolarHBondContact O-N 3.37Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L70-N72 PolarHBondContact O-N 3.2Å; L70-S73 PolarHBondContact O-N 3.42Å; L70-T74 HydrophobicContact CD1-CG2 3.88Å; L70-T74 HydrophobicContact CG-CG2 4.4Å; L70-T74 WeakPolarHBondContact O-CG2 3.21Å; L70-T74 PolarHBondContact O-N 2.76Å; L70-T74 PolarHBondContact O-OG1 3.03Å; L70-I103 HydrophobicContact CD1-CG2 4.27Å; L70-K105 HydrophobicContact CD1-CB 3.39Å; L70-K105 HydrophobicContact CD1-CD 4.04Å; L70-K105 HydrophobicContact CD1-CG 4.32Å; L70-V394 HydrophobicContact CD2-CB 4.19Å; L70-V394 HydrophobicContact CD2-CG2 3.84Å; L70-V394 HydrophobicContact CG-CB 4.4Å; L70-V394 HydrophobicContact CG-CG2 4.04Å
71	Y	90.2	Very high	86.1	Confident	7 Å²	7	55.9 Å²	55.9	3%	0.027	29%	0.293	C	S	.	.	H	α-helix	trans	-55.4	-49	179.1	172.6	-96.2	0	0	0	112.2	V67 L68 S73 T74 R75 Q331 P332 T383 L385	V67-Y71 PolarHBondContact O-N 3.49Å; L68-Y71 PolarHBondContact O-N 3.29Å; Y71-S73 PolarHBondContact O-N 3.18Å; Y71-T74 WeakPolarHBondContact CA-OG1 3.34Å; Y71-T74 PolarHBondContact O-N 2.99Å; Y71-T74 PolarHBondContact O-OG1 3.37Å; Y71-R75 WeakPolarHBondContact O-CB 3.48Å; Y71-R75 PolarHBondContact O-N 3.44Å; Y71-Q331 HydrophobicContact CD1-CB 4.14Å; Y71-Q331 HydrophobicContact CD1-CG 4.48Å; Y71-Q331 HydrophobicContact CD2-CB 4.27Å; Y71-Q331 HydrophobicContact CE1-CB 3.81Å; Y71-Q331 HydrophobicContact CE1-CG 4.37Å; Y71-Q331 HydrophobicContact CE2-CB 3.94Å; Y71-Q331 HydrophobicContact CG-CB 4.36Å; Y71-P332 WeakPolarHBondContact OH-CD 3.45Å; Y71-T383 HydrophobicContact CD2-CG2 4.06Å; Y71-T383 HydrophobicContact CE2-CG2 4.12Å; Y71-L385 HydrophobicContact CD2-CB 4.09Å
72	N	90.6	Very high	86	Confident	64 Å²	64	51.3 Å²	51.3	34%	0.342	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-46.5	180	-72.8	-21.2	0	0	0	112	L68 L70 T74 R75 E76	L68-N72 WeakPolarHBondContact O-CB 3.49Å; L68-N72 VanDerWaalsContact O-CG 3.32Å; L68-N72 PolarHBondContact O-N 3.21Å; L68-N72 PolarHBondContact O-ND2 3.21Å; L70-N72 PolarHBondContact O-N 3.2Å; N72-T74 VanDerWaalsContact C-N 3.3Å; N72-T74 PolarHBondContact O-N 2.95Å; N72-R75 PolarHBondContact O-N 2.99Å; N72-E76 WeakPolarHBondContact O-CG 3.33Å; N72-E76 PolarHBondContact O-N 3.36Å
73	S	89.2	Confident	85.9	Confident	8 Å²	8	50.7 Å²	50.7	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-39.8	177.6	-170.7	0	0	0	0	111.5	A69 L70 Y71 E76 L77 R150 H274	A69-S73 WeakPolarHBondContact O-CB 3.1Å; A69-S73 PolarHBondContact O-N 2.85Å; L70-S73 PolarHBondContact O-N 3.42Å; Y71-S73 PolarHBondContact O-N 3.18Å; S73-E76 PolarHBondContact O-N 2.86Å; S73-L77 WeakPolarHBondContact O-CB 3.42Å; S73-L77 PolarHBondContact O-N 3.46Å; S73-R150 PolarHBondContact O-NH1 2.95Å; S73-R150 PolarHBondContact OG-NH1 2.75Å; S73-H274 PolarHBondContact OG-NE2 3.49Å; S73-H274 VanDerWaalsContact OG-NE2 3.14Å
74	T	89.3	Confident	85.2	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.9	-40.4	176.8	60.1	0	0	0	0	112.3	L70 Y71 N72 L77 I78 I103 I276	L70-T74 HydrophobicContact CD1-CG2 3.88Å; L70-T74 HydrophobicContact CG-CG2 4.4Å; L70-T74 WeakPolarHBondContact O-CG2 3.21Å; L70-T74 PolarHBondContact O-N 2.76Å; L70-T74 PolarHBondContact O-OG1 3.03Å; Y71-T74 WeakPolarHBondContact CA-OG1 3.34Å; Y71-T74 PolarHBondContact O-N 2.99Å; Y71-T74 PolarHBondContact O-OG1 3.37Å; N72-T74 VanDerWaalsContact C-N 3.3Å; N72-T74 PolarHBondContact O-N 2.95Å; T74-L77 PolarHBondContact O-N 3.3Å; T74-I78 VanDerWaalsContact O-CG1 3.3Å; T74-I78 WeakPolarHBondContact O-CG1 3.35Å; T74-I78 PolarHBondContact O-N 2.97Å; T74-I103 HydrophobicContact CG2-CB 4.3Å; T74-I103 HydrophobicContact CG2-CD1 3.96Å; T74-I103 HydrophobicContact CG2-CG2 3.4Å; T74-I276 HydrophobicContact CG2-CD1 4.17Å; T74-I276 HydrophobicContact CG2-CG2 4.17Å
75	R	90	Very high	84.2	Confident	101 Å²	101	54.4 Å²	54.4	38%	0.381	27%	0.265	S	S	.	.	H	α-helix	trans	-60.4	-49.8	175.8	-174.1	-174.7	66.9	-171.9	-3.4	111.1	Y71 N72 L77 I78 E79	Y71-R75 WeakPolarHBondContact O-CB 3.48Å; Y71-R75 PolarHBondContact O-N 3.44Å; N72-R75 PolarHBondContact O-N 2.99Å; R75-L77 VanDerWaalsContact C-N 3.3Å; R75-L77 PolarHBondContact O-N 2.96Å; R75-I78 PolarHBondContact O-N 3.49Å; R75-E79 WeakPolarHBondContact O-CG 3.47Å; R75-E79 PolarHBondContact O-N 2.9Å
76	E	89.8	Confident	83.1	Confident	70 Å²	70	55.2 Å²	55.2	33%	0.327	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-38.5	177.8	-71.8	172.4	-162	0	0	112.2	N72 S73 E80 W197	N72-E76 WeakPolarHBondContact O-CG 3.33Å; N72-E76 PolarHBondContact O-N 3.36Å; S73-E76 PolarHBondContact O-N 2.86Å; E76-E80 WeakPolarHBondContact O-CB 3.31Å; E76-E80 PolarHBondContact O-N 3.49Å; E76-W197 PolarHBondContact OE2-NE1 2.8Å
77	L	88.1	Confident	81.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-46.1	175.7	175.9	63	0	0	0	111.7	S73 T74 R75 E79 E80 L81 E148 I276 M278	S73-L77 WeakPolarHBondContact O-CB 3.42Å; S73-L77 PolarHBondContact O-N 3.46Å; T74-L77 PolarHBondContact O-N 3.3Å; R75-L77 VanDerWaalsContact C-N 3.3Å; R75-L77 PolarHBondContact O-N 2.96Å; L77-E79 VanDerWaalsContact C-N 3.3Å; L77-E79 PolarHBondContact O-N 3.29Å; L77-E80 WeakPolarHBondContact O-CB 3.24Å; L77-E80 PolarHBondContact O-N 2.94Å; L77-L81 HydrophobicContact CD1-CD1 4.19Å; L77-L81 HydrophobicContact CD1-CG 4.2Å; L77-L81 HydrophobicContact CG-CD1 4.04Å; L77-L81 HydrophobicContact CG-CG 4.45Å; L77-L81 WeakPolarHBondContact O-CG 3.45Å; L77-L81 PolarHBondContact O-N 3.4Å; L77-E148 HydrophobicContact CD1-CB 4.05Å; L77-E148 HydrophobicContact CD1-CG 3.92Å; L77-E148 HydrophobicContact CD2-CB 3.73Å; L77-E148 HydrophobicContact CD2-CG 3.85Å; L77-E148 HydrophobicContact CG-CG 4.39Å; L77-I276 HydrophobicContact CD2-CB 4.13Å; L77-I276 HydrophobicContact CD2-CD1 3.95Å; L77-I276 HydrophobicContact CD2-CG2 4.04Å; L77-M278 HydrophobicContact CD2-CE 3.66Å; L77-M278 HydrophobicContact CG-CE 4.4Å
78	I	86.1	Confident	80.3	Confident	25 Å²	25	60 Å²	60	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-65	-37	179.5	-66.3	-49.3	0	0	0	111.1	T74 R75 L81 G82 M278 P381	T74-I78 VanDerWaalsContact O-CG1 3.3Å; T74-I78 WeakPolarHBondContact O-CG1 3.35Å; T74-I78 PolarHBondContact O-N 2.97Å; R75-I78 PolarHBondContact O-N 3.49Å; I78-L81 HydrophobicContact CD1-CD1 4.22Å; I78-G82 PolarHBondContact O-N 3.28Å; I78-M278 HydrophobicContact CD1-CE 3.56Å; I78-M278 HydrophobicContact CD1-SD 4.29Å; I78-P381 HydrophobicContact CG2-CG 3.87Å
79	E	86.2	Confident	78.4	Confident	94 Å²	94	64.3 Å²	64.3	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-42.4	173.2	-73.1	174.9	-164.5	0	0	112.1	R75 L77 G82 R83	R75-E79 WeakPolarHBondContact O-CG 3.47Å; R75-E79 PolarHBondContact O-N 2.9Å; L77-E79 VanDerWaalsContact C-N 3.3Å; L77-E79 PolarHBondContact O-N 3.29Å; E79-G82 PolarHBondContact O-N 3.1Å; E79-R83 WeakPolarHBondContact O-CG 3.18Å; E79-R83 PolarHBondContact O-N 2.98Å
80	E	85.3	Confident	76.3	Confident	34 Å²	34	64.9 Å²	64.9	16%	0.159	34%	0.336	C	S	.	.	H	α-helix	trans	-60.6	-51.9	175	-169.8	-178	167.4	0	0	111.1	E76 L77 G82 R83 D84 R150 K187 S199	E76-E80 WeakPolarHBondContact O-CB 3.31Å; E76-E80 PolarHBondContact O-N 3.49Å; L77-E80 WeakPolarHBondContact O-CB 3.24Å; L77-E80 PolarHBondContact O-N 2.94Å; E80-G82 VanDerWaalsContact C-N 3.26Å; E80-G82 PolarHBondContact O-N 3.33Å; E80-R83 WeakPolarHBondContact O-CB 3.23Å; E80-R83 PolarHBondContact O-N 2.76Å; E80-R83 VanDerWaalsContact O-N 3.09Å; E80-D84 PolarHBondContact O-N 2.71Å; E80-D84 VanDerWaalsContact O-N 3.11Å; E80-R150 IonicContact OE2-CZ 3.73Å; E80-R150 IonicContact OE2-NH2 3.77Å; E80-R150 PolarHBondContact OE2-NH2 3.48Å; E80-K187 IonicContact OE1-NZ 3.72Å; E80-S199 WeakPolarHBondContact OE1-CB 3.37Å; E80-S199 PolarHBondContact OE1-OG 3.29Å; E80-S199 PolarHBondContact OE2-OG 2.91Å
81	L	82.7	Confident	74.2	Confident	34 Å²	34	71.4 Å²	71.4	18%	0.178	37%	0.366	C	S	.	.	H	α-helix	trans	-60.4	-34.4	176.8	-68.4	173.5	0	0	0	112.7	L77 I78 D84 R85 M278	L77-L81 HydrophobicContact CD1-CD1 4.19Å; L77-L81 HydrophobicContact CD1-CG 4.2Å; L77-L81 HydrophobicContact CG-CD1 4.04Å; L77-L81 HydrophobicContact CG-CG 4.45Å; L77-L81 WeakPolarHBondContact O-CG 3.45Å; L77-L81 PolarHBondContact O-N 3.4Å; I78-L81 HydrophobicContact CD1-CD1 4.22Å; L81-D84 PolarHBondContact O-N 2.68Å; L81-R85 WeakPolarHBondContact O-CB 3.31Å; L81-R85 PolarHBondContact O-N 3.06Å; L81-M278 HydrophobicContact CD1-CE 4.39Å
82	G	74.8	Confident	72	Confident	27 Å²	27	76.1 Å²	76.1	28%	0.278	39%	0.391	S	S	.	.	H	α-helix	trans	-62.8	-40.1	175.1	0	0	0	0	0	112.8	I78 E79 E80 Q86	I78-G82 PolarHBondContact O-N 3.28Å; E79-G82 PolarHBondContact O-N 3.1Å; E80-G82 VanDerWaalsContact C-N 3.26Å; E80-G82 PolarHBondContact O-N 3.33Å; G82-Q86 WeakPolarHBondContact O-CG 3.46Å; G82-Q86 PolarHBondContact O-N 2.89Å
83	R	77.9	Confident	69.8	Low	151 Å²	151	79.5 Å²	79.5	57%	0.57	41%	0.409	S	S	*	.	H	α-helix	trans	-68.3	-43.7	176	-65.9	174.7	-166.3	152	7.7	111.3	E79 E80 R85 Q86 Q87	E79-R83 WeakPolarHBondContact O-CG 3.18Å; E79-R83 PolarHBondContact O-N 2.98Å; E80-R83 WeakPolarHBondContact O-CB 3.23Å; E80-R83 PolarHBondContact O-N 2.76Å; E80-R83 VanDerWaalsContact O-N 3.09Å; R83-R85 VanDerWaalsContact C-N 3.33Å; R83-R85 PolarHBondContact O-N 3.18Å; R83-Q86 WeakPolarHBondContact O-CB 3.45Å; R83-Q86 PolarHBondContact O-N 2.64Å; R83-Q87 PolarHBondContact O-N 2.8Å
84	D	69.8	Low	68.1	Low	72 Å²	72	81.6 Å²	81.6	39%	0.385	42%	0.422	S	S	.	.	H	α-helix	trans	-65	-37.5	179	-72.1	-4.8	0	0	0	111.8	E80 L81 Q86 Q87 S88	E80-D84 PolarHBondContact O-N 2.71Å; E80-D84 VanDerWaalsContact O-N 3.11Å; L81-D84 PolarHBondContact O-N 2.68Å; D84-Q86 VanDerWaalsContact C-N 3.32Å; D84-Q86 PolarHBondContact O-N 2.57Å; D84-Q87 PolarHBondContact O-N 2.89Å; D84-Q87 VanDerWaalsContact O-N 3.09Å; D84-S88 WeakPolarHBondContact O-CB 3.27Å; D84-S88 PolarHBondContact O-N 2.88Å
85	R	66.7	Low	66.2	Low	93 Å²	93	85.7 Å²	85.7	35%	0.351	44%	0.441	S	S	.	.	H	α-helix	trans	-66.6	-29.5	175.1	-167.4	178.4	-174.3	178.9	5.1	113.1	L81 R83 Q87 E97	L81-R85 WeakPolarHBondContact O-CB 3.31Å; L81-R85 PolarHBondContact O-N 3.06Å; R83-R85 VanDerWaalsContact C-N 3.33Å; R83-R85 PolarHBondContact O-N 3.18Å; R85-Q87 VanDerWaalsContact C-N 3.27Å; R85-E97 IonicContact CZ-OE1 2.78Å; R85-E97 IonicContact NH1-OE1 2.64Å; R85-E97 PolarHBondContact NH1-OE1 3.35Å; R85-E97 IonicContact NH1-OE2 2.84Å; R85-E97 IonicContact NH2-OE1 2.77Å; R85-E97 IonicContact NH2-OE2 3.04Å; R85-E97 PolarHBondContact NH2-OE2 3.45Å
86	Q	60.4	Low	64.3	Low	144 Å²	144	83.8 Å²	83.8	67%	0.673	44%	0.441	S	S	*	.	H	α-helix	trans	-70.1	-27.5	172.4	-71.9	173.6	-3.6	0	0	111.9	G82 R83 D84	G82-Q86 WeakPolarHBondContact O-CG 3.46Å; G82-Q86 PolarHBondContact O-N 2.89Å; R83-Q86 WeakPolarHBondContact O-CB 3.45Å; R83-Q86 PolarHBondContact O-N 2.64Å; D84-Q86 VanDerWaalsContact C-N 3.32Å; D84-Q86 PolarHBondContact O-N 2.57Å
87	Q	57.3	Low	62.7	Low	163 Å²	163	81.5 Å²	81.5	76%	0.762	43%	0.43	S	S	*	.	H	α-helix	trans	-86.7	-31.4	178	-66.4	179.5	5.6	0	0	112.9	R83 D84 R85	R83-Q87 PolarHBondContact O-N 2.8Å; D84-Q87 PolarHBondContact O-N 2.89Å; D84-Q87 VanDerWaalsContact O-N 3.09Å; R85-Q87 VanDerWaalsContact C-N 3.27Å
88	S	51.8	Low	61.2	Low	74 Å²	74	85.8 Å²	85.8	52%	0.517	45%	0.447	S	S	.	.			trans	-99.4	118.6	179.9	-174.6	0	0	0	0	112	D84 G90	D84-S88 WeakPolarHBondContact O-CB 3.27Å; D84-S88 PolarHBondContact O-N 2.88Å; S88-G90 PolarHBondContact O-N 3.28Å
89	C	46	Very low	60.4	Low	133 Å²	133	87.8 Å²	87.8	90%	0.899	45%	0.453	S	S	*	.			trans	-74.3	31.4	174.7	-71.1	0	0	0	0	113.8
90	G	42.8	Very low	59.8	Low	43 Å²	43	83.3 Å²	83.3	44%	0.443	43%	0.432	S	S	.	.			trans	-73.7	133.6	-178.6	0	0	0	0	0	112.9	S88 D92	S88-G90 PolarHBondContact O-N 3.28Å; G90-D92 PolarHBondContact O-N 2.77Å
91	Q	44	Very low	59.9	Low	163 Å²	163	81.8 Å²	81.8	76%	0.762	43%	0.425	S	S	*	.			trans	-85.6	100.7	172.4	-70	-175	-76.3	0	0	110.1
92	D	43.3	Very low	60.1	Low	106 Å²	106	81.7 Å²	81.7	57%	0.567	42%	0.424	S	S	*	.			trans	-90.6	143.6	166.7	-72.1	-30.2	0	0	0	111.6	G90 T94	G90-D92 PolarHBondContact O-N 2.77Å; D92-T94 PolarHBondContact O-N 2.81Å; D92-T94 VanDerWaalsContact O-N 3.12Å
93	N	45.2	Very low	60.8	Low	135 Å²	135	80.9 Å²	80.9	72%	0.722	41%	0.413	S	S	*	.			trans	-56.3	110.6	179.6	-80.6	-22.8	0	0	0	111.8	E95 T96	N93-E95 VanDerWaalsContact C-N 3.31Å; N93-E95 PolarHBondContact O-N 3.3Å; N93-T96 PolarHBondContact O-OG1 3.05Å; N93-T96 VanDerWaalsContact O-OG1 3.06Å
94	T	52.1	Low	61.5	Low	52 Å²	52	76.5 Å²	76.5	32%	0.319	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-11.2	-169.4	54.4	0	0	0	0	115.5	D92 E97	D92-T94 PolarHBondContact O-N 2.81Å; D92-T94 VanDerWaalsContact O-N 3.12Å; T94-E97 WeakPolarHBondContact O-CB 3.33Å
95	E	49.7	Very low	62.5	Low	86 Å²	86	75.8 Å²	75.8	40%	0.402	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-37.2	-173.2	-69.5	180	167.5	0	0	113.1	N93 E97 Y98 S289 S290	N93-E95 VanDerWaalsContact C-N 3.31Å; N93-E95 PolarHBondContact O-N 3.3Å; E95-E97 PolarHBondContact O-N 2.88Å; E95-E97 VanDerWaalsContact O-N 3.16Å; E95-Y98 WeakPolarHBondContact O-CB 3.21Å; E95-Y98 PolarHBondContact O-N 3.49Å; E95-S289 WeakPolarHBondContact OE2-CA 3.49Å; E95-S290 PolarHBondContact OE1-N 2.81Å; E95-S290 VanDerWaalsContact OE1-O 3.1Å
96	T	49.6	Very low	63.6	Low	61 Å²	61	72.5 Å²	72.5	37%	0.374	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.6	162.7	45.3	0	0	0	0	111.1	N93 K101	N93-T96 PolarHBondContact O-OG1 3.05Å; N93-T96 VanDerWaalsContact O-OG1 3.06Å; T96-K101 WeakPolarHBondContact O-CE 3.38Å; T96-K101 PolarHBondContact O-NZ 3.3Å
97	E	57.3	Low	64.9	Low	21 Å²	21	68.9 Å²	68.9	10%	0.098	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-28.3	169.4	-154.1	169.7	-170.9	0	0	112	R85 T94 E95 Y99 K101 S398	R85-E97 IonicContact CZ-OE1 2.78Å; R85-E97 IonicContact NH1-OE1 2.64Å; R85-E97 PolarHBondContact NH1-OE1 3.35Å; R85-E97 IonicContact NH1-OE2 2.84Å; R85-E97 IonicContact NH2-OE1 2.77Å; R85-E97 IonicContact NH2-OE2 3.04Å; R85-E97 PolarHBondContact NH2-OE2 3.45Å; T94-E97 WeakPolarHBondContact O-CB 3.33Å; E95-E97 PolarHBondContact O-N 2.88Å; E95-E97 VanDerWaalsContact O-N 3.16Å; E97-Y99 PolarHBondContact O-N 3.18Å; E97-K101 PolarHBondContact O-NZ 2.91Å; E97-S398 WeakPolarHBondContact O-CB 3.37Å; E97-S398 PolarHBondContact O-OG 2.85Å
98	Y	56.2	Low	66.4	Low	91 Å²	91	62.1 Å²	62.1	36%	0.357	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-42.9	-170.1	-177.3	-96	0	0	0	115.8	K48 E95 S398	K48-Y98 HydrophobicContact CG-CE1 4.32Å; K48-Y98 PolarHBondContact NZ-O 3.28Å; E95-Y98 WeakPolarHBondContact O-CB 3.21Å; E95-Y98 PolarHBondContact O-N 3.49Å; Y98-S398 WeakPolarHBondContact CA-OG 3.19Å; Y98-S398 PolarHBondContact O-OG 3.16Å
99	Y	68.8	Low	67.9	Low	66 Å²	66	62.8 Å²	62.8	26%	0.259	33%	0.329	S	S	.	.	S	Bend	trans	-78.8	156.3	-177.6	-67.9	-70.3	0	0	0	112.2	R50 E97 K101 R284	R50-Y99 VanDerWaalsContact NH2-CZ 3.32Å; R50-Y99 PolarHBondContact NH2-OH 2.79Å; R50-Y99 VanDerWaalsContact NH2-OH 3.09Å; E97-Y99 PolarHBondContact O-N 3.18Å; Y99-K101 VanDerWaalsContact O-CE 3.31Å; Y99-K101 WeakPolarHBondContact O-CE 2.78Å; Y99-K101 PolarHBondContact O-NZ 3.2Å; Y99-R284 HydrophobicContact CG-CB 4.32Å
100	A	75	Confident	68.8	Low	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-69.3	140.1	174.4	0	0	0	0	0	110.9	L49 R284 E395 Q396 L397	L49-A100 HydrophobicContact CD2-CB 4.13Å; A100-R284 PolarHBondContact O-NH1 3.49Å; A100-E395 HydrophobicContact CB-CB 4.43Å; A100-E395 VanDerWaalsContact CB-OE2 3.26Å; A100-E395 WeakPolarHBondContact CB-OE2 3.49Å; A100-Q396 WeakPolarHBondContact CA-O 3.35Å; A100-L397 HydrophobicContact CB-CD2 3.61Å
101	K	86.8	Confident	69.4	Low	3 Å²	3	61 Å²	61	1%	0.013	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	133.4	176.5	-64.5	89.5	-169.5	161.1	0	109.2	T96 E97 Y99 F145 M278 M279 I280 E395 Q396	T96-K101 WeakPolarHBondContact O-CE 3.38Å; T96-K101 PolarHBondContact O-NZ 3.3Å; E97-K101 PolarHBondContact O-NZ 2.91Å; Y99-K101 VanDerWaalsContact O-CE 3.31Å; Y99-K101 WeakPolarHBondContact O-CE 2.78Å; Y99-K101 PolarHBondContact O-NZ 3.2Å; K101-F145 HydrophobicContact CD-CD1 4.43Å; K101-F145 HydrophobicContact CG-CB 4.45Å; K101-F145 HydrophobicContact CG-CD1 4.25Å; K101-F145 HydrophobicContact CG-CG 4.39Å; K101-M278 HydrophobicContact CB-CB 4.28Å; K101-M279 CarbonylContact C-O 3.52Å; K101-M279 VanDerWaalsContact CA-O 3.31Å; K101-M279 WeakPolarHBondContact CA-O 3.44Å; K101-I280 HydrophobicContact CG-CG1 4.22Å; K101-E395 CarbonylContact O-C 3.59Å; K101-E395 WeakPolarHBondContact O-CA 2.93Å; K101-Q396 PolarHBondContact N-O 2.73Å; K101-Q396 VanDerWaalsContact N-O 3.16Å; K101-Q396 PolarHBondContact O-N 2.68Å
102	E	86.4	Confident	69.5	Low	31 Å²	31	58.7 Å²	58.7	15%	0.145	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	136.9	169	-74	-172.9	147.9	0	0	109.7	Y104 M279 P281 K393 E395	E102-Y104 HydrophobicContact CB-CD2 4.48Å; E102-Y104 HydrophobicContact CB-CE2 3.68Å; E102-Y104 PolarHBondContact OE2-OH 3.01Å; E102-M279 PolarHBondContact N-O 2.81Å; E102-M279 PolarHBondContact O-N 3.44Å; E102-P281 HydrophobicContact CB-CG 4.48Å; E102-P281 HydrophobicContact CG-CG 3.69Å; E102-K393 IonicContact OE1-NZ 3.28Å; E102-K393 PolarHBondContact OE1-NZ 3.5Å; E102-E395 HydrophobicContact CG-CG 4.11Å
103	I	90.8	Very high	69.7	Low	10 Å²	10	56 Å²	56	5%	0.051	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.3	-176.7	-57.4	164	0	0	0	110.4	L70 T74 I276 L277 M278 T383 V394 Q396	L70-I103 HydrophobicContact CD1-CG2 4.27Å; T74-I103 HydrophobicContact CG2-CB 4.3Å; T74-I103 HydrophobicContact CG2-CD1 3.96Å; T74-I103 HydrophobicContact CG2-CG2 3.4Å; I103-I276 HydrophobicContact CG2-CG2 3.53Å; I103-L277 WeakPolarHBondContact CA-O 3.24Å; I103-M278 HydrophobicContact CG1-CG 4.45Å; I103-T383 HydrophobicContact CD1-CG2 4.17Å; I103-V394 HydrophobicContact CB-CG1 4.42Å; I103-V394 HydrophobicContact CD1-CG1 3.96Å; I103-V394 PolarHBondContact N-O 3.35Å; I103-V394 VanDerWaalsContact N-O 3.07Å; I103-Q396 HydrophobicContact CD1-CB 4.17Å
104	Y	91.3	Very high	69.7	Low	60 Å²	60	58.8 Å²	58.8	24%	0.235	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.5	179.2	-63.2	-87.8	0	0	0	110.2	E102 M137 I276 L277 M279	E102-Y104 HydrophobicContact CB-CD2 4.48Å; E102-Y104 HydrophobicContact CB-CE2 3.68Å; E102-Y104 PolarHBondContact OE2-OH 3.01Å; Y104-M137 HydrophobicContact CD1-CE 4.3Å; Y104-M137 HydrophobicContact CD1-SD 4.12Å; Y104-M137 HydrophobicContact CD2-SD 4.22Å; Y104-M137 HydrophobicContact CE1-CE 4.23Å; Y104-M137 HydrophobicContact CE1-SD 4.24Å; Y104-M137 HydrophobicContact CE2-SD 4.36Å; Y104-M137 HydrophobicContact CG-SD 4.11Å; Y104-I276 WeakPolarHBondContact O-CA 3.5Å; Y104-L277 PolarHBondContact N-O 3.28Å; Y104-L277 PolarHBondContact O-N 3.44Å; Y104-M279 HydrophobicContact CD2-CB 4.41Å; Y104-M279 HydrophobicContact CD2-CG 4.1Å; Y104-M279 HydrophobicContact CD2-SD 4.02Å; Y104-M279 HydrophobicContact CE2-CB 4.22Å; Y104-M279 HydrophobicContact CE2-CG 4.33Å; Y104-M279 HydrophobicContact CE2-SD 4.15Å
105	K	90.9	Very high	69.1	Low	56 Å²	56	63.7 Å²	63.7	24%	0.243	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.6	176.5	166.9	-179.3	171.8	-171.7	0	110.9	L70 N107 H274 L275	L70-K105 HydrophobicContact CD1-CB 3.39Å; L70-K105 HydrophobicContact CD1-CD 4.04Å; L70-K105 HydrophobicContact CD1-CG 4.32Å; K105-N107 WeakPolarHBondContact CE-OD1 3.31Å; K105-H274 HydrophobicContact CG-CB 4.19Å; K105-L275 CarbonylContact C-O 3.58Å; K105-L275 VanDerWaalsContact CA-O 3.3Å; K105-L275 WeakPolarHBondContact CA-O 3.32Å
106	F	90.6	Very high	68.6	Low	25 Å²	25	63.4 Å²	63.4	11%	0.11	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	110.5	176.3	-62.2	-90.3	0	0	0	109.1	N133 V134 M137 H274 L275 L277	F106-N133 WeakPolarHBondContact CD1-O 3.12Å; F106-V134 HydrophobicContact CD1-CG1 4.32Å; F106-V134 HydrophobicContact CD2-CG1 4.3Å; F106-V134 HydrophobicContact CG-CG1 4.14Å; F106-M137 HydrophobicContact CE1-CG 4.36Å; F106-M137 HydrophobicContact CE2-CG 4.02Å; F106-M137 HydrophobicContact CZ-CE 4.49Å; F106-M137 HydrophobicContact CZ-CG 3.42Å; F106-M137 VanDerWaalsContact CZ-CG 3.42Å; F106-M137 HydrophobicContact CZ-SD 4.24Å; F106-H274 CarbonylContact O-C 3.37Å; F106-H274 WeakPolarHBondContact O-CA 3.47Å; F106-H274 VanDerWaalsContact O-CB 3.28Å; F106-H274 WeakPolarHBondContact O-CB 3.44Å; F106-L275 HydrophobicContact CB-CB 4.32Å; F106-L275 PolarHBondContact N-O 3.41Å; F106-L275 PolarHBondContact O-N 2.84Å; F106-L277 HydrophobicContact CD2-CD1 3.99Å; F106-L277 HydrophobicContact CD2-CD2 4.41Å; F106-L277 HydrophobicContact CE2-CB 4.46Å; F106-L277 HydrophobicContact CE2-CD1 4.27Å; F106-L277 HydrophobicContact CE2-CD2 3.92Å; F106-L277 HydrophobicContact CE2-CG 4.45Å
107	N	88.3	Confident	67.9	Low	67 Å²	67	69.1 Å²	69.1	36%	0.358	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	150.5	175	-67.8	-25	0	0	0	110.6	K105	K105-N107 WeakPolarHBondContact CE-OD1 3.31Å
108	M	86.9	Confident	67.2	Low	22 Å²	22	71.1 Å²	71.1	11%	0.108	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-58.8	142.4	171.1	-177.8	-175.7	73.2	0	0	110.9	F130 R131 F132 M251 P273	M108-F130 HydrophobicContact SD-CB 4.27Å; M108-F130 HydrophobicContact SD-CD1 3.55Å; M108-F130 VanDerWaalsContact SD-CD1 3.55Å; M108-F130 HydrophobicContact SD-CE1 4.32Å; M108-F130 HydrophobicContact SD-CG 4.29Å; M108-R131 WeakPolarHBondContact CA-O 3.5Å; M108-F132 HydrophobicContact CB-CE1 3.92Å; M108-F132 HydrophobicContact CB-CZ 4.49Å; M108-M251 HydrophobicContact CE-SD 3.9Å; M108-M251 HydrophobicContact SD-CE 4.21Å; M108-M251 HydrophobicContact SD-SD 3.81Å; M108-P273 HydrophobicContact CB-CB 4.34Å; M108-P273 VanDerWaalsContact CB-O 3.23Å; M108-P273 WeakPolarHBondContact CB-O 3.47Å; M108-P273 HydrophobicContact CE-CG 4.48Å; M108-P273 PolarHBondContact N-O 3.44Å; M108-P273 HydrophobicContact SD-CB 4.43Å; M108-P273 HydrophobicContact SD-CG 4.3Å
109	I	83.6	Confident	66.5	Low	88 Å²	88	70.9 Å²	70.9	45%	0.451	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-100.5	124.9	173.9	-57.4	172.5	0	0	0	109	R131 N133	I109-R131 PolarHBondContact N-O 2.74Å; I109-N133 HydrophobicContact CD1-CB 3.35Å
110	S	66.3	Low	65.2	Low	97 Å²	97	75 Å²	75	68%	0.678	41%	0.406	S	S	*	.			trans	-90.9	113.5	173.1	-64.1	0	0	0	0	109.8
111	G	54	Low	63.6	Low	41 Å²	41	78.8 Å²	78.8	42%	0.423	43%	0.432	S	S	.	.	S	Bend	trans	166.5	157.3	174.5	0	0	0	0	0	114.3	R131	G111-R131 PolarHBondContact O-NH1 2.8Å
112	P	46.7	Very low	61.5	Low	115 Å²	115	85.6 Å²	85.6	75%	0.747	47%	0.469	S	S	*	.	S	Bend	trans	-60.8	147.9	164.6	28.6	-31.2	0	0	0	108.9	E114	P112-E114 PolarHBondContact O-N 3.43Å
113	P	47.2	Very low	59.7	Low	50 Å²	50	88 Å²	88	33%	0.325	48%	0.483	S	S	.	.			trans	-66.6	131.4	-177.1	30.6	-27	0	0	0	108	N115 N116 R131	P113-N115 PolarHBondContact O-N 3Å; P113-N116 HydrophobicContact CB-CB 4.38Å; P113-N116 HydrophobicContact CG-CB 4.11Å; P113-N116 WeakPolarHBondContact CG-O 3.48Å; P113-R131 VanDerWaalsContact N-NH1 3.15Å
114	E	45.1	Very low	58	Low	193 Å²	193	94.5 Å²	94.5	90%	0.902	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-7	-178.6	-72.7	-176.8	162.6	0	0	113.6	P112	P112-E114 PolarHBondContact O-N 3.43Å
115	N	40.9	Very low	56.6	Low	155 Å²	155	97 Å²	97	83%	0.829	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-155.5	32.3	-175.8	-95.2	-35	0	0	0	116.4	P113	P113-N115 PolarHBondContact O-N 3Å
116	N	38.5	Very low	55.6	Low	80 Å²	80	95 Å²	95	43%	0.428	52%	0.515	S	S	.	.			trans	-141.2	113.5	169.5	-85	-38.9	0	0	0	111.1	P113 L118	P113-N116 HydrophobicContact CB-CB 4.38Å; P113-N116 HydrophobicContact CG-CB 4.11Å; P113-N116 WeakPolarHBondContact CG-O 3.48Å; N116-L118 HydrophobicContact CB-CD1 4.04Å; N116-L118 HydrophobicContact CB-CG 4.41Å; N116-L118 PolarHBondContact O-N 3.08Å
117	D	35.4	Very low	55	Low	180 Å²	180	94.2 Å²	94.2	96%	0.963	51%	0.513	S	S	*	.			trans	-64.9	57.4	163.4	-77	-33.8	0	0	0	110.9	S119	D117-S119 PolarHBondContact O-N 3.19Å; D117-S119 VanDerWaalsContact O-N 3.11Å
118	L	42.4	Very low	54.8	Low	64 Å²	64	94.3 Å²	94.3	34%	0.335	51%	0.51	S	S	.	.			trans	-79	94.3	166.9	-89.3	155.1	0	0	0	107	N116 Y120 K174 L217	N116-L118 HydrophobicContact CB-CD1 4.04Å; N116-L118 HydrophobicContact CB-CG 4.41Å; N116-L118 PolarHBondContact O-N 3.08Å; L118-Y120 PolarHBondContact O-N 2.87Å; L118-K174 HydrophobicContact CD2-CD 4.1Å; L118-K174 HydrophobicContact CD2-CG 4.34Å; L118-L217 HydrophobicContact CD1-CD2 4.29Å
119	S	40.6	Very low	54.8	Low	85 Å²	85	95.9 Å²	95.9	59%	0.594	52%	0.521	S	S	*	.			trans	-43.4	111	167.8	68.8	0	0	0	0	109.4	D117 C121 K174	D117-S119 PolarHBondContact O-N 3.19Å; D117-S119 VanDerWaalsContact O-N 3.11Å; S119-C121 PolarHBondContact O-N 3.45Å; S119-K174 PolarHBondContact OG-NZ 2.93Å
120	Y	41.2	Very low	55	Low	152 Å²	152	91.7 Å²	91.7	60%	0.596	50%	0.499	S	S	*	.			trans	-53.6	115.8	-173.7	-150.6	-102.2	0	0	0	110.7	L118 N122 R124	L118-Y120 PolarHBondContact O-N 2.87Å; Y120-N122 PolarHBondContact O-N 3.28Å; Y120-R124 HydrophobicContact CE1-CG 3.96Å; Y120-R124 PolarHBondContact OH-NE 2.78Å; Y120-R124 PolarHBondContact OH-NH2 3.24Å
121	C	41.1	Very low	56	Low	80 Å²	80	90.3 Å²	90.3	54%	0.541	48%	0.48	S	S	.	.			trans	-67.8	128.9	162.7	-73.8	0	0	0	0	107.2	S119 N123	S119-C121 PolarHBondContact O-N 3.45Å; C121-N123 PolarHBondContact O-N 2.89Å
122	N	42.5	Very low	57.8	Low	146 Å²	146	88.7 Å²	88.7	78%	0.781	46%	0.461	S	S	*	.	S	Bend	trans	-68.8	23.2	-177.3	-126.3	5.5	0	0	0	114	Y120 R124	Y120-N122 PolarHBondContact O-N 3.28Å; N122-R124 VanDerWaalsContact C-N 3.35Å; N122-R124 PolarHBondContact O-N 2.89Å
123	N	49.2	Very low	59.8	Low	83 Å²	83	87.3 Å²	87.3	44%	0.444	45%	0.447	S	S	.	.			trans	-90.1	29	-168.4	-71.9	2.3	0	0	0	114.3	C121 I125 T126 S127	C121-N123 PolarHBondContact O-N 2.89Å; N123-I125 PolarHBondContact O-N 3.04Å; N123-T126 PolarHBondContact O-N 2.79Å; N123-S127 PolarHBondContact O-N 2.8Å; N123-S127 PolarHBondContact O-OG 2.65Å
124	R	54.4	Low	61.8	Low	145 Å²	145	85 Å²	85	55%	0.547	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.6	176.6	-73.8	-171.3	-176.9	-152.9	-1.2	113.8	Y120 N122	Y120-R124 HydrophobicContact CE1-CG 3.96Å; Y120-R124 PolarHBondContact OH-NE 2.78Å; Y120-R124 PolarHBondContact OH-NH2 3.24Å; N122-R124 VanDerWaalsContact C-N 3.35Å; N122-R124 PolarHBondContact O-N 2.89Å
125	I	62.8	Low	63.8	Low	112 Å²	112	78.6 Å²	78.6	57%	0.574	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-26.9	-172.3	-31.7	-178.6	0	0	0	112.2	N123 L243 L244	N123-I125 PolarHBondContact O-N 3.04Å; I125-L243 HydrophobicContact CB-CD2 4.09Å; I125-L243 HydrophobicContact CG2-CD1 4.12Å; I125-L243 HydrophobicContact CG2-CD2 3.41Å; I125-L243 VanDerWaalsContact CG2-CD2 3.41Å; I125-L243 HydrophobicContact CG2-CG 4.23Å; I125-L244 PolarHBondContact O-N 3.44Å
126	T	69.2	Low	65.9	Low	14 Å²	14	77.4 Å²	77.4	9%	0.086	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-12	-177.8	61.8	0	0	0	0	113.3	N123 V223 N241 E242 L243	N123-T126 PolarHBondContact O-N 2.79Å; T126-V223 PolarHBondContact O-N 2.81Å; T126-N241 HydrophobicContact CG2-CB 4.49Å; T126-E242 VanDerWaalsContact CG2-O 3.28Å; T126-E242 WeakPolarHBondContact CG2-O 3.46Å; T126-L243 HydrophobicContact CG2-CD2 4.37Å
127	S	79.4	Confident	68.2	Low	9 Å²	9	74.3 Å²	74.3	6%	0.063	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	157.2	-173.9	66.3	0	0	0	0	112.7	N123 E220 I221	N123-S127 PolarHBondContact O-N 2.8Å; N123-S127 PolarHBondContact O-OG 2.65Å; S127-E220 WeakPolarHBondContact CB-OE1 3.4Å; S127-E220 PolarHBondContact OG-OE1 2.91Å; S127-I221 CarbonylContact C-O 3.46Å; S127-I221 VanDerWaalsContact CA-O 3.24Å; S127-I221 WeakPolarHBondContact CA-O 3.18Å
128	K	84.2	Confident	70.4	Confident	69 Å²	69	69.1 Å²	69.1	30%	0.3	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	133.1	173.8	-67.9	-65.2	-175.4	-176.3	0	109.3	F130 E220 I221 L244 M251	K128-F130 HydrophobicContact CB-CE2 3.9Å; K128-F130 HydrophobicContact CB-CZ 3.99Å; K128-F130 WeakPolarHBondContact O-CE2 3.45Å; K128-E220 CarbonylContact O-C 3.58Å; K128-E220 WeakPolarHBondContact O-CA 3.5Å; K128-I221 PolarHBondContact N-O 2.98Å; K128-I221 PolarHBondContact O-N 2.77Å; K128-L244 HydrophobicContact CB-CD2 4.3Å; K128-L244 HydrophobicContact CG-CD2 3.59Å; K128-M251 HydrophobicContact CB-CE 3.87Å; K128-M251 HydrophobicContact CD-CE 4.24Å; K128-M251 HydrophobicContact CD-CG 4.09Å
129	V	85.4	Confident	72.2	Confident	55 Å²	55	75.7 Å²	75.7	33%	0.333	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.2	-176.9	176.4	0	0	0	0	110.6	R131 I171 L219 E220 M251	V129-R131 HydrophobicContact CG1-CG 4.29Å; V129-I171 HydrophobicContact CB-CD1 4.46Å; V129-I171 HydrophobicContact CG1-CD1 3.55Å; V129-I171 HydrophobicContact CG2-CD1 4.14Å; V129-L219 CarbonylContact C-O 3.56Å; V129-L219 WeakPolarHBondContact CA-O 3.45Å; V129-E220 HydrophobicContact CG2-CB 4.42Å; V129-E220 HydrophobicContact CG2-CG 4.23Å; V129-M251 WeakPolarHBondContact O-CE 3.48Å
130	F	88.6	Confident	74	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.8	-178.3	-53.7	-94.2	0	0	0	109.4	M108 K128 F132 F149 G218 L219 I221 F248 M251 P273	M108-F130 HydrophobicContact SD-CB 4.27Å; M108-F130 HydrophobicContact SD-CD1 3.55Å; M108-F130 VanDerWaalsContact SD-CD1 3.55Å; M108-F130 HydrophobicContact SD-CE1 4.32Å; M108-F130 HydrophobicContact SD-CG 4.29Å; K128-F130 HydrophobicContact CB-CE2 3.9Å; K128-F130 HydrophobicContact CB-CZ 3.99Å; K128-F130 WeakPolarHBondContact O-CE2 3.45Å; F130-F132 HydrophobicContact CB-CE2 3.76Å; F130-F132 HydrophobicContact CB-CZ 3.84Å; F130-F149 HydrophobicContact CB-CE2 4.33Å; F130-F149 HydrophobicContact CB-CZ 4.45Å; F130-F149 HydrophobicContact CD1-CE2 4.09Å; F130-F149 AromaticContact CD1-CZ 3.84Å; F130-F149 HydrophobicContact CD1-CZ 3.84Å; F130-F149 HydrophobicContact CD2-CZ 4.03Å; F130-F149 HydrophobicContact CE1-CZ 4.05Å; F130-F149 HydrophobicContact CE2-CZ 4.26Å; F130-F149 HydrophobicContact CG-CE2 4.12Å; F130-F149 AromaticContact CG-CZ 3.83Å; F130-F149 HydrophobicContact CG-CZ 3.83Å; F130-F149 HydrophobicContact CZ-CZ 4.26Å; F130-G218 CarbonylContact O-C 3.52Å; F130-G218 WeakPolarHBondContact O-CA 3.33Å; F130-L219 HydrophobicContact CB-CB 4.47Å; F130-L219 PolarHBondContact N-O 2.95Å; F130-L219 PolarHBondContact O-N 3.16Å; F130-I221 HydrophobicContact CD2-CD1 4.34Å; F130-I221 HydrophobicContact CD2-CG1 4.21Å; F130-I221 HydrophobicContact CE2-CB 3.87Å; F130-I221 HydrophobicContact CE2-CD1 3.42Å; F130-I221 VanDerWaalsContact CE2-CD1 3.42Å; F130-I221 HydrophobicContact CE2-CG1 3.5Å; F130-I221 VanDerWaalsContact CE2-CG1 3.5Å; F130-I221 HydrophobicContact CZ-CD1 3.64Å; F130-I221 HydrophobicContact CZ-CG1 4.24Å; F130-F248 HydrophobicContact CZ-CD2 4.3Å; F130-M251 HydrophobicContact CD1-CE 4.2Å; F130-M251 HydrophobicContact CD1-SD 3.93Å; F130-M251 HydrophobicContact CE1-CE 4Å; F130-M251 HydrophobicContact CE1-SD 3.43Å; F130-M251 WeakPolarHBondContact CE1-SD 3.49Å; F130-M251 HydrophobicContact CZ-CE 4.21Å; F130-M251 HydrophobicContact CZ-SD 3.99Å; F130-P273 HydrophobicContact CD1-CB 3.7Å; F130-P273 HydrophobicContact CD1-CG 3.9Å; F130-P273 HydrophobicContact CE1-CB 3.88Å; F130-P273 HydrophobicContact CE1-CG 3.67Å
131	R	87.8	Confident	75.7	Confident	69 Å²	69	67.3 Å²	67.3	26%	0.26	34%	0.34	S	S	.	.			trans	-123.8	145	-177.9	-67.4	178.9	177.3	165.9	-4.6	111.1	M108 I109 G111 P113 V129	M108-R131 WeakPolarHBondContact CA-O 3.5Å; I109-R131 PolarHBondContact N-O 2.74Å; G111-R131 PolarHBondContact O-NH1 2.8Å; P113-R131 VanDerWaalsContact N-NH1 3.15Å; V129-R131 HydrophobicContact CG1-CG 4.29Å
132	F	90.6	Very high	77.4	Confident	7 Å²	7	69 Å²	69	3%	0.031	35%	0.348	C	S	.	.			trans	-139.3	141.2	-175	-54	-80.1	0	0	0	110.1	M108 F130 V134 F149 W209 N216 L219 L275	M108-F132 HydrophobicContact CB-CE1 3.92Å; M108-F132 HydrophobicContact CB-CZ 4.49Å; F130-F132 HydrophobicContact CB-CE2 3.76Å; F130-F132 HydrophobicContact CB-CZ 3.84Å; F132-V134 HydrophobicContact CB-CG1 4.43Å; F132-F149 HydrophobicContact CE2-CD2 4.23Å; F132-F149 HydrophobicContact CE2-CE2 4.36Å; F132-F149 AromaticContact CZ-CD2 3.75Å; F132-F149 HydrophobicContact CZ-CD2 3.75Å; F132-F149 AromaticContact CZ-CE2 3.7Å; F132-F149 HydrophobicContact CZ-CE2 3.7Å; F132-W209 HydrophobicContact CD2-CH2 4.35Å; F132-W209 HydrophobicContact CD2-CZ3 4.26Å; F132-N216 PolarHBondContact O-ND2 2.97Å; F132-L219 HydrophobicContact CE2-CD1 4.14Å; F132-L275 HydrophobicContact CB-CD1 3.65Å; F132-L275 HydrophobicContact CB-CG 4.43Å; F132-L275 HydrophobicContact CD1-CD1 3.89Å; F132-L275 HydrophobicContact CD1-CG 3.72Å; F132-L275 HydrophobicContact CD2-CD1 3.57Å; F132-L275 HydrophobicContact CD2-CD2 4.3Å; F132-L275 HydrophobicContact CD2-CG 3.85Å; F132-L275 HydrophobicContact CE1-CD1 4.48Å; F132-L275 HydrophobicContact CE1-CG 3.87Å; F132-L275 HydrophobicContact CE2-CD1 4.19Å; F132-L275 HydrophobicContact CE2-CD2 4.09Å; F132-L275 HydrophobicContact CE2-CG 3.99Å; F132-L275 HydrophobicContact CG-CD1 3.39Å; F132-L275 HydrophobicContact CG-CG 3.71Å; F132-L275 HydrophobicContact CZ-CD2 4.24Å; F132-L275 HydrophobicContact CZ-CG 3.99Å
133	N	89.3	Confident	79.4	Confident	86 Å²	86	62.4 Å²	62.4	46%	0.46	31%	0.313	S	S	.	.			trans	-100.6	106.4	168.6	-176.5	-14.5	0	0	0	108.6	F106 I109 S135	F106-N133 WeakPolarHBondContact CD1-O 3.12Å; I109-N133 HydrophobicContact CD1-CB 3.35Å; N133-S135 WeakPolarHBondContact OD1-CB 3.13Å; N133-S135 PolarHBondContact OD1-N 3.02Å; N133-S135 PolarHBondContact OD1-OG 2.72Å
134	V	89.3	Confident	81.3	Confident	1 Å²	1	59 Å²	59	1%	0.006	29%	0.294	C	S	.	.			trans	-107.2	11.5	177.8	-64.8	0	0	0	0	112.5	F106 F132 I136 M137 W209 L210 L275	F106-V134 HydrophobicContact CD1-CG1 4.32Å; F106-V134 HydrophobicContact CD2-CG1 4.3Å; F106-V134 HydrophobicContact CG-CG1 4.14Å; F132-V134 HydrophobicContact CB-CG1 4.43Å; V134-I136 PolarHBondContact O-N 2.98Å; V134-M137 PolarHBondContact O-N 2.03Å; V134-W209 HydrophobicContact CG2-CB 4.27Å; V134-W209 HydrophobicContact CG2-CE3 4.4Å; V134-L210 HydrophobicContact CB-CD2 4.13Å; V134-L210 HydrophobicContact CG2-CD2 4Å; V134-L275 HydrophobicContact CG1-CD1 4.14Å
135	S	86.3	Confident	82.7	Confident	59 Å²	59	55.2 Å²	55.2	41%	0.413	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-61.3	-24.9	-171.7	-66.1	0	0	0	0	114.2	N133 M137 E138	N133-S135 WeakPolarHBondContact OD1-CB 3.13Å; N133-S135 PolarHBondContact OD1-N 3.02Å; N133-S135 PolarHBondContact OD1-OG 2.72Å; S135-M137 PolarHBondContact O-N 3.38Å; S135-E138 VanDerWaalsContact CA-OE1 3.32Å; S135-E138 WeakPolarHBondContact CA-OE1 3.36Å; S135-E138 WeakPolarHBondContact CB-OE1 2.99Å; S135-E138 PolarHBondContact O-N 3.1Å; S135-E138 PolarHBondContact OG-OE1 3.4Å
136	I	86.3	Confident	83.9	Confident	129 Å²	129	52.6 Å²	52.6	66%	0.662	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-60.5	-27.2	175.1	-51.6	176.7	0	0	0	111.2	V134	V134-I136 PolarHBondContact O-N 2.98Å
137	M	86.3	Confident	85.1	Confident	15 Å²	15	52 Å²	52	7%	0.074	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-97.5	-5	-174.8	-60.1	-66.1	104.1	0	0	114.3	Y104 F106 V134 S135 K139 N140 L210 L277 M279	Y104-M137 HydrophobicContact CD1-CE 4.3Å; Y104-M137 HydrophobicContact CD1-SD 4.12Å; Y104-M137 HydrophobicContact CD2-SD 4.22Å; Y104-M137 HydrophobicContact CE1-CE 4.23Å; Y104-M137 HydrophobicContact CE1-SD 4.24Å; Y104-M137 HydrophobicContact CE2-SD 4.36Å; Y104-M137 HydrophobicContact CG-SD 4.11Å; F106-M137 HydrophobicContact CE1-CG 4.36Å; F106-M137 HydrophobicContact CE2-CG 4.02Å; F106-M137 HydrophobicContact CZ-CE 4.49Å; F106-M137 HydrophobicContact CZ-CG 3.42Å; F106-M137 VanDerWaalsContact CZ-CG 3.42Å; F106-M137 HydrophobicContact CZ-SD 4.24Å; V134-M137 PolarHBondContact O-N 2.03Å; S135-M137 PolarHBondContact O-N 3.38Å; M137-K139 PolarHBondContact O-N 3.2Å; M137-N140 CarbonylContact O-C 3.55Å; M137-N140 PolarHBondContact O-N 2.65Å; M137-L210 HydrophobicContact CB-CD2 3.65Å; M137-L277 HydrophobicContact CG-CD2 4.44Å; M137-M279 HydrophobicContact CB-SD 4.38Å; M137-M279 HydrophobicContact CG-SD 4.22Å; M137-M279 HydrophobicContact SD-SD 3.64Å; M137-M279 VanDerWaalsContact SD-SD 3.64Å
138	E	82.6	Confident	85.8	Confident	72 Å²	72	51.7 Å²	51.7	34%	0.336	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-56	-37.7	-176.2	-74.6	170.8	-163.6	0	0	112.4	S135 N140 A141	S135-E138 VanDerWaalsContact CA-OE1 3.32Å; S135-E138 WeakPolarHBondContact CA-OE1 3.36Å; S135-E138 WeakPolarHBondContact CB-OE1 2.99Å; S135-E138 PolarHBondContact O-N 3.1Å; S135-E138 PolarHBondContact OG-OE1 3.4Å; E138-N140 PolarHBondContact O-N 2.75Å; E138-N140 VanDerWaalsContact O-N 3.08Å; E138-A141 PolarHBondContact O-N 3.41Å
139	K	78.6	Confident	86.4	Confident	201 Å²	201	48.4 Å²	48.4	87%	0.874	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-62.5	-18	177.3	-64.9	-176.6	-179.8	179.7	0	114	M137	M137-K139 PolarHBondContact O-N 3.2Å
140	N	78.2	Confident	86.8	Confident	53 Å²	53	46 Å²	46	28%	0.283	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-117	25.3	-175.8	-64.8	-39.8	0	0	0	111.7	M137 E138 T142 N143 M279	M137-N140 CarbonylContact O-C 3.55Å; M137-N140 PolarHBondContact O-N 2.65Å; E138-N140 PolarHBondContact O-N 2.75Å; E138-N140 VanDerWaalsContact O-N 3.08Å; N140-T142 VanDerWaalsContact C-N 3.28Å; N140-T142 PolarHBondContact O-N 2.92Å; N140-N143 HydrophobicContact CB-CB 4.38Å; N140-N143 VanDerWaalsContact O-CB 3.24Å; N140-N143 WeakPolarHBondContact O-CB 3.04Å; N140-N143 PolarHBondContact O-N 2.63Å; N140-M279 HydrophobicContact CB-CE 3.52Å; N140-M279 WeakPolarHBondContact O-CE 3.38Å
141	A	77.6	Confident	86.9	Confident	9 Å²	9	46 Å²	46	7%	0.074	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-53.3	-39.3	-173.9	0	0	0	0	0	114.4	E138 N143 L144 L210 M211	E138-A141 PolarHBondContact O-N 3.41Å; A141-N143 PolarHBondContact O-N 3.26Å; A141-L144 PolarHBondContact O-N 3.08Å; A141-L210 HydrophobicContact CB-CB 3.62Å; A141-M211 HydrophobicContact CB-CE 4.06Å; A141-M211 HydrophobicContact CB-CG 4.26Å; A141-M211 HydrophobicContact CB-SD 3.73Å
142	T	78.1	Confident	87	Confident	114 Å²	114	43.9 Å²	43.9	70%	0.699	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-67.5	-15.9	179.2	53.2	0	0	0	0	114	N140 M211	N140-T142 VanDerWaalsContact C-N 3.28Å; N140-T142 PolarHBondContact O-N 2.92Å; T142-M211 HydrophobicContact CG2-CE 4.13Å
143	N	84.4	Confident	87	Confident	8 Å²	8	43.6 Å²	43.6	4%	0.043	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-91.5	-4.6	-173.1	-61.4	-4.8	0	0	0	112.3	N140 A141 F145 M279 I280 L285	N140-N143 HydrophobicContact CB-CB 4.38Å; N140-N143 VanDerWaalsContact O-CB 3.24Å; N140-N143 WeakPolarHBondContact O-CB 3.04Å; N140-N143 PolarHBondContact O-N 2.63Å; A141-N143 PolarHBondContact O-N 3.26Å; N143-F145 PolarHBondContact O-N 2.75Å; N143-M279 HydrophobicContact CB-CE 3.91Å; N143-M279 CarbonylContact O-C 3.55Å; N143-M279 VanDerWaalsContact O-CA 3.31Å; N143-M279 WeakPolarHBondContact O-CA 3.44Å; N143-I280 VanDerWaalsContact CB-O 3.23Å; N143-I280 WeakPolarHBondContact CB-O 3.41Å; N143-I280 PolarHBondContact O-N 2.85Å; N143-L285 VanDerWaalsContact OD1-CD1 3.25Å; N143-L285 WeakPolarHBondContact OD1-CD1 3.42Å
144	L	87.1	Confident	87	Confident	11 Å²	11	41 Å²	41	6%	0.058	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	114.4	179.7	-177.1	67.2	0	0	0	110.4	A141 A147 T203 V206 R207 L210 L277 M279	A141-L144 PolarHBondContact O-N 3.08Å; L144-A147 HydrophobicContact CD1-CB 4.27Å; L144-A147 HydrophobicContact CD2-CB 4.47Å; L144-T203 HydrophobicContact CD2-CG2 4.42Å; L144-V206 HydrophobicContact CD2-CB 4.18Å; L144-V206 HydrophobicContact CD2-CG1 3.96Å; L144-R207 HydrophobicContact CD2-CB 4.06Å; L144-L210 HydrophobicContact CB-CD1 4.3Å; L144-L210 HydrophobicContact CD2-CD1 4.17Å; L144-L277 HydrophobicContact CD1-CB 4.21Å; L144-L277 HydrophobicContact CD1-CD2 4.23Å; L144-L277 HydrophobicContact CD1-CG 3.93Å; L144-M279 HydrophobicContact CD1-CG 4.36Å
145	F	84.3	Confident	87	Confident	67 Å²	67	45.3 Å²	45.3	29%	0.294	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	-49.4	175.7	177	-102.6	0	0	0	111.4	K101 N143 M278 I280	K101-F145 HydrophobicContact CD-CD1 4.43Å; K101-F145 HydrophobicContact CG-CB 4.45Å; K101-F145 HydrophobicContact CG-CD1 4.25Å; K101-F145 HydrophobicContact CG-CG 4.39Å; N143-F145 PolarHBondContact O-N 2.75Å; F145-M278 WeakPolarHBondContact CA-O 3.15Å; F145-M278 WeakPolarHBondContact CB-O 3.39Å; F145-M278 HydrophobicContact CD1-CB 4.4Å; F145-M278 PolarHBondContact N-O 3.33Å; F145-I280 HydrophobicContact CB-CD1 4.22Å; F145-I280 HydrophobicContact CB-CG1 4.13Å; F145-I280 HydrophobicContact CD2-CD1 4.05Å; F145-I280 HydrophobicContact CG-CD1 4.48Å
146	R	89.3	Confident	86.9	Confident	57 Å²	57	43.1 Å²	43.1	22%	0.215	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	144.8	-180	-169	171.4	-173.8	74.7	5.7	110.4	E148 D201 T203 M278	R146-E148 HydrophobicContact CG-CG 4.35Å; R146-E148 IonicContact CZ-OE1 3.61Å; R146-E148 IonicContact NE-OE1 2.75Å; R146-E148 PolarHBondContact NE-OE1 3.32Å; R146-E148 IonicContact NH2-OE1 3.54Å; R146-E148 PolarHBondContact NH2-OE1 2.56Å; R146-D201 IonicContact CZ-OD2 3.62Å; R146-D201 IonicContact NH1-OD2 3.9Å; R146-D201 PolarHBondContact NH1-OD2 2.85Å; R146-D201 IonicContact NH2-OD2 3.61Å; R146-D201 PolarHBondContact NH2-OD2 2.9Å; R146-T203 WeakPolarHBondContact CA-OG1 3.34Å; R146-M278 HydrophobicContact CB-CB 4.32Å; R146-M278 HydrophobicContact CB-SD 4.17Å; R146-M278 PolarHBondContact N-O 3.06Å; R146-M278 PolarHBondContact O-N 3.46Å
147	A	93.6	Very high	86.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.1	169.8	0	0	0	0	0	110.8	L144 V202 T203 V206 I276 L277	L144-A147 HydrophobicContact CD1-CB 4.27Å; L144-A147 HydrophobicContact CD2-CB 4.47Å; A147-V202 HydrophobicContact CB-CG2 4.13Å; A147-V202 PolarHBondContact O-N 2.83Å; A147-T203 PolarHBondContact N-OG1 3.09Å; A147-T203 PolarHBondContact O-N 2.88Å; A147-T203 PolarHBondContact O-OG1 3.17Å; A147-V206 HydrophobicContact CB-CB 3.82Å; A147-V206 HydrophobicContact CB-CG1 4.12Å; A147-V206 HydrophobicContact CB-CG2 3.79Å; A147-I276 WeakPolarHBondContact CA-O 3.41Å; A147-L277 HydrophobicContact CB-CD1 4.22Å; A147-L277 HydrophobicContact CB-CG 4.21Å
148	E	94.9	Very high	86.6	Confident	3 Å²	3	46.2 Å²	46.2	1%	0.014	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.8	-177.4	-71.6	-73.2	174.7	0	0	109.7	L77 R146 F200 D201 L275 I276	L77-E148 HydrophobicContact CD1-CB 4.05Å; L77-E148 HydrophobicContact CD1-CG 3.92Å; L77-E148 HydrophobicContact CD2-CB 3.73Å; L77-E148 HydrophobicContact CD2-CG 3.85Å; L77-E148 HydrophobicContact CG-CG 4.39Å; R146-E148 HydrophobicContact CG-CG 4.35Å; R146-E148 IonicContact CZ-OE1 3.61Å; R146-E148 IonicContact NE-OE1 2.75Å; R146-E148 PolarHBondContact NE-OE1 3.32Å; R146-E148 IonicContact NH2-OE1 3.54Å; R146-E148 PolarHBondContact NH2-OE1 2.56Å; E148-F200 VanDerWaalsContact OE2-O 3.05Å; E148-D201 PolarHBondContact OE2-N 2.97Å; E148-L275 WeakPolarHBondContact O-CA 3.33Å; E148-I276 PolarHBondContact N-O 3.47Å; E148-I276 PolarHBondContact O-N 2.88Å
149	F	95.3	Very high	86.6	Confident	1 Å²	1	43 Å²	43	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	128	171	166.9	-114.7	0	0	0	109.3	F130 F132 A151 L168 S199 F200 V202 L219 I221 P273 L275	F130-F149 HydrophobicContact CB-CE2 4.33Å; F130-F149 HydrophobicContact CB-CZ 4.45Å; F130-F149 HydrophobicContact CD1-CE2 4.09Å; F130-F149 AromaticContact CD1-CZ 3.84Å; F130-F149 HydrophobicContact CD1-CZ 3.84Å; F130-F149 HydrophobicContact CD2-CZ 4.03Å; F130-F149 HydrophobicContact CE1-CZ 4.05Å; F130-F149 HydrophobicContact CE2-CZ 4.26Å; F130-F149 HydrophobicContact CG-CE2 4.12Å; F130-F149 AromaticContact CG-CZ 3.83Å; F130-F149 HydrophobicContact CG-CZ 3.83Å; F130-F149 HydrophobicContact CZ-CZ 4.26Å; F132-F149 HydrophobicContact CE2-CD2 4.23Å; F132-F149 HydrophobicContact CE2-CE2 4.36Å; F132-F149 AromaticContact CZ-CD2 3.75Å; F132-F149 HydrophobicContact CZ-CD2 3.75Å; F132-F149 AromaticContact CZ-CE2 3.7Å; F132-F149 HydrophobicContact CZ-CE2 3.7Å; F149-A151 HydrophobicContact CE1-CB 4.38Å; F149-A151 HydrophobicContact CZ-CB 3.92Å; F149-L168 HydrophobicContact CD1-CD1 4.09Å; F149-L168 HydrophobicContact CD1-CD2 4.11Å; F149-L168 HydrophobicContact CE1-CD1 4.04Å; F149-S199 CarbonylContact O-C 3.6Å; F149-S199 VanDerWaalsContact O-CA 3.23Å; F149-S199 WeakPolarHBondContact O-CA 3.47Å; F149-F200 HydrophobicContact CD1-CB 4.48Å; F149-F200 HydrophobicContact CD1-CD2 4.09Å; F149-F200 HydrophobicContact CE1-CD2 4.48Å; F149-F200 PolarHBondContact N-O 3.37Å; F149-F200 PolarHBondContact O-N 3.32Å; F149-V202 HydrophobicContact CB-CG1 3.91Å; F149-V202 HydrophobicContact CB-CG2 3.95Å; F149-L219 HydrophobicContact CB-CD1 3.96Å; F149-L219 HydrophobicContact CD1-CD1 4.19Å; F149-L219 HydrophobicContact CD2-CD1 4.1Å; F149-L219 HydrophobicContact CG-CD1 3.8Å; F149-I221 HydrophobicContact CE1-CD1 3.82Å; F149-I221 HydrophobicContact CE1-CG1 4.34Å; F149-I221 HydrophobicContact CZ-CD1 4.21Å; F149-P273 HydrophobicContact CE2-CB 4.01Å; F149-P273 HydrophobicContact CZ-CB 4.42Å; F149-L275 HydrophobicContact CB-CD2 3.69Å; F149-L275 HydrophobicContact CD2-CD2 4Å; F149-L275 HydrophobicContact CG-CD2 4.29Å
150	R	93.6	Very high	86.8	Confident	3 Å²	3	42.2 Å²	42.2	1%	0.011	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	134.4	179.8	-54.7	-162.5	84.4	-174.1	9	111.9	S73 E80 W197 I198 P273 H274	S73-R150 PolarHBondContact O-NH1 2.95Å; S73-R150 PolarHBondContact OG-NH1 2.75Å; E80-R150 IonicContact OE2-CZ 3.73Å; E80-R150 IonicContact OE2-NH2 3.77Å; E80-R150 PolarHBondContact OE2-NH2 3.48Å; R150-W197 HydrophobicContact CB-CE3 4.18Å; R150-W197 HydrophobicContact CB-CZ3 4.44Å; R150-I198 WeakPolarHBondContact CA-O 3.18Å; R150-P273 CarbonylContact O-C 3.51Å; R150-P273 VanDerWaalsContact O-CA 3.28Å; R150-P273 WeakPolarHBondContact O-CA 3.3Å; R150-H274 PolarHBondContact N-O 3.31Å; R150-H274 PolarHBondContact O-N 3.25Å
151	A	91.9	Very high	86.9	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	138.1	172.7	0	0	0	0	0	110.5	F149 R153 I198 F248 P273	F149-A151 HydrophobicContact CE1-CB 4.38Å; F149-A151 HydrophobicContact CZ-CB 3.92Å; A151-R153 PolarHBondContact O-N 3.27Å; A151-I198 PolarHBondContact N-O 3.36Å; A151-I198 PolarHBondContact O-N 2.95Å; A151-F248 HydrophobicContact CB-CD1 3.6Å; A151-F248 HydrophobicContact CB-CE1 3.91Å; A151-F248 HydrophobicContact CB-CG 4.42Å; A151-P273 HydrophobicContact CB-CB 4.15Å; A151-P273 HydrophobicContact CB-CG 4.32Å
152	L	90.6	Very high	87.2	Confident	24 Å²	24	48.4 Å²	48.4	13%	0.126	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	113.5	178.1	-176.8	66.9	0	0	0	109.6	P195 W197 F248 E249 P271	L152-P195 HydrophobicContact CD1-CB 4.19Å; L152-W197 HydrophobicContact CB-CD2 4.18Å; L152-W197 HydrophobicContact CB-CE3 3.87Å; L152-W197 HydrophobicContact CB-CH2 3.87Å; L152-W197 HydrophobicContact CB-CZ2 4.19Å; L152-W197 HydrophobicContact CB-CZ3 3.71Å; L152-W197 HydrophobicContact CD1-CD2 3.93Å; L152-W197 HydrophobicContact CD1-CE3 4.45Å; L152-W197 HydrophobicContact CD1-CG 4.14Å; L152-W197 HydrophobicContact CD1-CZ2 4.37Å; L152-F248 VanDerWaalsContact O-CA 3.31Å; L152-F248 WeakPolarHBondContact O-CA 3.46Å; L152-E249 HydrophobicContact CB-CB 4.3Å; L152-E249 HydrophobicContact CD2-CB 4.13Å; L152-E249 HydrophobicContact CD2-CG 4.47Å; L152-E249 HydrophobicContact CG-CB 4.48Å; L152-E249 PolarHBondContact O-N 2.94Å; L152-P271 HydrophobicContact CD2-CB 3.85Å; L152-P271 HydrophobicContact CD2-CG 3.55Å
153	R	90.4	Very high	87.6	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	136.1	169.7	-179.1	-180	68.6	85.6	6.4	109.8	A151 L190 T194 P195 E196 I198 V246 K247	A151-R153 PolarHBondContact O-N 3.27Å; R153-L190 WeakPolarHBondContact CD-O 3.31Å; R153-L190 PolarHBondContact NE-O 3.25Å; R153-L190 PolarHBondContact NH1-O 3.33Å; R153-T194 PolarHBondContact NH2-O 3.16Å; R153-P195 WeakPolarHBondContact O-CA 3.09Å; R153-E196 VanDerWaalsContact CB-O 3.29Å; R153-E196 WeakPolarHBondContact CB-O 3.22Å; R153-E196 IonicContact CZ-OE2 2.77Å; R153-E196 PolarHBondContact N-O 3.24Å; R153-E196 IonicContact NE-OE2 3.78Å; R153-E196 PolarHBondContact NE-OE2 3.23Å; R153-E196 IonicContact NH2-OE2 3.34Å; R153-E196 PolarHBondContact NH2-OE2 2.89Å; R153-E196 PolarHBondContact O-N 2.87Å; R153-E196 VanDerWaalsContact O-N 3.13Å; R153-I198 HydrophobicContact CB-CD1 3.77Å; R153-I198 HydrophobicContact CB-CG1 4.32Å; R153-I198 HydrophobicContact CG-CD1 4.35Å; R153-V246 HydrophobicContact CG-CG1 4.08Å; R153-K247 WeakPolarHBondContact CA-O 3.38Å
154	I	88.9	Confident	87.7	Confident	30 Å²	30	47.7 Å²	47.7	15%	0.154	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	160.6	175.1	55.3	163.7	0	0	0	112	N156 K247 E249	I154-N156 PolarHBondContact O-N 2.98Å; I154-K247 HydrophobicContact CD1-CB 3.89Å; I154-K247 HydrophobicContact CG1-CB 3.56Å; I154-K247 WeakPolarHBondContact CG1-O 3.24Å; I154-K247 PolarHBondContact N-O 3.11Å; I154-E249 HydrophobicContact CG2-CB 3.82Å; I154-E249 HydrophobicContact CG2-CG 4.49Å; I154-E249 WeakPolarHBondContact CG2-OE2 3.26Å
155	H	88	Confident	87.8	Confident	93 Å²	93	52.6 Å²	52.6	43%	0.431	25%	0.25	S	C	.	.			trans	-64.1	122.7	178.4	-179.2	82.7	0	0	0	111.1	P157 G193	H155-P157 WeakPolarHBondContact O-CD 3.3Å; H155-G193 PolarHBondContact ND1-N 3.21Å
156	N	85.4	Confident	88.1	Confident	12 Å²	12	49.4 Å²	49.4	6%	0.064	24%	0.236	C	C	.	.			trans	-102.8	104.5	170.3	-174.2	4.5	0	0	0	111.2	I154 N158 A159 T191 K192 E245 K247	I154-N156 PolarHBondContact O-N 2.98Å; N156-N158 PolarHBondContact O-N 3.34Å; N156-N158 PolarHBondContact OD1-N 3.49Å; N156-A159 HydrophobicContact CB-CB 4.17Å; N156-A159 PolarHBondContact O-N 3.17Å; N156-T191 PolarHBondContact N-O 2.79Å; N156-T191 VanDerWaalsContact N-O 3.15Å; N156-K192 WeakPolarHBondContact O-CG 3.3Å; N156-E245 WeakPolarHBondContact CB-O 3.46Å; N156-E245 PolarHBondContact ND2-O 2.88Å; N156-K247 HydrophobicContact CB-CD 3.9Å; N156-K247 HydrophobicContact CB-CG 4.03Å
157	P	83	Confident	88.3	Confident	78 Å²	78	47.1 Å²	47.1	51%	0.506	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.9	179.8	27.4	-33.7	0	0	0	112.3	H155 A159	H155-P157 WeakPolarHBondContact O-CD 3.3Å; P157-A159 VanDerWaalsContact C-N 3.34Å; P157-A159 PolarHBondContact O-N 2.74Å
158	N	83.1	Confident	88.2	Confident	131 Å²	131	47.1 Å²	47.1	70%	0.701	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	0.2	-174.9	-61.2	-23.9	0	0	0	113.6	N156	N156-N158 PolarHBondContact O-N 3.34Å; N156-N158 PolarHBondContact OD1-N 3.49Å
159	A	82.3	Confident	88	Confident	4 Å²	4	48.5 Å²	48.5	3%	0.033	23%	0.233	C	C	.	.			trans	-67	137.7	-179.7	0	0	0	0	0	111.7	N156 P157 T191 K192 E245	N156-A159 HydrophobicContact CB-CB 4.17Å; N156-A159 PolarHBondContact O-N 3.17Å; P157-A159 VanDerWaalsContact C-N 3.34Å; P157-A159 PolarHBondContact O-N 2.74Å; A159-T191 HydrophobicContact CB-CG2 4.33Å; A159-K192 HydrophobicContact CB-CG 4.36Å; A159-K192 WeakPolarHBondContact O-CE 3.39Å; A159-K192 PolarHBondContact O-NZ 2.79Å; A159-E245 HydrophobicContact CB-CB 4.04Å
160	K	81.8	Confident	87.8	Confident	186 Å²	186	48.4 Å²	48.4	81%	0.809	23%	0.233	S	C	*	.	S	Bend	trans	-85.3	-38.8	178.2	-62.8	177.5	-179.6	176.9	0	111.4	E245	K160-E245 VanDerWaalsContact CB-OE1 3.3Å; K160-E245 WeakPolarHBondContact CB-OE1 3.38Å; K160-E245 WeakPolarHBondContact CG-OE1 3.46Å; K160-E245 VanDerWaalsContact N-CD 3.3Å; K160-E245 PolarHBondContact N-OE1 3.02Å; K160-E245 PolarHBondContact N-OE2 3.46Å
161	K	80.3	Confident	87.6	Confident	83 Å²	83	49.6 Å²	49.6	36%	0.361	24%	0.239	S	C	.	.	S	Bend	trans	-91.4	157.4	174.3	-61.2	-178.9	-174	174.3	0	109	T191 E242 E245	K161-T191 PolarHBondContact O-OG1 2.79Å; K161-E242 IonicContact NZ-OE1 2.78Å; K161-E242 PolarHBondContact NZ-OE1 2.86Å; K161-E242 IonicContact NZ-OE2 3.08Å; K161-E242 PolarHBondContact NZ-OE2 3.33Å; K161-E242 VanDerWaalsContact NZ-OE2 3.08Å; K161-E245 PolarHBondContact N-OE2 3.43Å
162	N	84.2	Confident	87.3	Confident	109 Å²	109	51.4 Å²	51.4	58%	0.583	25%	0.248	S	C	*	.	S	Bend	trans	-91	-21.6	172.8	-73.4	-14.8	0	0	0	112.4	L190 T191	N162-L190 CarbonylContact O-C 3.48Å; N162-L190 VanDerWaalsContact O-CA 3.25Å; N162-L190 WeakPolarHBondContact O-CA 3.32Å; N162-T191 VanDerWaalsContact CA-OG1 3.31Å; N162-T191 WeakPolarHBondContact CA-OG1 3.25Å; N162-T191 PolarHBondContact O-N 3.18Å; N162-T191 PolarHBondContact O-OG1 3.07Å
163	E	87.3	Confident	86.5	Confident	102 Å²	102	55.4 Å²	55.4	48%	0.477	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140.4	-178.8	-172.2	-177.3	-179.6	0	0	108.3	N188 V189 L190	E163-N188 HydrophobicContact CG-CB 4.39Å; E163-N188 VanDerWaalsContact OE1-CB 3.23Å; E163-N188 WeakPolarHBondContact OE1-CB 3.28Å; E163-N188 PolarHBondContact OE1-ND2 3.32Å; E163-V189 CarbonylContact C-O 3.6Å; E163-V189 WeakPolarHBondContact CA-O 3.1Å; E163-L190 HydrophobicContact CB-CD2 4.23Å; E163-L190 HydrophobicContact CG-CD2 4.43Å
164	Q	86.9	Confident	85.3	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.019	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	137.3	177.1	-175.4	167.1	51.7	0	0	109.7	V189 T191 E242 L243 V246	Q164-V189 PolarHBondContact N-O 2.94Å; Q164-V189 WeakPolarHBondContact O-CG2 3.42Å; Q164-V189 PolarHBondContact O-N 2.03Å; Q164-T191 HydrophobicContact CB-CG2 3.78Å; Q164-E242 PolarHBondContact NE2-OE1 3.09Å; Q164-L243 PolarHBondContact NE2-O 3.19Å; Q164-V246 HydrophobicContact CB-CG2 4.2Å
165	R	88.8	Confident	83.9	Confident	114 Å²	114	65.3 Å²	65.3	43%	0.43	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	119.7	172.2	-176.8	174.5	173.3	128.1	-4.2	109.6	E167 N188 H224	R165-E167 IonicContact NE-OE1 3.43Å; R165-N188 VanDerWaalsContact CB-OD1 3.29Å; R165-N188 WeakPolarHBondContact CB-OD1 3.47Å; R165-N188 VanDerWaalsContact CG-OD1 3.27Å; R165-N188 WeakPolarHBondContact CG-OD1 3.42Å; R165-H224 HydrophobicContact CB-CB 4.24Å; R165-H224 HydrophobicContact CG-CB 4.13Å; R165-H224 PolarHBondContact O-N 2.84Å
166	I	91.2	Very high	82.4	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	149.6	173.8	61.8	167.3	0	0	0	110.3	G186 K187 V189 I198 F200 I221 L244 V246 F248	I166-G186 CarbonylContact O-C 3.51Å; I166-G186 WeakPolarHBondContact O-CA 3.5Å; I166-K187 HydrophobicContact CG1-CB 4.49Å; I166-K187 WeakPolarHBondContact CG1-O 3.3Å; I166-K187 PolarHBondContact N-O 3.35Å; I166-K187 PolarHBondContact O-N 2.77Å; I166-V189 HydrophobicContact CD1-CG1 4.02Å; I166-V189 HydrophobicContact CD1-CG2 4.12Å; I166-V189 HydrophobicContact CG1-CG1 4.15Å; I166-V189 HydrophobicContact CG1-CG2 4.04Å; I166-V189 HydrophobicContact CG2-CG2 3.93Å; I166-I198 HydrophobicContact CD1-CD1 4.08Å; I166-I198 HydrophobicContact CD1-CG2 4.42Å; I166-F200 HydrophobicContact CD1-CE2 4.26Å; I166-F200 HydrophobicContact CD1-CZ 4.14Å; I166-F200 HydrophobicContact CG1-CZ 4.36Å; I166-I221 HydrophobicContact CB-CG2 3.98Å; I166-I221 HydrophobicContact CD1-CG2 4.31Å; I166-I221 HydrophobicContact CG2-CG2 4.38Å; I166-L244 HydrophobicContact CG2-CD1 3.88Å; I166-V246 HydrophobicContact CG2-CB 4.32Å; I166-V246 HydrophobicContact CG2-CG2 3.81Å; I166-F248 HydrophobicContact CD1-CZ 4.26Å
167	E	91.8	Very high	81.1	Confident	9 Å²	9	69.6 Å²	69.6	4%	0.042	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.6	-179.7	-66.6	-175.5	155.7	0	0	109.9	R165 Y169 F183 G185 I221 S222 H224	R165-E167 IonicContact NE-OE1 3.43Å; E167-Y169 HydrophobicContact CB-CD2 4.26Å; E167-Y169 HydrophobicContact CB-CE2 3.42Å; E167-Y169 VanDerWaalsContact CB-CE2 3.42Å; E167-Y169 PolarHBondContact OE2-OH 2.81Å; E167-F183 HydrophobicContact CB-CD2 4.48Å; E167-F183 HydrophobicContact CB-CE2 4.08Å; E167-F183 HydrophobicContact CG-CE2 4.01Å; E167-G185 WeakPolarHBondContact CA-O 3.17Å; E167-I221 CarbonylContact O-C 3.57Å; E167-I221 WeakPolarHBondContact O-CA 3.46Å; E167-S222 PolarHBondContact N-O 3.02Å; E167-S222 PolarHBondContact O-N 2.93Å; E167-H224 VanDerWaalsContact CD-ND1 3.33Å; E167-H224 HydrophobicContact CG-CB 4.41Å; E167-H224 IonicContact OE1-CE1 3.08Å; E167-H224 IonicContact OE1-CG 2.77Å; E167-H224 IonicContact OE1-ND1 2.74Å; E167-H224 PolarHBondContact OE1-ND1 2.64Å; E167-H224 IonicContact OE2-ND1 3.94Å
168	L	93.4	Very high	79.7	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.1	178.6	-173.4	73.2	0	0	0	109.7	F149 I184 G185 F200 V202 L219 I221	F149-L168 HydrophobicContact CD1-CD1 4.09Å; F149-L168 HydrophobicContact CD1-CD2 4.11Å; F149-L168 HydrophobicContact CE1-CD1 4.04Å; L168-I184 HydrophobicContact CB-CB 4.45Å; L168-I184 HydrophobicContact CD2-CB 4.32Å; L168-I184 HydrophobicContact CD2-CD1 4.02Å; L168-I184 HydrophobicContact CD2-CG2 4.26Å; L168-I184 HydrophobicContact CG-CB 4.43Å; L168-I184 HydrophobicContact CG-CD1 4.17Å; L168-I184 WeakPolarHBondContact O-CB 3.33Å; L168-I184 PolarHBondContact O-N 3.25Å; L168-G185 PolarHBondContact N-O 3.47Å; L168-G185 PolarHBondContact O-N 3.2Å; L168-F200 HydrophobicContact CB-CD1 4.05Å; L168-F200 HydrophobicContact CB-CD2 4.41Å; L168-F200 HydrophobicContact CB-CE1 4.12Å; L168-F200 HydrophobicContact CB-CE2 4.46Å; L168-F200 HydrophobicContact CB-CG 4.21Å; L168-F200 HydrophobicContact CB-CZ 4.32Å; L168-F200 HydrophobicContact CD2-CB 3.43Å; L168-F200 VanDerWaalsContact CD2-CB 3.43Å; L168-F200 HydrophobicContact CD2-CD1 4.13Å; L168-F200 HydrophobicContact CD2-CD2 4.01Å; L168-F200 HydrophobicContact CD2-CG 3.62Å; L168-F200 HydrophobicContact CG-CG 4.49Å; L168-V202 HydrophobicContact CD2-CG1 3.7Å; L168-L219 HydrophobicContact CD1-CB 3.99Å; L168-L219 HydrophobicContact CD1-CD1 4.41Å; L168-L219 HydrophobicContact CD2-CD1 4.43Å; L168-I221 HydrophobicContact CD1-CD1 4.49Å; L168-I221 HydrophobicContact CD1-CG1 3.56Å
169	Y	90.7	Very high	78.7	Confident	32 Å²	32	72 Å²	72	13%	0.125	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.9	-179.1	-66.2	-89.1	0	0	0	111.2	E167 H181 R182 F183 L219 E220 S222	E167-Y169 HydrophobicContact CB-CD2 4.26Å; E167-Y169 HydrophobicContact CB-CE2 3.42Å; E167-Y169 VanDerWaalsContact CB-CE2 3.42Å; E167-Y169 PolarHBondContact OE2-OH 2.81Å; Y169-H181 HydrophobicContact CD1-CB 3.97Å; Y169-H181 AromaticContact CD1-CG 3.99Å; Y169-H181 HydrophobicContact CG-CB 4.24Å; Y169-R182 CarbonylContact C-O 3.57Å; Y169-R182 VanDerWaalsContact CA-O 3.24Å; Y169-R182 WeakPolarHBondContact CA-O 3.21Å; Y169-F183 HydrophobicContact CD1-CB 4.1Å; Y169-F183 HydrophobicContact CD1-CD2 4.48Å; Y169-F183 HydrophobicContact CE1-CB 3.82Å; Y169-F183 AromaticContact CE1-CD2 3.86Å; Y169-F183 HydrophobicContact CE1-CD2 3.86Å; Y169-F183 HydrophobicContact CE1-CG 4.36Å; Y169-F183 AromaticContact CZ-CD2 3.92Å; Y169-L219 CarbonylContact O-C 3.45Å; Y169-L219 WeakPolarHBondContact O-CA 3.32Å; Y169-E220 PolarHBondContact N-O 3.42Å; Y169-E220 PolarHBondContact O-N 2.57Å; Y169-S222 WeakPolarHBondContact CE2-OG 3.5Å
170	Q	91.2	Very high	78.2	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	130.7	163.4	173.9	-175.1	5	0	0	108.9	L172 H181 R182 I184 T205 E208	Q170-L172 HydrophobicContact CG-CD2 4.05Å; Q170-H181 CarbonylContact O-C 3.57Å; Q170-H181 VanDerWaalsContact O-CA 3.27Å; Q170-H181 WeakPolarHBondContact O-CA 3.35Å; Q170-R182 HydrophobicContact CB-CB 4.25Å; Q170-R182 PolarHBondContact N-O 2.91Å; Q170-R182 PolarHBondContact O-N 3.03Å; Q170-I184 HydrophobicContact CB-CD1 4.12Å; Q170-I184 HydrophobicContact CB-CG1 4.45Å; Q170-T205 HydrophobicContact CB-CG2 3.98Å; Q170-T205 HydrophobicContact CG-CG2 3.68Å; Q170-E208 PolarHBondContact NE2-OE2 2.87Å
171	I	87.6	Confident	78.2	Confident	28 Å²	28	73.2 Å²	73.2	14%	0.144	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	127.7	175.6	-58.8	172.5	0	0	0	108.6	V129 L217 G218 E220	V129-I171 HydrophobicContact CB-CD1 4.46Å; V129-I171 HydrophobicContact CG1-CD1 3.55Å; V129-I171 HydrophobicContact CG2-CD1 4.14Å; I171-L217 HydrophobicContact CB-CB 3.94Å; I171-L217 HydrophobicContact CG2-CB 3.77Å; I171-L217 HydrophobicContact CG2-CD1 4.28Å; I171-G218 PolarHBondContact N-O 2.94Å; I171-G218 VanDerWaalsContact N-O 3.14Å; I171-E220 HydrophobicContact CD1-CB 4.22Å; I171-E220 HydrophobicContact CG1-CB 4.04Å
172	L	85.6	Confident	78.6	Confident	38 Å²	38	74.4 Å²	74.4	20%	0.199	36%	0.357	C	S	.	.			trans	-107.9	157.9	178.4	-61.3	-178	0	0	0	111.6	Q170 V179 K180 R182 L217	Q170-L172 HydrophobicContact CG-CD2 4.05Å; L172-V179 HydrophobicContact CD1-CG1 4.06Å; L172-K180 PolarHBondContact N-O 2.92Å; L172-R182 HydrophobicContact CD1-CB 4.12Å; L172-R182 HydrophobicContact CG-CB 4.43Å; L172-L217 VanDerWaalsContact C-CD1 3.46Å
173	Q	74.4	Confident	78.9	Confident	108 Å²	108	74.1 Å²	74.1	51%	0.505	35%	0.35	S	S	.	.			trans	-68.5	143.5	177	-165.3	162.3	-0.1	0	0	110.2	D175 L217	Q173-D175 PolarHBondContact O-N 3.06Å; Q173-L217 HydrophobicContact CB-CD1 4.12Å
174	K	65	Low	79.1	Confident	105 Å²	105	71.3 Å²	71.3	46%	0.457	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	25.6	-172.5	-76	-175.6	178.5	174.7	0	114.7	L118 S119 D176	L118-K174 HydrophobicContact CD2-CD 4.1Å; L118-K174 HydrophobicContact CD2-CG 4.34Å; S119-K174 PolarHBondContact OG-NZ 2.93Å; K174-D176 PolarHBondContact O-N 3.2Å
175	D	60.2	Low	79.3	Confident	135 Å²	135	72 Å²	72	72%	0.722	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-24	-177.4	-63.4	-25.5	0	0	0	111.7	Q173	Q173-D175 PolarHBondContact O-N 3.06Å
176	D	57.2	Low	79.4	Confident	86 Å²	86	68 Å²	68	46%	0.46	34%	0.341	S	S	.	.	S	Bend	trans	-117	118.4	173.6	-159.2	-29.3	0	0	0	111.1	K174 K178 V179	K174-D176 PolarHBondContact O-N 3.2Å; D176-K178 PolarHBondContact O-N 3.02Å; D176-K178 PolarHBondContact OD1-N 3.31Å; D176-V179 PolarHBondContact O-N 3.49Å
177	P	56.8	Low	79.4	Confident	110 Å²	110	71 Å²	71	71%	0.714	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-14.2	-179	23.8	-33.6	0	0	0	114
178	K	55.2	Low	79.3	Confident	188 Å²	188	75 Å²	75	82%	0.817	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-22.4	-176.3	-68.2	-178.9	-179.3	177.8	0	114.9	D176	D176-K178 PolarHBondContact O-N 3.02Å; D176-K178 PolarHBondContact OD1-N 3.31Å
179	V	61.6	Low	79.2	Confident	70 Å²	70	75.4 Å²	75.4	42%	0.424	38%	0.378	S	S	.	.			trans	-129.4	87.1	-173.5	-168.4	0	0	0	0	110.5	L172 D176	L172-V179 HydrophobicContact CD1-CG1 4.06Å; D176-V179 PolarHBondContact O-N 3.49Å
180	K	71.4	Confident	79.2	Confident	127 Å²	127	77.9 Å²	77.9	55%	0.552	39%	0.393	S	S	*	.	S	Bend	trans	-83.4	-20.5	179.4	-65.6	179.1	-178.1	173.5	0	113.3	L172	L172-K180 PolarHBondContact N-O 2.92Å
181	H	82	Confident	78.9	Confident	90 Å²	90	78 Å²	78	42%	0.417	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	149.8	-175.4	41	-149.3	0	0	0	111.8	Y169 Q170	Y169-H181 HydrophobicContact CD1-CB 3.97Å; Y169-H181 AromaticContact CD1-CG 3.99Å; Y169-H181 HydrophobicContact CG-CB 4.24Å; Q170-H181 CarbonylContact O-C 3.57Å; Q170-H181 VanDerWaalsContact O-CA 3.27Å; Q170-H181 WeakPolarHBondContact O-CA 3.35Å
182	R	87.8	Confident	78.7	Confident	107 Å²	107	80.1 Å²	80.1	40%	0.404	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	123.8	172.4	179.5	-172.3	-64.1	156.8	-3.6	109.4	Y169 Q170 L172 E208	Y169-R182 CarbonylContact C-O 3.57Å; Y169-R182 VanDerWaalsContact CA-O 3.24Å; Y169-R182 WeakPolarHBondContact CA-O 3.21Å; Q170-R182 HydrophobicContact CB-CB 4.25Å; Q170-R182 PolarHBondContact N-O 2.91Å; Q170-R182 PolarHBondContact O-N 3.03Å; L172-R182 HydrophobicContact CD1-CB 4.12Å; L172-R182 HydrophobicContact CG-CB 4.43Å; R182-E208 IonicContact CZ-OE2 3.74Å; R182-E208 IonicContact NH1-OE2 2.85Å; R182-E208 PolarHBondContact NH1-OE2 2.74Å; R182-E208 IonicContact NH2-OE2 3.82Å
183	F	90.6	Very high	78.5	Confident	103 Å²	103	79.6 Å²	79.6	45%	0.452	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	134.1	177.1	176.7	-100.3	0	0	0	111	E167 Y169 G185	E167-F183 HydrophobicContact CB-CD2 4.48Å; E167-F183 HydrophobicContact CB-CE2 4.08Å; E167-F183 HydrophobicContact CG-CE2 4.01Å; Y169-F183 HydrophobicContact CD1-CB 4.1Å; Y169-F183 HydrophobicContact CD1-CD2 4.48Å; Y169-F183 HydrophobicContact CE1-CB 3.82Å; Y169-F183 AromaticContact CE1-CD2 3.86Å; Y169-F183 HydrophobicContact CE1-CD2 3.86Å; Y169-F183 HydrophobicContact CE1-CG 4.36Å; Y169-F183 AromaticContact CZ-CD2 3.92Å; F183-G185 VanDerWaalsContact CZ-CA 3.46Å
184	I	91.5	Very high	79.1	Confident	44 Å²	44	79.8 Å²	79.8	23%	0.226	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-51.7	176.5	-58.4	178.9	0	0	0	110.1	L168 Q170 D201 V202 T205 L219	L168-I184 HydrophobicContact CB-CB 4.45Å; L168-I184 HydrophobicContact CD2-CB 4.32Å; L168-I184 HydrophobicContact CD2-CD1 4.02Å; L168-I184 HydrophobicContact CD2-CG2 4.26Å; L168-I184 HydrophobicContact CG-CB 4.43Å; L168-I184 HydrophobicContact CG-CD1 4.17Å; L168-I184 WeakPolarHBondContact O-CB 3.33Å; L168-I184 PolarHBondContact O-N 3.25Å; Q170-I184 HydrophobicContact CB-CD1 4.12Å; Q170-I184 HydrophobicContact CB-CG1 4.45Å; I184-D201 WeakPolarHBondContact CG2-O 3.38Å; I184-V202 HydrophobicContact CD1-CG1 4.12Å; I184-V202 HydrophobicContact CG2-CG1 4.43Å; I184-T205 HydrophobicContact CD1-CG2 4.47Å; I184-T205 WeakPolarHBondContact CD1-OG1 3.49Å; I184-L219 HydrophobicContact CD1-CD2 3.7Å
185	G	91	Very high	80.2	Confident	17 Å²	17	79 Å²	79	18%	0.175	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	165.5	-176	0	0	0	0	0	112.7	E167 L168 F183	E167-G185 WeakPolarHBondContact CA-O 3.17Å; L168-G185 PolarHBondContact N-O 3.47Å; L168-G185 PolarHBondContact O-N 3.2Å; F183-G185 VanDerWaalsContact CZ-CA 3.46Å
186	G	91.9	Very high	81.6	Confident	31 Å²	31	77.2 Å²	77.2	32%	0.32	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	144	177.9	0	0	0	0	0	111.8	I166	I166-G186 CarbonylContact O-C 3.51Å; I166-G186 WeakPolarHBondContact O-CA 3.5Å
187	K	90.9	Very high	83.2	Confident	64 Å²	64	75.7 Å²	75.7	28%	0.278	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140.7	178.1	-73.7	-174.8	170.4	-172.9	0	109.6	E80 I166 V189 I198 S199 F200	E80-K187 IonicContact OE1-NZ 3.72Å; I166-K187 HydrophobicContact CG1-CB 4.49Å; I166-K187 WeakPolarHBondContact CG1-O 3.3Å; I166-K187 PolarHBondContact N-O 3.35Å; I166-K187 PolarHBondContact O-N 2.77Å; K187-V189 HydrophobicContact CB-CG1 4.27Å; K187-I198 HydrophobicContact CD-CG2 4.02Å; K187-S199 VanDerWaalsContact CE-O 3.25Å; K187-S199 WeakPolarHBondContact CE-O 3.35Å; K187-S199 PolarHBondContact NZ-O 3.36Å; K187-S199 PolarHBondContact NZ-OG 3.06Å; K187-F200 HydrophobicContact CB-CE1 4.35Å; K187-F200 HydrophobicContact CB-CZ 4.13Å; K187-F200 HydrophobicContact CD-CE1 4.08Å; K187-F200 HydrophobicContact CD-CZ 4.08Å; K187-F200 HydrophobicContact CG-CE1 3.85Å; K187-F200 HydrophobicContact CG-CZ 4.03Å
188	N	90.5	Very high	84.9	Confident	91 Å²	91	70.9 Å²	70.9	49%	0.487	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	128.3	167	-67	-3.6	0	0	0	108.5	E163 R165	E163-N188 HydrophobicContact CG-CB 4.39Å; E163-N188 VanDerWaalsContact OE1-CB 3.23Å; E163-N188 WeakPolarHBondContact OE1-CB 3.28Å; E163-N188 PolarHBondContact OE1-ND2 3.32Å; R165-N188 VanDerWaalsContact CB-OD1 3.29Å; R165-N188 WeakPolarHBondContact CB-OD1 3.47Å; R165-N188 VanDerWaalsContact CG-OD1 3.27Å; R165-N188 WeakPolarHBondContact CG-OD1 3.42Å
189	V	90.6	Very high	86.7	Confident	10 Å²	10	62 Å²	62	6%	0.061	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144.6	-175.4	-61.5	0	0	0	0	110.4	E163 Q164 I166 K187 I198 V246	E163-V189 CarbonylContact C-O 3.6Å; E163-V189 WeakPolarHBondContact CA-O 3.1Å; Q164-V189 PolarHBondContact N-O 2.94Å; Q164-V189 WeakPolarHBondContact O-CG2 3.42Å; Q164-V189 PolarHBondContact O-N 2.03Å; I166-V189 HydrophobicContact CD1-CG1 4.02Å; I166-V189 HydrophobicContact CD1-CG2 4.12Å; I166-V189 HydrophobicContact CG1-CG1 4.15Å; I166-V189 HydrophobicContact CG1-CG2 4.04Å; I166-V189 HydrophobicContact CG2-CG2 3.93Å; K187-V189 HydrophobicContact CB-CG1 4.27Å; V189-I198 HydrophobicContact CB-CD1 4.34Å; V189-I198 HydrophobicContact CG1-CD1 3.7Å; V189-I198 HydrophobicContact CG1-CG1 4.21Å; V189-V246 HydrophobicContact CG2-CB 4.48Å; V189-V246 HydrophobicContact CG2-CG1 4.18Å; V189-V246 HydrophobicContact CG2-CG2 3.49Å; V189-V246 VanDerWaalsContact CG2-CG2 3.49Å
190	L	89.9	Confident	88.2	Confident	84 Å²	84	59.3 Å²	59.3	44%	0.44	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	133.9	174.5	-62.8	176.7	0	0	0	109.6	R153 N162 E163	R153-L190 WeakPolarHBondContact CD-O 3.31Å; R153-L190 PolarHBondContact NE-O 3.25Å; R153-L190 PolarHBondContact NH1-O 3.33Å; N162-L190 CarbonylContact O-C 3.48Å; N162-L190 VanDerWaalsContact O-CA 3.25Å; N162-L190 WeakPolarHBondContact O-CA 3.32Å; E163-L190 HydrophobicContact CB-CD2 4.23Å; E163-L190 HydrophobicContact CG-CD2 4.43Å
191	T	84.7	Confident	89.2	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.006	30%	0.298	C	S	.	.	S	Bend	trans	-81.9	-30.4	174.3	55.6	0	0	0	0	111.2	N156 A159 K161 N162 Q164 E245 V246	N156-T191 PolarHBondContact N-O 2.79Å; N156-T191 VanDerWaalsContact N-O 3.15Å; A159-T191 HydrophobicContact CB-CG2 4.33Å; K161-T191 PolarHBondContact O-OG1 2.79Å; N162-T191 VanDerWaalsContact CA-OG1 3.31Å; N162-T191 WeakPolarHBondContact CA-OG1 3.25Å; N162-T191 PolarHBondContact O-N 3.18Å; N162-T191 PolarHBondContact O-OG1 3.07Å; Q164-T191 HydrophobicContact CB-CG2 3.78Å; T191-E245 HydrophobicContact CG2-CB 4.06Å; T191-V246 HydrophobicContact CG2-CG2 4.24Å
192	K	83.6	Confident	89.8	Confident	74 Å²	74	52.3 Å²	52.3	32%	0.322	28%	0.279	S	S	.	.	S	Bend	trans	-116.5	113.7	176.9	-66.1	179.8	-174.2	175.9	0	108.6	N156 A159	N156-K192 WeakPolarHBondContact O-CG 3.3Å; A159-K192 HydrophobicContact CB-CG 4.36Å; A159-K192 WeakPolarHBondContact O-CE 3.39Å; A159-K192 PolarHBondContact O-NZ 2.79Å
193	G	81.8	Confident	90	Very high	26 Å²	26	48 Å²	48	27%	0.268	26%	0.264	S	S	.	.	S	Bend	trans	179.2	-171.9	175.4	0	0	0	0	0	112.1	H155	H155-G193 PolarHBondContact ND1-N 3.21Å
194	T	87.3	Confident	89.9	Confident	113 Å²	113	48.5 Å²	48.5	69%	0.693	27%	0.268	S	S	*	.	S	Bend	trans	-65	150.3	170.1	51.5	0	0	0	0	110.3	R153	R153-T194 PolarHBondContact NH2-O 3.16Å
195	P	88.4	Confident	90	Very high	87 Å²	87	46.8 Å²	46.8	57%	0.565	26%	0.26	S	S	*	.			trans	-55.8	140.5	173	-23.9	33.7	0	0	0	111.5	L152 R153	L152-P195 HydrophobicContact CD1-CB 4.19Å; R153-P195 WeakPolarHBondContact O-CA 3.09Å
196	E	89.3	Confident	90.1	Very high	98 Å²	98	46 Å²	46	46%	0.458	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	135.4	-172.9	-177.4	-179.9	-163.6	0	0	110.7	R153	R153-E196 VanDerWaalsContact CB-O 3.29Å; R153-E196 WeakPolarHBondContact CB-O 3.22Å; R153-E196 IonicContact CZ-OE2 2.77Å; R153-E196 PolarHBondContact N-O 3.24Å; R153-E196 IonicContact NE-OE2 3.78Å; R153-E196 PolarHBondContact NE-OE2 3.23Å; R153-E196 IonicContact NH2-OE2 3.34Å; R153-E196 PolarHBondContact NH2-OE2 2.89Å; R153-E196 PolarHBondContact O-N 2.87Å; R153-E196 VanDerWaalsContact O-N 3.13Å
197	W	90.6	Very high	90	Very high	55 Å²	55	48.9 Å²	48.9	21%	0.208	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	126.6	173.4	-73.2	109	0	0	0	110.3	E76 R150 L152 P271 H274	E76-W197 PolarHBondContact OE2-NE1 2.8Å; R150-W197 HydrophobicContact CB-CE3 4.18Å; R150-W197 HydrophobicContact CB-CZ3 4.44Å; L152-W197 HydrophobicContact CB-CD2 4.18Å; L152-W197 HydrophobicContact CB-CE3 3.87Å; L152-W197 HydrophobicContact CB-CH2 3.87Å; L152-W197 HydrophobicContact CB-CZ2 4.19Å; L152-W197 HydrophobicContact CB-CZ3 3.71Å; L152-W197 HydrophobicContact CD1-CD2 3.93Å; L152-W197 HydrophobicContact CD1-CE3 4.45Å; L152-W197 HydrophobicContact CD1-CG 4.14Å; L152-W197 HydrophobicContact CD1-CZ2 4.37Å; W197-P271 HydrophobicContact CH2-CB 3.71Å; W197-P271 HydrophobicContact CZ2-CB 3.88Å; W197-H274 AromaticContact CH2-CE1 3.77Å; W197-H274 AromaticContact CZ3-CE1 3.69Å
198	I	91.6	Very high	90	Very high	8 Å²	8	48 Å²	48	4%	0.041	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.2	171.3	-59.6	163.4	0	0	0	107.8	R150 A151 R153 I166 K187 V189 F200 F248	R150-I198 WeakPolarHBondContact CA-O 3.18Å; A151-I198 PolarHBondContact N-O 3.36Å; A151-I198 PolarHBondContact O-N 2.95Å; R153-I198 HydrophobicContact CB-CD1 3.77Å; R153-I198 HydrophobicContact CB-CG1 4.32Å; R153-I198 HydrophobicContact CG-CD1 4.35Å; I166-I198 HydrophobicContact CD1-CD1 4.08Å; I166-I198 HydrophobicContact CD1-CG2 4.42Å; K187-I198 HydrophobicContact CD-CG2 4.02Å; V189-I198 HydrophobicContact CB-CD1 4.34Å; V189-I198 HydrophobicContact CG1-CD1 3.7Å; V189-I198 HydrophobicContact CG1-CG1 4.21Å; I198-F200 HydrophobicContact CG2-CD2 4.05Å; I198-F200 HydrophobicContact CG2-CE2 3.47Å; I198-F200 VanDerWaalsContact CG2-CE2 3.47Å; I198-F200 HydrophobicContact CG2-CZ 4.11Å; I198-F248 HydrophobicContact CD1-CE1 3.9Å; I198-F248 HydrophobicContact CD1-CZ 4.5Å
199	S	93.4	Very high	90	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	150.8	174.9	67.5	0	0	0	0	112.4	E80 F149 K187	E80-S199 WeakPolarHBondContact OE1-CB 3.37Å; E80-S199 PolarHBondContact OE1-OG 3.29Å; E80-S199 PolarHBondContact OE2-OG 2.91Å; F149-S199 CarbonylContact O-C 3.6Å; F149-S199 VanDerWaalsContact O-CA 3.23Å; F149-S199 WeakPolarHBondContact O-CA 3.47Å; K187-S199 VanDerWaalsContact CE-O 3.25Å; K187-S199 WeakPolarHBondContact CE-O 3.35Å; K187-S199 PolarHBondContact NZ-O 3.36Å; K187-S199 PolarHBondContact NZ-OG 3.06Å
200	F	93.8	Very high	90	Very high	12 Å²	12	43.4 Å²	43.4	5%	0.053	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	132.8	167.3	-71.1	-87.6	0	0	0	110.4	E148 F149 I166 L168 K187 I198 V202	E148-F200 VanDerWaalsContact OE2-O 3.05Å; F149-F200 HydrophobicContact CD1-CB 4.48Å; F149-F200 HydrophobicContact CD1-CD2 4.09Å; F149-F200 HydrophobicContact CE1-CD2 4.48Å; F149-F200 PolarHBondContact N-O 3.37Å; F149-F200 PolarHBondContact O-N 3.32Å; I166-F200 HydrophobicContact CD1-CE2 4.26Å; I166-F200 HydrophobicContact CD1-CZ 4.14Å; I166-F200 HydrophobicContact CG1-CZ 4.36Å; L168-F200 HydrophobicContact CB-CD1 4.05Å; L168-F200 HydrophobicContact CB-CD2 4.41Å; L168-F200 HydrophobicContact CB-CE1 4.12Å; L168-F200 HydrophobicContact CB-CE2 4.46Å; L168-F200 HydrophobicContact CB-CG 4.21Å; L168-F200 HydrophobicContact CB-CZ 4.32Å; L168-F200 HydrophobicContact CD2-CB 3.43Å; L168-F200 VanDerWaalsContact CD2-CB 3.43Å; L168-F200 HydrophobicContact CD2-CD1 4.13Å; L168-F200 HydrophobicContact CD2-CD2 4.01Å; L168-F200 HydrophobicContact CD2-CG 3.62Å; L168-F200 HydrophobicContact CG-CG 4.49Å; K187-F200 HydrophobicContact CB-CE1 4.35Å; K187-F200 HydrophobicContact CB-CZ 4.13Å; K187-F200 HydrophobicContact CD-CE1 4.08Å; K187-F200 HydrophobicContact CD-CZ 4.08Å; K187-F200 HydrophobicContact CG-CE1 3.85Å; K187-F200 HydrophobicContact CG-CZ 4.03Å; I198-F200 HydrophobicContact CG2-CD2 4.05Å; I198-F200 HydrophobicContact CG2-CE2 3.47Å; I198-F200 VanDerWaalsContact CG2-CE2 3.47Å; I198-F200 HydrophobicContact CG2-CZ 4.11Å; F200-V202 HydrophobicContact CB-CG1 4.44Å; F200-V202 PolarHBondContact O-N 3.01Å; F200-V202 VanDerWaalsContact O-N 3.16Å
201	D	92.6	Very high	89.9	Confident	69 Å²	69	44.1 Å²	44.1	37%	0.369	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	111.7	172.7	-169.8	-17.3	0	0	0	109.2	R146 E148 I184 T203	R146-D201 IonicContact CZ-OD2 3.62Å; R146-D201 IonicContact NH1-OD2 3.9Å; R146-D201 PolarHBondContact NH1-OD2 2.85Å; R146-D201 IonicContact NH2-OD2 3.61Å; R146-D201 PolarHBondContact NH2-OD2 2.9Å; E148-D201 PolarHBondContact OE2-N 2.97Å; I184-D201 WeakPolarHBondContact CG2-O 3.38Å; D201-T203 WeakPolarHBondContact OD1-CB 3.29Å; D201-T203 PolarHBondContact OD1-N 2.92Å; D201-T203 PolarHBondContact OD1-OG1 3.05Å
202	V	94.4	Very high	90	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	26%	0.256	C	S	.	.			trans	-117.6	22.8	179.3	-64.8	0	0	0	0	110.9	A147 F149 L168 I184 F200 E204 T205 V206 L219 L275	A147-V202 HydrophobicContact CB-CG2 4.13Å; A147-V202 PolarHBondContact O-N 2.83Å; F149-V202 HydrophobicContact CB-CG1 3.91Å; F149-V202 HydrophobicContact CB-CG2 3.95Å; L168-V202 HydrophobicContact CD2-CG1 3.7Å; I184-V202 HydrophobicContact CD1-CG1 4.12Å; I184-V202 HydrophobicContact CG2-CG1 4.43Å; F200-V202 HydrophobicContact CB-CG1 4.44Å; F200-V202 PolarHBondContact O-N 3.01Å; F200-V202 VanDerWaalsContact O-N 3.16Å; V202-E204 VanDerWaalsContact C-N 3.33Å; V202-E204 PolarHBondContact O-N 2.83Å; V202-T205 PolarHBondContact O-N 2.85Å; V202-V206 HydrophobicContact CB-CG2 4.37Å; V202-V206 HydrophobicContact CG2-CG2 3.83Å; V202-V206 WeakPolarHBondContact O-CG2 3.37Å; V202-V206 PolarHBondContact O-N 3.07Å; V202-L219 HydrophobicContact CG1-CD1 4.01Å; V202-L219 HydrophobicContact CG1-CD2 4.45Å; V202-L275 HydrophobicContact CG2-CD2 3.97Å
203	T	91.4	Very high	89.9	Confident	16 Å²	16	49.7 Å²	49.7	10%	0.098	26%	0.257	C	S	.	.	H	α-helix	trans	-54.8	-46.5	-174.3	-58.2	0	0	0	0	112.2	L144 R146 A147 D201 R207	L144-T203 HydrophobicContact CD2-CG2 4.42Å; R146-T203 WeakPolarHBondContact CA-OG1 3.34Å; A147-T203 PolarHBondContact N-OG1 3.09Å; A147-T203 PolarHBondContact O-N 2.88Å; A147-T203 PolarHBondContact O-OG1 3.17Å; D201-T203 WeakPolarHBondContact OD1-CB 3.29Å; D201-T203 PolarHBondContact OD1-N 2.92Å; D201-T203 PolarHBondContact OD1-OG1 3.05Å; T203-R207 VanDerWaalsContact O-CB 3.3Å; T203-R207 WeakPolarHBondContact O-CB 3.46Å; T203-R207 PolarHBondContact O-N 3.06Å
204	E	90	Very high	89.9	Confident	115 Å²	115	57.4 Å²	57.4	54%	0.537	28%	0.283	S	S	.	.	H	α-helix	trans	-69.7	-41.7	-178.8	-168.7	57.2	-151.1	0	0	112.1	V202 V206 R207 E208	V202-E204 VanDerWaalsContact C-N 3.33Å; V202-E204 PolarHBondContact O-N 2.83Å; E204-V206 PolarHBondContact O-N 3.41Å; E204-R207 WeakPolarHBondContact O-CB 3.43Å; E204-R207 PolarHBondContact O-N 2.88Å; E204-R207 IonicContact OE2-CZ 3.62Å; E204-R207 IonicContact OE2-NH1 2.68Å; E204-R207 PolarHBondContact OE2-NH1 3.47Å; E204-E208 PolarHBondContact O-N 3.38Å
205	T	92.2	Very high	89.6	Confident	8 Å²	8	53.6 Å²	53.6	5%	0.049	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-46.1	177.1	-56.2	0	0	0	0	111.7	Q170 I184 V202 E208 W209 L219	Q170-T205 HydrophobicContact CB-CG2 3.98Å; Q170-T205 HydrophobicContact CG-CG2 3.68Å; I184-T205 HydrophobicContact CD1-CG2 4.47Å; I184-T205 WeakPolarHBondContact CD1-OG1 3.49Å; V202-T205 PolarHBondContact O-N 2.85Å; T205-E208 WeakPolarHBondContact O-CB 3.01Å; T205-E208 PolarHBondContact O-N 2.81Å; T205-W209 HydrophobicContact CG2-CD2 4.32Å; T205-W209 HydrophobicContact CG2-CH2 4.26Å; T205-W209 HydrophobicContact CG2-CZ2 3.59Å; T205-W209 VanDerWaalsContact O-CG 3.31Å; T205-W209 PolarHBondContact O-N 3.23Å; T205-W209 VanDerWaalsContact O-N 3.09Å; T205-L219 HydrophobicContact CG2-CD2 4.04Å
206	V	92.9	Very high	89.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68.9	-37.1	178.1	175.3	0	0	0	0	110.7	L144 A147 V202 E204 E208 W209 L210 L275 L277	L144-V206 HydrophobicContact CD2-CB 4.18Å; L144-V206 HydrophobicContact CD2-CG1 3.96Å; A147-V206 HydrophobicContact CB-CB 3.82Å; A147-V206 HydrophobicContact CB-CG1 4.12Å; A147-V206 HydrophobicContact CB-CG2 3.79Å; V202-V206 HydrophobicContact CB-CG2 4.37Å; V202-V206 HydrophobicContact CG2-CG2 3.83Å; V202-V206 WeakPolarHBondContact O-CG2 3.37Å; V202-V206 PolarHBondContact O-N 3.07Å; E204-V206 PolarHBondContact O-N 3.41Å; V206-E208 VanDerWaalsContact C-N 3.29Å; V206-E208 PolarHBondContact O-N 2.98Å; V206-W209 HydrophobicContact CG2-CE3 4.03Å; V206-W209 HydrophobicContact CG2-CZ3 4.13Å; V206-W209 WeakPolarHBondContact O-CB 3.46Å; V206-W209 PolarHBondContact O-N 2.9Å; V206-W209 VanDerWaalsContact O-N 3.17Å; V206-L210 HydrophobicContact CG1-CD1 4.24Å; V206-L210 HydrophobicContact CG1-CG 4.24Å; V206-L210 VanDerWaalsContact O-CG 3.3Å; V206-L210 WeakPolarHBondContact O-CG 3.47Å; V206-L210 PolarHBondContact O-N 3.31Å; V206-L275 HydrophobicContact CG2-CD1 4.35Å; V206-L277 HydrophobicContact CG1-CD1 4.24Å; V206-L277 HydrophobicContact CG1-CD2 3.88Å; V206-L277 HydrophobicContact CG1-CG 4.12Å
207	R	90.8	Very high	89.2	Confident	91 Å²	91	47.5 Å²	47.5	34%	0.343	23%	0.226	S	C	.	.	H	α-helix	trans	-57.3	-44.4	173.2	-175.5	-178.5	-67.4	152.1	-2.7	111.3	L144 T203 E204 L210 M211	L144-R207 HydrophobicContact CD2-CB 4.06Å; T203-R207 VanDerWaalsContact O-CB 3.3Å; T203-R207 WeakPolarHBondContact O-CB 3.46Å; T203-R207 PolarHBondContact O-N 3.06Å; E204-R207 WeakPolarHBondContact O-CB 3.43Å; E204-R207 PolarHBondContact O-N 2.88Å; E204-R207 IonicContact OE2-CZ 3.62Å; E204-R207 IonicContact OE2-NH1 2.68Å; E204-R207 PolarHBondContact OE2-NH1 3.47Å; R207-L210 PolarHBondContact O-N 2.92Å; R207-M211 WeakPolarHBondContact O-CG 3.35Å; R207-M211 PolarHBondContact O-N 2.9Å
208	E	90.1	Very high	89.1	Confident	45 Å²	45	44.9 Å²	44.9	21%	0.21	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-43.9	175.4	-171.5	179	179.6	0	0	111.5	Q170 R182 E204 T205 V206 L210 M211 Y212	Q170-E208 PolarHBondContact NE2-OE2 2.87Å; R182-E208 IonicContact CZ-OE2 3.74Å; R182-E208 IonicContact NH1-OE2 2.85Å; R182-E208 PolarHBondContact NH1-OE2 2.74Å; R182-E208 IonicContact NH2-OE2 3.82Å; E204-E208 PolarHBondContact O-N 3.38Å; T205-E208 WeakPolarHBondContact O-CB 3.01Å; T205-E208 PolarHBondContact O-N 2.81Å; V206-E208 VanDerWaalsContact C-N 3.29Å; V206-E208 PolarHBondContact O-N 2.98Å; E208-L210 PolarHBondContact O-N 3.41Å; E208-M211 PolarHBondContact O-N 2.81Å; E208-Y212 HydrophobicContact CG-CD2 4.4Å; E208-Y212 PolarHBondContact O-N 2.84Å
209	W	91.4	Very high	89.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-36.8	176.8	-62.4	-13.7	0	0	0	113.4	F132 V134 T205 V206 Y212 G213 T215 N216 L219 L275	F132-W209 HydrophobicContact CD2-CH2 4.35Å; F132-W209 HydrophobicContact CD2-CZ3 4.26Å; V134-W209 HydrophobicContact CG2-CB 4.27Å; V134-W209 HydrophobicContact CG2-CE3 4.4Å; T205-W209 HydrophobicContact CG2-CD2 4.32Å; T205-W209 HydrophobicContact CG2-CH2 4.26Å; T205-W209 HydrophobicContact CG2-CZ2 3.59Å; T205-W209 VanDerWaalsContact O-CG 3.31Å; T205-W209 PolarHBondContact O-N 3.23Å; T205-W209 VanDerWaalsContact O-N 3.09Å; V206-W209 HydrophobicContact CG2-CE3 4.03Å; V206-W209 HydrophobicContact CG2-CZ3 4.13Å; V206-W209 WeakPolarHBondContact O-CB 3.46Å; V206-W209 PolarHBondContact O-N 2.9Å; V206-W209 VanDerWaalsContact O-N 3.17Å; W209-Y212 CarbonylContact O-C 3.51Å; W209-G213 WeakPolarHBondContact O-CA 3.35Å; W209-G213 PolarHBondContact O-N 2.88Å; W209-T215 PolarHBondContact NE1-O 2.94Å; W209-N216 HydrophobicContact CB-CB 4.09Å; W209-N216 HydrophobicContact CD2-CB 4.12Å; W209-N216 HydrophobicContact CG-CB 3.82Å; W209-L219 HydrophobicContact CH2-CD1 4.48Å; W209-L219 HydrophobicContact CH2-CD2 4Å; W209-L219 HydrophobicContact CH2-CG 3.86Å; W209-L219 HydrophobicContact CZ2-CD2 4.09Å; W209-L219 HydrophobicContact CZ2-CG 4.35Å; W209-L275 HydrophobicContact CZ3-CD1 4.01Å
210	L	90.4	Very high	88.9	Confident	6 Å²	6	46 Å²	46	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-72.4	-32.2	178	-64.8	179.9	0	0	0	112.3	V134 M137 A141 L144 V206 R207 E208	V134-L210 HydrophobicContact CB-CD2 4.13Å; V134-L210 HydrophobicContact CG2-CD2 4Å; M137-L210 HydrophobicContact CB-CD2 3.65Å; A141-L210 HydrophobicContact CB-CB 3.62Å; L144-L210 HydrophobicContact CB-CD1 4.3Å; L144-L210 HydrophobicContact CD2-CD1 4.17Å; V206-L210 HydrophobicContact CG1-CD1 4.24Å; V206-L210 HydrophobicContact CG1-CG 4.24Å; V206-L210 VanDerWaalsContact O-CG 3.3Å; V206-L210 WeakPolarHBondContact O-CG 3.47Å; V206-L210 PolarHBondContact O-N 3.31Å; R207-L210 PolarHBondContact O-N 2.92Å; E208-L210 PolarHBondContact O-N 3.41Å
211	M	87	Confident	88.7	Confident	99 Å²	99	45.4 Å²	45.4	49%	0.488	22%	0.218	S	C	.	.	H	α-helix	trans	-78.2	-38	175.7	-69	-66.2	-169.4	0	0	112.1	A141 T142 R207 E208	A141-M211 HydrophobicContact CB-CE 4.06Å; A141-M211 HydrophobicContact CB-CG 4.26Å; A141-M211 HydrophobicContact CB-SD 3.73Å; T142-M211 HydrophobicContact CG2-CE 4.13Å; R207-M211 WeakPolarHBondContact O-CG 3.35Å; R207-M211 PolarHBondContact O-N 2.9Å; E208-M211 PolarHBondContact O-N 2.81Å
212	Y	87.1	Confident	88.5	Confident	159 Å²	159	42.5 Å²	42.5	62%	0.624	20%	0.203	S	C	*	.			trans	-131.6	82.7	-175.9	-54.9	-73.1	0	0	0	110.4	E208 W209 K214 T215	E208-Y212 HydrophobicContact CG-CD2 4.4Å; E208-Y212 PolarHBondContact O-N 2.84Å; W209-Y212 CarbonylContact O-C 3.51Å; Y212-K214 PolarHBondContact O-N 2.98Å; Y212-T215 PolarHBondContact O-N 3.06Å; Y212-T215 PolarHBondContact O-OG1 3.27Å
213	G	81.2	Confident	88	Confident	33 Å²	33	42.4 Å²	42.4	34%	0.34	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-52.2	-26.7	-175.5	0	0	0	0	0	115.5	W209 T215 N216	W209-G213 WeakPolarHBondContact O-CA 3.35Å; W209-G213 PolarHBondContact O-N 2.88Å; G213-T215 VanDerWaalsContact C-N 3.28Å; G213-T215 PolarHBondContact O-N 2.88Å; G213-N216 WeakPolarHBondContact O-CB 3.5Å; G213-N216 PolarHBondContact O-N 3.3Å
214	K	81.1	Confident	87.3	Confident	187 Å²	187	44.6 Å²	44.6	81%	0.813	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-67.7	-20.8	176.4	-65.2	-176	179.7	-179.2	0	114.4	Y212 N216	Y212-K214 PolarHBondContact O-N 2.98Å; K214-N216 VanDerWaalsContact C-N 3.28Å
215	T	83.1	Confident	86.4	Confident	34 Å²	34	41.2 Å²	41.2	21%	0.209	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-82.9	-5.9	179.7	65.9	0	0	0	0	112.8	W209 Y212 G213 L217	W209-T215 PolarHBondContact NE1-O 2.94Å; Y212-T215 PolarHBondContact O-N 3.06Å; Y212-T215 PolarHBondContact O-OG1 3.27Å; G213-T215 VanDerWaalsContact C-N 3.28Å; G213-T215 PolarHBondContact O-N 2.88Å; T215-L217 PolarHBondContact O-N 3.34Å
216	N	85.6	Confident	85.1	Confident	37 Å²	37	43.5 Å²	43.5	20%	0.198	22%	0.215	C	C	.	.			trans	-76.6	86.5	178.6	-175.8	7.6	0	0	0	111.7	F132 W209 G213 K214	F132-N216 PolarHBondContact O-ND2 2.97Å; W209-N216 HydrophobicContact CB-CB 4.09Å; W209-N216 HydrophobicContact CD2-CB 4.12Å; W209-N216 HydrophobicContact CG-CB 3.82Å; G213-N216 WeakPolarHBondContact O-CB 3.5Å; G213-N216 PolarHBondContact O-N 3.3Å; K214-N216 VanDerWaalsContact C-N 3.28Å
217	L	82.8	Confident	83.5	Confident	19 Å²	19	46.6 Å²	46.6	10%	0.099	24%	0.236	C	C	.	.			trans	-102.6	-6	176.3	-60.9	175.1	0	0	0	113.2	L118 I171 L172 Q173 T215	L118-L217 HydrophobicContact CD1-CD2 4.29Å; I171-L217 HydrophobicContact CB-CB 3.94Å; I171-L217 HydrophobicContact CG2-CB 3.77Å; I171-L217 HydrophobicContact CG2-CD1 4.28Å; L172-L217 VanDerWaalsContact C-CD1 3.46Å; Q173-L217 HydrophobicContact CB-CD1 4.12Å; T215-L217 PolarHBondContact O-N 3.34Å
218	G	88.1	Confident	82.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.233	C	C	.	.			trans	100.2	-178.4	-179.2	0	0	0	0	0	114.5	F130 I171	F130-G218 CarbonylContact O-C 3.52Å; F130-G218 WeakPolarHBondContact O-CA 3.33Å; I171-G218 PolarHBondContact N-O 2.94Å; I171-G218 VanDerWaalsContact N-O 3.14Å
219	L	91.3	Very high	80.8	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	150.9	176.3	-59.6	171.7	0	0	0	109.9	V129 F130 F132 F149 L168 Y169 I184 V202 T205 W209 L275	V129-L219 CarbonylContact C-O 3.56Å; V129-L219 WeakPolarHBondContact CA-O 3.45Å; F130-L219 HydrophobicContact CB-CB 4.47Å; F130-L219 PolarHBondContact N-O 2.95Å; F130-L219 PolarHBondContact O-N 3.16Å; F132-L219 HydrophobicContact CE2-CD1 4.14Å; F149-L219 HydrophobicContact CB-CD1 3.96Å; F149-L219 HydrophobicContact CD1-CD1 4.19Å; F149-L219 HydrophobicContact CD2-CD1 4.1Å; F149-L219 HydrophobicContact CG-CD1 3.8Å; L168-L219 HydrophobicContact CD1-CB 3.99Å; L168-L219 HydrophobicContact CD1-CD1 4.41Å; L168-L219 HydrophobicContact CD2-CD1 4.43Å; Y169-L219 CarbonylContact O-C 3.45Å; Y169-L219 WeakPolarHBondContact O-CA 3.32Å; I184-L219 HydrophobicContact CD1-CD2 3.7Å; V202-L219 HydrophobicContact CG1-CD1 4.01Å; V202-L219 HydrophobicContact CG1-CD2 4.45Å; T205-L219 HydrophobicContact CG2-CD2 4.04Å; W209-L219 HydrophobicContact CH2-CD1 4.48Å; W209-L219 HydrophobicContact CH2-CD2 4Å; W209-L219 HydrophobicContact CH2-CG 3.86Å; W209-L219 HydrophobicContact CZ2-CD2 4.09Å; W209-L219 HydrophobicContact CZ2-CG 4.35Å; L219-L275 HydrophobicContact CD1-CD2 4.43Å
220	E	89.8	Confident	79.3	Confident	34 Å²	34	48.2 Å²	48.2	16%	0.159	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124	174.3	-176.9	179.7	-174.9	0	0	109	S127 K128 V129 Y169 I171	S127-E220 WeakPolarHBondContact CB-OE1 3.4Å; S127-E220 PolarHBondContact OG-OE1 2.91Å; K128-E220 CarbonylContact O-C 3.58Å; K128-E220 WeakPolarHBondContact O-CA 3.5Å; V129-E220 HydrophobicContact CG2-CB 4.42Å; V129-E220 HydrophobicContact CG2-CG 4.23Å; Y169-E220 PolarHBondContact N-O 3.42Å; Y169-E220 PolarHBondContact O-N 2.57Å; I171-E220 HydrophobicContact CD1-CB 4.22Å; I171-E220 HydrophobicContact CG1-CB 4.04Å
221	I	90.1	Very high	78.1	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	125.5	164.3	-62.8	173.8	0	0	0	107.4	S127 K128 F130 F149 I166 E167 L168 F248	S127-I221 CarbonylContact C-O 3.46Å; S127-I221 VanDerWaalsContact CA-O 3.24Å; S127-I221 WeakPolarHBondContact CA-O 3.18Å; K128-I221 PolarHBondContact N-O 2.98Å; K128-I221 PolarHBondContact O-N 2.77Å; F130-I221 HydrophobicContact CD2-CD1 4.34Å; F130-I221 HydrophobicContact CD2-CG1 4.21Å; F130-I221 HydrophobicContact CE2-CB 3.87Å; F130-I221 HydrophobicContact CE2-CD1 3.42Å; F130-I221 VanDerWaalsContact CE2-CD1 3.42Å; F130-I221 HydrophobicContact CE2-CG1 3.5Å; F130-I221 VanDerWaalsContact CE2-CG1 3.5Å; F130-I221 HydrophobicContact CZ-CD1 3.64Å; F130-I221 HydrophobicContact CZ-CG1 4.24Å; F149-I221 HydrophobicContact CE1-CD1 3.82Å; F149-I221 HydrophobicContact CE1-CG1 4.34Å; F149-I221 HydrophobicContact CZ-CD1 4.21Å; I166-I221 HydrophobicContact CB-CG2 3.98Å; I166-I221 HydrophobicContact CD1-CG2 4.31Å; I166-I221 HydrophobicContact CG2-CG2 4.38Å; E167-I221 CarbonylContact O-C 3.57Å; E167-I221 WeakPolarHBondContact O-CA 3.46Å; L168-I221 HydrophobicContact CD1-CD1 4.49Å; L168-I221 HydrophobicContact CD1-CG1 3.56Å; I221-F248 HydrophobicContact CD1-CE1 4.21Å; I221-F248 HydrophobicContact CD1-CE2 3.94Å; I221-F248 HydrophobicContact CD1-CZ 3.61Å; I221-F248 HydrophobicContact CG2-CE2 4.39Å; I221-F248 HydrophobicContact CG2-CZ 4.4Å
222	S	86.8	Confident	76.9	Confident	7 Å²	7	60.8 Å²	60.8	5%	0.049	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	166.2	173.4	73.7	0	0	0	0	111.6	E167 Y169	E167-S222 PolarHBondContact N-O 3.02Å; E167-S222 PolarHBondContact O-N 2.93Å; Y169-S222 WeakPolarHBondContact CE2-OG 3.5Å
223	V	83.9	Confident	75.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	153.1	167	-62.3	0	0	0	0	110.7	T126 C225 P226 E242 L244	T126-V223 PolarHBondContact O-N 2.81Å; V223-C225 PolarHBondContact O-N 2.77Å; V223-P226 HydrophobicContact CG2-CB 3.86Å; V223-E242 HydrophobicContact CB-CG 4.18Å; V223-E242 HydrophobicContact CG1-CG 4.19Å; V223-E242 HydrophobicContact CG2-CB 4.1Å; V223-E242 HydrophobicContact CG2-CG 4.29Å; V223-E242 WeakPolarHBondContact CG2-O 3.48Å; V223-L244 HydrophobicContact CG1-CB 3.98Å; V223-L244 HydrophobicContact CG1-CD1 3.8Å
224	H	78.4	Confident	75	Confident	62 Å²	62	59.2 Å²	59.2	29%	0.287	30%	0.303	S	S	.	.	S	Bend	trans	-64.4	122.9	171.2	179.8	68.6	0	0	0	110.6	R165 E167 F230	R165-H224 HydrophobicContact CB-CB 4.24Å; R165-H224 HydrophobicContact CG-CB 4.13Å; R165-H224 PolarHBondContact O-N 2.84Å; E167-H224 VanDerWaalsContact CD-ND1 3.33Å; E167-H224 HydrophobicContact CG-CB 4.41Å; E167-H224 IonicContact OE1-CE1 3.08Å; E167-H224 IonicContact OE1-CG 2.77Å; E167-H224 IonicContact OE1-ND1 2.74Å; E167-H224 PolarHBondContact OE1-ND1 2.64Å; E167-H224 IonicContact OE2-ND1 3.94Å; H224-F230 AromaticContact CD2-CE2 3.83Å
225	C	71	Confident	74.4	Confident	44 Å²	44	55.4 Å²	55.4	30%	0.297	29%	0.288	S	S	.	.	S	Bend	trans	48.4	76.9	-177.3	-68.6	0	0	0	0	114.1	V223 C227 H228 F230	V223-C225 PolarHBondContact O-N 2.77Å; C225-C227 PolarHBondContact O-N 2.91Å; C225-H228 PolarHBondContact O-N 2.9Å; C225-H228 VanDerWaalsContact O-N 3.12Å; C225-H228 VanDerWaalsContact O-O 3.05Å; C225-F230 HydrophobicContact CB-CE2 4.05Å; C225-F230 HydrophobicContact CB-CZ 4.29Å
226	P	63.4	Low	73.5	Confident	55 Å²	55	58.1 Å²	58.1	36%	0.357	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.2	-174.9	24.4	-34.1	0	0	0	115.3	V223	V223-P226 HydrophobicContact CG2-CB 3.86Å
227	C	60.4	Low	72.5	Confident	66 Å²	66	57.7 Å²	57.7	45%	0.446	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-12.2	179.4	57.1	0	0	0	0	114.3	C225	C225-C227 PolarHBondContact O-N 2.91Å
228	H	62.3	Low	71.3	Confident	59 Å²	59	61.6 Å²	61.6	27%	0.273	32%	0.32	S	S	.	.			trans	-133.6	140.2	-172.6	-60.2	150.2	0	0	0	111.2	C225 I236 D238	C225-H228 PolarHBondContact O-N 2.9Å; C225-H228 VanDerWaalsContact O-N 3.12Å; C225-H228 VanDerWaalsContact O-O 3.05Å; H228-I236 HydrophobicContact CB-CG2 3.57Å; H228-D238 IonicContact CD2-OD1 2.77Å; H228-D238 PolarHBondContact CD2-OD1 3.2Å; H228-D238 IonicContact CG-OD1 3.11Å; H228-D238 IonicContact NE2-OD1 3.73Å
229	T	61	Low	69.9	Low	23 Å²	23	69.1 Å²	69.1	14%	0.141	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.5	169.6	40	0	0	0	0	110.8	V237 I240 E242	T229-V237 PolarHBondContact N-O 3.36Å; T229-V237 PolarHBondContact O-N 3.27Å; T229-V237 WeakPolarHBondContact OG1-CB 3.41Å; T229-V237 PolarHBondContact OG1-O 3.28Å; T229-I240 HydrophobicContact CG2-CB 4.17Å; T229-I240 HydrophobicContact CG2-CG2 4.06Å; T229-I240 VanDerWaalsContact CG2-O 3.27Å; T229-I240 WeakPolarHBondContact CG2-O 3.37Å; T229-E242 HydrophobicContact CG2-CB 3.96Å
230	F	61.5	Low	68.6	Low	87 Å²	87	73.9 Å²	73.9	38%	0.382	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.5	178.1	-57.6	-82.6	0	0	0	110.4	H224 C225 I236	H224-F230 AromaticContact CD2-CE2 3.83Å; C225-F230 HydrophobicContact CB-CE2 4.05Å; C225-F230 HydrophobicContact CB-CZ 4.29Å; F230-I236 HydrophobicContact CD1-CG1 4.27Å; F230-I236 HydrophobicContact CE1-CD1 4.38Å; F230-I236 HydrophobicContact CE1-CG1 4.07Å
231	R	63.5	Low	67.5	Low	146 Å²	146	77.3 Å²	77.3	55%	0.551	40%	0.404	S	S	*	.			trans	-77.4	163.4	166.4	-62.6	-174	-156.5	-132.5	1.8	110.6	N233 G234 E235 V237	R231-N233 WeakPolarHBondContact CB-OD1 3.37Å; R231-N233 PolarHBondContact O-N 2.95Å; R231-G234 PolarHBondContact O-N 3.45Å; R231-E235 PolarHBondContact N-O 3.11Å; R231-V237 HydrophobicContact CG-CG2 4.13Å
232	K	62.7	Low	66.6	Low	224 Å²	224	78.2 Å²	78.2	97%	0.974	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-22.2	179	-68.4	-173.1	176.8	-176.2	0	113.9
233	N	64.3	Low	66.1	Low	103 Å²	103	81.9 Å²	81.9	55%	0.551	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	4.1	176.7	46.9	-36.3	0	0	0	113.9	R231 E235	R231-N233 WeakPolarHBondContact CB-OD1 3.37Å; R231-N233 PolarHBondContact O-N 2.95Å; N233-E235 VanDerWaalsContact C-N 3.3Å; N233-E235 PolarHBondContact ND2-OE1 3.2Å; N233-E235 PolarHBondContact ND2-OE2 3.09Å; N233-E235 VanDerWaalsContact ND2-OE2 3.09Å; N233-E235 PolarHBondContact O-N 3.46Å
234	G	64.2	Low	66	Low	56 Å²	56	83 Å²	83	58%	0.577	43%	0.433	S	S	*	.	S	Bend	trans	82.4	0.7	176.7	0	0	0	0	0	115.1	R231	R231-G234 PolarHBondContact O-N 3.45Å
235	E	67.9	Low	66.2	Low	107 Å²	107	81.3 Å²	81.3	50%	0.5	43%	0.425	S	S	.	.			trans	-71	132.6	174.5	-72	173	-177.9	0	0	111.2	R231 N233	R231-E235 PolarHBondContact N-O 3.11Å; N233-E235 VanDerWaalsContact C-N 3.3Å; N233-E235 PolarHBondContact ND2-OE1 3.2Å; N233-E235 PolarHBondContact ND2-OE2 3.09Å; N233-E235 VanDerWaalsContact ND2-OE2 3.09Å; N233-E235 PolarHBondContact O-N 3.46Å
236	I	65.3	Low	66.9	Low	90 Å²	90	79.4 Å²	79.4	46%	0.462	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	124.9	177.1	-49	-177	0	0	0	108.3	H228 F230 D238	H228-I236 HydrophobicContact CB-CG2 3.57Å; F230-I236 HydrophobicContact CD1-CG1 4.27Å; F230-I236 HydrophobicContact CE1-CD1 4.38Å; F230-I236 HydrophobicContact CE1-CG1 4.07Å; I236-D238 WeakPolarHBondContact CG2-OD1 3.44Å
237	V	64.8	Low	67.9	Low	29 Å²	29	79.4 Å²	79.4	18%	0.176	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	104.7	173.9	-179.4	0	0	0	0	108.5	T229 R231 N239 I240	T229-V237 PolarHBondContact N-O 3.36Å; T229-V237 PolarHBondContact O-N 3.27Å; T229-V237 WeakPolarHBondContact OG1-CB 3.41Å; T229-V237 PolarHBondContact OG1-O 3.28Å; R231-V237 HydrophobicContact CG-CG2 4.13Å; V237-N239 PolarHBondContact O-N 2.78Å; V237-I240 HydrophobicContact CG1-CD1 4.03Å; V237-I240 HydrophobicContact CG1-CG1 4.18Å
238	D	56.4	Low	69.2	Low	101 Å²	101	76.5 Å²	76.5	54%	0.54	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	10.1	-168.3	-62.9	-31.1	0	0	0	115.2	H228 I236	H228-D238 IonicContact CD2-OD1 2.77Å; H228-D238 PolarHBondContact CD2-OD1 3.2Å; H228-D238 IonicContact CG-OD1 3.11Å; H228-D238 IonicContact NE2-OD1 3.73Å; I236-D238 WeakPolarHBondContact CG2-OD1 3.44Å
239	N	58.3	Low	70.1	Confident	158 Å²	158	77 Å²	77	85%	0.845	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	10.5	-173.2	-80.1	-32.9	0	0	0	114.8	V237	V237-N239 PolarHBondContact O-N 2.78Å
240	I	64.8	Low	70.8	Confident	99 Å²	99	76.7 Å²	76.7	51%	0.508	39%	0.39	S	S	.	.			trans	-126.4	114.3	176.7	-55.7	173.8	0	0	0	107.6	T229 V237 E242	T229-I240 HydrophobicContact CG2-CB 4.17Å; T229-I240 HydrophobicContact CG2-CG2 4.06Å; T229-I240 VanDerWaalsContact CG2-O 3.27Å; T229-I240 WeakPolarHBondContact CG2-O 3.37Å; V237-I240 HydrophobicContact CG1-CD1 4.03Å; V237-I240 HydrophobicContact CG1-CG1 4.18Å; I240-E242 PolarHBondContact O-N 2.77Å
241	N	65.8	Low	71.3	Confident	106 Å²	106	74.5 Å²	74.5	57%	0.567	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-69.2	126.9	172.4	-67	-15.5	0	0	0	109	T126 L243	T126-N241 HydrophobicContact CG2-CB 4.49Å; N241-L243 PolarHBondContact O-N 3.43Å
242	E	71.3	Confident	71.2	Confident	21 Å²	21	73.1 Å²	73.1	10%	0.098	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-71.5	126	172.2	-175.2	150.8	179.8	0	0	109.2	T126 K161 Q164 V223 T229 I240	T126-E242 VanDerWaalsContact CG2-O 3.28Å; T126-E242 WeakPolarHBondContact CG2-O 3.46Å; K161-E242 IonicContact NZ-OE1 2.78Å; K161-E242 PolarHBondContact NZ-OE1 2.86Å; K161-E242 IonicContact NZ-OE2 3.08Å; K161-E242 PolarHBondContact NZ-OE2 3.33Å; K161-E242 VanDerWaalsContact NZ-OE2 3.08Å; Q164-E242 PolarHBondContact NE2-OE1 3.09Å; V223-E242 HydrophobicContact CB-CG 4.18Å; V223-E242 HydrophobicContact CG1-CG 4.19Å; V223-E242 HydrophobicContact CG2-CB 4.1Å; V223-E242 HydrophobicContact CG2-CG 4.29Å; V223-E242 WeakPolarHBondContact CG2-O 3.48Å; T229-E242 HydrophobicContact CG2-CB 3.96Å; I240-E242 PolarHBondContact O-N 2.77Å
243	L	77.8	Confident	70.7	Confident	84 Å²	84	64.9 Å²	64.9	44%	0.44	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-89.4	145.7	178.9	-57.7	-174.1	0	0	0	109.8	I125 T126 Q164 N241 E245	I125-L243 HydrophobicContact CB-CD2 4.09Å; I125-L243 HydrophobicContact CG2-CD1 4.12Å; I125-L243 HydrophobicContact CG2-CD2 3.41Å; I125-L243 VanDerWaalsContact CG2-CD2 3.41Å; I125-L243 HydrophobicContact CG2-CG 4.23Å; T126-L243 HydrophobicContact CG2-CD2 4.37Å; Q164-L243 PolarHBondContact NE2-O 3.19Å; N241-L243 PolarHBondContact O-N 3.43Å; L243-E245 PolarHBondContact O-N 2.9Å
244	L	81.1	Confident	69.6	Low	23 Å²	23	66 Å²	66	12%	0.12	37%	0.366	C	S	.	.			trans	-74.1	100.3	171.5	-173.3	70.4	0	0	0	108.5	I125 K128 I166 V223 V246	I125-L244 PolarHBondContact O-N 3.44Å; K128-L244 HydrophobicContact CB-CD2 4.3Å; K128-L244 HydrophobicContact CG-CD2 3.59Å; I166-L244 HydrophobicContact CG2-CD1 3.88Å; V223-L244 HydrophobicContact CG1-CB 3.98Å; V223-L244 HydrophobicContact CG1-CD1 3.8Å; L244-V246 VanDerWaalsContact C-N 3.34Å; L244-V246 HydrophobicContact CD1-CB 4.26Å
245	E	82.7	Confident	68.8	Low	27 Å²	27	71.9 Å²	71.9	13%	0.126	37%	0.373	C	S	.	.			trans	-84.2	-16.1	178.3	-60.2	-168.7	150.8	0	0	111.5	N156 A159 K160 K161 T191 L243 K247	N156-E245 WeakPolarHBondContact CB-O 3.46Å; N156-E245 PolarHBondContact ND2-O 2.88Å; A159-E245 HydrophobicContact CB-CB 4.04Å; K160-E245 VanDerWaalsContact CB-OE1 3.3Å; K160-E245 WeakPolarHBondContact CB-OE1 3.38Å; K160-E245 WeakPolarHBondContact CG-OE1 3.46Å; K160-E245 VanDerWaalsContact N-CD 3.3Å; K160-E245 PolarHBondContact N-OE1 3.02Å; K160-E245 PolarHBondContact N-OE2 3.46Å; K161-E245 PolarHBondContact N-OE2 3.43Å; T191-E245 HydrophobicContact CG2-CB 4.06Å; L243-E245 PolarHBondContact O-N 2.9Å; E245-K247 PolarHBondContact O-N 3.15Å
246	V	84.8	Confident	67.5	Low	4 Å²	4	74.3 Å²	74.3	2%	0.024	39%	0.389	C	S	.	.			trans	-71.5	124.6	176	-176.1	0	0	0	0	109.9	R153 Q164 I166 V189 T191 L244 F248	R153-V246 HydrophobicContact CG-CG1 4.08Å; Q164-V246 HydrophobicContact CB-CG2 4.2Å; I166-V246 HydrophobicContact CG2-CB 4.32Å; I166-V246 HydrophobicContact CG2-CG2 3.81Å; V189-V246 HydrophobicContact CG2-CB 4.48Å; V189-V246 HydrophobicContact CG2-CG1 4.18Å; V189-V246 HydrophobicContact CG2-CG2 3.49Å; V189-V246 VanDerWaalsContact CG2-CG2 3.49Å; T191-V246 HydrophobicContact CG2-CG2 4.24Å; L244-V246 VanDerWaalsContact C-N 3.34Å; L244-V246 HydrophobicContact CD1-CB 4.26Å; V246-F248 HydrophobicContact CG1-CE1 4.22Å; V246-F248 HydrophobicContact CG1-CE2 4Å; V246-F248 HydrophobicContact CG1-CZ 3.76Å
247	K	85.5	Confident	66.6	Low	55 Å²	55	74 Å²	74	24%	0.239	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	143.3	176.7	-72.3	-175.6	168.8	-142.2	0	110.8	R153 I154 N156 E245 E252	R153-K247 WeakPolarHBondContact CA-O 3.38Å; I154-K247 HydrophobicContact CD1-CB 3.89Å; I154-K247 HydrophobicContact CG1-CB 3.56Å; I154-K247 WeakPolarHBondContact CG1-O 3.24Å; I154-K247 PolarHBondContact N-O 3.11Å; N156-K247 HydrophobicContact CB-CD 3.9Å; N156-K247 HydrophobicContact CB-CG 4.03Å; E245-K247 PolarHBondContact O-N 3.15Å; K247-E252 WeakPolarHBondContact CD-OE1 3.45Å; K247-E252 WeakPolarHBondContact CE-OE1 3.46Å; K247-E252 IonicContact NZ-OE1 2.68Å; K247-E252 PolarHBondContact NZ-OE1 2.89Å; K247-E252 IonicContact NZ-OE2 3.41Å; K247-E252 PolarHBondContact NZ-OE2 3.39Å
248	F	86.4	Confident	65.7	Low	5 Å²	5	77.6 Å²	77.6	2%	0.022	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.2	177.4	-61.1	-80.7	0	0	0	110	F130 A151 L152 I166 I198 I221 V246 M251	F130-F248 HydrophobicContact CZ-CD2 4.3Å; A151-F248 HydrophobicContact CB-CD1 3.6Å; A151-F248 HydrophobicContact CB-CE1 3.91Å; A151-F248 HydrophobicContact CB-CG 4.42Å; L152-F248 VanDerWaalsContact O-CA 3.31Å; L152-F248 WeakPolarHBondContact O-CA 3.46Å; I166-F248 HydrophobicContact CD1-CZ 4.26Å; I198-F248 HydrophobicContact CD1-CE1 3.9Å; I198-F248 HydrophobicContact CD1-CZ 4.5Å; I221-F248 HydrophobicContact CD1-CE1 4.21Å; I221-F248 HydrophobicContact CD1-CE2 3.94Å; I221-F248 HydrophobicContact CD1-CZ 3.61Å; I221-F248 HydrophobicContact CG2-CE2 4.39Å; I221-F248 HydrophobicContact CG2-CZ 4.4Å; V246-F248 HydrophobicContact CG1-CE1 4.22Å; V246-F248 HydrophobicContact CG1-CE2 4Å; V246-F248 HydrophobicContact CG1-CZ 3.76Å; F248-M251 HydrophobicContact CB-CB 4.35Å; F248-M251 WeakPolarHBondContact O-CB 3.16Å; F248-M251 PolarHBondContact O-N 3.15Å
249	E	82.4	Confident	65.1	Low	68 Å²	68	81.8 Å²	81.8	32%	0.318	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	139	178	-167.7	63.9	-171.2	0	0	110.3	L152 I154 M251 P271	L152-E249 HydrophobicContact CB-CB 4.3Å; L152-E249 HydrophobicContact CD2-CB 4.13Å; L152-E249 HydrophobicContact CD2-CG 4.47Å; L152-E249 HydrophobicContact CG-CB 4.48Å; L152-E249 PolarHBondContact O-N 2.94Å; I154-E249 HydrophobicContact CG2-CB 3.82Å; I154-E249 HydrophobicContact CG2-CG 4.49Å; I154-E249 WeakPolarHBondContact CG2-OE2 3.26Å; E249-M251 VanDerWaalsContact C-N 3.29Å; E249-M251 PolarHBondContact O-N 2.94Å; E249-P271 HydrophobicContact CB-CG 4.15Å; E249-P271 HydrophobicContact CG-CG 3.54Å
250	G	75.3	Confident	64.3	Low	17 Å²	17	82 Å²	82	18%	0.175	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	6.4	-179.4	0	0	0	0	0	115.7	Y272	G250-Y272 VanDerWaalsContact CA-CD1 3.43Å; G250-Y272 WeakPolarHBondContact O-CD1 3.47Å; G250-Y272 WeakPolarHBondContact O-CE1 3.16Å
251	M	71.5	Confident	63.2	Low	41 Å²	41	81 Å²	81	20%	0.202	40%	0.403	C	S	.	.			trans	-103.4	-14.8	174.9	-153.9	90.8	-174.4	0	0	113.4	M108 K128 V129 F130 F248 E249 G253	M108-M251 HydrophobicContact CE-SD 3.9Å; M108-M251 HydrophobicContact SD-CE 4.21Å; M108-M251 HydrophobicContact SD-SD 3.81Å; K128-M251 HydrophobicContact CB-CE 3.87Å; K128-M251 HydrophobicContact CD-CE 4.24Å; K128-M251 HydrophobicContact CD-CG 4.09Å; V129-M251 WeakPolarHBondContact O-CE 3.48Å; F130-M251 HydrophobicContact CD1-CE 4.2Å; F130-M251 HydrophobicContact CD1-SD 3.93Å; F130-M251 HydrophobicContact CE1-CE 4Å; F130-M251 HydrophobicContact CE1-SD 3.43Å; F130-M251 WeakPolarHBondContact CE1-SD 3.49Å; F130-M251 HydrophobicContact CZ-CE 4.21Å; F130-M251 HydrophobicContact CZ-SD 3.99Å; F248-M251 HydrophobicContact CB-CB 4.35Å; F248-M251 WeakPolarHBondContact O-CB 3.16Å; F248-M251 PolarHBondContact O-N 3.15Å; E249-M251 VanDerWaalsContact C-N 3.29Å; E249-M251 PolarHBondContact O-N 2.94Å; M251-G253 PolarHBondContact O-N 2.96Å
252	E	62.4	Low	62.1	Low	117 Å²	117	82.3 Å²	82.3	55%	0.547	41%	0.406	S	S	.	.			trans	-87.6	97.5	-179.3	-63.6	-166	155.3	0	0	109.9	K247	K247-E252 WeakPolarHBondContact CD-OE1 3.45Å; K247-E252 WeakPolarHBondContact CE-OE1 3.46Å; K247-E252 IonicContact NZ-OE1 2.68Å; K247-E252 PolarHBondContact NZ-OE1 2.89Å; K247-E252 IonicContact NZ-OE2 3.41Å; K247-E252 PolarHBondContact NZ-OE2 3.39Å
253	G	52.1	Low	60.7	Low	52 Å²	52	90.1 Å²	90.1	54%	0.536	44%	0.442	S	S	.	.			trans	-92.5	89.5	168.1	0	0	0	0	0	109.9	M251 Y255	M251-G253 PolarHBondContact O-N 2.96Å; G253-Y255 PolarHBondContact O-N 3.42Å
254	D	41.1	Very low	58.9	Low	126 Å²	126	93.8 Å²	93.8	67%	0.674	46%	0.457	S	S	*	.			trans	-70.4	114.5	155.2	-95.8	-17.2	0	0	0	107.2	N256 D257	D254-N256 PolarHBondContact O-N 2.83Å; D254-D257 PolarHBondContact O-N 2.92Å
255	Y	47.5	Very low	57.1	Low	180 Å²	180	99.2 Å²	99.2	71%	0.706	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-18.3	-178.1	-92	-88.5	0	0	0	113.7	G253	G253-Y255 PolarHBondContact O-N 3.42Å
256	N	40.8	Very low	55.1	Low	158 Å²	158	106.9 Å²	106.9	85%	0.845	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-15.9	-179.9	-76.4	-18.3	0	0	0	114.6	D254	D254-N256 PolarHBondContact O-N 2.83Å
257	D	46	Very low	53.2	Low	84 Å²	84	114.6 Å²	114.6	45%	0.449	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.1	-6.4	-177.2	-92	-23.2	0	0	0	114.5	D254 K259 K260 Q261	D254-D257 PolarHBondContact O-N 2.92Å; D257-K259 VanDerWaalsContact C-N 3.3Å; D257-K259 PolarHBondContact O-N 2.85Å; D257-K260 PolarHBondContact O-N 3.42Å; D257-Q261 PolarHBondContact O-N 3.05Å
258	Q	46.3	Very low	51.4	Low	103 Å²	103	120.6 Å²	120.6	48%	0.481	58%	0.578	S	S	.	*	H	α-helix	trans	-63.5	-33.1	-178.7	-72	-177.2	-19.4	0	0	113
259	K	42.4	Very low	50.1	Low	189 Å²	189	124.4 Å²	124.4	82%	0.822	60%	0.595	S	S	*	*	H	α-helix	trans	-76.1	-21.2	178.4	-88.5	-175.4	174.6	-179.3	0	114.7	D257	D257-K259 VanDerWaalsContact C-N 3.3Å; D257-K259 PolarHBondContact O-N 2.85Å
260	K	41.6	Very low	49.1	Very low	163 Å²	163	124.6 Å²	124.6	71%	0.709	60%	0.596	S	S	*	*	H	α-helix	trans	-89.8	-23.1	174.8	-84.5	-178.4	176.1	176.2	0	112.9	D257	D257-K260 PolarHBondContact O-N 3.42Å
261	Q	41.8	Very low	49	Very low	78 Å²	78	125.9 Å²	125.9	36%	0.364	60%	0.602	S	S	.	*	H	α-helix	trans	-82.5	-19	-179.5	-77.7	-178.2	-7.6	0	0	114	D257 E263 Q264 K265	D257-Q261 PolarHBondContact O-N 3.05Å; Q261-E263 PolarHBondContact O-N 3.23Å; Q261-Q264 PolarHBondContact O-N 3.14Å; Q261-K265 WeakPolarHBondContact O-CG 3.35Å; Q261-K265 PolarHBondContact O-N 2.84Å
262	E	44	Very low	49.5	Very low	134 Å²	134	127.1 Å²	127.1	63%	0.626	61%	0.605	S	S	*	*	S	Bend	trans	-69.4	-30.4	179.3	-77.6	179.1	165.8	0	0	113.5
263	E	41.3	Very low	50.8	Low	184 Å²	184	121.6 Å²	121.6	86%	0.86	58%	0.578	S	S	*	*	S	Bend	trans	-86.5	-13.1	177.9	-69	179.7	166.6	0	0	113.8	Q261	Q261-E263 PolarHBondContact O-N 3.23Å
264	Q	39.3	Very low	52.8	Low	161 Å²	161	119.2 Å²	119.2	75%	0.752	55%	0.554	S	S	*	*	S	Bend	trans	-110.5	9	-179.8	-69.6	-174.3	7.5	0	0	114.3	Q261 E266	Q261-Q264 PolarHBondContact O-N 3.14Å; Q264-E266 PolarHBondContact O-N 3.18Å
265	K	43.9	Very low	55.3	Low	137 Å²	137	113.2 Å²	113.2	60%	0.596	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-11.9	-176.8	-102.9	169.6	-173	172.7	0	115.2	Q261	Q261-K265 WeakPolarHBondContact O-CG 3.35Å; Q261-K265 PolarHBondContact O-N 2.84Å
266	E	41.5	Very low	57.5	Low	188 Å²	188	104.7 Å²	104.7	88%	0.879	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-7.4	-174	-82.6	-168.7	150.2	0	0	116.1	Q264	Q264-E266 PolarHBondContact O-N 3.18Å
267	Q	43.7	Very low	60	Low	167 Å²	167	97.1 Å²	97.1	78%	0.78	45%	0.448	S	S	*	.	S	Bend	trans	-127	-8.1	-169	-67.6	-172.5	1.8	0	0	117.7
268	K	48.3	Very low	62	Low	181 Å²	181	93.3 Å²	93.3	79%	0.787	43%	0.427	S	S	*	.			trans	-138.4	106.5	170.3	-75	-177.7	-179.7	175.4	0	110.1	Q270	K268-Q270 PolarHBondContact O-N 2.72Å
269	E	58.1	Low	64	Low	85 Å²	85	88.6 Å²	88.6	40%	0.397	41%	0.405	S	S	.	.			trans	-61	112	166.3	-73.2	-158	151.3	0	0	108.7	Q66 A69	Q66-E269 WeakPolarHBondContact CA-OE1 3.3Å; Q66-E269 WeakPolarHBondContact CA-OE2 3.48Å; Q66-E269 WeakPolarHBondContact CB-OE1 3.39Å; Q66-E269 WeakPolarHBondContact CG-OE1 3.45Å; Q66-E269 PolarHBondContact NE2-OE1 3.03Å; A69-E269 WeakPolarHBondContact CB-OE2 3.07Å
270	Q	63.3	Low	65.9	Low	72 Å²	72	80.4 Å²	80.4	34%	0.336	37%	0.37	S	S	.	.			trans	-72.9	144.9	173.5	-63.5	-167.1	-3.5	0	0	109.5	K268 Y272	K268-Q270 PolarHBondContact O-N 2.72Å; Q270-Y272 HydrophobicContact CB-CD2 3.92Å; Q270-Y272 HydrophobicContact CB-CE2 3.55Å; Q270-Y272 HydrophobicContact CG-CE2 4.35Å; Q270-Y272 WeakPolarHBondContact O-CD2 3.28Å; Q270-Y272 PolarHBondContact O-N 2.9Å; Q270-Y272 PolarHBondContact OE1-OH 3.4Å
271	P	71.1	Confident	67.5	Low	44 Å²	44	73.3 Å²	73.3	29%	0.286	34%	0.341	S	S	.	.			trans	-76.7	65.2	-177.3	34.7	-37.4	0	0	0	110.6	L152 W197 E249	L152-P271 HydrophobicContact CD2-CB 3.85Å; L152-P271 HydrophobicContact CD2-CG 3.55Å; W197-P271 HydrophobicContact CH2-CB 3.71Å; W197-P271 HydrophobicContact CZ2-CB 3.88Å; E249-P271 HydrophobicContact CB-CG 4.15Å; E249-P271 HydrophobicContact CG-CG 3.54Å
272	Y	82.8	Confident	68.9	Low	67 Å²	67	72.9 Å²	72.9	26%	0.263	35%	0.345	S	S	.	.			trans	-64.8	150.8	176.3	-71	-73.6	0	0	0	111.1	G250 Q270 H274	G250-Y272 VanDerWaalsContact CA-CD1 3.43Å; G250-Y272 WeakPolarHBondContact O-CD1 3.47Å; G250-Y272 WeakPolarHBondContact O-CE1 3.16Å; Q270-Y272 HydrophobicContact CB-CD2 3.92Å; Q270-Y272 HydrophobicContact CB-CE2 3.55Å; Q270-Y272 HydrophobicContact CG-CE2 4.35Å; Q270-Y272 WeakPolarHBondContact O-CD2 3.28Å; Q270-Y272 PolarHBondContact O-N 2.9Å; Q270-Y272 PolarHBondContact OE1-OH 3.4Å; Y272-H274 PolarHBondContact O-N 3.27Å; Y272-H274 PolarHBondContact O-ND1 3.39Å
273	P	90.6	Very high	69.9	Low	0 Å²	0	74.1 Å²	74.1	0%	0	35%	0.35	C	S	.	.			trans	-54.3	136.1	169.1	-21.8	32.2	0	0	0	110.5	M108 F130 F149 R150 A151	M108-P273 HydrophobicContact CB-CB 4.34Å; M108-P273 VanDerWaalsContact CB-O 3.23Å; M108-P273 WeakPolarHBondContact CB-O 3.47Å; M108-P273 HydrophobicContact CE-CG 4.48Å; M108-P273 PolarHBondContact N-O 3.44Å; M108-P273 HydrophobicContact SD-CB 4.43Å; M108-P273 HydrophobicContact SD-CG 4.3Å; F130-P273 HydrophobicContact CD1-CB 3.7Å; F130-P273 HydrophobicContact CD1-CG 3.9Å; F130-P273 HydrophobicContact CE1-CB 3.88Å; F130-P273 HydrophobicContact CE1-CG 3.67Å; F149-P273 HydrophobicContact CE2-CB 4.01Å; F149-P273 HydrophobicContact CZ-CB 4.42Å; R150-P273 CarbonylContact O-C 3.51Å; R150-P273 VanDerWaalsContact O-CA 3.28Å; R150-P273 WeakPolarHBondContact O-CA 3.3Å; A151-P273 HydrophobicContact CB-CB 4.15Å; A151-P273 HydrophobicContact CB-CG 4.32Å
274	H	92.4	Very high	71.3	Confident	3 Å²	3	66.2 Å²	66.2	1%	0.014	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	158.5	-175.2	59.3	-83.3	0	0	0	111.8	S73 K105 F106 R150 W197 Y272	S73-H274 PolarHBondContact OG-NE2 3.49Å; S73-H274 VanDerWaalsContact OG-NE2 3.14Å; K105-H274 HydrophobicContact CG-CB 4.19Å; F106-H274 CarbonylContact O-C 3.37Å; F106-H274 WeakPolarHBondContact O-CA 3.47Å; F106-H274 VanDerWaalsContact O-CB 3.28Å; F106-H274 WeakPolarHBondContact O-CB 3.44Å; R150-H274 PolarHBondContact N-O 3.31Å; R150-H274 PolarHBondContact O-N 3.25Å; W197-H274 AromaticContact CH2-CE1 3.77Å; W197-H274 AromaticContact CZ3-CE1 3.69Å; Y272-H274 PolarHBondContact O-N 3.27Å; Y272-H274 PolarHBondContact O-ND1 3.39Å
275	L	93.9	Very high	72.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138.2	168.9	-62.2	174.9	0	0	0	109.8	K105 F106 F132 V134 E148 F149 V202 V206 W209 L219 L277	K105-L275 CarbonylContact C-O 3.58Å; K105-L275 VanDerWaalsContact CA-O 3.3Å; K105-L275 WeakPolarHBondContact CA-O 3.32Å; F106-L275 HydrophobicContact CB-CB 4.32Å; F106-L275 PolarHBondContact N-O 3.41Å; F106-L275 PolarHBondContact O-N 2.84Å; F132-L275 HydrophobicContact CB-CD1 3.65Å; F132-L275 HydrophobicContact CB-CG 4.43Å; F132-L275 HydrophobicContact CD1-CD1 3.89Å; F132-L275 HydrophobicContact CD1-CG 3.72Å; F132-L275 HydrophobicContact CD2-CD1 3.57Å; F132-L275 HydrophobicContact CD2-CD2 4.3Å; F132-L275 HydrophobicContact CD2-CG 3.85Å; F132-L275 HydrophobicContact CE1-CD1 4.48Å; F132-L275 HydrophobicContact CE1-CG 3.87Å; F132-L275 HydrophobicContact CE2-CD1 4.19Å; F132-L275 HydrophobicContact CE2-CD2 4.09Å; F132-L275 HydrophobicContact CE2-CG 3.99Å; F132-L275 HydrophobicContact CG-CD1 3.39Å; F132-L275 HydrophobicContact CG-CG 3.71Å; F132-L275 HydrophobicContact CZ-CD2 4.24Å; F132-L275 HydrophobicContact CZ-CG 3.99Å; V134-L275 HydrophobicContact CG1-CD1 4.14Å; E148-L275 WeakPolarHBondContact O-CA 3.33Å; F149-L275 HydrophobicContact CB-CD2 3.69Å; F149-L275 HydrophobicContact CD2-CD2 4Å; F149-L275 HydrophobicContact CG-CD2 4.29Å; V202-L275 HydrophobicContact CG2-CD2 3.97Å; V206-L275 HydrophobicContact CG2-CD1 4.35Å; W209-L275 HydrophobicContact CZ3-CD1 4.01Å; L219-L275 HydrophobicContact CD1-CD2 4.43Å; L275-L277 HydrophobicContact CB-CD1 3.77Å
276	I	93.7	Very high	72.5	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	114.6	167.8	-60.5	-174.4	0	0	0	107.7	T74 L77 I103 Y104 A147 E148	T74-I276 HydrophobicContact CG2-CD1 4.17Å; T74-I276 HydrophobicContact CG2-CG2 4.17Å; L77-I276 HydrophobicContact CD2-CB 4.13Å; L77-I276 HydrophobicContact CD2-CD1 3.95Å; L77-I276 HydrophobicContact CD2-CG2 4.04Å; I103-I276 HydrophobicContact CG2-CG2 3.53Å; Y104-I276 WeakPolarHBondContact O-CA 3.5Å; A147-I276 WeakPolarHBondContact CA-O 3.41Å; E148-I276 PolarHBondContact N-O 3.47Å; E148-I276 PolarHBondContact O-N 2.88Å
277	L	93.2	Very high	72.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.1	175	-83.9	63.2	0	0	0	108.9	I103 Y104 F106 M137 L144 A147 V206 L275 M279	I103-L277 WeakPolarHBondContact CA-O 3.24Å; Y104-L277 PolarHBondContact N-O 3.28Å; Y104-L277 PolarHBondContact O-N 3.44Å; F106-L277 HydrophobicContact CD2-CD1 3.99Å; F106-L277 HydrophobicContact CD2-CD2 4.41Å; F106-L277 HydrophobicContact CE2-CB 4.46Å; F106-L277 HydrophobicContact CE2-CD1 4.27Å; F106-L277 HydrophobicContact CE2-CD2 3.92Å; F106-L277 HydrophobicContact CE2-CG 4.45Å; M137-L277 HydrophobicContact CG-CD2 4.44Å; L144-L277 HydrophobicContact CD1-CB 4.21Å; L144-L277 HydrophobicContact CD1-CD2 4.23Å; L144-L277 HydrophobicContact CD1-CG 3.93Å; A147-L277 HydrophobicContact CB-CD1 4.22Å; A147-L277 HydrophobicContact CB-CG 4.21Å; V206-L277 HydrophobicContact CG1-CD1 4.24Å; V206-L277 HydrophobicContact CG1-CD2 3.88Å; V206-L277 HydrophobicContact CG1-CG 4.12Å; L275-L277 HydrophobicContact CB-CD1 3.77Å; L277-M279 HydrophobicContact CB-CG 4.42Å
278	M	89.4	Confident	72.6	Confident	3 Å²	3	59 Å²	59	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	115.9	171	-57.1	178.2	-167	0	0	107.9	L77 I78 L81 K101 I103 F145 R146	L77-M278 HydrophobicContact CD2-CE 3.66Å; L77-M278 HydrophobicContact CG-CE 4.4Å; I78-M278 HydrophobicContact CD1-CE 3.56Å; I78-M278 HydrophobicContact CD1-SD 4.29Å; L81-M278 HydrophobicContact CD1-CE 4.39Å; K101-M278 HydrophobicContact CB-CB 4.28Å; I103-M278 HydrophobicContact CG1-CG 4.45Å; F145-M278 WeakPolarHBondContact CA-O 3.15Å; F145-M278 WeakPolarHBondContact CB-O 3.39Å; F145-M278 HydrophobicContact CD1-CB 4.4Å; F145-M278 PolarHBondContact N-O 3.33Å; R146-M278 HydrophobicContact CB-CB 4.32Å; R146-M278 HydrophobicContact CB-SD 4.17Å; R146-M278 PolarHBondContact N-O 3.06Å; R146-M278 PolarHBondContact O-N 3.46Å
279	M	86.8	Confident	72.2	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.025	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	144.9	-176.1	-57.9	-168.9	70.9	0	0	111.2	K101 E102 Y104 M137 N140 N143 L144 L277 P281	K101-M279 CarbonylContact C-O 3.52Å; K101-M279 VanDerWaalsContact CA-O 3.31Å; K101-M279 WeakPolarHBondContact CA-O 3.44Å; E102-M279 PolarHBondContact N-O 2.81Å; E102-M279 PolarHBondContact O-N 3.44Å; Y104-M279 HydrophobicContact CD2-CB 4.41Å; Y104-M279 HydrophobicContact CD2-CG 4.1Å; Y104-M279 HydrophobicContact CD2-SD 4.02Å; Y104-M279 HydrophobicContact CE2-CB 4.22Å; Y104-M279 HydrophobicContact CE2-CG 4.33Å; Y104-M279 HydrophobicContact CE2-SD 4.15Å; M137-M279 HydrophobicContact CB-SD 4.38Å; M137-M279 HydrophobicContact CG-SD 4.22Å; M137-M279 HydrophobicContact SD-SD 3.64Å; M137-M279 VanDerWaalsContact SD-SD 3.64Å; N140-M279 HydrophobicContact CB-CE 3.52Å; N140-M279 WeakPolarHBondContact O-CE 3.38Å; N143-M279 HydrophobicContact CB-CE 3.91Å; N143-M279 CarbonylContact O-C 3.55Å; N143-M279 VanDerWaalsContact O-CA 3.31Å; N143-M279 WeakPolarHBondContact O-CA 3.44Å; L144-M279 HydrophobicContact CD1-CG 4.36Å; L277-M279 HydrophobicContact CB-CG 4.42Å; M279-P281 WeakPolarHBondContact O-CD 2.92Å
280	I	82.4	Confident	71.1	Confident	16 Å²	16	54.8 Å²	54.8	8%	0.082	30%	0.297	C	S	.	.			trans	-92.5	115.7	172.4	-60.7	167.8	0	0	0	107.7	K101 N143 F145 R284 L285	K101-I280 HydrophobicContact CG-CG1 4.22Å; N143-I280 VanDerWaalsContact CB-O 3.23Å; N143-I280 WeakPolarHBondContact CB-O 3.41Å; N143-I280 PolarHBondContact O-N 2.85Å; F145-I280 HydrophobicContact CB-CD1 4.22Å; F145-I280 HydrophobicContact CB-CG1 4.13Å; F145-I280 HydrophobicContact CD2-CD1 4.05Å; F145-I280 HydrophobicContact CG-CD1 4.48Å; I280-R284 HydrophobicContact CG2-CB 4.08Å; I280-L285 HydrophobicContact CB-CD2 4.23Å; I280-L285 HydrophobicContact CG2-CD2 3.68Å; I280-L285 HydrophobicContact CG2-CG 4.24Å
281	P	76.6	Confident	69.8	Low	15 Å²	15	56.8 Å²	56.8	10%	0.097	32%	0.318	C	S	.	.			trans	-53	140	177.6	-28.5	35.2	0	0	0	112	E102 M279 H283 R284	E102-P281 HydrophobicContact CB-CG 4.48Å; E102-P281 HydrophobicContact CG-CG 3.69Å; M279-P281 WeakPolarHBondContact O-CD 2.92Å; P281-H283 PolarHBondContact O-N 3.24Å; P281-R284 HydrophobicContact CB-CG 4.22Å; P281-R284 WeakPolarHBondContact O-CA 3.28Å; P281-R284 WeakPolarHBondContact O-CB 3.47Å; P281-R284 PolarHBondContact O-N 2.96Å
282	P	70	Confident	68.6	Low	68 Å²	68	65.2 Å²	65.2	44%	0.442	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-60.7	-34.3	-173.8	23.1	-32.5	0	0	0	112.1	R284 L285	P282-R284 PolarHBondContact O-N 2.9Å; P282-L285 PolarHBondContact O-N 2.9Å
283	H	66.3	Low	66.7	Low	160 Å²	160	72.5 Å²	72.5	74%	0.741	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-64.3	-1.6	173.2	-56.9	-59.5	0	0	0	114.3	R50 P281	R50-H283 PolarHBondContact NH1-O 3.33Å; P281-H283 PolarHBondContact O-N 3.24Å
284	R	69.4	Low	64.7	Low	18 Å²	18	78 Å²	78	7%	0.068	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-108.2	3.4	178	-60.1	-173.2	-178.7	153.7	-2.4	113.8	L49 R50 Y99 A100 I280 P281 P282 E395	L49-R284 PolarHBondContact O-NH2 3.26Å; R50-R284 HydrophobicContact CG-CG 4.3Å; R50-R284 VanDerWaalsContact CZ-CA 3.47Å; R50-R284 PolarHBondContact NH2-O 3.39Å; Y99-R284 HydrophobicContact CG-CB 4.32Å; A100-R284 PolarHBondContact O-NH1 3.49Å; I280-R284 HydrophobicContact CG2-CB 4.08Å; P281-R284 HydrophobicContact CB-CG 4.22Å; P281-R284 WeakPolarHBondContact O-CA 3.28Å; P281-R284 WeakPolarHBondContact O-CB 3.47Å; P281-R284 PolarHBondContact O-N 2.96Å; P282-R284 PolarHBondContact O-N 2.9Å; R284-E395 IonicContact CZ-OE2 3.35Å; R284-E395 IonicContact NH1-OE2 2.76Å; R284-E395 PolarHBondContact NH1-OE2 2.98Å; R284-E395 IonicContact NH2-OE1 3.68Å; R284-E395 IonicContact NH2-OE2 2.95Å; R284-E395 PolarHBondContact NH2-OE2 2.94Å
285	L	61.4	Low	62.4	Low	84 Å²	84	84.8 Å²	84.8	44%	0.44	42%	0.422	S	S	.	.			trans	-91.6	6.8	-168	-69.1	173.3	0	0	0	117	N143 I280 P282 V287	N143-L285 VanDerWaalsContact OD1-CD1 3.25Å; N143-L285 WeakPolarHBondContact OD1-CD1 3.42Å; I280-L285 HydrophobicContact CB-CD2 4.23Å; I280-L285 HydrophobicContact CG2-CD2 3.68Å; I280-L285 HydrophobicContact CG2-CG 4.24Å; P282-L285 PolarHBondContact O-N 2.9Å; L285-V287 PolarHBondContact O-N 2.75Å
286	D	48	Very low	60.2	Low	126 Å²	126	96.6 Å²	96.6	67%	0.674	47%	0.466	S	S	*	.			trans	-76.7	96	179.8	-67.4	-40.8	0	0	0	114.2
287	V	46.1	Very low	58.5	Low	109 Å²	109	98.2 Å²	98.2	66%	0.661	48%	0.48	S	S	*	.				64.2	126.9	129	-172.6	0	0	0	0	124	L285	L285-V287 PolarHBondContact O-N 2.75Å
288	H	40.6	Very low	57	Low	183 Å²	183	102.3 Å²	102.3	85%	0.847	50%	0.502	S	S	*	.			trans	68.1	151.7	153.2	-67.3	-43	0	0	0	124.3
289	S	40.9	Very low	56	Low	92 Å²	92	105.4 Å²	105.4	64%	0.643	52%	0.518	S	S	*	.			trans	-116.6	154.3	-137	57	0	0	0	0	116.8	E95	E95-S289 WeakPolarHBondContact OE2-CA 3.49Å
290	S	34.8	Very low	55.3	Low	85 Å²	85	105.9 Å²	105.9	59%	0.594	52%	0.521	S	S	*	.			trans	-152.9	116.7	145.7	71.2	0	0	0	0	113.3	E95	E95-S290 PolarHBondContact OE1-N 2.81Å; E95-S290 VanDerWaalsContact OE1-O 3.1Å
291	S	36.3	Very low	54.9	Low	114 Å²	114	110.1 Å²	110.1	80%	0.797	54%	0.544	S	S	*	.			trans	-83.8	130.9	178.7	-177.1	0	0	0	0	112.3
292	R	45.7	Very low	54.8	Low	221 Å²	221	114 Å²	114	83%	0.834	56%	0.558	S	S	*	*			trans	-121.8	129.4	164.4	-70.5	-173.4	-167.2	178.4	4	110.3
293	R	42.4	Very low	55.1	Low	221 Å²	221	111.2 Å²	111.2	83%	0.834	54%	0.539	S	S	*	.			trans	-65.5	135.4	176.7	-116.2	177.9	-172	143.5	1.8	111.4
294	R	49.2	Very low	55.7	Low	115 Å²	115	108 Å²	108	43%	0.434	52%	0.524	S	S	.	.			trans	-88.5	141.4	173.5	-63.4	-173.8	-175.9	-178.8	5	110.8	D378	R294-D378 IonicContact NH1-OD1 3.73Å
295	K	43.5	Very low	56	Low	146 Å²	146	113.6 Å²	113.6	64%	0.635	55%	0.554	S	S	*	*			trans	-127.9	152.9	169.3	-77.4	-176.7	178.7	176.5	0	108.2	Q377	K295-Q377 PolarHBondContact O-NE2 3.02Å; K295-Q377 PolarHBondContact O-OE1 2.85Å
296	R	48.4	Very low	56.4	Low	247 Å²	247	113.2 Å²	113.2	93%	0.932	55%	0.553	S	S	*	*			trans	-69.2	141.7	-168	-56.2	178.2	-151.9	154.6	5.7	112.8
297	A	56.9	Low	57.5	Low	35 Å²	35	116.1 Å²	116.1	29%	0.289	56%	0.556	S	S	.	*			trans	-133.4	175	173.7	0	0	0	0	0	111.2	C405 K406	A297-C405 WeakPolarHBondContact CB-O 3.44Å; A297-K406 HydrophobicContact CB-CB 4.13Å
298	L	62	Low	58.7	Low	86 Å²	86	112.9 Å²	112.9	45%	0.45	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	134.7	-178.2	-62.7	170.2	0	0	0	111.2	Y302 S404	L298-Y302 HydrophobicContact CB-CD1 4.39Å; L298-Y302 HydrophobicContact CD1-CD1 4.22Å; L298-Y302 HydrophobicContact CD1-CE1 4.15Å; L298-Y302 HydrophobicContact CD2-CD1 4.07Å; L298-Y302 HydrophobicContact CD2-CE1 4.32Å; L298-Y302 HydrophobicContact CD2-CG 4.39Å; L298-Y302 HydrophobicContact CG-CD1 4.46Å; L298-S404 WeakPolarHBondContact O-CA 3.15Å; L298-S404 WeakPolarHBondContact O-CB 3.45Å
299	D	68.4	Low	60.2	Low	68 Å²	68	110.6 Å²	110.6	36%	0.364	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	174.6	-172.6	75.4	-11.4	0	0	0	113.6	N301 Y302 C303 K403	D299-N301 PolarHBondContact O-N 3.49Å; D299-N301 PolarHBondContact OD1-N 3.27Å; D299-N301 WeakPolarHBondContact OD2-CB 3.47Å; D299-N301 PolarHBondContact OD2-ND2 2.91Å; D299-Y302 PolarHBondContact O-N 2.87Å; D299-Y302 WeakPolarHBondContact OD1-CB 3.26Å; D299-Y302 PolarHBondContact OD1-N 3.5Å; D299-C303 PolarHBondContact O-N 2.99Å; D299-K403 CarbonylContact C-O 3.39Å
300	T	72.7	Confident	62	Low	14 Å²	14	109.4 Å²	109.4	9%	0.086	51%	0.51	C	S	.	.	H	α-helix	trans	-57.8	-34.7	174.5	43.4	0	0	0	0	113.1	Y302 C303 F304 V313 K403	T300-Y302 VanDerWaalsContact C-N 3.3Å; T300-Y302 PolarHBondContact O-N 3.24Å; T300-C303 PolarHBondContact O-N 3.26Å; T300-F304 HydrophobicContact CG2-CD2 4.47Å; T300-F304 HydrophobicContact CG2-CE2 3.73Å; T300-F304 HydrophobicContact CG2-CZ 3.84Å; T300-F304 WeakPolarHBondContact O-CB 3.41Å; T300-F304 WeakPolarHBondContact O-CD2 3.3Å; T300-F304 VanDerWaalsContact O-CG 3.26Å; T300-F304 WeakPolarHBondContact O-CG 3.39Å; T300-F304 PolarHBondContact O-N 2.55Å; T300-V313 HydrophobicContact CG2-CG1 3.94Å; T300-K403 HydrophobicContact CG2-CD 4.2Å; T300-K403 WeakPolarHBondContact CG2-O 3.35Å; T300-K403 PolarHBondContact N-O 3.44Å
301	N	72.4	Confident	64.2	Low	106 Å²	106	105.9 Å²	105.9	57%	0.567	49%	0.485	S	S	*	.	H	α-helix	trans	-67.6	-35.8	-175.3	-58.7	-39.8	0	0	0	110.9	D299 N305	D299-N301 PolarHBondContact O-N 3.49Å; D299-N301 PolarHBondContact OD1-N 3.27Å; D299-N301 WeakPolarHBondContact OD2-CB 3.47Å; D299-N301 PolarHBondContact OD2-ND2 2.91Å; N301-N305 WeakPolarHBondContact O-CB 3.32Å; N301-N305 VanDerWaalsContact O-CG 3.28Å; N301-N305 PolarHBondContact O-ND2 2.73Å
302	Y	75.3	Confident	66.5	Low	97 Å²	97	100.5 Å²	100.5	38%	0.38	45%	0.447	S	S	.	.	H	α-helix	trans	-73.9	-49.1	174.6	-175	-97.9	0	0	0	112.3	L298 D299 T300 F304 N305 N306	L298-Y302 HydrophobicContact CB-CD1 4.39Å; L298-Y302 HydrophobicContact CD1-CD1 4.22Å; L298-Y302 HydrophobicContact CD1-CE1 4.15Å; L298-Y302 HydrophobicContact CD2-CD1 4.07Å; L298-Y302 HydrophobicContact CD2-CE1 4.32Å; L298-Y302 HydrophobicContact CD2-CG 4.39Å; L298-Y302 HydrophobicContact CG-CD1 4.46Å; D299-Y302 PolarHBondContact O-N 2.87Å; D299-Y302 WeakPolarHBondContact OD1-CB 3.26Å; D299-Y302 PolarHBondContact OD1-N 3.5Å; T300-Y302 VanDerWaalsContact C-N 3.3Å; T300-Y302 PolarHBondContact O-N 3.24Å; Y302-F304 PolarHBondContact O-N 2.92Å; Y302-N305 PolarHBondContact O-N 3.34Å; Y302-N306 WeakPolarHBondContact CD2-ND2 3.2Å; Y302-N306 WeakPolarHBondContact CE2-ND2 3.03Å; Y302-N306 PolarHBondContact O-N 3.45Å; Y302-N306 VanDerWaalsContact O-N 3.11Å; Y302-N306 PolarHBondContact O-ND2 3.02Å; Y302-N306 VanDerWaalsContact O-ND2 3.15Å
303	C	77.1	Confident	68.5	Low	8 Å²	8	90 Å²	90	5%	0.054	41%	0.408	C	S	.	.	H	α-helix	trans	-71.4	-24.2	-173.5	-70.5	0	0	0	0	114.8	D299 T300 C312 V313	D299-C303 PolarHBondContact O-N 2.99Å; T300-C303 PolarHBondContact O-N 3.26Å; C303-C312 VanDerWaalsContact CA-SG 3.52Å; C303-C312 HydrophobicContact CB-CB 3.88Å; C303-C312 WeakPolarHBondContact CB-SG 3.46Å; C303-C312 VanDerWaalsContact SG-CA 3.58Å; C303-C312 WeakPolarHBondContact SG-CB 3.46Å; C303-C312 CovalentContact SG-SG 2.03Å; C303-C312 PolarHBondContact SG-SG 2.9Å; C303-V313 HydrophobicContact CB-CG1 3.46Å; C303-V313 VanDerWaalsContact CB-CG1 3.46Å; C303-V313 PolarHBondContact SG-N 2.88Å; C303-V313 VanDerWaalsContact SG-N 3.38Å
304	F	79.1	Confident	70.6	Confident	94 Å²	94	82 Å²	82	41%	0.412	38%	0.378	S	S	.	.	H	α-helix	trans	-88.7	-25.1	178.1	-64.2	-16.6	0	0	0	113.1	T300 Y302 V313	T300-F304 HydrophobicContact CG2-CD2 4.47Å; T300-F304 HydrophobicContact CG2-CE2 3.73Å; T300-F304 HydrophobicContact CG2-CZ 3.84Å; T300-F304 WeakPolarHBondContact O-CB 3.41Å; T300-F304 WeakPolarHBondContact O-CD2 3.3Å; T300-F304 VanDerWaalsContact O-CG 3.26Å; T300-F304 WeakPolarHBondContact O-CG 3.39Å; T300-F304 PolarHBondContact O-N 2.55Å; Y302-F304 PolarHBondContact O-N 2.92Å; F304-V313 HydrophobicContact CE1-CG1 3.99Å; F304-V313 HydrophobicContact CE1-CG2 4.33Å; F304-V313 HydrophobicContact CZ-CG1 4.39Å; F304-V313 HydrophobicContact CZ-CG2 4.4Å
305	N	73.9	Confident	72.5	Confident	134 Å²	134	80.3 Å²	80.3	72%	0.717	38%	0.383	S	S	*	.	H	α-helix	trans	-89.2	-25.8	179.5	-69.8	-25.3	0	0	0	112.8	N301 Y302	N301-N305 WeakPolarHBondContact O-CB 3.32Å; N301-N305 VanDerWaalsContact O-CG 3.28Å; N301-N305 PolarHBondContact O-ND2 2.73Å; Y302-N305 PolarHBondContact O-N 3.34Å
306	N	71.1	Confident	74.7	Confident	77 Å²	77	74 Å²	74	41%	0.412	36%	0.357	S	S	.	.	S	Bend	trans	-114	135.7	179.4	-59.1	-66.4	0	0	0	110.4	Y302 E308	Y302-N306 WeakPolarHBondContact CD2-ND2 3.2Å; Y302-N306 WeakPolarHBondContact CE2-ND2 3.03Å; Y302-N306 PolarHBondContact O-N 3.45Å; Y302-N306 VanDerWaalsContact O-N 3.11Å; Y302-N306 PolarHBondContact O-ND2 3.02Å; Y302-N306 VanDerWaalsContact O-ND2 3.15Å; N306-E308 VanDerWaalsContact C-N 3.29Å; N306-E308 PolarHBondContact O-N 3.11Å
307	Y	70.9	Confident	76.8	Confident	187 Å²	187	67 Å²	67	73%	0.733	33%	0.331	S	S	*	.			trans	-75	87.4	168.7	-171.3	-96.7	0	0	0	108.9	E309	Y307-E309 HydrophobicContact CD1-CG 4.22Å; Y307-E309 HydrophobicContact CE1-CG 3.74Å
308	E	70.6	Confident	78.5	Confident	40 Å²	40	65.3 Å²	65.3	19%	0.187	32%	0.317	C	S	.	.			trans	-86.8	128.3	173.9	-173.8	59	-121.8	0	0	108.9	N306 N310 C312 R314	N306-E308 VanDerWaalsContact C-N 3.29Å; N306-E308 PolarHBondContact O-N 3.11Å; E308-N310 HydrophobicContact CG-CB 4.1Å; E308-N310 WeakPolarHBondContact OE1-CB 3.41Å; E308-N310 PolarHBondContact OE1-N 2.73Å; E308-N310 PolarHBondContact OE1-ND2 3.35Å; E308-C312 HydrophobicContact CB-CB 4.17Å; E308-C312 HydrophobicContact CG-CB 4.3Å; E308-R314 VanDerWaalsContact O-CZ 3.3Å; E308-R314 PolarHBondContact O-NH1 3.07Å; E308-R314 PolarHBondContact O-NH2 3.4Å
309	E	72.4	Confident	79.9	Confident	135 Å²	135	62.2 Å²	62.2	63%	0.631	30%	0.301	S	S	*	.			trans	-83.9	-28.6	175	-70	-172.6	170	0	0	111.7	Y307 P343	Y307-E309 HydrophobicContact CD1-CG 4.22Å; Y307-E309 HydrophobicContact CE1-CG 3.74Å; E309-P343 WeakPolarHBondContact O-CD 2.98Å
310	N	78.1	Confident	81.1	Confident	67 Å²	67	59 Å²	59	36%	0.358	28%	0.284	S	S	.	.	S	Bend	trans	-70.7	178.7	176.9	-61.7	-58.6	0	0	0	112.7	E308 C312	E308-N310 HydrophobicContact CG-CB 4.1Å; E308-N310 WeakPolarHBondContact OE1-CB 3.41Å; E308-N310 PolarHBondContact OE1-N 2.73Å; E308-N310 PolarHBondContact OE1-ND2 3.35Å; N310-C312 PolarHBondContact O-N 3.23Å
311	C	81.3	Confident	82	Confident	12 Å²	12	65.1 Å²	65.1	8%	0.081	31%	0.305	C	S	.	.	S	Bend	trans	-50	109.3	176.9	175.7	0	0	0	0	112.8	P343 C344 C374 C407	C311-P343 PolarHBondContact N-O 2.85Å; C311-C344 VanDerWaalsContact CB-SG 3.5Å; C311-C374 WeakPolarHBondContact CA-SG 3.1Å; C311-C374 HydrophobicContact CB-CB 3.71Å; C311-C374 WeakPolarHBondContact CB-SG 3.24Å; C311-C374 WeakPolarHBondContact SG-CA 3.09Å; C311-C374 WeakPolarHBondContact SG-CB 3.43Å; C311-C374 CovalentContact SG-SG 2.03Å; C311-C374 PolarHBondContact SG-SG 3.08Å; C311-C407 VanDerWaalsContact CB-SG 3.55Å
312	C	84.4	Confident	82.8	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.007	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	165	178.1	-123	0	0	0	0	110.8	C303 E308 N310 S341	C303-C312 VanDerWaalsContact CA-SG 3.52Å; C303-C312 HydrophobicContact CB-CB 3.88Å; C303-C312 WeakPolarHBondContact CB-SG 3.46Å; C303-C312 VanDerWaalsContact SG-CA 3.58Å; C303-C312 WeakPolarHBondContact SG-CB 3.46Å; C303-C312 CovalentContact SG-SG 2.03Å; C303-C312 PolarHBondContact SG-SG 2.9Å; E308-C312 HydrophobicContact CB-CB 4.17Å; E308-C312 HydrophobicContact CG-CB 4.3Å; N310-C312 PolarHBondContact O-N 3.23Å; C312-S341 PolarHBondContact N-O 2.86Å; C312-S341 VanDerWaalsContact N-O 3.1Å; C312-S341 PolarHBondContact O-N 2.89Å; C312-S341 VanDerWaalsContact O-O 3.08Å
313	V	87.7	Confident	83.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	135.1	170.6	61.5	0	0	0	0	110.1	T300 C303 F304 N338 Y339 V402 C405	T300-V313 HydrophobicContact CG2-CG1 3.94Å; C303-V313 HydrophobicContact CB-CG1 3.46Å; C303-V313 VanDerWaalsContact CB-CG1 3.46Å; C303-V313 PolarHBondContact SG-N 2.88Å; C303-V313 VanDerWaalsContact SG-N 3.38Å; F304-V313 HydrophobicContact CE1-CG1 3.99Å; F304-V313 HydrophobicContact CE1-CG2 4.33Å; F304-V313 HydrophobicContact CZ-CG1 4.39Å; F304-V313 HydrophobicContact CZ-CG2 4.4Å; V313-N338 HydrophobicContact CG2-CB 3.75Å; V313-Y339 WeakPolarHBondContact CA-O 3.28Å; V313-V402 HydrophobicContact CG2-CB 4.41Å; V313-V402 HydrophobicContact CG2-CG1 4.04Å; V313-C405 VanDerWaalsContact CA-SG 3.55Å
314	R	87.6	Confident	83.9	Confident	53 Å²	53	65 Å²	65	20%	0.2	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.5	176.9	-56.2	-59.1	-178.8	165.7	2.9	109.6	E308 L316 N338 Y339	E308-R314 VanDerWaalsContact O-CZ 3.3Å; E308-R314 PolarHBondContact O-NH1 3.07Å; E308-R314 PolarHBondContact O-NH2 3.4Å; R314-L316 PolarHBondContact O-N 2.85Å; R314-N338 VanDerWaalsContact O-CA 3.29Å; R314-N338 WeakPolarHBondContact O-CA 3.01Å; R314-N338 WeakPolarHBondContact O-CB 3.07Å; R314-Y339 HydrophobicContact CB-CD1 3.97Å; R314-Y339 HydrophobicContact CB-CD2 4.33Å; R314-Y339 HydrophobicContact CB-CE1 3.49Å; R314-Y339 VanDerWaalsContact CB-CE1 3.49Å; R314-Y339 HydrophobicContact CB-CE2 3.89Å; R314-Y339 HydrophobicContact CB-CG 4.37Å; R314-Y339 VanDerWaalsContact CB-CZ 3.45Å; R314-Y339 HydrophobicContact CG-CE1 4.49Å; R314-Y339 HydrophobicContact CG-CE2 4.06Å; R314-Y339 PolarHBondContact N-O 2.62Å; R314-Y339 PolarHBondContact O-N 3.25Å
315	S	88.9	Confident	84.4	Confident	79 Å²	79	63.1 Å²	63.1	55%	0.552	31%	0.313	S	S	*	.			trans	-69.8	129.9	180	58.7	0	0	0	0	110.8	N338	S315-N338 WeakPolarHBondContact CA-OD1 3.37Å
316	L	90.1	Very high	85.1	Confident	15 Å²	15	57.4 Å²	57.4	8%	0.079	28%	0.281	C	S	.	.			trans	-144.1	118.3	171.3	179.3	70	0	0	0	109.7	K34 R37 R314 I318 F336 A337 N338 Y339	K34-L316 HydrophobicContact CB-CD1 4.1Å; K34-L316 HydrophobicContact CD-CD1 4.01Å; K34-L316 HydrophobicContact CG-CD1 3.86Å; R37-L316 HydrophobicContact CB-CD2 3.88Å; R37-L316 HydrophobicContact CG-CD2 3.69Å; R314-L316 PolarHBondContact O-N 2.85Å; L316-I318 HydrophobicContact CD2-CD1 4.34Å; L316-I318 HydrophobicContact CD2-CG1 4.28Å; L316-I318 HydrophobicContact CG-CG1 4.29Å; L316-F336 CarbonylContact O-C 3.48Å; L316-F336 WeakPolarHBondContact O-CA 3.48Å; L316-A337 PolarHBondContact O-N 2.82Å; L316-N338 PolarHBondContact N-OD1 3.45Å; L316-N338 PolarHBondContact O-N 2.82Å; L316-Y339 HydrophobicContact CB-CD1 3.63Å; L316-Y339 HydrophobicContact CB-CE1 3.95Å; L316-Y339 HydrophobicContact CD2-CD1 4.13Å; L316-Y339 HydrophobicContact CG-CD1 4.43Å
317	Y	92	Very high	85.9	Confident	98 Å²	98	62.8 Å²	62.8	38%	0.384	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	131.8	172	-172.8	-99.2	0	0	0	110	N319 G334 F336	Y317-N319 HydrophobicContact CE1-CB 4.04Å; Y317-G334 VanDerWaalsContact OH-CA 3.28Å; Y317-G334 WeakPolarHBondContact OH-CA 3.46Å; Y317-F336 HydrophobicContact CD2-CD1 4.02Å; Y317-F336 AromaticContact CD2-CD2 3.95Å; Y317-F336 HydrophobicContact CD2-CD2 3.95Å; Y317-F336 AromaticContact CD2-CE1 3.92Å; Y317-F336 HydrophobicContact CD2-CE1 3.92Å; Y317-F336 AromaticContact CD2-CE2 3.84Å; Y317-F336 HydrophobicContact CD2-CE2 3.84Å; Y317-F336 HydrophobicContact CD2-CG 4.04Å; Y317-F336 AromaticContact CD2-CZ 3.82Å; Y317-F336 HydrophobicContact CD2-CZ 3.82Å; Y317-F336 HydrophobicContact CE2-CD2 4.48Å; Y317-F336 HydrophobicContact CE2-CE2 4.3Å; Y317-F336 HydrophobicContact CG-CD1 4.49Å; Y317-F336 HydrophobicContact CG-CE1 4.29Å; Y317-F336 HydrophobicContact CG-CZ 4.48Å
318	I	92.2	Very high	86.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.5	175.7	-60.5	179.5	0	0	0	107.9	R37 V38 V41 L316 D323 L324 G334 Y335 A337	R37-I318 HydrophobicContact CG-CD1 4.35Å; V38-I318 HydrophobicContact CG2-CD1 4.13Å; V38-I318 HydrophobicContact CG2-CG1 4.24Å; V38-I318 HydrophobicContact CG2-CG2 4.29Å; V41-I318 HydrophobicContact CB-CD1 4.33Å; V41-I318 HydrophobicContact CG2-CD1 3.86Å; L316-I318 HydrophobicContact CD2-CD1 4.34Å; L316-I318 HydrophobicContact CD2-CG1 4.28Å; L316-I318 HydrophobicContact CG-CG1 4.29Å; I318-D323 WeakPolarHBondContact CA-OD2 3.43Å; I318-D323 HydrophobicContact CG2-CB 4.19Å; I318-L324 HydrophobicContact CG2-CD1 4.04Å; I318-L324 HydrophobicContact CG2-CG 4.43Å; I318-G334 CarbonylContact O-C 3.54Å; I318-G334 WeakPolarHBondContact O-CA 3.4Å; I318-Y335 PolarHBondContact N-O 2.79Å; I318-Y335 PolarHBondContact O-N 2.85Å; I318-A337 HydrophobicContact CD1-CB 3.58Å; I318-A337 HydrophobicContact CG1-CB 4.1Å
319	N	92.5	Very high	87.7	Confident	21 Å²	21	52.7 Å²	52.7	11%	0.112	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	124.9	173	-173.2	-61	0	0	0	109.7	Y317 R321 Q322 D323	Y317-N319 HydrophobicContact CE1-CB 4.04Å; N319-R321 VanDerWaalsContact C-N 3.27Å; N319-R321 PolarHBondContact O-N 2.96Å; N319-R321 WeakPolarHBondContact OD1-CA 3.27Å; N319-R321 WeakPolarHBondContact OD1-CB 3.44Å; N319-R321 PolarHBondContact OD1-N 3.03Å; N319-Q322 HydrophobicContact CB-CB 4.1Å; N319-Q322 HydrophobicContact CB-CG 4.45Å; N319-Q322 PolarHBondContact OD1-N 3.17Å; N319-D323 PolarHBondContact N-OD2 2.77Å; N319-D323 WeakPolarHBondContact O-CB 3.24Å; N319-D323 PolarHBondContact O-N 3.4Å
320	F	92.8	Very high	88.6	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-35.7	-177.2	-68.8	-65	0	0	0	112.5	I45 L324 G325 W326 I329 P332 E333 Y335 L382	I45-F320 HydrophobicContact CD1-CE1 3.76Å; I45-F320 HydrophobicContact CD1-CZ 4.49Å; F320-L324 HydrophobicContact CD1-CD1 3.56Å; F320-L324 HydrophobicContact CE1-CD1 4.04Å; F320-L324 CarbonylContact O-C 3.56Å; F320-L324 WeakPolarHBondContact O-CB 3.48Å; F320-L324 PolarHBondContact O-N 2.82Å; F320-G325 PolarHBondContact O-N 2.88Å; F320-W326 CarbonylContact C-O 3.47Å; F320-W326 HydrophobicContact CB-CB 4.44Å; F320-W326 HydrophobicContact CD1-CE3 4.03Å; F320-W326 PolarHBondContact O-N 3.41Å; F320-I329 HydrophobicContact CD1-CD1 3.79Å; F320-I329 HydrophobicContact CD2-CG2 4.1Å; F320-I329 HydrophobicContact CE1-CD1 3.79Å; F320-I329 HydrophobicContact CE2-CG2 4.17Å; F320-I329 HydrophobicContact CG-CD1 4.21Å; F320-I329 HydrophobicContact CZ-CD1 4.17Å; F320-P332 WeakPolarHBondContact CD2-O 3.19Å; F320-P332 HydrophobicContact CE2-CG 4.17Å; F320-P332 WeakPolarHBondContact CE2-O 3.39Å; F320-E333 WeakPolarHBondContact CD2-O 3.48Å; F320-E333 PolarHBondContact N-O 3.27Å; F320-Y335 HydrophobicContact CE1-CD1 4.28Å; F320-Y335 AromaticContact CE1-CE1 3.99Å; F320-Y335 HydrophobicContact CE1-CE1 3.99Å; F320-Y335 HydrophobicContact CE2-CD1 4.04Å; F320-Y335 AromaticContact CZ-CD1 3.59Å; F320-Y335 HydrophobicContact CZ-CD1 3.59Å; F320-Y335 AromaticContact CZ-CE1 3.68Å; F320-Y335 HydrophobicContact CZ-CE1 3.68Å; F320-L382 HydrophobicContact CZ-CD2 4.16Å
321	R	90.8	Very high	89.2	Confident	142 Å²	142	46.9 Å²	46.9	54%	0.536	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-46.9	-178.9	-66.5	-176.3	178.4	-174.4	3	112.2	N319 G325 W326	N319-R321 VanDerWaalsContact C-N 3.27Å; N319-R321 PolarHBondContact O-N 2.96Å; N319-R321 WeakPolarHBondContact OD1-CA 3.27Å; N319-R321 WeakPolarHBondContact OD1-CB 3.44Å; N319-R321 PolarHBondContact OD1-N 3.03Å; R321-G325 VanDerWaalsContact O-CA 3.3Å; R321-G325 WeakPolarHBondContact O-CA 3.25Å; R321-G325 PolarHBondContact O-N 2.94Å; R321-W326 WeakPolarHBondContact CG-O 3.44Å
322	Q	89.7	Confident	89.8	Confident	160 Å²	160	47.2 Å²	47.2	75%	0.748	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-47	-173.4	-62.2	177.3	-7.6	0	0	112.4	N319	N319-Q322 HydrophobicContact CB-CB 4.1Å; N319-Q322 HydrophobicContact CB-CG 4.45Å; N319-Q322 PolarHBondContact OD1-N 3.17Å
323	D	89.1	Confident	90.2	Very high	44 Å²	44	52.3 Å²	52.3	24%	0.235	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-37.2	-173	-59.4	-54.2	0	0	0	112.1	K34 V38 I318 N319	K34-D323 WeakPolarHBondContact CE-OD1 3.37Å; K34-D323 IonicContact NZ-OD1 2.68Å; K34-D323 PolarHBondContact NZ-OD1 3.15Å; K34-D323 IonicContact NZ-OD2 3.53Å; V38-D323 HydrophobicContact CG1-CB 4.3Å; V38-D323 HydrophobicContact CG2-CB 4.06Å; I318-D323 WeakPolarHBondContact CA-OD2 3.43Å; I318-D323 HydrophobicContact CG2-CB 4.19Å; N319-D323 PolarHBondContact N-OD2 2.77Å; N319-D323 WeakPolarHBondContact O-CB 3.24Å; N319-D323 PolarHBondContact O-N 3.4Å
324	L	87.5	Confident	90.4	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.021	26%	0.257	C	S	.	.	S	Bend	trans	-98.5	-15.7	-177.8	-75.1	162.4	0	0	0	113.8	V38 V41 R42 I318 F320 W326	V38-L324 HydrophobicContact CG1-CD2 3.64Å; V38-L324 HydrophobicContact CG1-CG 3.96Å; V41-L324 HydrophobicContact CG1-CD1 4.32Å; R42-L324 HydrophobicContact CB-CD2 3.62Å; R42-L324 HydrophobicContact CG-CD2 4.14Å; R42-L324 PolarHBondContact NH2-O 2.63Å; I318-L324 HydrophobicContact CG2-CD1 4.04Å; I318-L324 HydrophobicContact CG2-CG 4.43Å; F320-L324 HydrophobicContact CD1-CD1 3.56Å; F320-L324 HydrophobicContact CE1-CD1 4.04Å; F320-L324 CarbonylContact O-C 3.56Å; F320-L324 WeakPolarHBondContact O-CB 3.48Å; F320-L324 PolarHBondContact O-N 2.82Å; L324-W326 HydrophobicContact CB-CB 4.34Å; L324-W326 HydrophobicContact CB-CD2 3.96Å; L324-W326 HydrophobicContact CB-CE3 4.32Å; L324-W326 HydrophobicContact CB-CG 3.95Å; L324-W326 HydrophobicContact CD1-CD2 4.43Å; L324-W326 HydrophobicContact CD1-CE3 3.97Å; L324-W326 HydrophobicContact CD1-CZ3 4.16Å; L324-W326 VanDerWaalsContact O-CD1 3.29Å; L324-W326 PolarHBondContact O-N 3.14Å
325	G	87.9	Confident	90.7	Very high	56 Å²	56	50.9 Å²	50.9	58%	0.577	25%	0.249	S	C	*	.			trans	69.8	16	-174.1	0	0	0	0	0	113.7	F320 R321	F320-G325 PolarHBondContact O-N 2.88Å; R321-G325 VanDerWaalsContact O-CA 3.3Å; R321-G325 WeakPolarHBondContact O-CA 3.25Å; R321-G325 PolarHBondContact O-N 2.94Å
326	W	89.5	Confident	90.8	Very high	14 Å²	14	53 Å²	53	5%	0.053	25%	0.249	C	C	.	.			trans	-91.5	127.1	-173.8	-71.7	-3.6	0	0	0	111.9	R42 I45 L46 P54 F320 R321 L324 W328 I329	R42-W326 HydrophobicContact CB-CZ2 4.37Å; R42-W326 HydrophobicContact CG-CH2 4.14Å; R42-W326 HydrophobicContact CG-CZ2 3.56Å; I45-W326 HydrophobicContact CB-CH2 3.96Å; I45-W326 HydrophobicContact CB-CZ3 4.01Å; I45-W326 HydrophobicContact CD1-CH2 4.29Å; I45-W326 HydrophobicContact CD1-CZ3 3.65Å; I45-W326 HydrophobicContact CG1-CZ3 4.41Å; I45-W326 HydrophobicContact CG2-CH2 4.01Å; I45-W326 HydrophobicContact CG2-CZ3 3.82Å; L46-W326 HydrophobicContact CD1-CZ2 4.25Å; L46-W326 HydrophobicContact CD2-CH2 4.46Å; L46-W326 HydrophobicContact CD2-CZ2 4.34Å; L46-W326 HydrophobicContact CG-CH2 4.18Å; L46-W326 HydrophobicContact CG-CZ2 4.13Å; P54-W326 HydrophobicContact CG-CZ2 4.47Å; F320-W326 CarbonylContact C-O 3.47Å; F320-W326 HydrophobicContact CB-CB 4.44Å; F320-W326 HydrophobicContact CD1-CE3 4.03Å; F320-W326 PolarHBondContact O-N 3.41Å; R321-W326 WeakPolarHBondContact CG-O 3.44Å; L324-W326 HydrophobicContact CB-CB 4.34Å; L324-W326 HydrophobicContact CB-CD2 3.96Å; L324-W326 HydrophobicContact CB-CE3 4.32Å; L324-W326 HydrophobicContact CB-CG 3.95Å; L324-W326 HydrophobicContact CD1-CD2 4.43Å; L324-W326 HydrophobicContact CD1-CE3 3.97Å; L324-W326 HydrophobicContact CD1-CZ3 4.16Å; L324-W326 VanDerWaalsContact O-CD1 3.29Å; L324-W326 PolarHBondContact O-N 3.14Å; W326-W328 AromaticContact CD1-NE1 3.68Å; W326-W328 AromaticContact CD2-CE2 3.95Å; W326-W328 HydrophobicContact CD2-CZ2 4.03Å; W326-W328 AromaticContact CD2-NE1 3.34Å; W326-W328 VanDerWaalsContact CD2-NE1 3.34Å; W326-W328 AromaticContact CE2-NE1 3.78Å; W326-W328 AromaticContact CE3-CE2 3.96Å; W326-W328 AromaticContact CE3-CZ2 3.67Å; W326-W328 HydrophobicContact CE3-CZ2 3.67Å; W326-W328 AromaticContact CE3-NE1 3.82Å; W326-W328 AromaticContact CG-CD1 3.91Å; W326-W328 AromaticContact CG-NE1 3.24Å; W326-W328 HydrophobicContact CH2-CZ2 4.04Å; W326-W328 HydrophobicContact CZ2-CZ2 4.34Å; W326-W328 AromaticContact CZ3-CZ2 3.7Å; W326-W328 HydrophobicContact CZ3-CZ2 3.7Å; W326-W328 AromaticContact NE1-NE1 3.96Å; W326-I329 HydrophobicContact CE3-CD1 3.67Å; W326-I329 HydrophobicContact CE3-CG1 4.48Å; W326-I329 HydrophobicContact CZ3-CD1 3.97Å
327	R	87.2	Confident	90.8	Very high	190 Å²	190	52.2 Å²	52.2	72%	0.717	25%	0.245	S	C	*	.			trans	-113.2	-3.2	175.9	-60.8	-177.5	179.7	-177.4	-0.5	113.6	T58	T58-R327 HydrophobicContact CG2-CB 4.21Å
328	W	89	Confident	90.8	Very high	9 Å²	9	48 Å²	48	3%	0.034	23%	0.229	C	C	.	.	S	Bend	trans	-89.6	-16.7	-175	63.9	-89.4	0	0	0	113.3	I45 L49 P54 P55 T58 W326 H330 Y386	I45-W328 HydrophobicContact CG2-CH2 4.21Å; L49-W328 HydrophobicContact CD1-CH2 3.67Å; L49-W328 HydrophobicContact CD1-CZ3 4.11Å; P54-W328 HydrophobicContact CB-CG 4.46Å; P55-W328 HydrophobicContact CG-CB 4.03Å; P55-W328 HydrophobicContact CG-CD2 3.87Å; P55-W328 HydrophobicContact CG-CE3 3.66Å; P55-W328 HydrophobicContact CG-CG 4.04Å; P55-W328 HydrophobicContact CG-CZ3 4.42Å; T58-W328 HydrophobicContact CG2-CB 4.39Å; W326-W328 AromaticContact CD1-NE1 3.68Å; W326-W328 AromaticContact CD2-CE2 3.95Å; W326-W328 HydrophobicContact CD2-CZ2 4.03Å; W326-W328 AromaticContact CD2-NE1 3.34Å; W326-W328 VanDerWaalsContact CD2-NE1 3.34Å; W326-W328 AromaticContact CE2-NE1 3.78Å; W326-W328 AromaticContact CE3-CE2 3.96Å; W326-W328 AromaticContact CE3-CZ2 3.67Å; W326-W328 HydrophobicContact CE3-CZ2 3.67Å; W326-W328 AromaticContact CE3-NE1 3.82Å; W326-W328 AromaticContact CG-CD1 3.91Å; W326-W328 AromaticContact CG-NE1 3.24Å; W326-W328 HydrophobicContact CH2-CZ2 4.04Å; W326-W328 HydrophobicContact CZ2-CZ2 4.34Å; W326-W328 AromaticContact CZ3-CZ2 3.7Å; W326-W328 HydrophobicContact CZ3-CZ2 3.7Å; W326-W328 AromaticContact NE1-NE1 3.96Å; W328-H330 PolarHBondContact O-ND1 2.94Å; W328-Y386 AromaticContact CE3-CD2 3.91Å; W328-Y386 HydrophobicContact CE3-CD2 3.91Å; W328-Y386 HydrophobicContact CE3-CG 4.01Å; W328-Y386 HydrophobicContact CZ3-CD1 4.38Å; W328-Y386 AromaticContact CZ3-CD2 3.71Å; W328-Y386 HydrophobicContact CZ3-CD2 3.71Å; W328-Y386 HydrophobicContact CZ3-CE2 4.39Å; W328-Y386 AromaticContact CZ3-CG 3.7Å; W328-Y386 HydrophobicContact CZ3-CG 3.7Å; W328-Y386 WeakPolarHBondContact O-CB 3.35Å
329	I	91.2	Very high	90.6	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	119.3	167.7	-59.2	-179.1	0	0	0	107.4	F320 W326	F320-I329 HydrophobicContact CD1-CD1 3.79Å; F320-I329 HydrophobicContact CD2-CG2 4.1Å; F320-I329 HydrophobicContact CE1-CD1 3.79Å; F320-I329 HydrophobicContact CE2-CG2 4.17Å; F320-I329 HydrophobicContact CG-CD1 4.21Å; F320-I329 HydrophobicContact CZ-CD1 4.17Å; W326-I329 HydrophobicContact CE3-CD1 3.67Å; W326-I329 HydrophobicContact CE3-CG1 4.48Å; W326-I329 HydrophobicContact CZ3-CD1 3.97Å
330	H	90.7	Very high	90.3	Very high	21 Å²	21	49.7 Å²	49.7	10%	0.097	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-36.2	-179.1	-65.7	75.9	0	0	0	112.5	T58 P60 V63 W328 L385 Y387	T58-H330 PolarHBondContact O-CE1 3.37Å; T58-H330 PolarHBondContact O-NE2 2.99Å; T58-H330 VanDerWaalsContact O-NE2 3.15Å; P60-H330 PolarHBondContact O-NE2 3.46Å; V63-H330 HydrophobicContact CG2-CB 3.66Å; W328-H330 PolarHBondContact O-ND1 2.94Å; H330-L385 HydrophobicContact CB-CG 4.49Å; H330-L385 PolarHBondContact N-O 2.88Å; H330-Y387 AromaticContact CE1-CD2 3.39Å; H330-Y387 WeakPolarHBondContact CE1-CD2 3.09Å; H330-Y387 AromaticContact CE1-CE2 3.94Å; H330-Y387 AromaticContact ND1-CD2 3.62Å
331	Q	91.8	Very high	90	Very high	60 Å²	60	51.1 Å²	51.1	28%	0.28	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	141.9	176.4	-67.6	-65	-31.2	0	0	111.4	L68 Y71 I384 L385	L68-Q331 HydrophobicContact CD2-CG 3.96Å; Y71-Q331 HydrophobicContact CD1-CB 4.14Å; Y71-Q331 HydrophobicContact CD1-CG 4.48Å; Y71-Q331 HydrophobicContact CD2-CB 4.27Å; Y71-Q331 HydrophobicContact CE1-CB 3.81Å; Y71-Q331 HydrophobicContact CE1-CG 4.37Å; Y71-Q331 HydrophobicContact CE2-CB 3.94Å; Y71-Q331 HydrophobicContact CG-CB 4.36Å; Q331-I384 CarbonylContact O-C 3.52Å; Q331-I384 WeakPolarHBondContact O-CA 3.29Å; Q331-L385 HydrophobicContact CB-CB 4.12Å; Q331-L385 HydrophobicContact CB-CD2 4.49Å; Q331-L385 HydrophobicContact CG-CD2 4.43Å; Q331-L385 PolarHBondContact N-O 3.04Å; Q331-L385 PolarHBondContact O-N 3.2Å
332	P	93.8	Very high	89.6	Confident	19 Å²	19	45.5 Å²	45.5	12%	0.123	23%	0.234	C	C	.	.			cis	-72.3	168.8	-13.5	30.5	-30.5	0	0	0	111.2	Y71 F320 G334 L382 T383	Y71-P332 WeakPolarHBondContact OH-CD 3.45Å; F320-P332 WeakPolarHBondContact CD2-O 3.19Å; F320-P332 HydrophobicContact CE2-CG 4.17Å; F320-P332 WeakPolarHBondContact CE2-O 3.39Å; P332-G334 VanDerWaalsContact C-N 3.26Å; P332-G334 PolarHBondContact O-N 2.84Å; P332-L382 HydrophobicContact CG-CD1 4.14Å; P332-T383 WeakPolarHBondContact CD-O 3.29Å
333	E	91.7	Very high	89.1	Confident	108 Å²	108	41.8 Å²	41.8	51%	0.505	22%	0.224	S	C	.	.	S	Bend	trans	-71.8	-23.4	175	-61.6	-168.8	158.8	0	0	113.1	F320	F320-E333 WeakPolarHBondContact CD2-O 3.48Å; F320-E333 PolarHBondContact N-O 3.27Å
334	G	92.1	Very high	88.3	Confident	10 Å²	10	40.5 Å²	40.5	10%	0.103	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	169.8	176.8	0	0	0	0	0	110.4	Y317 I318 P332	Y317-G334 VanDerWaalsContact OH-CA 3.28Å; Y317-G334 WeakPolarHBondContact OH-CA 3.46Å; I318-G334 CarbonylContact O-C 3.54Å; I318-G334 WeakPolarHBondContact O-CA 3.4Å; P332-G334 VanDerWaalsContact C-N 3.26Å; P332-G334 PolarHBondContact O-N 2.84Å
335	Y	94	Very high	87.5	Confident	12 Å²	12	43.3 Å²	43.3	5%	0.047	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	160.5	-176.5	75.2	-74.7	0	0	0	111.8	V41 I318 F320 A337 L382 M400 V401	V41-Y335 HydrophobicContact CG1-CE1 4.43Å; V41-Y335 VanDerWaalsContact CG1-OH 3.25Å; V41-Y335 WeakPolarHBondContact CG1-OH 3.49Å; V41-Y335 WeakPolarHBondContact CG2-OH 2.95Å; I318-Y335 PolarHBondContact N-O 2.79Å; I318-Y335 PolarHBondContact O-N 2.85Å; F320-Y335 HydrophobicContact CE1-CD1 4.28Å; F320-Y335 AromaticContact CE1-CE1 3.99Å; F320-Y335 HydrophobicContact CE1-CE1 3.99Å; F320-Y335 HydrophobicContact CE2-CD1 4.04Å; F320-Y335 AromaticContact CZ-CD1 3.59Å; F320-Y335 HydrophobicContact CZ-CD1 3.59Å; F320-Y335 AromaticContact CZ-CE1 3.68Å; F320-Y335 HydrophobicContact CZ-CE1 3.68Å; Y335-A337 HydrophobicContact CD2-CB 4.25Å; Y335-A337 VanDerWaalsContact CE2-CA 3.44Å; Y335-A337 HydrophobicContact CE2-CB 3.51Å; Y335-A337 PolarHBondContact O-N 3.03Å; Y335-L382 HydrophobicContact CD1-CD2 3.68Å; Y335-L382 HydrophobicContact CD2-CD1 4.27Å; Y335-L382 HydrophobicContact CD2-CD2 3.93Å; Y335-L382 HydrophobicContact CE1-CD2 3.81Å; Y335-L382 HydrophobicContact CE2-CD2 4.03Å; Y335-L382 HydrophobicContact CG-CD1 4.11Å; Y335-L382 HydrophobicContact CG-CD2 3.76Å; Y335-M400 HydrophobicContact CE2-CB 4.36Å; Y335-M400 WeakPolarHBondContact OH-CE 3.27Å; Y335-V401 HydrophobicContact CD2-CG2 3.77Å; Y335-V401 HydrophobicContact CE2-CG2 4.02Å
336	F	91.7	Very high	86.2	Confident	123 Å²	123	42.3 Å²	42.3	54%	0.539	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	92.7	173.6	-69.7	-82.5	0	0	0	109.8	L316 Y317 N338 V401	L316-F336 CarbonylContact O-C 3.48Å; L316-F336 WeakPolarHBondContact O-CA 3.48Å; Y317-F336 HydrophobicContact CD2-CD1 4.02Å; Y317-F336 AromaticContact CD2-CD2 3.95Å; Y317-F336 HydrophobicContact CD2-CD2 3.95Å; Y317-F336 AromaticContact CD2-CE1 3.92Å; Y317-F336 HydrophobicContact CD2-CE1 3.92Å; Y317-F336 AromaticContact CD2-CE2 3.84Å; Y317-F336 HydrophobicContact CD2-CE2 3.84Å; Y317-F336 HydrophobicContact CD2-CG 4.04Å; Y317-F336 AromaticContact CD2-CZ 3.82Å; Y317-F336 HydrophobicContact CD2-CZ 3.82Å; Y317-F336 HydrophobicContact CE2-CD2 4.48Å; Y317-F336 HydrophobicContact CE2-CE2 4.3Å; Y317-F336 HydrophobicContact CG-CD1 4.49Å; Y317-F336 HydrophobicContact CG-CE1 4.29Å; Y317-F336 HydrophobicContact CG-CZ 4.48Å; F336-N338 VanDerWaalsContact C-N 3.31Å; F336-V401 WeakPolarHBondContact O-CG1 3.32Å
337	A	89.8	Confident	84.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.253	C	S	.	.			trans	-70.6	-31.9	177.8	0	0	0	0	0	112.3	L316 I318 Y335 V402	L316-A337 PolarHBondContact O-N 2.82Å; I318-A337 HydrophobicContact CD1-CB 3.58Å; I318-A337 HydrophobicContact CG1-CB 4.1Å; Y335-A337 HydrophobicContact CD2-CB 4.25Å; Y335-A337 VanDerWaalsContact CE2-CA 3.44Å; Y335-A337 HydrophobicContact CE2-CB 3.51Å; Y335-A337 PolarHBondContact O-N 3.03Å; A337-V402 PolarHBondContact O-N 2.89Å
338	N	91.6	Very high	82.7	Confident	9 Å²	9	50.9 Å²	50.9	5%	0.048	26%	0.259	C	S	.	.			trans	54.3	169.1	-172.3	-57.1	-23.9	0	0	0	112.8	R37 V313 R314 S315 L316 F336 V402	R37-N338 PolarHBondContact NE-O 3.03Å; V313-N338 HydrophobicContact CG2-CB 3.75Å; R314-N338 VanDerWaalsContact O-CA 3.29Å; R314-N338 WeakPolarHBondContact O-CA 3.01Å; R314-N338 WeakPolarHBondContact O-CB 3.07Å; S315-N338 WeakPolarHBondContact CA-OD1 3.37Å; L316-N338 PolarHBondContact N-OD1 3.45Å; L316-N338 PolarHBondContact O-N 2.82Å; F336-N338 VanDerWaalsContact C-N 3.31Å; N338-V402 HydrophobicContact CB-CB 3.98Å; N338-V402 PolarHBondContact ND2-O 3.34Å
339	Y	88.6	Confident	80.7	Confident	32 Å²	32	51.1 Å²	51.1	13%	0.125	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	157.8	175.1	67	-77.7	0	0	0	110.9	I33 V313 R314 L316	I33-Y339 HydrophobicContact CD1-CE2 4.36Å; I33-Y339 HydrophobicContact CG2-CD2 3.71Å; I33-Y339 HydrophobicContact CG2-CE2 3.6Å; I33-Y339 HydrophobicContact CG2-CG 4.3Å; V313-Y339 WeakPolarHBondContact CA-O 3.28Å; R314-Y339 HydrophobicContact CB-CD1 3.97Å; R314-Y339 HydrophobicContact CB-CD2 4.33Å; R314-Y339 HydrophobicContact CB-CE1 3.49Å; R314-Y339 VanDerWaalsContact CB-CE1 3.49Å; R314-Y339 HydrophobicContact CB-CE2 3.89Å; R314-Y339 HydrophobicContact CB-CG 4.37Å; R314-Y339 VanDerWaalsContact CB-CZ 3.45Å; R314-Y339 HydrophobicContact CG-CE1 4.49Å; R314-Y339 HydrophobicContact CG-CE2 4.06Å; R314-Y339 PolarHBondContact N-O 2.62Å; R314-Y339 PolarHBondContact O-N 3.25Å; L316-Y339 HydrophobicContact CB-CD1 3.63Å; L316-Y339 HydrophobicContact CB-CE1 3.95Å; L316-Y339 HydrophobicContact CD2-CD1 4.13Å; L316-Y339 HydrophobicContact CG-CD1 4.43Å
340	C	86.4	Confident	78.7	Confident	25 Å²	25	54.6 Å²	54.6	17%	0.169	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	131.1	174.2	-63.9	0	0	0	0	109.8	P376 C405	C340-P376 WeakPolarHBondContact SG-CA 3.34Å; C340-P376 VanDerWaalsContact SG-N 3.41Å; C340-C405 WeakPolarHBondContact CA-SG 3.49Å; C340-C405 HydrophobicContact CB-CB 3.77Å; C340-C405 WeakPolarHBondContact CB-SG 3.3Å; C340-C405 WeakPolarHBondContact SG-CB 3.45Å; C340-C405 CovalentContact SG-SG 2.03Å; C340-C405 PolarHBondContact SG-SG 3.05Å
341	S	86.1	Confident	77	Confident	31 Å²	31	58.4 Å²	58.4	22%	0.217	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	143.5	176.1	-175.4	0	0	0	0	111.4	C312	C312-S341 PolarHBondContact N-O 2.86Å; C312-S341 VanDerWaalsContact N-O 3.1Å; C312-S341 PolarHBondContact O-N 2.89Å; C312-S341 VanDerWaalsContact O-O 3.08Å
342	G	81.9	Confident	75.4	Confident	24 Å²	24	59.1 Å²	59.1	25%	0.247	32%	0.321	C	S	.	.	S	Bend	trans	138.5	155.2	178.6	0	0	0	0	0	111.3
343	P	78.7	Confident	73.8	Confident	82 Å²	82	64.1 Å²	64.1	53%	0.532	35%	0.352	S	S	.	.			trans	-66.5	146.5	174.1	30.5	-32.3	0	0	0	110.6	E309 C311 P345	E309-P343 WeakPolarHBondContact O-CD 2.98Å; C311-P343 PolarHBondContact N-O 2.85Å; P343-P345 WeakPolarHBondContact O-CD 3.18Å
344	C	73.9	Confident	72.4	Confident	16 Å²	16	64.9 Å²	64.9	11%	0.108	36%	0.355	C	S	.	.			trans	-112.5	98	173.5	-79	0	0	0	0	108.6	C311 P372 C407	C311-C344 VanDerWaalsContact CB-SG 3.5Å; C344-P372 HydrophobicContact CB-CB 4.04Å; C344-P372 HydrophobicContact CB-CG 3.72Å; C344-P372 VanDerWaalsContact CB-O 3.32Å; C344-P372 WeakPolarHBondContact CB-O 3.39Å; C344-P372 WeakPolarHBondContact O-CG 3.38Å; C344-C407 VanDerWaalsContact CA-SG 3.57Å; C344-C407 HydrophobicContact CB-CB 3.64Å; C344-C407 WeakPolarHBondContact CB-SG 3.39Å; C344-C407 VanDerWaalsContact SG-CA 3.52Å; C344-C407 WeakPolarHBondContact SG-CB 3.45Å; C344-C407 CovalentContact SG-SG 2.03Å; C344-C407 PolarHBondContact SG-SG 3.26Å
345	P	69.8	Low	70.7	Confident	64 Å²	64	65 Å²	65	42%	0.416	35%	0.354	S	S	.	.			trans	-69.7	137.9	175.2	27	-32	0	0	0	110.6	P343 L347	P343-P345 WeakPolarHBondContact O-CD 3.18Å; P345-L347 PolarHBondContact O-N 2.9Å
346	Y	61.9	Low	69.2	Low	34 Å²	34	67.1 Å²	67.1	13%	0.133	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-12.2	-179.8	-73.8	-93.1	0	0	0	115	R348 L358 S359 N362 S369 A370 S371 P372	Y346-R348 VanDerWaalsContact C-N 3.26Å; Y346-R348 PolarHBondContact O-N 2.68Å; Y346-L358 HydrophobicContact CE1-CD2 4.37Å; Y346-L358 HydrophobicContact CE1-CG 4.35Å; Y346-S359 PolarHBondContact O-OG 2.77Å; Y346-N362 HydrophobicContact CD1-CB 4.13Å; Y346-N362 HydrophobicContact CD2-CB 4.41Å; Y346-N362 WeakPolarHBondContact CD2-ND2 3.15Å; Y346-N362 HydrophobicContact CE1-CB 4.03Å; Y346-N362 HydrophobicContact CE2-CB 4.31Å; Y346-N362 WeakPolarHBondContact CE2-ND2 3.35Å; Y346-N362 HydrophobicContact CG-CB 4.26Å; Y346-S369 PolarHBondContact OH-O 3.41Å; Y346-S369 PolarHBondContact OH-OG 2.98Å; Y346-A370 VanDerWaalsContact CE1-O 3.25Å; Y346-A370 WeakPolarHBondContact CE1-O 3.38Å; Y346-A370 VanDerWaalsContact CZ-O 3.27Å; Y346-A370 PolarHBondContact OH-O 3.13Å; Y346-S371 WeakPolarHBondContact OH-CA 3.23Å; Y346-S371 PolarHBondContact OH-N 3.43Å; Y346-S371 VanDerWaalsContact OH-N 3.1Å; Y346-P372 HydrophobicContact CD1-CG 4.36Å; Y346-P372 VanDerWaalsContact CE1-CD 3.5Å
347	L	52.8	Low	67.8	Low	163 Å²	163	66.9 Å²	66.9	85%	0.853	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	0.1	-170.6	-78.9	152.9	0	0	0	114.4	P345	P345-L347 PolarHBondContact O-N 2.9Å
348	R	50	Low	66.4	Low	221 Å²	221	68.6 Å²	68.6	83%	0.834	38%	0.384	S	S	*	.	S	Bend	trans	-132.5	-1.3	176.9	-74.2	-170.3	-176.5	156.2	1.9	115.8	Y346 A350	Y346-R348 VanDerWaalsContact C-N 3.26Å; Y346-R348 PolarHBondContact O-N 2.68Å; R348-A350 PolarHBondContact O-N 3.47Å
349	S	46.6	Very low	64.9	Low	14 Å²	14	69.7 Å²	69.7	10%	0.098	39%	0.392	C	S	.	.			trans	-86.7	52.4	-178.5	-26.5	0	0	0	0	111.5	D351 S355	S349-D351 PolarHBondContact O-N 2.87Å; S349-D351 VanDerWaalsContact O-N 3.11Å; S349-S355 WeakPolarHBondContact O-CB 3.16Å; S349-S355 PolarHBondContact O-OG 3.49Å
350	A	48.8	Very low	63.6	Low	78 Å²	78	73.1 Å²	73.1	65%	0.645	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	24.7	175.8	0	0	0	0	0	112.7	R348	R348-A350 PolarHBondContact O-N 3.47Å
351	D	55.5	Low	62.5	Low	101 Å²	101	77.6 Å²	77.6	54%	0.54	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-16.8	-165.1	-74.7	-40.5	0	0	0	114.7	S349 S355	S349-D351 PolarHBondContact O-N 2.87Å; S349-D351 VanDerWaalsContact O-N 3.11Å; D351-S355 PolarHBondContact N-OG 2.9Å
352	T	58.1	Low	61.2	Low	76 Å²	76	77.8 Å²	77.8	47%	0.466	43%	0.425	S	S	.	.	S	Bend	trans	-141.3	154.6	176.3	65	0	0	0	0	111.2	H354 S355 S356	T352-H354 PolarHBondContact O-N 2.78Å; T352-S355 PolarHBondContact N-OG 3.37Å; T352-S355 PolarHBondContact O-N 2.81Å; T352-S355 PolarHBondContact O-OG 3.38Å; T352-S355 VanDerWaalsContact OG1-CB 3.29Å; T352-S355 WeakPolarHBondContact OG1-CB 3.28Å; T352-S355 PolarHBondContact OG1-N 2.85Å; T352-S355 PolarHBondContact OG1-OG 2.82Å; T352-S356 PolarHBondContact O-N 2.92Å; T352-S356 PolarHBondContact O-OG 3.2Å
353	T	60.2	Low	60.4	Low	124 Å²	124	81.7 Å²	81.7	76%	0.761	44%	0.444	S	S	*	.	H	α-helix	trans	-57.2	-34.7	175	50.2	0	0	0	0	112.2	L357	T353-L357 WeakPolarHBondContact O-CG 3.33Å; T353-L357 PolarHBondContact O-N 2.97Å; T353-L357 VanDerWaalsContact O-N 3.12Å
354	H	62.8	Low	59.6	Low	124 Å²	124	83.6 Å²	83.6	57%	0.574	45%	0.449	S	S	*	.	H	α-helix	trans	-65.8	-43	174	-172.6	-91.7	0	0	0	112.4	T352 L357 L358	T352-H354 PolarHBondContact O-N 2.78Å; H354-L357 PolarHBondContact O-N 3.23Å; H354-L358 WeakPolarHBondContact O-CB 3.37Å; H354-L358 PolarHBondContact O-N 3.01Å
355	S	56.2	Low	59	Low	12 Å²	12	87 Å²	87	8%	0.084	47%	0.466	C	S	.	.	H	α-helix	trans	-72.9	-30.8	-179.8	65.1	0	0	0	0	113	S349 D351 T352 L358 S359	S349-S355 WeakPolarHBondContact O-CB 3.16Å; S349-S355 PolarHBondContact O-OG 3.49Å; D351-S355 PolarHBondContact N-OG 2.9Å; T352-S355 PolarHBondContact N-OG 3.37Å; T352-S355 PolarHBondContact O-N 2.81Å; T352-S355 PolarHBondContact O-OG 3.38Å; T352-S355 VanDerWaalsContact OG1-CB 3.29Å; T352-S355 WeakPolarHBondContact OG1-CB 3.28Å; T352-S355 PolarHBondContact OG1-N 2.85Å; T352-S355 PolarHBondContact OG1-OG 2.82Å; S355-L358 PolarHBondContact O-N 3.12Å; S355-S359 WeakPolarHBondContact O-CB 3.37Å; S355-S359 PolarHBondContact O-N 3.35Å
356	S	61.4	Low	58.6	Low	57 Å²	57	88.5 Å²	88.5	40%	0.399	48%	0.476	S	S	.	.	H	α-helix	trans	-65.1	-43.8	169	-60.4	0	0	0	0	112.3	T352 S359 L360	T352-S356 PolarHBondContact O-N 2.92Å; T352-S356 PolarHBondContact O-OG 3.2Å; S356-S359 PolarHBondContact O-N 2.9Å; S356-L360 PolarHBondContact O-N 3.34Å; S356-L360 VanDerWaalsContact O-N 3.13Å
357	L	63	Low	58.2	Low	117 Å²	117	96.5 Å²	96.5	61%	0.613	51%	0.514	S	S	*	.	H	α-helix	trans	-63.6	-40.7	174.6	-76.9	167.5	0	0	0	111.8	T353 H354 L360 Y361	T353-L357 WeakPolarHBondContact O-CG 3.33Å; T353-L357 PolarHBondContact O-N 2.97Å; T353-L357 VanDerWaalsContact O-N 3.12Å; H354-L357 PolarHBondContact O-N 3.23Å; L357-L360 PolarHBondContact O-N 3.21Å; L357-Y361 WeakPolarHBondContact O-CB 3.33Å; L357-Y361 PolarHBondContact O-N 3.08Å
358	L	60.5	Low	58.2	Low	37 Å²	37	92 Å²	92	19%	0.194	50%	0.501	C	S	.	.	H	α-helix	trans	-66.6	-37	178.5	-147.8	72.2	0	0	0	112.2	Y346 H354 S355 Y361 N362 S369 A370	Y346-L358 HydrophobicContact CE1-CD2 4.37Å; Y346-L358 HydrophobicContact CE1-CG 4.35Å; H354-L358 WeakPolarHBondContact O-CB 3.37Å; H354-L358 PolarHBondContact O-N 3.01Å; S355-L358 PolarHBondContact O-N 3.12Å; L358-Y361 PolarHBondContact O-N 2.73Å; L358-N362 WeakPolarHBondContact O-CB 3.23Å; L358-N362 PolarHBondContact O-N 3.27Å; L358-S369 PolarHBondContact O-OG 3.34Å; L358-A370 HydrophobicContact CD1-CB 4.45Å; L358-A370 HydrophobicContact CD2-CB 4.27Å; L358-A370 WeakPolarHBondContact CD2-O 3.43Å
359	S	59.5	Low	58.5	Low	32 Å²	32	82.4 Å²	82.4	22%	0.224	47%	0.467	C	S	.	.	H	α-helix	trans	-64.3	-43	174.4	-169.6	0	0	0	0	111.8	Y346 S355 S356 N362 T363	Y346-S359 PolarHBondContact O-OG 2.77Å; S355-S359 WeakPolarHBondContact O-CB 3.37Å; S355-S359 PolarHBondContact O-N 3.35Å; S356-S359 PolarHBondContact O-N 2.9Å; S359-N362 WeakPolarHBondContact O-CB 3.43Å; S359-N362 PolarHBondContact O-N 3.35Å; S359-T363 PolarHBondContact O-N 3.31Å
360	L	62.7	Low	59.2	Low	104 Å²	104	84.7 Å²	84.7	55%	0.545	49%	0.487	S	S	.	.	H	α-helix	trans	-66.9	-39.9	173.7	-175	66.7	0	0	0	112	S356 L357 N362 T363 L364	S356-L360 PolarHBondContact O-N 3.34Å; S356-L360 VanDerWaalsContact O-N 3.13Å; L357-L360 PolarHBondContact O-N 3.21Å; L360-N362 VanDerWaalsContact C-N 3.3Å; L360-N362 PolarHBondContact O-N 3.42Å; L360-T363 PolarHBondContact O-N 2.98Å; L360-T363 PolarHBondContact O-OG1 3.43Å; L360-L364 PolarHBondContact O-N 2.99Å
361	Y	61.8	Low	59.9	Low	118 Å²	118	85 Å²	85	46%	0.463	48%	0.484	S	S	.	.	H	α-helix	trans	-65.1	-35.5	177	-160.9	-98.2	0	0	0	111.8	L357 L358 T363 L364 N365	L357-Y361 WeakPolarHBondContact O-CB 3.33Å; L357-Y361 PolarHBondContact O-N 3.08Å; L358-Y361 PolarHBondContact O-N 2.73Å; Y361-T363 VanDerWaalsContact C-N 3.33Å; Y361-T363 PolarHBondContact O-N 3.02Å; Y361-L364 PolarHBondContact O-N 3.06Å; Y361-L364 VanDerWaalsContact O-N 3.1Å; Y361-N365 PolarHBondContact O-N 2.79Å
362	N	59.7	Low	60.6	Low	36 Å²	36	80.9 Å²	80.9	19%	0.193	46%	0.463	C	S	.	.	H	α-helix	trans	-63	-35.9	174.2	-170.5	47.3	0	0	0	112.8	Y346 L358 S359 L360 L364 P366	Y346-N362 HydrophobicContact CD1-CB 4.13Å; Y346-N362 HydrophobicContact CD2-CB 4.41Å; Y346-N362 WeakPolarHBondContact CD2-ND2 3.15Å; Y346-N362 HydrophobicContact CE1-CB 4.03Å; Y346-N362 HydrophobicContact CE2-CB 4.31Å; Y346-N362 WeakPolarHBondContact CE2-ND2 3.35Å; Y346-N362 HydrophobicContact CG-CB 4.26Å; L358-N362 WeakPolarHBondContact O-CB 3.23Å; L358-N362 PolarHBondContact O-N 3.27Å; S359-N362 WeakPolarHBondContact O-CB 3.43Å; S359-N362 PolarHBondContact O-N 3.35Å; L360-N362 VanDerWaalsContact C-N 3.3Å; L360-N362 PolarHBondContact O-N 3.42Å; N362-L364 PolarHBondContact O-N 3.19Å; N362-P366 WeakPolarHBondContact O-CG 3.27Å; N362-P366 WeakPolarHBondContact OD1-CA 3.18Å
363	T	64.3	Low	61.5	Low	106 Å²	106	80.8 Å²	80.8	65%	0.65	47%	0.465	S	S	*	.	H	α-helix	trans	-68.8	-22	174	50	0	0	0	0	113.6	S359 L360 Y361	S359-T363 PolarHBondContact O-N 3.31Å; L360-T363 PolarHBondContact O-N 2.98Å; L360-T363 PolarHBondContact O-OG1 3.43Å; Y361-T363 VanDerWaalsContact C-N 3.33Å; Y361-T363 PolarHBondContact O-N 3.02Å
364	L	62.8	Low	62.5	Low	121 Å²	121	76.2 Å²	76.2	63%	0.634	44%	0.438	S	S	*	.	H	α-helix	trans	-93	-37.7	-179.7	-66.9	170	0	0	0	112.3	L360 Y361 N362	L360-L364 PolarHBondContact O-N 2.99Å; Y361-L364 PolarHBondContact O-N 3.06Å; Y361-L364 VanDerWaalsContact O-N 3.1Å; N362-L364 PolarHBondContact O-N 3.19Å
365	N	60.8	Low	63.5	Low	89 Å²	89	72.3 Å²	72.3	48%	0.476	42%	0.423	S	S	.	.			trans	-146.3	88.7	178	-83	-46.5	0	0	0	111.4	Y361 E367 A368 S369	Y361-N365 PolarHBondContact O-N 2.79Å; N365-E367 VanDerWaalsContact C-N 3.33Å; N365-E367 PolarHBondContact O-N 3.02Å; N365-A368 HydrophobicContact CB-CB 4.23Å; N365-A368 PolarHBondContact O-N 3.05Å; N365-S369 PolarHBondContact O-N 3.04Å
366	P	60.4	Low	64.7	Low	94 Å²	94	74.7 Å²	74.7	61%	0.61	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-63.3	-34.3	-177.3	-20.3	30.3	0	0	0	114	N362 A368	N362-P366 WeakPolarHBondContact O-CG 3.27Å; N362-P366 WeakPolarHBondContact OD1-CA 3.18Å; P366-A368 VanDerWaalsContact C-N 3.32Å; P366-A368 PolarHBondContact O-N 2.82Å
367	E	55.3	Low	65.5	Low	202 Å²	202	73.2 Å²	73.2	94%	0.944	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-76.6	-17.6	-177.8	-67.6	-167.9	157.2	0	0	113.8	N365	N365-E367 VanDerWaalsContact C-N 3.33Å; N365-E367 PolarHBondContact O-N 3.02Å
368	A	52.9	Low	66.2	Low	69 Å²	69	70.1 Å²	70.1	57%	0.57	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-110.3	1.1	-176.7	0	0	0	0	0	113.6	N365 P366	N365-A368 HydrophobicContact CB-CB 4.23Å; N365-A368 PolarHBondContact O-N 3.05Å; P366-A368 VanDerWaalsContact C-N 3.32Å; P366-A368 PolarHBondContact O-N 2.82Å
369	S	56.3	Low	67.3	Low	19 Å²	19	70.2 Å²	70.2	13%	0.133	41%	0.409	C	S	.	.	S	Bend	trans	-91.6	138.4	-177.1	-163.8	0	0	0	0	112.1	Y346 L358 N365	Y346-S369 PolarHBondContact OH-O 3.41Å; Y346-S369 PolarHBondContact OH-OG 2.98Å; L358-S369 PolarHBondContact O-OG 3.34Å; N365-S369 PolarHBondContact O-N 3.04Å
370	A	60.8	Low	68.5	Low	63 Å²	63	71.5 Å²	71.5	52%	0.521	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-76.3	125.1	177.2	0	0	0	0	0	110.4	Y346 L358	Y346-A370 VanDerWaalsContact CE1-O 3.25Å; Y346-A370 WeakPolarHBondContact CE1-O 3.38Å; Y346-A370 VanDerWaalsContact CZ-O 3.27Å; Y346-A370 PolarHBondContact OH-O 3.13Å; L358-A370 HydrophobicContact CD1-CB 4.45Å; L358-A370 HydrophobicContact CD2-CB 4.27Å; L358-A370 WeakPolarHBondContact CD2-O 3.43Å
371	S	63	Low	69.7	Low	83 Å²	83	68 Å²	68	58%	0.58	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-83.3	138	-177	57.7	0	0	0	0	112.8	Y346	Y346-S371 WeakPolarHBondContact OH-CA 3.23Å; Y346-S371 PolarHBondContact OH-N 3.43Å; Y346-S371 VanDerWaalsContact OH-N 3.1Å
372	P	70.3	Confident	71.1	Confident	15 Å²	15	63.3 Å²	63.3	10%	0.097	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-62.6	140.2	177.8	25.5	-33.2	0	0	0	109.9	C344 Y346 C407	C344-P372 HydrophobicContact CB-CB 4.04Å; C344-P372 HydrophobicContact CB-CG 3.72Å; C344-P372 VanDerWaalsContact CB-O 3.32Å; C344-P372 WeakPolarHBondContact CB-O 3.39Å; C344-P372 WeakPolarHBondContact O-CG 3.38Å; Y346-P372 HydrophobicContact CD1-CG 4.36Å; Y346-P372 VanDerWaalsContact CE1-CD 3.5Å; P372-C407 HydrophobicContact CB-CB 4.38Å
373	C	77.8	Confident	72.6	Confident	74 Å²	74	62 Å²	62	50%	0.5	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-99.3	142.4	-177.2	-72.1	0	0	0	0	111	V375 C407 S408	C373-V375 HydrophobicContact CB-CG1 4.06Å; C373-V375 PolarHBondContact O-N 3.42Å; C373-C407 WeakPolarHBondContact O-CA 3.4Å; C373-S408 PolarHBondContact N-O 3.49Å; C373-S408 PolarHBondContact O-N 2.79Å
374	C	80.9	Confident	74	Confident	29 Å²	29	57 Å²	57	20%	0.196	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	103.3	172.4	-171.4	0	0	0	0	109.8	C311 K406	C311-C374 WeakPolarHBondContact CA-SG 3.1Å; C311-C374 HydrophobicContact CB-CB 3.71Å; C311-C374 WeakPolarHBondContact CB-SG 3.24Å; C311-C374 WeakPolarHBondContact SG-CA 3.09Å; C311-C374 WeakPolarHBondContact SG-CB 3.43Å; C311-C374 CovalentContact SG-SG 2.03Å; C311-C374 PolarHBondContact SG-SG 3.08Å; C374-K406 CarbonylContact C-O 3.6Å; C374-K406 WeakPolarHBondContact CA-O 3.31Å
375	V	82.3	Confident	75.4	Confident	42 Å²	42	51.2 Å²	51.2	26%	0.255	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	150.5	-173.4	-62.5	0	0	0	0	111.8	C373 C405 K406 S408	C373-V375 HydrophobicContact CB-CG1 4.06Å; C373-V375 PolarHBondContact O-N 3.42Å; V375-C405 CarbonylContact O-C 3.58Å; V375-C405 WeakPolarHBondContact O-CA 3.32Å; V375-K406 HydrophobicContact CG2-CG 3.84Å; V375-K406 PolarHBondContact N-O 3.05Å; V375-K406 PolarHBondContact O-N 2.93Å; V375-S408 VanDerWaalsContact CG2-OG 3.32Å; V375-S408 WeakPolarHBondContact CG2-OG 2.98Å
376	P	83.1	Confident	76.9	Confident	61 Å²	61	47.2 Å²	47.2	40%	0.396	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	141.8	175.5	28	-34.4	0	0	0	111.2	C340 L379 V402 S404	C340-P376 WeakPolarHBondContact SG-CA 3.34Å; C340-P376 VanDerWaalsContact SG-N 3.41Å; P376-L379 HydrophobicContact CB-CD2 3.66Å; P376-L379 HydrophobicContact CB-CG 4.36Å; P376-L379 HydrophobicContact CG-CD2 4.36Å; P376-V402 HydrophobicContact CB-CG1 3.87Å; P376-V402 HydrophobicContact CB-CG2 4.16Å; P376-S404 WeakPolarHBondContact CA-O 3.48Å
377	Q	77.6	Confident	78.2	Confident	27 Å²	27	43.1 Å²	43.1	13%	0.126	26%	0.261	C	S	.	.			trans	-110.4	-64.2	176.4	176.3	-176.7	-61.9	0	0	111.2	K295 S404 K406	K295-Q377 PolarHBondContact O-NE2 3.02Å; K295-Q377 PolarHBondContact O-OE1 2.85Å; Q377-S404 PolarHBondContact N-O 2.78Å; Q377-K406 HydrophobicContact CB-CB 4.42Å; Q377-K406 HydrophobicContact CB-CD 4.17Å; Q377-K406 HydrophobicContact CB-CG 4.12Å; Q377-K406 HydrophobicContact CG-CD 4.35Å
378	D	78.4	Confident	79.6	Confident	52 Å²	52	36.5 Å²	36.5	28%	0.278	23%	0.234	S	C	.	.			trans	-98.5	127.3	179.4	-56.2	-53.4	0	0	0	109.1	R294 K403 S404	R294-D378 IonicContact NH1-OD1 3.73Å; D378-K403 HydrophobicContact CB-CB 4.4Å; D378-K403 PolarHBondContact O-N 2.68Å; D378-S404 WeakPolarHBondContact CB-OG 3.49Å; D378-S404 PolarHBondContact N-OG 2.84Å; D378-S404 PolarHBondContact O-N 3.48Å; D378-S404 PolarHBondContact OD2-OG 3.31Å
379	L	83.6	Confident	81.1	Confident	38 Å²	38	35.3 Å²	35.3	20%	0.199	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138.3	-177.2	-58.6	167.9	0	0	0	109.1	P376 N399 V401 V402	P376-L379 HydrophobicContact CB-CD2 3.66Å; P376-L379 HydrophobicContact CB-CG 4.36Å; P376-L379 HydrophobicContact CG-CD2 4.36Å; L379-N399 HydrophobicContact CB-CB 3.97Å; L379-N399 HydrophobicContact CD1-CB 3.59Å; L379-N399 HydrophobicContact CG-CB 4.4Å; L379-V401 CarbonylContact C-O 3.5Å; L379-V401 WeakPolarHBondContact CA-O 3.37Å; L379-V402 HydrophobicContact CD2-CB 4.13Å; L379-V402 HydrophobicContact CD2-CG1 4.39Å; L379-V402 HydrophobicContact CD2-CG2 3.69Å
380	E	83.3	Confident	82.3	Confident	59 Å²	59	45.9 Å²	45.9	28%	0.276	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	147.3	176	-88.3	171.8	-168	0	0	111.3	M400 V401 K403	E380-M400 PolarHBondContact O-N 3.19Å; E380-V401 HydrophobicContact CB-CB 3.96Å; E380-V401 HydrophobicContact CB-CG1 4.38Å; E380-V401 PolarHBondContact N-O 2.85Å; E380-V401 PolarHBondContact O-N 3.24Å; E380-K403 HydrophobicContact CB-CG 4.15Å; E380-K403 VanDerWaalsContact CD-CD 3.42Å; E380-K403 VanDerWaalsContact CD-CG 3.49Å; E380-K403 HydrophobicContact CG-CD 4.19Å; E380-K403 HydrophobicContact CG-CG 3.71Å; E380-K403 WeakPolarHBondContact OE1-CD 3.25Å; E380-K403 WeakPolarHBondContact OE1-CE 2.92Å; E380-K403 IonicContact OE1-NZ 2.77Å; E380-K403 PolarHBondContact OE1-NZ 3.21Å; E380-K403 VanDerWaalsContact OE2-CD 3.28Å; E380-K403 WeakPolarHBondContact OE2-CD 3.45Å; E380-K403 WeakPolarHBondContact OE2-CE 3.03Å; E380-K403 IonicContact OE2-NZ 2.79Å; E380-K403 PolarHBondContact OE2-NZ 3.24Å
381	P	88.1	Confident	83.4	Confident	30 Å²	30	45.4 Å²	45.4	20%	0.195	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	159	173.1	32.2	-35	0	0	0	111.9	I78 Q396 L397	I78-P381 HydrophobicContact CG2-CG 3.87Å; P381-Q396 HydrophobicContact CB-CG 3.91Å; P381-Q396 VanDerWaalsContact CG-NE2 3.3Å; P381-L397 CarbonylContact C-O 3.56Å; P381-L397 WeakPolarHBondContact CA-O 3.49Å; P381-L397 VanDerWaalsContact CB-O 3.28Å; P381-L397 WeakPolarHBondContact CB-O 3.17Å
382	L	90.9	Very high	84.7	Confident	20 Å²	20	44.1 Å²	44.1	11%	0.105	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124.4	174.2	177.7	69.4	0	0	0	109.3	F320 P332 Y335 I384 L397 M400	F320-L382 HydrophobicContact CZ-CD2 4.16Å; P332-L382 HydrophobicContact CG-CD1 4.14Å; Y335-L382 HydrophobicContact CD1-CD2 3.68Å; Y335-L382 HydrophobicContact CD2-CD1 4.27Å; Y335-L382 HydrophobicContact CD2-CD2 3.93Å; Y335-L382 HydrophobicContact CE1-CD2 3.81Å; Y335-L382 HydrophobicContact CE2-CD2 4.03Å; Y335-L382 HydrophobicContact CG-CD1 4.11Å; Y335-L382 HydrophobicContact CG-CD2 3.76Å; L382-I384 HydrophobicContact CD2-CG2 3.99Å; L382-I384 HydrophobicContact CG-CG2 4.05Å; L382-L397 PolarHBondContact N-O 2.99Å; L382-L397 WeakPolarHBondContact O-CB 3.28Å; L382-L397 PolarHBondContact O-N 3.15Å; L382-M400 HydrophobicContact CB-CB 3.69Å; L382-M400 HydrophobicContact CB-CG 3.95Å
383	T	92	Very high	85.5	Confident	9 Å²	9	46 Å²	46	6%	0.055	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	134	170.8	-51.8	0	0	0	0	109.7	Y71 I103 P332 V394 E395	Y71-T383 HydrophobicContact CD2-CG2 4.06Å; Y71-T383 HydrophobicContact CE2-CG2 4.12Å; I103-T383 HydrophobicContact CD1-CG2 4.17Å; P332-T383 WeakPolarHBondContact CD-O 3.29Å; T383-V394 HydrophobicContact CG2-CG1 3.83Å; T383-E395 WeakPolarHBondContact CA-O 3.42Å
384	I	93.1	Very high	86.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	152.2	176.9	64.2	162.8	0	0	0	111.2	L49 Q331 L382 Y386 V394 E395 L397	L49-I384 HydrophobicContact CD1-CD1 4.14Å; L49-I384 HydrophobicContact CD2-CD1 4.36Å; Q331-I384 CarbonylContact O-C 3.52Å; Q331-I384 WeakPolarHBondContact O-CA 3.29Å; L382-I384 HydrophobicContact CD2-CG2 3.99Å; L382-I384 HydrophobicContact CG-CG2 4.05Å; I384-Y386 HydrophobicContact CD1-CD1 4.04Å; I384-Y386 HydrophobicContact CD1-CE1 4.41Å; I384-Y386 HydrophobicContact CG1-CD1 4.39Å; I384-V394 WeakPolarHBondContact O-CA 3.41Å; I384-E395 PolarHBondContact N-O 3.35Å; I384-E395 PolarHBondContact O-N 3.31Å; I384-L397 HydrophobicContact CD1-CD1 3.9Å; I384-L397 HydrophobicContact CD1-CD2 4.22Å; I384-L397 HydrophobicContact CD1-CG 4.11Å; I384-L397 HydrophobicContact CG1-CD1 4.26Å; I384-L397 HydrophobicContact CG1-CG 4.12Å; I384-L397 HydrophobicContact CG2-CD1 4.05Å; I384-L397 HydrophobicContact CG2-CG 4.46Å
385	L	92.9	Very high	86.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.5	171.6	167.8	63.3	0	0	0	109.8	V63 V67 L68 Y71 H330 Q331 P392 K393 V394	V63-L385 HydrophobicContact CB-CD2 4.4Å; V63-L385 HydrophobicContact CG1-CD2 3.56Å; V63-L385 HydrophobicContact CG2-CD2 4.05Å; V67-L385 HydrophobicContact CG1-CD1 3.33Å; V67-L385 HydrophobicContact CG1-CD2 3.81Å; V67-L385 HydrophobicContact CG1-CG 4.23Å; L68-L385 HydrophobicContact CD2-CD2 4.35Å; Y71-L385 HydrophobicContact CD2-CB 4.09Å; H330-L385 HydrophobicContact CB-CG 4.49Å; H330-L385 PolarHBondContact N-O 2.88Å; Q331-L385 HydrophobicContact CB-CB 4.12Å; Q331-L385 HydrophobicContact CB-CD2 4.49Å; Q331-L385 HydrophobicContact CG-CD2 4.43Å; Q331-L385 PolarHBondContact N-O 3.04Å; Q331-L385 PolarHBondContact O-N 3.2Å; L385-P392 HydrophobicContact CD1-CB 4.47Å; L385-K393 WeakPolarHBondContact CA-O 3.32Å; L385-V394 HydrophobicContact CD1-CG2 3.8Å
386	Y	91.8	Very high	86.8	Confident	5 Å²	5	40.4 Å²	40.4	2%	0.02	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	174.2	177.3	72.9	-77.4	0	0	0	111.4	L49 M51 W328 I384 V388 K393 E395	L49-Y386 HydrophobicContact CD2-CE1 4.16Å; M51-Y386 HydrophobicContact CE-CE2 3.59Å; M51-Y386 WeakPolarHBondContact CE-OH 3.48Å; W328-Y386 AromaticContact CE3-CD2 3.91Å; W328-Y386 HydrophobicContact CE3-CD2 3.91Å; W328-Y386 HydrophobicContact CE3-CG 4.01Å; W328-Y386 HydrophobicContact CZ3-CD1 4.38Å; W328-Y386 AromaticContact CZ3-CD2 3.71Å; W328-Y386 HydrophobicContact CZ3-CD2 3.71Å; W328-Y386 HydrophobicContact CZ3-CE2 4.39Å; W328-Y386 AromaticContact CZ3-CG 3.7Å; W328-Y386 HydrophobicContact CZ3-CG 3.7Å; W328-Y386 WeakPolarHBondContact O-CB 3.35Å; I384-Y386 HydrophobicContact CD1-CD1 4.04Å; I384-Y386 HydrophobicContact CD1-CE1 4.41Å; I384-Y386 HydrophobicContact CG1-CD1 4.39Å; Y386-V388 HydrophobicContact CD2-CG2 4.1Å; Y386-V388 HydrophobicContact CE2-CG2 3.39Å; Y386-K393 HydrophobicContact CD1-CB 4.17Å; Y386-K393 HydrophobicContact CE1-CB 3.74Å; Y386-K393 HydrophobicContact CE2-CB 4.35Å; Y386-K393 PolarHBondContact N-O 3.47Å; Y386-K393 PolarHBondContact O-N 3.09Å; Y386-E395 HydrophobicContact CE1-CB 4.4Å; Y386-E395 HydrophobicContact CE1-CG 4.16Å; Y386-E395 PolarHBondContact OH-OE1 3.41Å
387	Y	87.1	Confident	87	Confident	8 Å²	8	37.5 Å²	37.5	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	139.2	178.2	-78.4	-101.9	0	0	0	111.9	P60 V63 P64 H330 S391 P392	P60-Y387 HydrophobicContact CG-CE1 3.86Å; P60-Y387 HydrophobicContact CG-CE2 4.15Å; V63-Y387 HydrophobicContact CG2-CE2 4.38Å; P64-Y387 WeakPolarHBondContact CD-OH 3.23Å; H330-Y387 AromaticContact CE1-CD2 3.39Å; H330-Y387 WeakPolarHBondContact CE1-CD2 3.09Å; H330-Y387 AromaticContact CE1-CE2 3.94Å; H330-Y387 AromaticContact ND1-CD2 3.62Å; Y387-S391 WeakPolarHBondContact CA-O 3.33Å; Y387-P392 HydrophobicContact CD1-CB 4.29Å; Y387-P392 HydrophobicContact CE1-CB 3.74Å; Y387-P392 HydrophobicContact CE1-CG 4.33Å; Y387-P392 HydrophobicContact CE2-CB 4.45Å
388	V	85	Confident	87.3	Confident	63 Å²	63	36.3 Å²	36.3	38%	0.382	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	104.5	164	-175.4	0	0	0	0	107.4	M51 Y386 R390 S391 K393	M51-V388 HydrophobicContact CE-CG2 4.35Å; Y386-V388 HydrophobicContact CD2-CG2 4.1Å; Y386-V388 HydrophobicContact CE2-CG2 3.39Å; V388-R390 PolarHBondContact O-N 3.44Å; V388-S391 PolarHBondContact N-O 2.9Å; V388-S391 PolarHBondContact O-N 3.05Å; V388-S391 PolarHBondContact O-OG 3.35Å; V388-K393 HydrophobicContact CG2-CG 4.3Å
389	G	84.7	Confident	87.4	Confident	45 Å²	45	35.1 Å²	35.1	46%	0.464	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	-114.9	-170.7	0	0	0	0	0	111.3
390	R	82.1	Confident	87.6	Confident	240 Å²	240	33.3 Å²	33.3	91%	0.906	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-4.5	174.7	-67.8	-175.3	179.5	168	0.2	113.8	V388	V388-R390 PolarHBondContact O-N 3.44Å
391	S	83.8	Confident	87.9	Confident	54 Å²	54	31.5 Å²	31.5	38%	0.378	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.2	-176.8	65.7	0	0	0	0	111.1	Y387 V388	Y387-S391 WeakPolarHBondContact CA-O 3.33Å; V388-S391 PolarHBondContact N-O 2.9Å; V388-S391 PolarHBondContact O-N 3.05Å; V388-S391 PolarHBondContact O-OG 3.35Å
392	P	89.3	Confident	87.9	Confident	56 Å²	56	30.1 Å²	30.1	36%	0.364	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	139.5	171	28.9	-32.1	0	0	0	110.3	V67 L385 Y387	V67-P392 HydrophobicContact CB-CB 4.42Å; V67-P392 HydrophobicContact CG1-CB 3.72Å; V67-P392 HydrophobicContact CG1-CG 4.46Å; V67-P392 HydrophobicContact CG2-CB 3.8Å; V67-P392 HydrophobicContact CG2-CG 3.67Å; L385-P392 HydrophobicContact CD1-CB 4.47Å; Y387-P392 HydrophobicContact CD1-CB 4.29Å; Y387-P392 HydrophobicContact CE1-CB 3.74Å; Y387-P392 HydrophobicContact CE1-CG 4.33Å; Y387-P392 HydrophobicContact CE2-CB 4.45Å
393	K	88.6	Confident	87.7	Confident	54 Å²	54	31.7 Å²	31.7	24%	0.235	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	120.1	178.4	-69.4	-69.5	-172.4	165.2	0	109.8	E102 L385 Y386 V388	E102-K393 IonicContact OE1-NZ 3.28Å; E102-K393 PolarHBondContact OE1-NZ 3.5Å; L385-K393 WeakPolarHBondContact CA-O 3.32Å; Y386-K393 HydrophobicContact CD1-CB 4.17Å; Y386-K393 HydrophobicContact CE1-CB 3.74Å; Y386-K393 HydrophobicContact CE2-CB 4.35Å; Y386-K393 PolarHBondContact N-O 3.47Å; Y386-K393 PolarHBondContact O-N 3.09Å; V388-K393 HydrophobicContact CG2-CG 4.3Å
394	V	90.9	Very high	87.2	Confident	8 Å²	8	31.4 Å²	31.4	5%	0.048	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117.4	170.3	-176.8	0	0	0	0	107.3	V67 L70 I103 T383 I384 L385	V67-V394 HydrophobicContact CG1-CG2 4.34Å; L70-V394 HydrophobicContact CD2-CB 4.19Å; L70-V394 HydrophobicContact CD2-CG2 3.84Å; L70-V394 HydrophobicContact CG-CB 4.4Å; L70-V394 HydrophobicContact CG-CG2 4.04Å; I103-V394 HydrophobicContact CB-CG1 4.42Å; I103-V394 HydrophobicContact CD1-CG1 3.96Å; I103-V394 PolarHBondContact N-O 3.35Å; I103-V394 VanDerWaalsContact N-O 3.07Å; T383-V394 HydrophobicContact CG2-CG1 3.83Å; I384-V394 WeakPolarHBondContact O-CA 3.41Å; L385-V394 HydrophobicContact CD1-CG2 3.8Å
395	E	89.4	Confident	86.7	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.009	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.4	-177.6	-73.3	-170.3	-135.7	0	0	111.9	L49 A100 K101 E102 R284 T383 I384 Y386	L49-E395 VanDerWaalsContact CD2-OE2 3.24Å; L49-E395 WeakPolarHBondContact CD2-OE2 3.31Å; A100-E395 HydrophobicContact CB-CB 4.43Å; A100-E395 VanDerWaalsContact CB-OE2 3.26Å; A100-E395 WeakPolarHBondContact CB-OE2 3.49Å; K101-E395 CarbonylContact O-C 3.59Å; K101-E395 WeakPolarHBondContact O-CA 2.93Å; E102-E395 HydrophobicContact CG-CG 4.11Å; R284-E395 IonicContact CZ-OE2 3.35Å; R284-E395 IonicContact NH1-OE2 2.76Å; R284-E395 PolarHBondContact NH1-OE2 2.98Å; R284-E395 IonicContact NH2-OE1 3.68Å; R284-E395 IonicContact NH2-OE2 2.95Å; R284-E395 PolarHBondContact NH2-OE2 2.94Å; T383-E395 WeakPolarHBondContact CA-O 3.42Å; I384-E395 PolarHBondContact N-O 3.35Å; I384-E395 PolarHBondContact O-N 3.31Å; Y386-E395 HydrophobicContact CE1-CB 4.4Å; Y386-E395 HydrophobicContact CE1-CG 4.16Å; Y386-E395 PolarHBondContact OH-OE1 3.41Å
396	Q	87.9	Confident	86	Confident	18 Å²	18	35.9 Å²	35.9	8%	0.084	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	111.1	174.6	-173.9	-172.1	4	0	0	110.5	A100 K101 I103 P381	A100-Q396 WeakPolarHBondContact CA-O 3.35Å; K101-Q396 PolarHBondContact N-O 2.73Å; K101-Q396 VanDerWaalsContact N-O 3.16Å; K101-Q396 PolarHBondContact O-N 2.68Å; I103-Q396 HydrophobicContact CD1-CB 4.17Å; P381-Q396 HydrophobicContact CB-CG 3.91Å; P381-Q396 VanDerWaalsContact CG-NE2 3.3Å
397	L	86.7	Confident	85.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	128.7	172.8	-54	-177.4	0	0	0	109.9	I45 K48 L49 A100 P381 L382 I384 M400	I45-L397 HydrophobicContact CB-CD1 4.38Å; I45-L397 HydrophobicContact CG1-CD1 3.83Å; I45-L397 HydrophobicContact CG2-CD1 4.09Å; K48-L397 HydrophobicContact CB-CD2 4.17Å; K48-L397 HydrophobicContact CD-CB 4.42Å; L49-L397 HydrophobicContact CD2-CD2 3.79Å; L49-L397 HydrophobicContact CG-CD2 4.09Å; A100-L397 HydrophobicContact CB-CD2 3.61Å; P381-L397 CarbonylContact C-O 3.56Å; P381-L397 WeakPolarHBondContact CA-O 3.49Å; P381-L397 VanDerWaalsContact CB-O 3.28Å; P381-L397 WeakPolarHBondContact CB-O 3.17Å; L382-L397 PolarHBondContact N-O 2.99Å; L382-L397 WeakPolarHBondContact O-CB 3.28Å; L382-L397 PolarHBondContact O-N 3.15Å; I384-L397 HydrophobicContact CD1-CD1 3.9Å; I384-L397 HydrophobicContact CD1-CD2 4.22Å; I384-L397 HydrophobicContact CD1-CG 4.11Å; I384-L397 HydrophobicContact CG1-CD1 4.26Å; I384-L397 HydrophobicContact CG1-CG 4.12Å; I384-L397 HydrophobicContact CG2-CD1 4.05Å; I384-L397 HydrophobicContact CG2-CG 4.46Å; L397-M400 HydrophobicContact CB-CG 3.57Å; L397-M400 HydrophobicContact CB-SD 4.23Å; L397-M400 HydrophobicContact CD1-CE 4.46Å; L397-M400 HydrophobicContact CD1-CG 4.3Å; L397-M400 HydrophobicContact CD1-SD 4.35Å
398	S	83.4	Confident	84.2	Confident	1 Å²	1	41 Å²	41	1%	0.007	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	163.2	175	60.8	0	0	0	0	113.9	K48 E97 Y98 M400	K48-S398 WeakPolarHBondContact CE-O 3.2Å; K48-S398 PolarHBondContact NZ-O 3Å; K48-S398 PolarHBondContact NZ-OG 2.53Å; E97-S398 WeakPolarHBondContact O-CB 3.37Å; E97-S398 PolarHBondContact O-OG 2.85Å; Y98-S398 WeakPolarHBondContact CA-OG 3.19Å; Y98-S398 PolarHBondContact O-OG 3.16Å; S398-M400 VanDerWaalsContact C-N 3.28Å; S398-M400 PolarHBondContact O-N 3.02Å
399	N	81.3	Confident	84.2	Confident	28 Å²	28	40 Å²	40	15%	0.15	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.3	36.4	168	-64	-17.2	0	0	0	113.9	Q44 L379	Q44-N399 PolarHBondContact NE2-O 3.47Å; L379-N399 HydrophobicContact CB-CB 3.97Å; L379-N399 HydrophobicContact CD1-CB 3.59Å; L379-N399 HydrophobicContact CG-CB 4.4Å
400	M	87.9	Confident	84.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-34.1	-172.7	-69.8	-53.4	-61.2	0	0	113	V41 Q44 I45 K48 Y335 E380 L382 L397 S398	V41-M400 HydrophobicContact CG1-CE 4.1Å; Q44-M400 VanDerWaalsContact CD-SD 3.59Å; Q44-M400 HydrophobicContact CG-SD 3.86Å; I45-M400 HydrophobicContact CD1-CE 3.89Å; I45-M400 HydrophobicContact CG1-CE 3.45Å; I45-M400 VanDerWaalsContact CG1-CE 3.45Å; I45-M400 HydrophobicContact CG1-SD 4.39Å; K48-M400 HydrophobicContact CD-SD 4.05Å; Y335-M400 HydrophobicContact CE2-CB 4.36Å; Y335-M400 WeakPolarHBondContact OH-CE 3.27Å; E380-M400 PolarHBondContact O-N 3.19Å; L382-M400 HydrophobicContact CB-CB 3.69Å; L382-M400 HydrophobicContact CB-CG 3.95Å; L397-M400 HydrophobicContact CB-CG 3.57Å; L397-M400 HydrophobicContact CB-SD 4.23Å; L397-M400 HydrophobicContact CD1-CE 4.46Å; L397-M400 HydrophobicContact CD1-CG 4.3Å; L397-M400 HydrophobicContact CD1-SD 4.35Å; S398-M400 VanDerWaalsContact C-N 3.28Å; S398-M400 PolarHBondContact O-N 3.02Å
401	V	89.8	Confident	84.2	Confident	20 Å²	20	28.6 Å²	28.6	12%	0.121	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126	-176.9	174.1	0	0	0	0	109.6	Y335 F336 L379 E380 K403	Y335-V401 HydrophobicContact CD2-CG2 3.77Å; Y335-V401 HydrophobicContact CE2-CG2 4.02Å; F336-V401 WeakPolarHBondContact O-CG1 3.32Å; L379-V401 CarbonylContact C-O 3.5Å; L379-V401 WeakPolarHBondContact CA-O 3.37Å; E380-V401 HydrophobicContact CB-CB 3.96Å; E380-V401 HydrophobicContact CB-CG1 4.38Å; E380-V401 PolarHBondContact N-O 2.85Å; E380-V401 PolarHBondContact O-N 3.24Å; V401-K403 HydrophobicContact CG1-CD 4.18Å
402	V	87.3	Confident	84.3	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.012	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.4	176.9	-175.9	0	0	0	0	110.7	V313 A337 N338 P376 L379	V313-V402 HydrophobicContact CG2-CB 4.41Å; V313-V402 HydrophobicContact CG2-CG1 4.04Å; A337-V402 PolarHBondContact O-N 2.89Å; N338-V402 HydrophobicContact CB-CB 3.98Å; N338-V402 PolarHBondContact ND2-O 3.34Å; P376-V402 HydrophobicContact CB-CG1 3.87Å; P376-V402 HydrophobicContact CB-CG2 4.16Å; L379-V402 HydrophobicContact CD2-CB 4.13Å; L379-V402 HydrophobicContact CD2-CG1 4.39Å; L379-V402 HydrophobicContact CD2-CG2 3.69Å
403	K	85.6	Confident	84	Confident	53 Å²	53	25.3 Å²	25.3	23%	0.23	14%	0.136	C	C	.	.			trans	-109.8	-32.9	177.7	-62.6	-66.4	-81.1	-132.5	0	114	D299 T300 D378 E380 V401	D299-K403 CarbonylContact C-O 3.39Å; T300-K403 HydrophobicContact CG2-CD 4.2Å; T300-K403 WeakPolarHBondContact CG2-O 3.35Å; T300-K403 PolarHBondContact N-O 3.44Å; D378-K403 HydrophobicContact CB-CB 4.4Å; D378-K403 PolarHBondContact O-N 2.68Å; E380-K403 HydrophobicContact CB-CG 4.15Å; E380-K403 VanDerWaalsContact CD-CD 3.42Å; E380-K403 VanDerWaalsContact CD-CG 3.49Å; E380-K403 HydrophobicContact CG-CD 4.19Å; E380-K403 HydrophobicContact CG-CG 3.71Å; E380-K403 WeakPolarHBondContact OE1-CD 3.25Å; E380-K403 WeakPolarHBondContact OE1-CE 2.92Å; E380-K403 IonicContact OE1-NZ 2.77Å; E380-K403 PolarHBondContact OE1-NZ 3.21Å; E380-K403 VanDerWaalsContact OE2-CD 3.28Å; E380-K403 WeakPolarHBondContact OE2-CD 3.45Å; E380-K403 WeakPolarHBondContact OE2-CE 3.03Å; E380-K403 IonicContact OE2-NZ 2.79Å; E380-K403 PolarHBondContact OE2-NZ 3.24Å; V401-K403 HydrophobicContact CG1-CD 4.18Å
404	S	82.4	Confident	83.7	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.021	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	153.4	176.5	67.8	0	0	0	0	110.9	L298 P376 Q377 D378	L298-S404 WeakPolarHBondContact O-CA 3.15Å; L298-S404 WeakPolarHBondContact O-CB 3.45Å; P376-S404 WeakPolarHBondContact CA-O 3.48Å; Q377-S404 PolarHBondContact N-O 2.78Å; D378-S404 WeakPolarHBondContact CB-OG 3.49Å; D378-S404 PolarHBondContact N-OG 2.84Å; D378-S404 PolarHBondContact O-N 3.48Å; D378-S404 PolarHBondContact OD2-OG 3.31Å
405	C	83.4	Confident	83.1	Confident	6 Å²	6	24.4 Å²	24.4	4%	0.041	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.1	178.9	-60.5	0	0	0	0	109.8	A297 V313 C340 V375	A297-C405 WeakPolarHBondContact CB-O 3.44Å; V313-C405 VanDerWaalsContact CA-SG 3.55Å; C340-C405 WeakPolarHBondContact CA-SG 3.49Å; C340-C405 HydrophobicContact CB-CB 3.77Å; C340-C405 WeakPolarHBondContact CB-SG 3.3Å; C340-C405 WeakPolarHBondContact SG-CB 3.45Å; C340-C405 CovalentContact SG-SG 2.03Å; C340-C405 PolarHBondContact SG-SG 3.05Å; V375-C405 CarbonylContact O-C 3.58Å; V375-C405 WeakPolarHBondContact O-CA 3.32Å
406	K	77	Confident	82.7	Confident	88 Å²	88	26.2 Å²	26.2	38%	0.383	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	162.6	175.3	70.5	172.6	-178.3	175.7	0	111.1	A297 C374 V375 Q377	A297-K406 HydrophobicContact CB-CB 4.13Å; C374-K406 CarbonylContact C-O 3.6Å; C374-K406 WeakPolarHBondContact CA-O 3.31Å; V375-K406 HydrophobicContact CG2-CG 3.84Å; V375-K406 PolarHBondContact N-O 3.05Å; V375-K406 PolarHBondContact O-N 2.93Å; Q377-K406 HydrophobicContact CB-CB 4.42Å; Q377-K406 HydrophobicContact CB-CD 4.17Å; Q377-K406 HydrophobicContact CB-CG 4.12Å; Q377-K406 HydrophobicContact CG-CD 4.35Å
407	C	74.2	Confident	82.2	Confident	35 Å²	35	26.8 Å²	26.8	24%	0.236	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	126.9	168.5	-63.3	0	0	0	0	109.5	C311 C344 P372 C373	C311-C407 VanDerWaalsContact CB-SG 3.55Å; C344-C407 VanDerWaalsContact CA-SG 3.57Å; C344-C407 HydrophobicContact CB-CB 3.64Å; C344-C407 WeakPolarHBondContact CB-SG 3.39Å; C344-C407 VanDerWaalsContact SG-CA 3.52Å; C344-C407 WeakPolarHBondContact SG-CB 3.45Å; C344-C407 CovalentContact SG-SG 2.03Å; C344-C407 PolarHBondContact SG-SG 3.26Å; P372-C407 HydrophobicContact CB-CB 4.38Å; C373-C407 WeakPolarHBondContact O-CA 3.4Å
408	S	67.5	Low	81.8	Confident	86 Å²	86	29.3 Å²	29.3	60%	0.601	16%	0.164	S	C	*	.			trans	-137.6	0	176.4	74.5	0	0	0	0	113.7	C373 V375	C373-S408 PolarHBondContact N-O 3.49Å; C373-S408 PolarHBondContact O-N 2.79Å; V375-S408 VanDerWaalsContact CG2-OG 3.32Å; V375-S408 WeakPolarHBondContact CG2-OG 2.98Å

Retrieved 408 of 408 residues in 458.7 ms (Link to these results)

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