RBM8A_SALSA Loading...

RNA-binding protein 8A

Required for pre-mRNA splicing as component of the spliceosome (By similarity). Core component of the splicing-dependent multiprotein exon junction complex (EJC) deposited at splice junctions on mRNAs. The EJC is a dynamic structure consisting of core proteins and several peripheral nuclear and cytoplasmic associated factors that join the complex only transiently either during EJC assembly or during subsequent mRNA metabolism. The EJC marks the position of the exon-exon junction in the mature mRNA for the gene expression machinery and the core components remain bound to spliced mRNAs throughout all stages of mRNA metabolism thereby influencing downstream processes including nuclear mRNA export, subcellular mRNA localization, translation efficiency and nonsense-mediated mRNA decay (NMD). Its removal from cytoplasmic mRNAs requires translation initiation from EJC-bearing spliced mRNAs. Associates preferentially with mRNAs produced by splicing. Does not interact with pre-mRNAs, introns, or mRNAs produced from intronless cDNAs. Associates with both nuclear mRNAs and newly exported cytoplasmic mRNAs (By similarity).

AlphaFold DB , UniProt , Accession B5DGI7, Species SALSA (Salmo salar, Atlantic salmon), Gene rbm8a, Length 175 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	44.5	Very low	49.2	Very low	238 Å²	238	143.8 Å²	143.8	100%	1.172	82%	0.82	S	S	*	*				0	112.9	0	-86.7	160.2	160.4	0	0	105.3
2	A	43.1	Very low	49	Very low	97 Å²	97	138.3 Å²	138.3	80%	0.802	82%	0.818	S	S	*	*			trans	-90	117	171.9	0	0	0	0	0	105.9	V4	A2-V4 PolarHBondContact O-N 2.81Å
3	D	48.6	Very low	50.4	Low	153 Å²	153	141.6 Å²	141.6	82%	0.818	82%	0.82	S	S	*	*			trans	-67.2	117.6	174.3	-67.4	-41.4	0	0	0	108.1	L5	D3-L5 PolarHBondContact O-N 2.98Å
4	V	48.7	Very low	52.2	Low	122 Å²	122	142.4 Å²	142.4	74%	0.739	82%	0.82	S	S	*	*			trans	-75.9	109	172	172.8	0	0	0	0	106.1	A2 D6	A2-V4 PolarHBondContact O-N 2.81Å; V4-D6 PolarHBondContact O-N 3.11Å; V4-D6 VanDerWaalsContact O-N 3.17Å
5	L	52.1	Low	53.7	Low	147 Å²	147	146.7 Å²	146.7	77%	0.77	83%	0.826	S	S	*	*			trans	-66.8	108.1	165.7	-75.5	164.9	0	0	0	107.8	D3 L7	D3-L5 PolarHBondContact O-N 2.98Å; L5-L7 PolarHBondContact O-N 3.02Å
6	D	48.4	Very low	55.2	Low	141 Å²	141	142.7 Å²	142.7	75%	0.754	82%	0.817	S	S	*	*			trans	-67.3	88.6	164.4	-79.4	-35.8	0	0	0	108.2	V4 H8	V4-D6 PolarHBondContact O-N 3.11Å; V4-D6 VanDerWaalsContact O-N 3.17Å; D6-H8 PolarHBondContact O-N 3.19Å
7	L	54.8	Low	56.6	Low	160 Å²	160	145.1 Å²	145.1	84%	0.838	82%	0.822	S	S	*	*			trans	-56.4	105.5	160.5	-90.1	140.6	0	0	0	106.6	L5 E9	L5-L7 PolarHBondContact O-N 3.02Å; L7-E9 PolarHBondContact O-N 3.25Å
8	H	52.6	Low	57.9	Low	180 Å²	180	141.3 Å²	141.3	83%	0.833	80%	0.799	S	S	*	*			trans	-50.1	120.3	163.9	-79.2	63.1	0	0	0	106.3	D6 A10	D6-H8 PolarHBondContact O-N 3.19Å; H8-A10 PolarHBondContact O-N 2.98Å
9	E	48.6	Very low	59.2	Low	185 Å²	185	139.2 Å²	139.2	86%	0.864	78%	0.782	S	S	*	*			trans	-44.7	128.7	171.6	-74.1	179.2	143.1	0	0	107.3	L7 G11	L7-E9 PolarHBondContact O-N 3.25Å; E9-G11 PolarHBondContact O-N 2.71Å
10	A	53.6	Low	60.3	Low	104 Å²	104	137 Å²	137	86%	0.86	77%	0.768	S	S	*	*			trans	-61	82.6	162.6	0	0	0	0	0	106.3	H8 G12	H8-A10 PolarHBondContact O-N 2.98Å; A10-G12 PolarHBondContact O-N 2.91Å; A10-G12 VanDerWaalsContact O-N 3.15Å
11	G	45.8	Very low	61.4	Low	55 Å²	55	131.4 Å²	131.4	57%	0.567	74%	0.741	S	S	*	*			trans	-50.6	124.2	166.4	0	0	0	0	0	105.1	E9 E13	E9-G11 PolarHBondContact O-N 2.71Å; G11-E13 PolarHBondContact O-N 3.14Å
12	G	47.7	Very low	63.3	Low	77 Å²	77	125.3 Å²	125.3	79%	0.794	71%	0.713	S	S	*	*			trans	-62.6	70.8	-174.7	0	0	0	0	0	112	A10 D14	A10-G12 PolarHBondContact O-N 2.91Å; A10-G12 VanDerWaalsContact O-N 3.15Å; G12-D14 VanDerWaalsContact C-N 3.35Å; G12-D14 PolarHBondContact O-N 3.48Å; G12-D14 VanDerWaalsContact O-N 3.15Å
13	E	66.4	Low	65.3	Low	182 Å²	182	125.1 Å²	125.1	85%	0.85	70%	0.699	S	S	*	*			trans	-73.4	97.7	162.5	-64.7	-167.3	159.3	0	0	105.5	G11 F15	G11-E13 PolarHBondContact O-N 3.14Å; E13-F15 PolarHBondContact O-N 3.01Å
14	D	75.4	Confident	67	Low	153 Å²	153	121.4 Å²	121.4	82%	0.818	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-49.7	137.5	164.7	-71.4	-40.5	0	0	0	108.3	G12 A16	G12-D14 VanDerWaalsContact C-N 3.35Å; G12-D14 PolarHBondContact O-N 3.48Å; G12-D14 VanDerWaalsContact O-N 3.15Å; D14-A16 PolarHBondContact O-N 3.15Å; D14-A16 VanDerWaalsContact O-N 3.11Å
15	F	75.5	Confident	68.8	Low	207 Å²	207	119.5 Å²	119.5	91%	0.908	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-49	125.8	174.2	-69.1	-72.4	0	0	0	109	E13 M17	E13-F15 PolarHBondContact O-N 3.01Å; F15-M17 PolarHBondContact O-N 2.64Å
16	A	77.2	Confident	70.3	Confident	82 Å²	82	117.6 Å²	117.6	68%	0.678	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-57.4	129.8	176.9	0	0	0	0	0	109.2	D14 D18	D14-A16 PolarHBondContact O-N 3.15Å; D14-A16 VanDerWaalsContact O-N 3.11Å; A16-D18 PolarHBondContact O-N 2.76Å
17	M	78.7	Confident	72.2	Confident	184 Å²	184	116.6 Å²	116.6	91%	0.906	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-59.6	122.3	174.9	-70.6	-174.9	-167.6	0	0	109.7	F15	F15-M17 PolarHBondContact O-N 2.64Å
18	D	81.3	Confident	73.7	Confident	77 Å²	77	114.9 Å²	114.9	41%	0.412	64%	0.637	S	S	.	*			trans	-121.6	82	177.4	-177.2	12.8	0	0	0	109.4	A16 D20 G21 D22	A16-D18 PolarHBondContact O-N 2.76Å; D18-D20 PolarHBondContact O-N 3.31Å; D18-D20 PolarHBondContact OD1-N 3.24Å; D18-G21 PolarHBondContact O-N 3.47Å; D18-G21 PolarHBondContact OD1-N 3.47Å; D18-G21 VanDerWaalsContact OD1-N 3.08Å; D18-G21 WeakPolarHBondContact OD2-CA 3.2Å; D18-D22 WeakPolarHBondContact O-CB 3.28Å; D18-D22 PolarHBondContact O-N 2.75Å
19	E	82.4	Confident	75.3	Confident	100 Å²	100	112.6 Å²	112.6	47%	0.467	62%	0.624	S	S	.	*	H	α-helix	trans	-57.5	-35.6	180	-66	177.7	-172	0	0	111.9	D23 R159	E19-D23 WeakPolarHBondContact O-CB 3.31Å; E19-D23 PolarHBondContact O-N 3.03Å; E19-R159 IonicContact OE2-CZ 3.9Å; E19-R159 IonicContact OE2-NH1 3.69Å; E19-R159 IonicContact OE2-NH2 2.77Å; E19-R159 PolarHBondContact OE2-NH2 2.77Å
20	D	81.2	Confident	77.1	Confident	96 Å²	96	110 Å²	110	51%	0.513	61%	0.612	S	S	.	*	H	α-helix	trans	-69.8	-43.3	-179.7	-69	-35.9	0	0	0	110.6	D18 S24 S157	D18-D20 PolarHBondContact O-N 3.31Å; D18-D20 PolarHBondContact OD1-N 3.24Å; D20-S24 WeakPolarHBondContact O-CB 3.45Å; D20-S24 PolarHBondContact O-N 2.82Å; D20-S157 PolarHBondContact OD2-OG 2.77Å
21	G	82.7	Confident	78.8	Confident	20 Å²	20	113.1 Å²	113.1	21%	0.206	61%	0.606	C	S	.	*	H	α-helix	trans	-63.5	-44.5	174.3	0	0	0	0	0	113	D18 D23 S24 I25	D18-G21 PolarHBondContact O-N 3.47Å; D18-G21 PolarHBondContact OD1-N 3.47Å; D18-G21 VanDerWaalsContact OD1-N 3.08Å; D18-G21 WeakPolarHBondContact OD2-CA 3.2Å; G21-D23 PolarHBondContact O-N 2.94Å; G21-S24 WeakPolarHBondContact O-CB 3.49Å; G21-S24 PolarHBondContact O-N 3.36Å; G21-I25 WeakPolarHBondContact O-CG1 3.35Å; G21-I25 PolarHBondContact O-N 3.21Å
22	D	84.5	Confident	80.7	Confident	109 Å²	109	112.8 Å²	112.8	58%	0.583	60%	0.598	S	S	*	*	H	α-helix	trans	-61.3	-44.8	177.1	-77.2	-25.1	0	0	0	111.9	D18 S24 I25 H26	D18-D22 WeakPolarHBondContact O-CB 3.28Å; D18-D22 PolarHBondContact O-N 2.75Å; D22-S24 VanDerWaalsContact C-N 3.32Å; D22-S24 PolarHBondContact O-N 2.9Å; D22-I25 PolarHBondContact O-N 3.04Å; D22-H26 WeakPolarHBondContact O-CB 3.41Å; D22-H26 PolarHBondContact O-N 2.96Å
23	D	85.6	Confident	82.4	Confident	93 Å²	93	119.1 Å²	119.1	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-62.8	-38.1	175.4	-87.1	-8.8	0	0	0	112.2	E19 G21 H26 K27	E19-D23 WeakPolarHBondContact O-CB 3.31Å; E19-D23 PolarHBondContact O-N 3.03Å; G21-D23 PolarHBondContact O-N 2.94Å; D23-H26 PolarHBondContact O-N 3.44Å; D23-K27 WeakPolarHBondContact O-CG 3.47Å; D23-K27 PolarHBondContact O-N 3.43Å
24	S	84.3	Confident	83.2	Confident	75 Å²	75	121.3 Å²	121.3	52%	0.524	60%	0.604	S	S	.	*	H	α-helix	trans	-63.9	-47.8	176.4	-172.6	0	0	0	0	111.3	D20 G21 D22 H26 K27 L28	D20-S24 WeakPolarHBondContact O-CB 3.45Å; D20-S24 PolarHBondContact O-N 2.82Å; G21-S24 WeakPolarHBondContact O-CB 3.49Å; G21-S24 PolarHBondContact O-N 3.36Å; D22-S24 VanDerWaalsContact C-N 3.32Å; D22-S24 PolarHBondContact O-N 2.9Å; S24-H26 VanDerWaalsContact C-N 3.29Å; S24-H26 PolarHBondContact O-N 2.8Å; S24-K27 PolarHBondContact O-N 2.92Å; S24-L28 WeakPolarHBondContact O-CB 3.13Å; S24-L28 PolarHBondContact O-N 2.93Å
25	I	85.7	Confident	83.4	Confident	82 Å²	82	120.7 Å²	120.7	42%	0.421	59%	0.59	S	S	.	*	H	α-helix	trans	-61.2	-39.8	175.8	-68	170.6	0	0	0	110.6	G21 D22 L28 K29	G21-I25 WeakPolarHBondContact O-CG1 3.35Å; G21-I25 PolarHBondContact O-N 3.21Å; D22-I25 PolarHBondContact O-N 3.04Å; I25-L28 PolarHBondContact O-N 3.03Å; I25-K29 HydrophobicContact CG2-CD 3.99Å; I25-K29 HydrophobicContact CG2-CG 4.48Å; I25-K29 WeakPolarHBondContact O-CB 3.37Å; I25-K29 WeakPolarHBondContact O-CG 3.38Å; I25-K29 PolarHBondContact O-N 3.32Å
26	H	83.3	Confident	83.6	Confident	107 Å²	107	115.1 Å²	115.1	50%	0.495	57%	0.566	S	S	.	*	H	α-helix	trans	-60.8	-50.3	176.1	-170.2	-87.3	0	0	0	111.5	D22 D23 S24 L28 K29 E30	D22-H26 WeakPolarHBondContact O-CB 3.41Å; D22-H26 PolarHBondContact O-N 2.96Å; D23-H26 PolarHBondContact O-N 3.44Å; S24-H26 VanDerWaalsContact C-N 3.29Å; S24-H26 PolarHBondContact O-N 2.8Å; H26-L28 VanDerWaalsContact C-N 3.32Å; H26-L28 PolarHBondContact O-N 3.26Å; H26-K29 PolarHBondContact O-N 2.89Å; H26-E30 IonicContact CE1-OE1 3.42Å; H26-E30 PolarHBondContact CE1-OE1 2.97Å; H26-E30 IonicContact CE1-OE2 2.78Å; H26-E30 IonicContact ND1-OE1 3.53Å; H26-E30 IonicContact ND1-OE2 3.12Å; H26-E30 WeakPolarHBondContact O-CG 3.5Å; H26-E30 PolarHBondContact O-N 3.43Å
27	K	88.2	Confident	83.7	Confident	121 Å²	121	113.4 Å²	113.4	53%	0.526	56%	0.556	S	S	.	*	H	α-helix	trans	-60.3	-39.7	176.8	-71.6	166.7	-172	159.8	0	112.2	D23 S24 E30 K31	D23-K27 WeakPolarHBondContact O-CG 3.47Å; D23-K27 PolarHBondContact O-N 3.43Å; S24-K27 PolarHBondContact O-N 2.92Å; K27-E30 PolarHBondContact O-N 3.39Å; K27-K31 WeakPolarHBondContact O-CG 3.38Å; K27-K31 PolarHBondContact O-N 2.84Å
28	L	87.6	Confident	83.9	Confident	124 Å²	124	116.9 Å²	116.9	65%	0.649	56%	0.559	S	S	*	*	H	α-helix	trans	-62.1	-45.9	176.4	-176.1	65.9	0	0	0	111	S24 I25 H26 E30 K31 A32	S24-L28 WeakPolarHBondContact O-CB 3.13Å; S24-L28 PolarHBondContact O-N 2.93Å; I25-L28 PolarHBondContact O-N 3.03Å; H26-L28 VanDerWaalsContact C-N 3.32Å; H26-L28 PolarHBondContact O-N 3.26Å; L28-E30 VanDerWaalsContact C-N 3.35Å; L28-E30 PolarHBondContact O-N 3.33Å; L28-K31 PolarHBondContact O-N 2.87Å; L28-A32 PolarHBondContact O-N 2.84Å
29	K	86.2	Confident	83.9	Confident	132 Å²	132	117 Å²	117	57%	0.574	58%	0.578	S	S	*	*	H	α-helix	trans	-64.4	-35.3	176.5	-73.6	172.2	-179.9	170.1	0	112.8	I25 H26 A32	I25-K29 HydrophobicContact CG2-CD 3.99Å; I25-K29 HydrophobicContact CG2-CG 4.48Å; I25-K29 WeakPolarHBondContact O-CB 3.37Å; I25-K29 WeakPolarHBondContact O-CG 3.38Å; I25-K29 PolarHBondContact O-N 3.32Å; H26-K29 PolarHBondContact O-N 2.89Å; K29-A32 WeakPolarHBondContact O-CB 3.46Å; K29-A32 PolarHBondContact O-N 3.23Å
30	E	85.8	Confident	83.5	Confident	129 Å²	129	117.6 Å²	117.6	60%	0.603	58%	0.58	S	S	*	*	H	α-helix	trans	-69.7	-36	175.6	-75.1	-172.3	144.6	0	0	112.9	H26 K27 L28 A32	H26-E30 IonicContact CE1-OE1 3.42Å; H26-E30 PolarHBondContact CE1-OE1 2.97Å; H26-E30 IonicContact CE1-OE2 2.78Å; H26-E30 IonicContact ND1-OE1 3.53Å; H26-E30 IonicContact ND1-OE2 3.12Å; H26-E30 WeakPolarHBondContact O-CG 3.5Å; H26-E30 PolarHBondContact O-N 3.43Å; K27-E30 PolarHBondContact O-N 3.39Å; L28-E30 VanDerWaalsContact C-N 3.35Å; L28-E30 PolarHBondContact O-N 3.33Å; E30-A32 PolarHBondContact O-N 3.44Å
31	K	89.6	Confident	82.6	Confident	171 Å²	171	115.6 Å²	115.6	74%	0.743	58%	0.582	S	S	*	*	H	α-helix	trans	-69.4	-16.3	176.7	-74.7	177.7	-179.9	179	0	113.5	K27 L28 K33	K27-K31 WeakPolarHBondContact O-CG 3.38Å; K27-K31 PolarHBondContact O-N 2.84Å; L28-K31 PolarHBondContact O-N 2.87Å; K31-K33 PolarHBondContact O-N 3.38Å; K31-K33 VanDerWaalsContact O-N 3.1Å
32	A	86.1	Confident	80.9	Confident	47 Å²	47	120.5 Å²	120.5	39%	0.388	61%	0.613	S	S	.	*			trans	-68.6	105.5	-178.6	0	0	0	0	0	112.1	L28 K29 E30 R34	L28-A32 PolarHBondContact O-N 2.84Å; K29-A32 WeakPolarHBondContact O-CB 3.46Å; K29-A32 PolarHBondContact O-N 3.23Å; E30-A32 PolarHBondContact O-N 3.44Å; A32-R34 VanDerWaalsContact C-N 3.28Å; A32-R34 PolarHBondContact O-N 3.32Å
33	K	83.4	Confident	79.2	Confident	210 Å²	210	123.7 Å²	123.7	91%	0.913	62%	0.624	S	S	*	*	S	Bend	trans	-70.6	-19.2	179	-65.2	-178	-179.1	177	0	114.4	K31	K31-K33 PolarHBondContact O-N 3.38Å; K31-K33 VanDerWaalsContact O-N 3.1Å
34	R	83.4	Confident	77.5	Confident	228 Å²	228	127.9 Å²	127.9	86%	0.86	64%	0.641	S	S	*	*			trans	-123.8	124	-178.9	-69.3	-175.7	174.4	166.8	-0.7	109	A32	A32-R34 VanDerWaalsContact C-N 3.28Å; A32-R34 PolarHBondContact O-N 3.32Å
35	R	78.5	Confident	75.5	Confident	140 Å²	140	127.2 Å²	127.2	53%	0.528	65%	0.645	S	S	.	*			trans	-128.9	130.3	178.5	-59	173.6	79.3	144.3	-3.2	107.4	F40	R35-F40 HydrophobicContact CB-CD1 4.38Å; R35-F40 HydrophobicContact CB-CD2 4.21Å; R35-F40 HydrophobicContact CB-CE1 4.35Å; R35-F40 HydrophobicContact CB-CE2 4.18Å; R35-F40 HydrophobicContact CB-CG 4.31Å; R35-F40 HydrophobicContact CB-CZ 4.25Å; R35-F40 HydrophobicContact CG-CE1 4.42Å; R35-F40 HydrophobicContact CG-CZ 4.49Å
36	K	80.7	Confident	73.9	Confident	91 Å²	91	127.2 Å²	127.2	40%	0.396	66%	0.658	S	S	.	*			trans	-149.1	140.4	173.9	173.4	171.1	-168.6	159.6	0	109.8	F40 A46 R47	K36-F40 WeakPolarHBondContact O-CE2 3.45Å; K36-A46 VanDerWaalsContact CD-N 3.33Å; K36-A46 WeakPolarHBondContact CD-O 3.35Å; K36-R47 HydrophobicContact CD-CG 4.34Å
37	G	78.8	Confident	72.3	Confident	45 Å²	45	133.5 Å²	133.5	46%	0.464	68%	0.677	S	S	.	*	S	Bend	trans	138.3	162.1	170.3	0	0	0	0	0	111.1	G39 F40	G37-G39 PolarHBondContact O-N 3.36Å; G37-G39 VanDerWaalsContact O-N 3.15Å; G37-F40 PolarHBondContact O-N 2.82Å
38	R	82.5	Confident	70.7	Confident	257 Å²	257	132.2 Å²	132.2	97%	0.97	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-63.6	-18.2	179.5	-68	-179.9	174.7	179.7	-2.7	113.2	F40	R38-F40 VanDerWaalsContact C-N 3.25Å; R38-F40 PolarHBondContact O-N 2.89Å
39	G	81.6	Confident	68.9	Low	80 Å²	80	138.3 Å²	138.3	83%	0.825	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-73.4	-6.2	177.5	0	0	0	0	0	115.5	G37	G37-G39 PolarHBondContact O-N 3.36Å; G37-G39 VanDerWaalsContact O-N 3.15Å
40	F	74.5	Confident	67.3	Low	112 Å²	112	138.1 Å²	138.1	49%	0.491	71%	0.708	S	S	.	*	G	3₁₀ helix	trans	-100.5	3.4	-178.2	-67.4	-67.5	0	0	0	114.8	R35 K36 G37 R38	R35-F40 HydrophobicContact CB-CD1 4.38Å; R35-F40 HydrophobicContact CB-CD2 4.21Å; R35-F40 HydrophobicContact CB-CE1 4.35Å; R35-F40 HydrophobicContact CB-CE2 4.18Å; R35-F40 HydrophobicContact CB-CG 4.31Å; R35-F40 HydrophobicContact CB-CZ 4.25Å; R35-F40 HydrophobicContact CG-CE1 4.42Å; R35-F40 HydrophobicContact CG-CZ 4.49Å; K36-F40 WeakPolarHBondContact O-CE2 3.45Å; G37-F40 PolarHBondContact O-N 2.82Å; R38-F40 VanDerWaalsContact C-N 3.25Å; R38-F40 PolarHBondContact O-N 2.89Å
41	G	61.9	Low	65.6	Low	54 Å²	54	143 Å²	143	56%	0.557	72%	0.721	S	S	*	*			trans	68	158.2	-166.2	0	0	0	0	0	110.8	E43	G41-E43 PolarHBondContact O-N 3.09Å
42	S	46.3	Very low	64.2	Low	123 Å²	123	140.4 Å²	140.4	86%	0.86	71%	0.711	S	S	*	*	S	Bend	trans	-67.1	101.1	-167.7	51.4	0	0	0	0	113.6
43	E	50.2	Low	63.1	Low	177 Å²	177	145.4 Å²	145.4	83%	0.827	73%	0.731	S	S	*	*			trans	-161.2	104.9	148.9	-110.7	172.3	160.1	0	0	110.5	G41	G41-E43 PolarHBondContact O-N 3.09Å
44	E	48.8	Very low	62.2	Low	181 Å²	181	139.1 Å²	139.1	85%	0.846	70%	0.702	S	S	*	*			trans	58.7	140.8	152.5	-58.8	-167.7	144.6	0	0	123.2
45	G	41.7	Very low	61.2	Low	60 Å²	60	136.3 Å²	136.3	62%	0.619	70%	0.704	S	S	*	*			trans	-86.5	156.6	-171.3	0	0	0	0	0	115.5
46	A	53.4	Low	60.5	Low	83 Å²	83	135 Å²	135	69%	0.686	71%	0.712	S	S	*	*				-162.3	131.4	110.1	0	0	0	0	0	111.7	K36	K36-A46 VanDerWaalsContact CD-N 3.33Å; K36-A46 WeakPolarHBondContact CD-O 3.35Å
47	R	48.5	Very low	59.4	Low	238 Å²	238	136.6 Å²	136.6	90%	0.898	73%	0.729	S	S	*	*			trans	-85.9	121.1	-176.8	-93.4	176.6	156.8	174.4	-7.4	106.7	K36	K36-R47 HydrophobicContact CD-CG 4.34Å
48	S	56.1	Low	58.3	Low	94 Å²	94	142.9 Å²	142.9	66%	0.657	75%	0.746	S	S	*	*			trans	-116.3	142.3	160.3	75.4	0	0	0	0	109.7	V50	S48-V50 PolarHBondContact O-N 3.36Å
49	R	48.8	Very low	56.8	Low	253 Å²	253	137.4 Å²	137.4	96%	0.955	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-65.8	126.5	172.4	-66.1	173.7	-173	159	1.4	107.9
50	V	52.2	Low	55.1	Low	128 Å²	128	140.5 Å²	140.5	78%	0.776	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-95.1	128.9	177.6	177.8	0	0	0	0	107.4	S48	S48-V50 PolarHBondContact O-N 3.36Å
51	R	51.8	Low	54.1	Low	232 Å²	232	139 Å²	139	88%	0.875	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-64.7	136.3	170.5	179.5	177	174.5	173.4	-2.2	107.5	D53	R51-D53 VanDerWaalsContact C-N 3.31Å; R51-D53 PolarHBondContact O-N 2.65Å
52	E	58.2	Low	53.9	Low	115 Å²	115	142.8 Å²	142.8	54%	0.537	75%	0.753	S	S	.	*			trans	-72	92	-177.6	-62.8	-177.9	154.2	0	0	108.7	K114	E52-K114 WeakPolarHBondContact OE1-CE 3.42Å; E52-K114 IonicContact OE1-NZ 3.75Å; E52-K114 PolarHBondContact OE1-NZ 3.37Å; E52-K114 WeakPolarHBondContact OE2-CE 3.43Å; E52-K114 IonicContact OE2-NZ 2.85Å; E52-K114 PolarHBondContact OE2-NZ 3.37Å
53	D	65	Low	54.5	Low	153 Å²	153	143.2 Å²	143.2	82%	0.818	74%	0.742	S	S	*	*			trans	-90.6	123.3	168.7	-157.6	30.9	0	0	0	106	R51	R51-D53 VanDerWaalsContact C-N 3.31Å; R51-D53 PolarHBondContact O-N 2.65Å
54	Y	63	Low	55.5	Low	78 Å²	78	137 Å²	137	31%	0.306	72%	0.717	S	S	.	*			trans	-80	129.8	172.4	-65	-83.4	0	0	0	107	T56 F76 K114 Y116	Y54-T56 PolarHBondContact O-N 2.57Å; Y54-F76 HydrophobicContact CD1-CZ 4.09Å; Y54-F76 HydrophobicContact CE1-CZ 4.44Å; Y54-K114 PolarHBondContact OH-O 2.8Å; Y54-K114 VanDerWaalsContact OH-O 3.09Å; Y54-Y116 AromaticContact CE1-CD1 3.79Å; Y54-Y116 HydrophobicContact CE1-CD1 3.79Å; Y54-Y116 HydrophobicContact CE1-CE1 4.25Å; Y54-Y116 HydrophobicContact CE1-CG 4.46Å; Y54-Y116 AromaticContact CZ-CD1 3.86Å; Y54-Y116 VanDerWaalsContact OH-CD1 3.31Å; Y54-Y116 WeakPolarHBondContact OH-CD1 3.48Å
55	D	63.5	Low	57.3	Low	168 Å²	168	129.9 Å²	129.9	90%	0.898	69%	0.693	S	S	*	*			trans	-68.8	97.9	175.6	-128.1	-23.2	0	0	0	107.6
56	T	63.3	Low	59.7	Low	113 Å²	113	128 Å²	128	69%	0.693	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-84.8	127.7	169.7	-54.8	0	0	0	0	107.7	Y54 E58	Y54-T56 PolarHBondContact O-N 2.57Å; T56-E58 PolarHBondContact O-N 2.77Å
57	V	58.4	Low	61.7	Low	125 Å²	125	128.2 Å²	128.2	76%	0.758	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-65.7	119.1	174.3	-177.7	0	0	0	0	108.2	Q59	V57-Q59 PolarHBondContact O-N 2.82Å
58	E	54.9	Low	63.9	Low	176 Å²	176	121.8 Å²	121.8	82%	0.822	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-60	128.5	176.2	-67.8	-168.5	139.8	0	0	110.2	T56 D60	T56-E58 PolarHBondContact O-N 2.77Å; E58-D60 PolarHBondContact O-N 3.06Å
59	Q	50.8	Low	65.8	Low	142 Å²	142	118.7 Å²	118.7	66%	0.664	61%	0.61	S	S	*	*			trans	-80.2	77.6	-171.1	-161.7	-178.2	47.1	0	0	111.1	V57 G61 E63	V57-Q59 PolarHBondContact O-N 2.82Å; Q59-G61 PolarHBondContact O-N 3.35Å; Q59-E63 HydrophobicContact CG-CG 3.73Å; Q59-E63 PolarHBondContact NE2-OE1 3.29Å; Q59-E63 PolarHBondContact NE2-OE2 2.96Å
60	D	47	Very low	68	Low	145 Å²	145	113 Å²	113	78%	0.775	60%	0.603	S	S	*	*			trans	-85.4	93.3	171.9	-85.2	-45.5	0	0	0	111.4	E58 D62	E58-D60 PolarHBondContact O-N 3.06Å; D60-D62 VanDerWaalsContact C-N 3.27Å; D60-D62 PolarHBondContact O-N 2.77Å
61	G	51.9	Low	69.9	Low	82 Å²	82	113.3 Å²	113.3	85%	0.845	60%	0.596	S	S	*	*	S	Bend	trans	58.8	-9.5	143.3	0	0	0	0	0	122.6	Q59	Q59-G61 PolarHBondContact O-N 3.35Å
62	D	58.3	Low	72.1	Confident	132 Å²	132	102.2 Å²	102.2	71%	0.706	56%	0.555	S	S	*	*	S	Bend	trans	-149.9	69	177	-132.5	-71.6	0	0	0	106.6	D60 P64	D60-D62 VanDerWaalsContact C-N 3.27Å; D60-D62 PolarHBondContact O-N 2.77Å; D62-P64 WeakPolarHBondContact O-CD 3.07Å; D62-P64 VanDerWaalsContact O-N 3.12Å
63	E	59.3	Low	73.9	Confident	132 Å²	132	98.6 Å²	98.6	62%	0.617	54%	0.536	S	S	*	.			trans	-56.4	120.8	-173.4	-90.7	-175.7	118.3	0	0	110.3	Q59 G65	Q59-E63 HydrophobicContact CG-CG 3.73Å; Q59-E63 PolarHBondContact NE2-OE1 3.29Å; Q59-E63 PolarHBondContact NE2-OE2 2.96Å; E63-G65 PolarHBondContact O-N 3.47Å
64	P	71.7	Confident	75.5	Confident	46 Å²	46	92.6 Å²	92.6	30%	0.299	50%	0.504	S	S	.	.			trans	-60	114.8	168.9	21.2	-26.7	0	0	0	107.5	D62 V151 R152	D62-P64 WeakPolarHBondContact O-CD 3.07Å; D62-P64 VanDerWaalsContact O-N 3.12Å; P64-V151 HydrophobicContact CB-CB 4.31Å; P64-V151 HydrophobicContact CG-CB 3.99Å; P64-V151 HydrophobicContact CG-CG2 4Å; P64-R152 HydrophobicContact CB-CB 3.94Å; P64-R152 WeakPolarHBondContact CB-O 3.47Å; P64-R152 WeakPolarHBondContact CG-O 3.37Å
65	G	85	Confident	77.2	Confident	33 Å²	33	88.9 Å²	88.9	34%	0.34	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-53.3	158.9	179.3	0	0	0	0	0	111.5	E63 R152	E63-G65 PolarHBondContact O-N 3.47Å; G65-R152 WeakPolarHBondContact O-CB 3.5Å; G65-R152 WeakPolarHBondContact O-CD 3.26Å; G65-R152 WeakPolarHBondContact O-CG 3.33Å; G65-R152 PolarHBondContact O-N 3.33Å
66	P	93.9	Very high	78.9	Confident	21 Å²	21	83.5 Å²	83.5	14%	0.136	46%	0.458	C	S	.	.	B	Isolated β-bridge	trans	-59.9	147.6	-172.6	22.9	-33	0	0	0	112.8	W73 Y124 W148	P66-W73 HydrophobicContact CB-CE3 4.29Å; P66-W73 HydrophobicContact CB-CZ3 3.88Å; P66-W73 HydrophobicContact CG-CZ3 4.03Å; P66-Y124 HydrophobicContact CG-CD2 4.44Å; P66-Y124 HydrophobicContact CG-CE2 3.59Å; P66-W148 HydrophobicContact CB-CB 4.19Å; P66-W148 HydrophobicContact CB-CD2 3.33Å; P66-W148 HydrophobicContact CB-CE3 3.71Å; P66-W148 HydrophobicContact CB-CG 3.54Å; P66-W148 HydrophobicContact CB-CH2 4.49Å; P66-W148 HydrophobicContact CB-CZ2 4.19Å; P66-W148 HydrophobicContact CB-CZ3 4.27Å; P66-W148 HydrophobicContact CG-CD2 3.9Å; P66-W148 HydrophobicContact CG-CE3 4.39Å; P66-W148 HydrophobicContact CG-CG 4.31Å; P66-W148 HydrophobicContact CG-CH2 4.35Å; P66-W148 HydrophobicContact CG-CZ2 3.84Å
67	Q	94.6	Very high	80.5	Confident	86 Å²	86	78.1 Å²	78.1	40%	0.402	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-103.9	122.8	178.4	178	57.9	62.8	0	0	109.4	F150 R152	Q67-F150 HydrophobicContact CB-CB 3.99Å; Q67-F150 HydrophobicContact CG-CB 4.44Å; Q67-F150 PolarHBondContact N-O 3.32Å; Q67-R152 HydrophobicContact CB-CG 4.44Å
68	R	94.9	Very high	82.4	Confident	103 Å²	103	73.5 Å²	73.5	39%	0.389	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-69.1	136.9	172.3	-165.3	-174.9	175.4	-85.8	3.7	109.5	V70 E71 G72 W73	R68-V70 PolarHBondContact NH1-O 2.96Å; R68-E71 PolarHBondContact NH2-O 3.43Å; R68-G72 WeakPolarHBondContact CG-O 3.24Å; R68-W73 HydrophobicContact CB-CD2 4.1Å; R68-W73 HydrophobicContact CB-CE3 4.2Å; R68-W73 HydrophobicContact CB-CH2 3.92Å; R68-W73 HydrophobicContact CB-CZ2 3.79Å; R68-W73 HydrophobicContact CB-CZ3 4.11Å; R68-W73 HydrophobicContact CG-CD2 3.98Å; R68-W73 HydrophobicContact CG-CG 4.3Å; R68-W73 HydrophobicContact CG-CZ2 4Å
69	S	95.5	Very high	84.3	Confident	29 Å²	29	66.1 Å²	66.1	20%	0.203	37%	0.368	C	S	.	.			trans	-77.6	-177.5	168.7	-68	0	0	0	0	111	E71 G72 I74 F150	S69-E71 VanDerWaalsContact C-N 3.34Å; S69-E71 PolarHBondContact O-N 2.9Å; S69-G72 WeakPolarHBondContact CA-O 3.36Å; S69-G72 WeakPolarHBondContact CB-O 3.06Å; S69-G72 PolarHBondContact N-O 3.28Å; S69-I74 WeakPolarHBondContact OG-CD1 3.19Å; S69-F150 WeakPolarHBondContact OG-CD2 3.5Å
70	V	94.4	Very high	86.5	Confident	134 Å²	134	59.5 Å²	59.5	81%	0.812	34%	0.337	S	S	*	.	S	Bend	trans	-59.2	-46.4	-178	-179.1	0	0	0	0	110.9	R68	R68-V70 PolarHBondContact NH1-O 2.96Å
71	E	93.6	Very high	88.9	Confident	134 Å²	134	54.6 Å²	54.6	63%	0.626	31%	0.309	S	S	*	.	S	Bend	trans	-109.3	-19.1	-172.2	-60.4	-169.8	145	0	0	113.7	R68 S69	R68-E71 PolarHBondContact NH2-O 3.43Å; S69-E71 VanDerWaalsContact C-N 3.34Å; S69-E71 PolarHBondContact O-N 2.9Å
72	G	96.2	Very high	91	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.	S	Bend	trans	-165.6	-157.1	-179.6	0	0	0	0	0	115.2	R68 S69 E120 Y121	R68-G72 WeakPolarHBondContact CG-O 3.24Å; S69-G72 WeakPolarHBondContact CA-O 3.36Å; S69-G72 WeakPolarHBondContact CB-O 3.06Å; S69-G72 PolarHBondContact N-O 3.28Å; G72-E120 VanDerWaalsContact CA-OE1 3.32Å; G72-E120 WeakPolarHBondContact CA-OE1 3.46Å; G72-E120 PolarHBondContact N-OE1 2.96Å; G72-Y121 CarbonylContact C-O 3.46Å; G72-Y121 WeakPolarHBondContact CA-O 3.43Å
73	W	97.9	Very high	92.8	Very high	39 Å²	39	54.7 Å²	54.7	15%	0.148	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	118.1	177.1	-64	84.1	0	0	0	108.5	P66 R68 E120 Y121 Y124 A127 W148	P66-W73 HydrophobicContact CB-CE3 4.29Å; P66-W73 HydrophobicContact CB-CZ3 3.88Å; P66-W73 HydrophobicContact CG-CZ3 4.03Å; R68-W73 HydrophobicContact CB-CD2 4.1Å; R68-W73 HydrophobicContact CB-CE3 4.2Å; R68-W73 HydrophobicContact CB-CH2 3.92Å; R68-W73 HydrophobicContact CB-CZ2 3.79Å; R68-W73 HydrophobicContact CB-CZ3 4.11Å; R68-W73 HydrophobicContact CG-CD2 3.98Å; R68-W73 HydrophobicContact CG-CG 4.3Å; R68-W73 HydrophobicContact CG-CZ2 4Å; W73-E120 WeakPolarHBondContact O-CA 3.23Å; W73-Y121 PolarHBondContact N-O 3.19Å; W73-Y121 PolarHBondContact O-N 3.22Å; W73-Y124 AromaticContact CD2-CD2 3.99Å; W73-Y124 HydrophobicContact CD2-CD2 3.99Å; W73-Y124 AromaticContact CE3-CD2 3.8Å; W73-Y124 HydrophobicContact CE3-CD2 3.8Å; W73-Y124 AromaticContact CH2-CD2 3.67Å; W73-Y124 HydrophobicContact CH2-CD2 3.67Å; W73-Y124 HydrophobicContact CH2-CE2 4.42Å; W73-Y124 HydrophobicContact CH2-CG 4.44Å; W73-Y124 AromaticContact CZ2-CD2 3.87Å; W73-Y124 HydrophobicContact CZ2-CD2 3.87Å; W73-Y124 HydrophobicContact CZ2-CG 4.25Å; W73-Y124 AromaticContact CZ3-CD2 3.65Å; W73-Y124 HydrophobicContact CZ3-CD2 3.65Å; W73-Y124 HydrophobicContact CZ3-CE2 4.2Å; W73-A127 HydrophobicContact CB-CB 3.76Å; W73-W148 HydrophobicContact CB-CZ3 4.27Å; W73-W148 HydrophobicContact CE3-CE3 4.48Å; W73-W148 AromaticContact CE3-CZ3 4Å; W73-W148 HydrophobicContact CE3-CZ3 4Å
74	I	98.2	Very high	94.6	Very high	27 Å²	27	48.7 Å²	48.7	14%	0.138	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	130.3	-175.8	-63.5	-177.5	0	0	0	109.1	S69 L118 V119 E120 G149 F150	S69-I74 WeakPolarHBondContact OG-CD1 3.19Å; I74-L118 HydrophobicContact CG2-CB 4.14Å; I74-L118 HydrophobicContact CG2-CD2 3.92Å; I74-V119 CarbonylContact C-O 3.59Å; I74-V119 WeakPolarHBondContact CA-O 3.47Å; I74-E120 HydrophobicContact CG1-CB 4Å; I74-E120 HydrophobicContact CG1-CG 3.86Å; I74-G149 WeakPolarHBondContact O-CA 3.31Å; I74-G149 PolarHBondContact O-N 3.17Å; I74-F150 HydrophobicContact CB-CD2 4.23Å; I74-F150 HydrophobicContact CB-CE2 4.06Å; I74-F150 HydrophobicContact CD1-CE2 3.83Å; I74-F150 HydrophobicContact CG1-CE2 4.4Å; I74-F150 HydrophobicContact CG2-CE2 4.21Å
75	L	98.3	Very high	95.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	139.9	167.1	-61.1	-179.4	0	0	0	109.7	F93 L118 V119 Y121 A127 A130 M131 V146 D147 W148	L75-F93 HydrophobicContact CD1-CE1 4.28Å; L75-L118 WeakPolarHBondContact O-CA 3.35Å; L75-V119 PolarHBondContact N-O 3.45Å; L75-V119 PolarHBondContact O-N 3.35Å; L75-Y121 HydrophobicContact CD1-CD2 4.3Å; L75-Y121 HydrophobicContact CD1-CE2 3.96Å; L75-A127 HydrophobicContact CD1-CB 4.46Å; L75-A127 WeakPolarHBondContact CD1-O 3.34Å; L75-A127 HydrophobicContact CD2-CB 4.16Å; L75-A127 HydrophobicContact CG-CB 4.25Å; L75-A130 HydrophobicContact CD1-CB 3.86Å; L75-M131 HydrophobicContact CD2-CB 4.32Å; L75-M131 HydrophobicContact CD2-CE 3.49Å; L75-M131 VanDerWaalsContact CD2-CE 3.49Å; L75-V146 HydrophobicContact CB-CG1 4.17Å; L75-V146 HydrophobicContact CD1-CG1 3.9Å; L75-V146 HydrophobicContact CG-CG1 4.44Å; L75-D147 CarbonylContact C-O 3.45Å; L75-D147 VanDerWaalsContact CA-O 3.31Å; L75-D147 WeakPolarHBondContact CA-O 3.47Å; L75-W148 HydrophobicContact CD2-CD2 4.45Å; L75-W148 HydrophobicContact CD2-CE3 3.84Å; L75-W148 HydrophobicContact CD2-CZ3 4.02Å
76	F	98.1	Very high	96.3	Very high	54 Å²	54	53.6 Å²	53.6	24%	0.237	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116.6	170.6	-176.1	-120.5	0	0	0	108.9	Y54 T78 Y116 L118 D147	Y54-F76 HydrophobicContact CD1-CZ 4.09Å; Y54-F76 HydrophobicContact CE1-CZ 4.44Å; F76-T78 HydrophobicContact CD1-CG2 3.65Å; F76-T78 HydrophobicContact CE1-CG2 3.16Å; F76-T78 HydrophobicContact CE2-CG2 4.46Å; F76-T78 HydrophobicContact CG-CG2 4.48Å; F76-T78 HydrophobicContact CZ-CG2 3.64Å; F76-Y116 HydrophobicContact CD2-CD2 4.45Å; F76-Y116 AromaticContact CE2-CD2 3.68Å; F76-Y116 HydrophobicContact CE2-CD2 3.68Å; F76-Y116 HydrophobicContact CE2-CE2 4.44Å; F76-Y116 AromaticContact CE2-CG 3.93Å; F76-Y116 HydrophobicContact CE2-CG 3.93Å; F76-Y116 HydrophobicContact CZ-CG 4.36Å; F76-L118 HydrophobicContact CB-CD2 4.42Å; F76-L118 HydrophobicContact CD2-CD2 3.66Å; F76-L118 HydrophobicContact CE2-CD2 4.48Å; F76-D147 PolarHBondContact N-O 3.39Å; F76-D147 PolarHBondContact O-N 3.11Å
77	V	97.7	Very high	96.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.1	-177.9	-173.5	0	0	0	0	107.9	V80 F93 Y116 A117 V119 I144 S145 V146	V77-V80 HydrophobicContact CG1-CG2 3.91Å; V77-F93 HydrophobicContact CB-CZ 4.42Å; V77-F93 HydrophobicContact CG1-CZ 4.12Å; V77-F93 HydrophobicContact CG2-CE1 3.88Å; V77-F93 HydrophobicContact CG2-CE2 4.26Å; V77-F93 HydrophobicContact CG2-CZ 3.42Å; V77-F93 VanDerWaalsContact CG2-CZ 3.42Å; V77-Y116 CarbonylContact O-C 3.59Å; V77-Y116 WeakPolarHBondContact O-CA 3.24Å; V77-Y116 VanDerWaalsContact O-CB 3.24Å; V77-Y116 WeakPolarHBondContact O-CB 2.94Å; V77-A117 HydrophobicContact CB-CB 4.24Å; V77-A117 PolarHBondContact N-O 3.47Å; V77-A117 PolarHBondContact O-N 2.81Å; V77-V119 HydrophobicContact CG2-CG2 4.14Å; V77-I144 HydrophobicContact CG1-CB 4.23Å; V77-I144 HydrophobicContact CG1-CD1 4.25Å; V77-S145 CarbonylContact C-O 3.54Å; V77-S145 WeakPolarHBondContact CA-O 3.39Å; V77-V146 HydrophobicContact CG1-CG2 4.3Å; V77-V146 HydrophobicContact CG2-CG1 4.4Å; V77-V146 HydrophobicContact CG2-CG2 4.41Å
78	T	97.5	Very high	96.5	Very high	29 Å²	29	58 Å²	58	18%	0.178	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	162	176.8	64.7	0	0	0	0	111.2	F76 V80 I144 S145	F76-T78 HydrophobicContact CD1-CG2 3.65Å; F76-T78 HydrophobicContact CE1-CG2 3.16Å; F76-T78 HydrophobicContact CE2-CG2 4.46Å; F76-T78 HydrophobicContact CG-CG2 4.48Å; F76-T78 HydrophobicContact CZ-CG2 3.64Å; T78-V80 VanDerWaalsContact C-N 3.33Å; T78-I144 CarbonylContact O-C 3.57Å; T78-I144 VanDerWaalsContact O-CA 3.31Å; T78-I144 WeakPolarHBondContact O-CA 3.47Å; T78-S145 PolarHBondContact N-O 3.25Å; T78-S145 PolarHBondContact O-N 3.19Å; T78-S145 WeakPolarHBondContact OG1-CB 3.17Å
79	G	95.7	Very high	96.6	Very high	20 Å²	20	53.1 Å²	53.1	21%	0.206	27%	0.273	C	S	.	.			trans	78.1	19.6	-177.2	0	0	0	0	0	113.3	H81 G115 Q142	G79-H81 PolarHBondContact O-N 2.59Å; G79-G115 PolarHBondContact N-O 2.97Å; G79-Q142 PolarHBondContact O-NE2 3Å
80	V	96.9	Very high	96.7	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.018	28%	0.282	C	S	.	.			trans	-64.9	132.6	174.6	-179.3	0	0	0	0	109.4	V77 T78 A84 I89 L104 L113 G115 A117 M139	V77-V80 HydrophobicContact CG1-CG2 3.91Å; T78-V80 VanDerWaalsContact C-N 3.33Å; V80-A84 HydrophobicContact CG1-CB 3.89Å; V80-I89 HydrophobicContact CG1-CD1 3.86Å; V80-I89 HydrophobicContact CG2-CD1 4.25Å; V80-L104 HydrophobicContact CG1-CD1 4.3Å; V80-L113 HydrophobicContact CG1-CD1 3.68Å; V80-G115 PolarHBondContact N-O 2.78Å; V80-G115 VanDerWaalsContact N-O 3.14Å; V80-G115 WeakPolarHBondContact O-CA 3.44Å; V80-A117 HydrophobicContact CG2-CB 4.39Å; V80-M139 HydrophobicContact CG1-SD 4.45Å
81	H	97	Very high	96.7	Very high	42 Å²	42	54.3 Å²	54.3	19%	0.194	27%	0.27	C	S	.	.			trans	-60.8	141	179.8	-173.5	-88.3	0	0	0	111.3	G79 E83 A84 L113 M140	G79-H81 PolarHBondContact O-N 2.59Å; H81-E83 PolarHBondContact ND1-N 2.94Å; H81-E83 VanDerWaalsContact ND1-N 3.19Å; H81-E83 PolarHBondContact O-N 3.14Å; H81-E83 VanDerWaalsContact O-N 3.15Å; H81-A84 HydrophobicContact CB-CB 4.29Å; H81-A84 WeakPolarHBondContact O-CB 3.46Å; H81-A84 PolarHBondContact O-N 2.89Å; H81-L113 WeakPolarHBondContact O-CD1 3.45Å; H81-M140 HydrophobicContact CB-CB 3.86Å; H81-M140 HydrophobicContact CB-CG 4.37Å; H81-M140 HydrophobicContact CB-SD 3.95Å
82	E	96.2	Very high	96.8	Very high	108 Å²	108	50.1 Å²	50.1	51%	0.505	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23	-170.7	73.1	-177.3	164.1	0	0	114.3	Y112 L113	E82-Y112 HydrophobicContact CG-CD1 4.45Å; E82-Y112 HydrophobicContact CG-CG 4.43Å; E82-Y112 WeakPolarHBondContact O-CB 3.45Å; E82-L113 PolarHBondContact O-N 3.39Å
83	E	96	Very high	96.9	Very high	108 Å²	108	50.1 Å²	50.1	51%	0.505	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	5.7	175.9	-53.4	-167.4	150.5	0	0	114	H81 Y112 M140	H81-E83 PolarHBondContact ND1-N 2.94Å; H81-E83 VanDerWaalsContact ND1-N 3.19Å; H81-E83 PolarHBondContact O-N 3.14Å; H81-E83 VanDerWaalsContact O-N 3.15Å; E83-Y112 HydrophobicContact CG-CD1 4.13Å; E83-Y112 HydrophobicContact CG-CE1 3.9Å; E83-M140 HydrophobicContact CB-CE 4.48Å
84	A	96.7	Very high	96.9	Very high	6 Å²	6	50.2 Å²	50.2	5%	0.05	26%	0.259	C	S	.	.			trans	-64.2	157	174.4	0	0	0	0	0	110.8	V80 H81 L113 M140	V80-A84 HydrophobicContact CG1-CB 3.89Å; H81-A84 HydrophobicContact CB-CB 4.29Å; H81-A84 WeakPolarHBondContact O-CB 3.46Å; H81-A84 PolarHBondContact O-N 2.89Å; A84-L113 HydrophobicContact CB-CD1 3.85Å; A84-L113 WeakPolarHBondContact O-CD1 3.43Å; A84-L113 WeakPolarHBondContact O-CG 3.33Å; A84-M140 HydrophobicContact CB-SD 3.78Å
85	T	96.5	Very high	96.8	Very high	65 Å²	65	56.9 Å²	56.9	40%	0.399	29%	0.289	S	S	.	.			trans	-113.7	167.6	178.6	68.3	0	0	0	0	111	E87 D88 I89 L104	T85-E87 PolarHBondContact O-N 3.1Å; T85-E87 PolarHBondContact OG1-N 3.06Å; T85-D88 WeakPolarHBondContact CA-OD2 3.44Å; T85-D88 WeakPolarHBondContact CB-OD2 3.41Å; T85-D88 PolarHBondContact N-OD2 3.41Å; T85-D88 PolarHBondContact O-N 3.31Å; T85-D88 PolarHBondContact OG1-N 3.46Å; T85-D88 PolarHBondContact OG1-OD2 3.31Å; T85-I89 PolarHBondContact O-N 2.97Å; T85-L104 VanDerWaalsContact C-CD2 3.49Å
86	E	96	Very high	96.8	Very high	118 Å²	118	59.1 Å²	59.1	55%	0.551	30%	0.299	S	S	*	.	H	α-helix	trans	-60.6	-33.5	172.9	-174.4	172	159.5	0	0	111.8	I89 H90 L102 L104	E86-I89 PolarHBondContact O-N 2.88Å; E86-H90 VanDerWaalsContact O-CB 3.23Å; E86-H90 WeakPolarHBondContact O-CB 3.2Å; E86-H90 PolarHBondContact O-N 3.26Å; E86-L102 HydrophobicContact CG-CD1 4.01Å; E86-L102 HydrophobicContact CG-CD2 3.84Å; E86-L102 HydrophobicContact CG-CG 4.46Å; E86-L104 HydrophobicContact CB-CD2 4.17Å
87	E	96.6	Very high	96.7	Very high	137 Å²	137	57.5 Å²	57.5	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-61.9	-44.7	174.8	-172.3	175.5	176.4	0	0	111.3	T85 I89 H90 D91	T85-E87 PolarHBondContact O-N 3.1Å; T85-E87 PolarHBondContact OG1-N 3.06Å; E87-I89 VanDerWaalsContact C-N 3.32Å; E87-I89 PolarHBondContact O-N 2.93Å; E87-H90 PolarHBondContact O-N 3.15Å; E87-D91 WeakPolarHBondContact O-CB 3.43Å; E87-D91 PolarHBondContact O-N 3.35Å
88	D	96.2	Very high	96.7	Very high	62 Å²	62	63.3 Å²	63.3	33%	0.332	33%	0.325	S	S	.	.	H	α-helix	trans	-61.8	-39.1	178.4	-60.5	-67.3	0	0	0	112.6	T85 K92	T85-D88 WeakPolarHBondContact CA-OD2 3.44Å; T85-D88 WeakPolarHBondContact CB-OD2 3.41Å; T85-D88 PolarHBondContact N-OD2 3.41Å; T85-D88 PolarHBondContact O-N 3.31Å; T85-D88 PolarHBondContact OG1-N 3.46Å; T85-D88 PolarHBondContact OG1-OD2 3.31Å; D88-K92 PolarHBondContact O-N 3.24Å
89	I	96.7	Very high	96.7	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-70.6	-48.1	175.5	-56.1	-53.7	0	0	0	109.7	V80 T85 E86 E87 D91 K92 F93 L102 L104 V119 M139	V80-I89 HydrophobicContact CG1-CD1 3.86Å; V80-I89 HydrophobicContact CG2-CD1 4.25Å; T85-I89 PolarHBondContact O-N 2.97Å; E86-I89 PolarHBondContact O-N 2.88Å; E87-I89 VanDerWaalsContact C-N 3.32Å; E87-I89 PolarHBondContact O-N 2.93Å; I89-D91 PolarHBondContact O-N 3.04Å; I89-K92 PolarHBondContact O-N 2.86Å; I89-F93 HydrophobicContact CG2-CD2 3.86Å; I89-F93 HydrophobicContact CG2-CE2 4.18Å; I89-F93 WeakPolarHBondContact O-CB 3.44Å; I89-F93 VanDerWaalsContact O-CD2 3.26Å; I89-F93 WeakPolarHBondContact O-CD2 3.46Å; I89-F93 PolarHBondContact O-N 3.01Å; I89-L102 HydrophobicContact CB-CD1 4.04Å; I89-L102 HydrophobicContact CG2-CD1 3.77Å; I89-L102 HydrophobicContact CG2-CG 4.26Å; I89-L104 HydrophobicContact CG1-CD1 4.03Å; I89-L104 HydrophobicContact CG1-CD2 4.22Å; I89-V119 HydrophobicContact CG2-CG2 4.06Å; I89-M139 HydrophobicContact CD1-CE 3.52Å; I89-M139 HydrophobicContact CD1-SD 3.49Å; I89-M139 WeakPolarHBondContact CD1-SD 3.46Å
90	H	97.5	Very high	96.8	Very high	85 Å²	85	66.4 Å²	66.4	39%	0.394	33%	0.331	S	S	.	.	H	α-helix	trans	-57.9	-49.6	-178.6	-178.3	-78.8	0	0	0	111.1	E86 E87 K92 F93 A94 I99 L102	E86-H90 VanDerWaalsContact O-CB 3.23Å; E86-H90 WeakPolarHBondContact O-CB 3.2Å; E86-H90 PolarHBondContact O-N 3.26Å; E87-H90 PolarHBondContact O-N 3.15Å; H90-K92 VanDerWaalsContact C-N 3.31Å; H90-K92 PolarHBondContact O-N 2.64Å; H90-F93 PolarHBondContact O-N 3.28Å; H90-A94 WeakPolarHBondContact O-CB 3.26Å; H90-A94 PolarHBondContact O-N 2.89Å; H90-I99 HydrophobicContact CB-CD1 4.49Å; H90-L102 HydrophobicContact CB-CD1 4.27Å
91	D	95.9	Very high	96.8	Very high	104 Å²	104	69.6 Å²	69.6	56%	0.556	35%	0.348	S	S	*	.	H	α-helix	trans	-60	-40	-178.7	-77.3	-6.3	0	0	0	112.6	E87 I89	E87-D91 WeakPolarHBondContact O-CB 3.43Å; E87-D91 PolarHBondContact O-N 3.35Å; I89-D91 PolarHBondContact O-N 3.04Å
92	K	95.8	Very high	96.9	Very high	46 Å²	46	68.4 Å²	68.4	20%	0.2	34%	0.343	C	S	.	.	H	α-helix	trans	-73.7	-34.8	-179.3	-155.2	-178.8	-170.6	-175	0	112.5	D88 I89 H90 L134 D138 M139 I144	D88-K92 PolarHBondContact O-N 3.24Å; I89-K92 PolarHBondContact O-N 2.86Å; H90-K92 VanDerWaalsContact C-N 3.31Å; H90-K92 PolarHBondContact O-N 2.64Å; K92-L134 HydrophobicContact CD-CD2 4.12Å; K92-L134 HydrophobicContact CG-CD1 4.46Å; K92-L134 HydrophobicContact CG-CD2 3.79Å; K92-D138 PolarHBondContact NZ-O 2.69Å; K92-M139 HydrophobicContact CB-CE 4.18Å; K92-M139 HydrophobicContact CD-CE 3.39Å; K92-M139 HydrophobicContact CG-CE 4.42Å; K92-I144 HydrophobicContact CD-CD1 4.33Å
93	F	97.7	Very high	96.9	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-90.2	-25.2	-176.9	-80.5	-100.4	0	0	0	112.8	L75 V77 I89 H90 E95 F96 I99 V119 Y121 A130 L134 I144 V146	L75-F93 HydrophobicContact CD1-CE1 4.28Å; V77-F93 HydrophobicContact CB-CZ 4.42Å; V77-F93 HydrophobicContact CG1-CZ 4.12Å; V77-F93 HydrophobicContact CG2-CE1 3.88Å; V77-F93 HydrophobicContact CG2-CE2 4.26Å; V77-F93 HydrophobicContact CG2-CZ 3.42Å; V77-F93 VanDerWaalsContact CG2-CZ 3.42Å; I89-F93 HydrophobicContact CG2-CD2 3.86Å; I89-F93 HydrophobicContact CG2-CE2 4.18Å; I89-F93 WeakPolarHBondContact O-CB 3.44Å; I89-F93 VanDerWaalsContact O-CD2 3.26Å; I89-F93 WeakPolarHBondContact O-CD2 3.46Å; I89-F93 PolarHBondContact O-N 3.01Å; H90-F93 PolarHBondContact O-N 3.28Å; F93-E95 PolarHBondContact O-N 2.99Å; F93-E95 VanDerWaalsContact O-N 3.14Å; F93-F96 PolarHBondContact O-N 3.46Å; F93-I99 HydrophobicContact CB-CD1 3.75Å; F93-I99 HydrophobicContact CB-CG1 4.46Å; F93-V119 HydrophobicContact CB-CG1 4.3Å; F93-V119 HydrophobicContact CD1-CB 4.21Å; F93-V119 HydrophobicContact CD1-CG1 3.91Å; F93-V119 HydrophobicContact CD1-CG2 4.06Å; F93-V119 HydrophobicContact CE1-CB 4.46Å; F93-V119 HydrophobicContact CE1-CG2 4.18Å; F93-V119 HydrophobicContact CG-CG1 4.29Å; F93-V119 HydrophobicContact CG-CG2 4.27Å; F93-Y121 WeakPolarHBondContact CB-OH 3.48Å; F93-Y121 HydrophobicContact CD1-CE2 4.38Å; F93-Y121 PolarHBondContact O-OH 3.29Å; F93-A130 HydrophobicContact CD1-CB 4.36Å; F93-L134 HydrophobicContact CB-CD1 4.48Å; F93-L134 HydrophobicContact CD1-CD1 3.62Å; F93-L134 HydrophobicContact CD2-CD1 3.71Å; F93-L134 HydrophobicContact CE1-CD1 3.61Å; F93-L134 HydrophobicContact CE2-CD1 3.71Å; F93-L134 HydrophobicContact CG-CD1 3.67Å; F93-L134 HydrophobicContact CZ-CD1 3.65Å; F93-I144 HydrophobicContact CE2-CD1 4.23Å; F93-I144 HydrophobicContact CZ-CD1 4.39Å; F93-V146 HydrophobicContact CE1-CG1 4.37Å; F93-V146 HydrophobicContact CZ-CG2 4.06Å
94	A	97.4	Very high	97	Very high	41 Å²	41	63.8 Å²	63.8	34%	0.339	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-65.1	-18.6	-177.8	0	0	0	0	0	113.9	H90 F96 I99	H90-A94 WeakPolarHBondContact O-CB 3.26Å; H90-A94 PolarHBondContact O-N 2.89Å; A94-F96 PolarHBondContact O-N 3.5Å; A94-I99 HydrophobicContact CB-CD1 4.42Å
95	E	96.5	Very high	97	Very high	166 Å²	166	66.7 Å²	66.7	78%	0.776	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-61.7	-27.6	175.1	-175	176.7	171	0	0	112.9	F93	F93-E95 PolarHBondContact O-N 2.99Å; F93-E95 VanDerWaalsContact O-N 3.14Å
96	F	97.6	Very high	97	Very high	48 Å²	48	68.1 Å²	68.1	21%	0.211	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-96.3	-12.8	-171.2	-59.3	-84.5	0	0	0	114.4	F93 A94 E126 A129 A130 L134	F93-F96 PolarHBondContact O-N 3.46Å; A94-F96 PolarHBondContact O-N 3.5Å; F96-E126 WeakPolarHBondContact O-CB 3.48Å; F96-E126 WeakPolarHBondContact O-CG 3.33Å; F96-A129 HydrophobicContact CD1-CB 4.06Å; F96-A129 WeakPolarHBondContact CD1-O 3.43Å; F96-A129 WeakPolarHBondContact CE1-O 3.18Å; F96-A130 HydrophobicContact CB-CB 3.7Å; F96-A130 HydrophobicContact CD1-CB 4.38Å; F96-A130 HydrophobicContact CD2-CB 3.94Å; F96-A130 VanDerWaalsContact CG-CA 3.46Å; F96-A130 HydrophobicContact CG-CB 3.73Å; F96-L134 HydrophobicContact CD2-CD1 4.01Å; F96-L134 HydrophobicContact CD2-CG 4.29Å; F96-L134 HydrophobicContact CE2-CD1 3.61Å; F96-L134 HydrophobicContact CE2-CD2 3.72Å; F96-L134 HydrophobicContact CE2-CG 3.48Å; F96-L134 VanDerWaalsContact CE2-CG 3.48Å; F96-L134 HydrophobicContact CZ-CD1 4.49Å; F96-L134 HydrophobicContact CZ-CD2 4.06Å; F96-L134 HydrophobicContact CZ-CG 3.89Å
97	G	96.8	Very high	97	Very high	19 Å²	19	63.5 Å²	63.5	20%	0.196	32%	0.32	C	S	.	.	S	Bend	trans	162.3	178.6	-177.4	0	0	0	0	0	113.1	I99	G97-I99 PolarHBondContact O-N 3.27Å
98	E	97.2	Very high	97	Very high	122 Å²	122	68.5 Å²	68.5	57%	0.57	33%	0.333	S	S	*	.			trans	-76.2	119	175.1	-171.3	-172.2	134.8	0	0	110.5	K100 Y121	E98-K100 PolarHBondContact O-N 3.28Å; E98-K100 IonicContact OE1-NZ 2.57Å; E98-K100 PolarHBondContact OE1-NZ 3.41Å; E98-K100 IonicContact OE2-NZ 2.61Å; E98-Y121 WeakPolarHBondContact O-CD1 3.48Å
99	I	97.9	Very high	96.9	Very high	27 Å²	27	75.4 Å²	75.4	14%	0.138	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	115.6	175.7	-59.1	171.7	0	0	0	108.4	H90 F93 A94 G97 N101 L102 V119 Y121	H90-I99 HydrophobicContact CB-CD1 4.49Å; F93-I99 HydrophobicContact CB-CD1 3.75Å; F93-I99 HydrophobicContact CB-CG1 4.46Å; A94-I99 HydrophobicContact CB-CD1 4.42Å; G97-I99 PolarHBondContact O-N 3.27Å; I99-N101 WeakPolarHBondContact CG2-O 3.31Å; I99-L102 HydrophobicContact CG2-CB 4.2Å; I99-V119 HydrophobicContact CG1-CG1 4.27Å; I99-V119 HydrophobicContact CG2-CG1 4.11Å; I99-Y121 HydrophobicContact CG1-CE1 4.12Å
100	K	97.6	Very high	96.9	Very high	88 Å²	88	78.3 Å²	78.3	38%	0.383	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-37.3	177.4	-65.9	-60	-177.9	-173.6	0	112.3	E98 E120 E122	E98-K100 PolarHBondContact O-N 3.28Å; E98-K100 IonicContact OE1-NZ 2.57Å; E98-K100 PolarHBondContact OE1-NZ 3.41Å; E98-K100 IonicContact OE2-NZ 2.61Å; K100-E120 HydrophobicContact CB-CB 4.49Å; K100-E120 HydrophobicContact CB-CG 4.35Å; K100-E120 PolarHBondContact N-O 2.95Å; K100-E122 WeakPolarHBondContact CE-OE2 3.38Å; K100-E122 HydrophobicContact CG-CB 4.28Å; K100-E122 IonicContact NZ-OE2 3.7Å; K100-E122 PolarHBondContact NZ-OE2 2.7Å
101	N	97.4	Very high	96.8	Very high	69 Å²	69	76.6 Å²	76.6	37%	0.369	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	147.7	-179.7	-152.6	-14.2	0	0	0	110.9	I99 E120	I99-N101 WeakPolarHBondContact CG2-O 3.31Å; N101-E120 HydrophobicContact CB-CB 3.95Å; N101-E120 PolarHBondContact O-N 2.75Å
102	L	97.7	Very high	96.7	Very high	17 Å²	17	76.7 Å²	76.7	9%	0.089	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	117.1	-179.1	-168.5	166.2	0	0	0	108.9	E86 I89 H90 I99 L104 L118	E86-L102 HydrophobicContact CG-CD1 4.01Å; E86-L102 HydrophobicContact CG-CD2 3.84Å; E86-L102 HydrophobicContact CG-CG 4.46Å; I89-L102 HydrophobicContact CB-CD1 4.04Å; I89-L102 HydrophobicContact CG2-CD1 3.77Å; I89-L102 HydrophobicContact CG2-CG 4.26Å; H90-L102 HydrophobicContact CB-CD1 4.27Å; I99-L102 HydrophobicContact CG2-CB 4.2Å; L102-L104 HydrophobicContact CD2-CB 3.8Å; L102-L118 CarbonylContact C-O 3.53Å; L102-L118 WeakPolarHBondContact CA-O 3.16Å
103	H	97.7	Very high	96.8	Very high	90 Å²	90	75.4 Å²	75.4	42%	0.417	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	114.4	173.4	-65.4	178.5	0	0	0	110.5	A117 L118	H103-A117 CarbonylContact O-C 3.58Å; H103-A117 WeakPolarHBondContact O-CA 3.4Å; H103-L118 HydrophobicContact CB-CB 4.13Å; H103-L118 HydrophobicContact CB-CD1 4.39Å; H103-L118 PolarHBondContact N-O 2.97Å; H103-L118 PolarHBondContact O-N 3.2Å
104	L	97	Very high	96.7	Very high	30 Å²	30	77.6 Å²	77.6	16%	0.157	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	88.3	178.1	-166.1	62.7	0	0	0	110	V80 T85 E86 I89 L102 L113 A117	V80-L104 HydrophobicContact CG1-CD1 4.3Å; T85-L104 VanDerWaalsContact C-CD2 3.49Å; E86-L104 HydrophobicContact CB-CD2 4.17Å; I89-L104 HydrophobicContact CG1-CD1 4.03Å; I89-L104 HydrophobicContact CG1-CD2 4.22Å; L102-L104 HydrophobicContact CD2-CB 3.8Å; L104-L113 HydrophobicContact CD1-CD1 3.72Å; L104-L113 HydrophobicContact CD1-CD2 4.35Å; L104-L113 HydrophobicContact CD2-CD1 3.85Å; L104-L113 HydrophobicContact CD2-CD2 3.92Å; L104-L113 HydrophobicContact CG-CD1 3.84Å; L104-L113 HydrophobicContact CG-CD2 3.66Å; L104-L113 HydrophobicContact CG-CG 4.39Å; L104-A117 HydrophobicContact CD1-CB 3.77Å
105	N	97	Very high	96.7	Very high	66 Å²	66	76.4 Å²	76.4	35%	0.353	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	144.5	-169.1	-70.9	-24.8	0	0	0	112.5	K114 Y116	N105-K114 VanDerWaalsContact O-CB 3.24Å; N105-K114 WeakPolarHBondContact O-CB 3.32Å; N105-K114 PolarHBondContact O-N 3.38Å; N105-Y116 HydrophobicContact CB-CE2 4.33Å; N105-Y116 PolarHBondContact ND2-OH 2.93Å
106	L	96.6	Very high	96.7	Very high	96 Å²	96	70.9 Å²	70.9	50%	0.503	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	146.4	178.9	-55.4	-176.7	0	0	0	112.8	R108 Y112 L113	L106-R108 PolarHBondContact O-N 2.98Å; L106-Y112 CarbonylContact C-O 3.53Å; L106-Y112 WeakPolarHBondContact CA-O 3.22Å; L106-L113 HydrophobicContact CD2-CD2 3.5Å; L106-L113 VanDerWaalsContact CD2-CD2 3.5Å
107	D	96.2	Very high	96.7	Very high	20 Å²	20	68.6 Å²	68.6	11%	0.107	33%	0.33	C	S	.	.			trans	-67.2	115.6	160.8	-175.1	-66.6	0	0	0	109.8	R109 T110 G111 Y112 K114	D107-R109 PolarHBondContact O-N 3.41Å; D107-R109 WeakPolarHBondContact OD1-CA 3.43Å; D107-R109 WeakPolarHBondContact OD1-CB 3.09Å; D107-R109 PolarHBondContact OD1-N 2.78Å; D107-T110 WeakPolarHBondContact CB-OG1 3.36Å; D107-T110 PolarHBondContact O-N 3.35Å; D107-T110 PolarHBondContact OD1-N 3.44Å; D107-G111 WeakPolarHBondContact O-CA 3.39Å; D107-G111 PolarHBondContact O-N 3.37Å; D107-Y112 PolarHBondContact N-O 2.91Å; D107-K114 HydrophobicContact CB-CD 4.06Å; D107-K114 IonicContact OD2-NZ 2.65Å; D107-K114 PolarHBondContact OD2-NZ 2.88Å
108	R	95.8	Very high	96.8	Very high	242 Å²	242	69.7 Å²	69.7	91%	0.913	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.3	-173.4	-60.4	-59.9	-62.5	-106.4	-1.1	114.6	L106	L106-R108 PolarHBondContact O-N 2.98Å
109	R	95.3	Very high	96.9	Very high	207 Å²	207	63.9 Å²	63.9	78%	0.781	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-43.9	-179.9	177.2	179.5	56.9	80	7.3	111.8	D107	D107-R109 PolarHBondContact O-N 3.41Å; D107-R109 WeakPolarHBondContact OD1-CA 3.43Å; D107-R109 WeakPolarHBondContact OD1-CB 3.09Å; D107-R109 PolarHBondContact OD1-N 2.78Å
110	T	95.7	Very high	96.9	Very high	62 Å²	62	63.4 Å²	63.4	38%	0.38	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-27.9	-176.4	63.1	0	0	0	0	113	D107 Y112	D107-T110 WeakPolarHBondContact CB-OG1 3.36Å; D107-T110 PolarHBondContact O-N 3.35Å; D107-T110 PolarHBondContact OD1-N 3.44Å; T110-Y112 VanDerWaalsContact C-N 3.27Å; T110-Y112 PolarHBondContact OG1-N 3.04Å
111	G	95.1	Very high	96.9	Very high	49 Å²	49	59.2 Å²	59.2	51%	0.505	28%	0.283	S	S	.	.	S	Bend	trans	85.1	-8.6	-173.4	0	0	0	0	0	114.4	D107	D107-G111 WeakPolarHBondContact O-CA 3.39Å; D107-G111 PolarHBondContact O-N 3.37Å
112	Y	95.8	Very high	96.9	Very high	106 Å²	106	60.6 Å²	60.6	42%	0.416	29%	0.287	S	S	.	.	S	Bend	trans	-76.1	172.6	172.3	-69	-66.5	0	0	0	111.8	E82 E83 L106 D107 T110	E82-Y112 HydrophobicContact CG-CD1 4.45Å; E82-Y112 HydrophobicContact CG-CG 4.43Å; E82-Y112 WeakPolarHBondContact O-CB 3.45Å; E83-Y112 HydrophobicContact CG-CD1 4.13Å; E83-Y112 HydrophobicContact CG-CE1 3.9Å; L106-Y112 CarbonylContact C-O 3.53Å; L106-Y112 WeakPolarHBondContact CA-O 3.22Å; D107-Y112 PolarHBondContact N-O 2.91Å; T110-Y112 VanDerWaalsContact C-N 3.27Å; T110-Y112 PolarHBondContact OG1-N 3.04Å
113	L	96.6	Very high	96.9	Very high	19 Å²	19	62.4 Å²	62.4	10%	0.099	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	150.3	174	-62.3	-167.8	0	0	0	112.1	V80 H81 E82 A84 L104 L106 G115	V80-L113 HydrophobicContact CG1-CD1 3.68Å; H81-L113 WeakPolarHBondContact O-CD1 3.45Å; E82-L113 PolarHBondContact O-N 3.39Å; A84-L113 HydrophobicContact CB-CD1 3.85Å; A84-L113 WeakPolarHBondContact O-CD1 3.43Å; A84-L113 WeakPolarHBondContact O-CG 3.33Å; L104-L113 HydrophobicContact CD1-CD1 3.72Å; L104-L113 HydrophobicContact CD1-CD2 4.35Å; L104-L113 HydrophobicContact CD2-CD1 3.85Å; L104-L113 HydrophobicContact CD2-CD2 3.92Å; L104-L113 HydrophobicContact CG-CD1 3.84Å; L104-L113 HydrophobicContact CG-CD2 3.66Å; L104-L113 HydrophobicContact CG-CG 4.39Å; L106-L113 HydrophobicContact CD2-CD2 3.5Å; L106-L113 VanDerWaalsContact CD2-CD2 3.5Å; L113-G115 PolarHBondContact O-N 2.81Å
114	K	96.4	Very high	96.9	Very high	45 Å²	45	62.4 Å²	62.4	20%	0.196	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-12.8	177.6	-162.3	47.6	162.3	172.9	0	113.7	E52 Y54 N105 D107 Y116	E52-K114 WeakPolarHBondContact OE1-CE 3.42Å; E52-K114 IonicContact OE1-NZ 3.75Å; E52-K114 PolarHBondContact OE1-NZ 3.37Å; E52-K114 WeakPolarHBondContact OE2-CE 3.43Å; E52-K114 IonicContact OE2-NZ 2.85Å; E52-K114 PolarHBondContact OE2-NZ 3.37Å; Y54-K114 PolarHBondContact OH-O 2.8Å; Y54-K114 VanDerWaalsContact OH-O 3.09Å; N105-K114 VanDerWaalsContact O-CB 3.24Å; N105-K114 WeakPolarHBondContact O-CB 3.32Å; N105-K114 PolarHBondContact O-N 3.38Å; D107-K114 HydrophobicContact CB-CD 4.06Å; D107-K114 IonicContact OD2-NZ 2.65Å; D107-K114 PolarHBondContact OD2-NZ 2.88Å; K114-Y116 HydrophobicContact CB-CD1 3.95Å; K114-Y116 HydrophobicContact CB-CE1 3.8Å; K114-Y116 HydrophobicContact CG-CD1 3.81Å; K114-Y116 HydrophobicContact CG-CE1 3.43Å; K114-Y116 VanDerWaalsContact CG-CE1 3.43Å
115	G	96.1	Very high	96.9	Very high	16 Å²	16	69 Å²	69	17%	0.165	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	91.3	10.8	-179.1	0	0	0	0	0	114.8	G79 V80 L113	G79-G115 PolarHBondContact N-O 2.97Å; V80-G115 PolarHBondContact N-O 2.78Å; V80-G115 VanDerWaalsContact N-O 3.14Å; V80-G115 WeakPolarHBondContact O-CA 3.44Å; L113-G115 PolarHBondContact O-N 2.81Å
116	Y	97.8	Very high	97	Very high	50 Å²	50	68.2 Å²	68.2	20%	0.196	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	158.6	171.7	73.9	-92.2	0	0	0	112.1	Y54 F76 V77 N105 K114	Y54-Y116 AromaticContact CE1-CD1 3.79Å; Y54-Y116 HydrophobicContact CE1-CD1 3.79Å; Y54-Y116 HydrophobicContact CE1-CE1 4.25Å; Y54-Y116 HydrophobicContact CE1-CG 4.46Å; Y54-Y116 AromaticContact CZ-CD1 3.86Å; Y54-Y116 VanDerWaalsContact OH-CD1 3.31Å; Y54-Y116 WeakPolarHBondContact OH-CD1 3.48Å; F76-Y116 HydrophobicContact CD2-CD2 4.45Å; F76-Y116 AromaticContact CE2-CD2 3.68Å; F76-Y116 HydrophobicContact CE2-CD2 3.68Å; F76-Y116 HydrophobicContact CE2-CE2 4.44Å; F76-Y116 AromaticContact CE2-CG 3.93Å; F76-Y116 HydrophobicContact CE2-CG 3.93Å; F76-Y116 HydrophobicContact CZ-CG 4.36Å; V77-Y116 CarbonylContact O-C 3.59Å; V77-Y116 WeakPolarHBondContact O-CA 3.24Å; V77-Y116 VanDerWaalsContact O-CB 3.24Å; V77-Y116 WeakPolarHBondContact O-CB 2.94Å; N105-Y116 HydrophobicContact CB-CE2 4.33Å; N105-Y116 PolarHBondContact ND2-OH 2.93Å; K114-Y116 HydrophobicContact CB-CD1 3.95Å; K114-Y116 HydrophobicContact CB-CE1 3.8Å; K114-Y116 HydrophobicContact CG-CD1 3.81Å; K114-Y116 HydrophobicContact CG-CE1 3.43Å; K114-Y116 VanDerWaalsContact CG-CE1 3.43Å
117	A	97.9	Very high	97	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	155.4	172.1	0	0	0	0	0	111.4	V77 V80 H103 L104	V77-A117 HydrophobicContact CB-CB 4.24Å; V77-A117 PolarHBondContact N-O 3.47Å; V77-A117 PolarHBondContact O-N 2.81Å; V80-A117 HydrophobicContact CG2-CB 4.39Å; H103-A117 CarbonylContact O-C 3.58Å; H103-A117 WeakPolarHBondContact O-CA 3.4Å; L104-A117 HydrophobicContact CD1-CB 3.77Å
118	L	98.4	Very high	97.1	Very high	43 Å²	43	65.7 Å²	65.7	23%	0.225	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.9	166.2	-59.6	169.2	0	0	0	108.5	I74 L75 F76 L102 H103	I74-L118 HydrophobicContact CG2-CB 4.14Å; I74-L118 HydrophobicContact CG2-CD2 3.92Å; L75-L118 WeakPolarHBondContact O-CA 3.35Å; F76-L118 HydrophobicContact CB-CD2 4.42Å; F76-L118 HydrophobicContact CD2-CD2 3.66Å; F76-L118 HydrophobicContact CE2-CD2 4.48Å; L102-L118 CarbonylContact C-O 3.53Å; L102-L118 WeakPolarHBondContact CA-O 3.16Å; H103-L118 HydrophobicContact CB-CB 4.13Å; H103-L118 HydrophobicContact CB-CD1 4.39Å; H103-L118 PolarHBondContact N-O 2.97Å; H103-L118 PolarHBondContact O-N 3.2Å
119	V	98.4	Very high	97.2	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	123.5	178.4	-176.6	0	0	0	0	108.5	I74 L75 V77 I89 F93 I99 Y121	I74-V119 CarbonylContact C-O 3.59Å; I74-V119 WeakPolarHBondContact CA-O 3.47Å; L75-V119 PolarHBondContact N-O 3.45Å; L75-V119 PolarHBondContact O-N 3.35Å; V77-V119 HydrophobicContact CG2-CG2 4.14Å; I89-V119 HydrophobicContact CG2-CG2 4.06Å; F93-V119 HydrophobicContact CB-CG1 4.3Å; F93-V119 HydrophobicContact CD1-CB 4.21Å; F93-V119 HydrophobicContact CD1-CG1 3.91Å; F93-V119 HydrophobicContact CD1-CG2 4.06Å; F93-V119 HydrophobicContact CE1-CB 4.46Å; F93-V119 HydrophobicContact CE1-CG2 4.18Å; F93-V119 HydrophobicContact CG-CG1 4.29Å; F93-V119 HydrophobicContact CG-CG2 4.27Å; I99-V119 HydrophobicContact CG1-CG1 4.27Å; I99-V119 HydrophobicContact CG2-CG1 4.11Å; V119-Y121 HydrophobicContact CG1-CD2 4.42Å; V119-Y121 HydrophobicContact CG1-CE2 3.87Å
120	E	98.5	Very high	97.3	Very high	16 Å²	16	46.2 Å²	46.2	8%	0.075	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.1	-179.6	-171.6	167.9	-159	0	0	111.3	G72 W73 I74 K100 N101	G72-E120 VanDerWaalsContact CA-OE1 3.32Å; G72-E120 WeakPolarHBondContact CA-OE1 3.46Å; G72-E120 PolarHBondContact N-OE1 2.96Å; W73-E120 WeakPolarHBondContact O-CA 3.23Å; I74-E120 HydrophobicContact CG1-CB 4Å; I74-E120 HydrophobicContact CG1-CG 3.86Å; K100-E120 HydrophobicContact CB-CB 4.49Å; K100-E120 HydrophobicContact CB-CG 4.35Å; K100-E120 PolarHBondContact N-O 2.95Å; N101-E120 HydrophobicContact CB-CB 3.95Å; N101-E120 PolarHBondContact O-N 2.75Å
121	Y	98.6	Very high	97.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	156.7	169.3	-69.1	-81.8	0	0	0	111.3	G72 W73 L75 F93 E98 I99 V119 E126 A127 A130	G72-Y121 CarbonylContact C-O 3.46Å; G72-Y121 WeakPolarHBondContact CA-O 3.43Å; W73-Y121 PolarHBondContact N-O 3.19Å; W73-Y121 PolarHBondContact O-N 3.22Å; L75-Y121 HydrophobicContact CD1-CD2 4.3Å; L75-Y121 HydrophobicContact CD1-CE2 3.96Å; F93-Y121 WeakPolarHBondContact CB-OH 3.48Å; F93-Y121 HydrophobicContact CD1-CE2 4.38Å; F93-Y121 PolarHBondContact O-OH 3.29Å; E98-Y121 WeakPolarHBondContact O-CD1 3.48Å; I99-Y121 HydrophobicContact CG1-CE1 4.12Å; V119-Y121 HydrophobicContact CG1-CD2 4.42Å; V119-Y121 HydrophobicContact CG1-CE2 3.87Å; Y121-E126 HydrophobicContact CD1-CB 3.76Å; Y121-E126 HydrophobicContact CE1-CB 4.41Å; Y121-E126 HydrophobicContact CG-CB 3.91Å; Y121-A127 HydrophobicContact CD2-CB 3.93Å; Y121-A127 HydrophobicContact CG-CB 4.46Å; Y121-A130 HydrophobicContact CE2-CB 3.71Å
122	E	97.3	Very high	97.5	Very high	98 Å²	98	48.8 Å²	48.8	46%	0.458	23%	0.233	S	C	.	.	S	Bend	trans	-67.8	-43.8	175.6	-166.6	171.5	157.2	0	0	111.8	K100	K100-E122 WeakPolarHBondContact CE-OE2 3.38Å; K100-E122 HydrophobicContact CG-CB 4.28Å; K100-E122 IonicContact NZ-OE2 3.7Å; K100-E122 PolarHBondContact NZ-OE2 2.7Å
123	T	97.2	Very high	97.6	Very high	55 Å²	55	45 Å²	45	34%	0.337	23%	0.226	S	C	.	.	S	Bend	trans	-111.2	150.1	-171.4	76.3	0	0	0	0	113.3	K125 E126 A127	T123-K125 PolarHBondContact O-N 2.79Å; T123-E126 WeakPolarHBondContact CB-OE2 3.43Å; T123-E126 WeakPolarHBondContact CG2-OE2 3.43Å; T123-E126 PolarHBondContact N-OE2 3.26Å; T123-E126 PolarHBondContact O-N 3.03Å; T123-E126 WeakPolarHBondContact OG1-CG 3.47Å; T123-E126 PolarHBondContact OG1-N 2.85Å; T123-E126 PolarHBondContact OG1-OE2 2.89Å; T123-A127 PolarHBondContact O-N 2.99Å
124	Y	97.1	Very high	97.6	Very high	91 Å²	91	44.6 Å²	44.6	36%	0.357	22%	0.224	S	C	.	.	H	α-helix	trans	-57.5	-37.9	174.2	176.5	-98.9	0	0	0	111.7	P66 W73 A127 Q128 W148	P66-Y124 HydrophobicContact CG-CD2 4.44Å; P66-Y124 HydrophobicContact CG-CE2 3.59Å; W73-Y124 AromaticContact CD2-CD2 3.99Å; W73-Y124 HydrophobicContact CD2-CD2 3.99Å; W73-Y124 AromaticContact CE3-CD2 3.8Å; W73-Y124 HydrophobicContact CE3-CD2 3.8Å; W73-Y124 AromaticContact CH2-CD2 3.67Å; W73-Y124 HydrophobicContact CH2-CD2 3.67Å; W73-Y124 HydrophobicContact CH2-CE2 4.42Å; W73-Y124 HydrophobicContact CH2-CG 4.44Å; W73-Y124 AromaticContact CZ2-CD2 3.87Å; W73-Y124 HydrophobicContact CZ2-CD2 3.87Å; W73-Y124 HydrophobicContact CZ2-CG 4.25Å; W73-Y124 AromaticContact CZ3-CD2 3.65Å; W73-Y124 HydrophobicContact CZ3-CD2 3.65Å; W73-Y124 HydrophobicContact CZ3-CE2 4.2Å; Y124-A127 PolarHBondContact O-N 3.36Å; Y124-Q128 HydrophobicContact CE1-CB 4.24Å; Y124-Q128 HydrophobicContact CE1-CG 4.49Å; Y124-Q128 VanDerWaalsContact O-CB 3.32Å; Y124-Q128 WeakPolarHBondContact O-CB 3.43Å; Y124-Q128 PolarHBondContact O-N 2.96Å; Y124-Q128 PolarHBondContact OH-OE1 3.05Å; Y124-W148 AromaticContact CD2-CH2 3.72Å; Y124-W148 HydrophobicContact CD2-CH2 3.72Å; Y124-W148 HydrophobicContact CD2-CZ2 4.28Å; Y124-W148 HydrophobicContact CD2-CZ3 4.42Å; Y124-W148 AromaticContact CE2-CH2 3.45Å; Y124-W148 HydrophobicContact CE2-CH2 3.45Å; Y124-W148 VanDerWaalsContact CE2-CH2 3.45Å; Y124-W148 AromaticContact CE2-CZ2 3.53Å; Y124-W148 HydrophobicContact CE2-CZ2 3.53Å; Y124-W148 HydrophobicContact CE2-CZ3 4.4Å; Y124-W148 AromaticContact CZ-CZ2 4Å
125	K	97.7	Very high	97.7	Very high	169 Å²	169	46.1 Å²	46.1	74%	0.735	23%	0.234	S	C	*	.	H	α-helix	trans	-67	-42.8	-175.1	-173.7	-176.1	175.7	-169.2	0	111.6	T123 A129	T123-K125 PolarHBondContact O-N 2.79Å; K125-A129 VanDerWaalsContact O-CB 3.26Å; K125-A129 WeakPolarHBondContact O-CB 3.01Å; K125-A129 PolarHBondContact O-N 3.45Å
126	E	98	Very high	97.7	Very high	48 Å²	48	47.6 Å²	47.6	22%	0.224	25%	0.249	C	C	.	.	H	α-helix	trans	-64.9	-48.3	177	-66.8	160.3	147.5	0	0	110.5	F96 Y121 T123 Q128 A129 A130	F96-E126 WeakPolarHBondContact O-CB 3.48Å; F96-E126 WeakPolarHBondContact O-CG 3.33Å; Y121-E126 HydrophobicContact CD1-CB 3.76Å; Y121-E126 HydrophobicContact CE1-CB 4.41Å; Y121-E126 HydrophobicContact CG-CB 3.91Å; T123-E126 WeakPolarHBondContact CB-OE2 3.43Å; T123-E126 WeakPolarHBondContact CG2-OE2 3.43Å; T123-E126 PolarHBondContact N-OE2 3.26Å; T123-E126 PolarHBondContact O-N 3.03Å; T123-E126 WeakPolarHBondContact OG1-CG 3.47Å; T123-E126 PolarHBondContact OG1-N 2.85Å; T123-E126 PolarHBondContact OG1-OE2 2.89Å; E126-Q128 PolarHBondContact O-N 3.39Å; E126-A129 PolarHBondContact O-N 3.22Å; E126-A130 WeakPolarHBondContact O-CB 3.43Å; E126-A130 PolarHBondContact O-N 3.4Å
127	A	97.8	Very high	97.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-43.7	178.5	0	0	0	0	0	112.7	W73 L75 Y121 T123 Y124 A130 M131 W148	W73-A127 HydrophobicContact CB-CB 3.76Å; L75-A127 HydrophobicContact CD1-CB 4.46Å; L75-A127 WeakPolarHBondContact CD1-O 3.34Å; L75-A127 HydrophobicContact CD2-CB 4.16Å; L75-A127 HydrophobicContact CG-CB 4.25Å; Y121-A127 HydrophobicContact CD2-CB 3.93Å; Y121-A127 HydrophobicContact CG-CB 4.46Å; T123-A127 PolarHBondContact O-N 2.99Å; Y124-A127 PolarHBondContact O-N 3.36Å; A127-A130 PolarHBondContact O-N 3.5Å; A127-M131 WeakPolarHBondContact O-CB 3.14Å; A127-M131 PolarHBondContact O-N 2.82Å; A127-W148 HydrophobicContact CB-CH2 4.02Å; A127-W148 HydrophobicContact CB-CZ3 3.68Å
128	Q	97.7	Very high	97.4	Very high	63 Å²	63	55 Å²	55	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-65.4	-42	177.3	-165.1	-167.3	-85	0	0	111.3	Y124 E126 M131 E132 W148	Y124-Q128 HydrophobicContact CE1-CB 4.24Å; Y124-Q128 HydrophobicContact CE1-CG 4.49Å; Y124-Q128 VanDerWaalsContact O-CB 3.32Å; Y124-Q128 WeakPolarHBondContact O-CB 3.43Å; Y124-Q128 PolarHBondContact O-N 2.96Å; Y124-Q128 PolarHBondContact OH-OE1 3.05Å; E126-Q128 PolarHBondContact O-N 3.39Å; Q128-M131 PolarHBondContact O-N 2.81Å; Q128-E132 WeakPolarHBondContact CG-OE1 3.48Å; Q128-E132 PolarHBondContact NE2-OE1 2.9Å; Q128-E132 WeakPolarHBondContact O-CG 3.33Å; Q128-E132 PolarHBondContact O-N 2.78Å; Q128-W148 HydrophobicContact CB-CH2 4.08Å; Q128-W148 HydrophobicContact CB-CZ2 4.13Å; Q128-W148 HydrophobicContact CG-CZ2 4.25Å
129	A	98	Very high	97.1	Very high	40 Å²	40	53.6 Å²	53.6	33%	0.331	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-42.7	177.2	0	0	0	0	0	111.9	F96 K125 E126 E132 G133	F96-A129 HydrophobicContact CD1-CB 4.06Å; F96-A129 WeakPolarHBondContact CD1-O 3.43Å; F96-A129 WeakPolarHBondContact CE1-O 3.18Å; K125-A129 VanDerWaalsContact O-CB 3.26Å; K125-A129 WeakPolarHBondContact O-CB 3.01Å; K125-A129 PolarHBondContact O-N 3.45Å; E126-A129 PolarHBondContact O-N 3.22Å; A129-E132 PolarHBondContact O-N 3.12Å; A129-G133 PolarHBondContact O-N 2.84Å
130	A	98.2	Very high	96.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-44.2	175.2	0	0	0	0	0	111.8	L75 F93 F96 Y121 E126 A127 G133 L134	L75-A130 HydrophobicContact CD1-CB 3.86Å; F93-A130 HydrophobicContact CD1-CB 4.36Å; F96-A130 HydrophobicContact CB-CB 3.7Å; F96-A130 HydrophobicContact CD1-CB 4.38Å; F96-A130 HydrophobicContact CD2-CB 3.94Å; F96-A130 VanDerWaalsContact CG-CA 3.46Å; F96-A130 HydrophobicContact CG-CB 3.73Å; Y121-A130 HydrophobicContact CE2-CB 3.71Å; E126-A130 WeakPolarHBondContact O-CB 3.43Å; E126-A130 PolarHBondContact O-N 3.4Å; A127-A130 PolarHBondContact O-N 3.5Å; A130-G133 PolarHBondContact O-N 2.79Å; A130-L134 WeakPolarHBondContact O-CB 3.5Å; A130-L134 WeakPolarHBondContact O-CG 3.39Å; A130-L134 PolarHBondContact O-N 3.03Å
131	M	97.3	Very high	96.6	Very high	27 Å²	27	60.8 Å²	60.8	13%	0.133	34%	0.336	C	S	.	.	H	α-helix	trans	-58.7	-53	175.6	179.7	-174.6	-61.5	0	0	111.9	L75 A127 Q128 G133 N135 V146 D147 W148	L75-M131 HydrophobicContact CD2-CB 4.32Å; L75-M131 HydrophobicContact CD2-CE 3.49Å; L75-M131 VanDerWaalsContact CD2-CE 3.49Å; A127-M131 WeakPolarHBondContact O-CB 3.14Å; A127-M131 PolarHBondContact O-N 2.82Å; Q128-M131 PolarHBondContact O-N 2.81Å; M131-G133 VanDerWaalsContact C-N 3.3Å; M131-G133 PolarHBondContact O-N 2.95Å; M131-N135 WeakPolarHBondContact O-CB 3.42Å; M131-N135 PolarHBondContact O-N 3.42Å; M131-V146 HydrophobicContact CB-CG1 4.22Å; M131-V146 HydrophobicContact CG-CG1 4.36Å; M131-V146 WeakPolarHBondContact CG-O 2.95Å; M131-D147 VanDerWaalsContact CE-C 3.46Å; M131-W148 HydrophobicContact CE-CB 4.27Å; M131-W148 HydrophobicContact CE-CD2 3.35Å; M131-W148 HydrophobicContact CE-CE3 3.97Å; M131-W148 HydrophobicContact CE-CG 3.49Å; M131-W148 VanDerWaalsContact CE-CG 3.49Å; M131-W148 HydrophobicContact CE-CZ2 3.99Å; M131-W148 VanDerWaalsContact CE-N 3.32Å
132	E	97.2	Very high	96.3	Very high	138 Å²	138	64.5 Å²	64.5	65%	0.645	35%	0.353	S	S	*	.	H	α-helix	trans	-63.9	-35.4	-179.2	-70.8	173.9	-160.4	0	0	112.4	Q128 A129	Q128-E132 WeakPolarHBondContact CG-OE1 3.48Å; Q128-E132 PolarHBondContact NE2-OE1 2.9Å; Q128-E132 WeakPolarHBondContact O-CG 3.33Å; Q128-E132 PolarHBondContact O-N 2.78Å; A129-E132 PolarHBondContact O-N 3.12Å
133	G	97.3	Very high	96.3	Very high	27 Å²	27	63.5 Å²	63.5	28%	0.278	36%	0.355	S	S	.	.	H	α-helix	trans	-78.4	-34.5	-178.9	0	0	0	0	0	114.3	A129 A130 M131 Q137	A129-G133 PolarHBondContact O-N 2.84Å; A130-G133 PolarHBondContact O-N 2.79Å; M131-G133 VanDerWaalsContact C-N 3.3Å; M131-G133 PolarHBondContact O-N 2.95Å; G133-Q137 WeakPolarHBondContact O-CG 3.32Å; G133-Q137 PolarHBondContact O-NE2 3.44Å
134	L	97.7	Very high	96.3	Very high	10 Å²	10	60.9 Å²	60.9	5%	0.052	34%	0.339	C	S	.	.	H	α-helix	trans	-107.1	-18.3	-169.8	-61.7	179.3	0	0	0	114.8	K92 F93 F96 A130 G136 Q137 I144 V146	K92-L134 HydrophobicContact CD-CD2 4.12Å; K92-L134 HydrophobicContact CG-CD1 4.46Å; K92-L134 HydrophobicContact CG-CD2 3.79Å; F93-L134 HydrophobicContact CB-CD1 4.48Å; F93-L134 HydrophobicContact CD1-CD1 3.62Å; F93-L134 HydrophobicContact CD2-CD1 3.71Å; F93-L134 HydrophobicContact CE1-CD1 3.61Å; F93-L134 HydrophobicContact CE2-CD1 3.71Å; F93-L134 HydrophobicContact CG-CD1 3.67Å; F93-L134 HydrophobicContact CZ-CD1 3.65Å; F96-L134 HydrophobicContact CD2-CD1 4.01Å; F96-L134 HydrophobicContact CD2-CG 4.29Å; F96-L134 HydrophobicContact CE2-CD1 3.61Å; F96-L134 HydrophobicContact CE2-CD2 3.72Å; F96-L134 HydrophobicContact CE2-CG 3.48Å; F96-L134 VanDerWaalsContact CE2-CG 3.48Å; F96-L134 HydrophobicContact CZ-CD1 4.49Å; F96-L134 HydrophobicContact CZ-CD2 4.06Å; F96-L134 HydrophobicContact CZ-CG 3.89Å; A130-L134 WeakPolarHBondContact O-CB 3.5Å; A130-L134 WeakPolarHBondContact O-CG 3.39Å; A130-L134 PolarHBondContact O-N 3.03Å; L134-G136 PolarHBondContact O-N 2.91Å; L134-Q137 HydrophobicContact CD2-CG 4.4Å; L134-Q137 WeakPolarHBondContact O-CB 3.35Å; L134-Q137 PolarHBondContact O-N 3.22Å; L134-I144 HydrophobicContact CB-CD1 4.49Å; L134-V146 HydrophobicContact CB-CG2 4.07Å
135	N	97.3	Very high	96.3	Very high	78 Å²	78	59 Å²	59	42%	0.417	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	121.9	177.8	-171.2	26.9	0	0	0	110.8	M131 Q137 S145 V146	M131-N135 WeakPolarHBondContact O-CB 3.42Å; M131-N135 PolarHBondContact O-N 3.42Å; N135-Q137 VanDerWaalsContact C-N 3.33Å; N135-S145 WeakPolarHBondContact OD1-CA 3.38Å; N135-V146 HydrophobicContact CB-CB 4.15Å; N135-V146 PolarHBondContact OD1-N 3.26Å
136	G	96.2	Very high	96.3	Very high	46 Å²	46	51 Å²	51	47%	0.474	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	0.6	-176.1	0	0	0	0	0	115.1	L134 I144	L134-G136 PolarHBondContact O-N 2.91Å; G136-I144 VanDerWaalsContact CA-O 3.28Å; G136-I144 WeakPolarHBondContact CA-O 3.48Å; G136-I144 PolarHBondContact N-O 3.08Å
137	Q	95.9	Very high	96.3	Very high	98 Å²	98	52.4 Å²	52.4	46%	0.458	31%	0.313	S	S	.	.			trans	-73.9	146.8	177.7	-68	-65.6	-17.7	0	0	112	G133 L134 N135 I144	G133-Q137 WeakPolarHBondContact O-CG 3.32Å; G133-Q137 PolarHBondContact O-NE2 3.44Å; L134-Q137 HydrophobicContact CD2-CG 4.4Å; L134-Q137 WeakPolarHBondContact O-CB 3.35Å; L134-Q137 PolarHBondContact O-N 3.22Å; N135-Q137 VanDerWaalsContact C-N 3.33Å; Q137-I144 WeakPolarHBondContact O-CG1 3.43Å; Q137-I144 PolarHBondContact O-N 2.61Å
138	D	94.5	Very high	96.2	Very high	108 Å²	108	54.9 Å²	54.9	58%	0.578	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	137	174.5	-76.3	-78.6	0	0	0	112.3	K92	K92-D138 PolarHBondContact NZ-O 2.69Å
139	M	91	Very high	96.1	Very high	13 Å²	13	53 Å²	53	6%	0.064	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117.7	170.3	-177.1	179.8	-82.6	0	0	108.2	V80 I89 K92 G141 Q142 I144	V80-M139 HydrophobicContact CG1-SD 4.45Å; I89-M139 HydrophobicContact CD1-CE 3.52Å; I89-M139 HydrophobicContact CD1-SD 3.49Å; I89-M139 WeakPolarHBondContact CD1-SD 3.46Å; K92-M139 HydrophobicContact CB-CE 4.18Å; K92-M139 HydrophobicContact CD-CE 3.39Å; K92-M139 HydrophobicContact CG-CE 4.42Å; M139-G141 PolarHBondContact O-N 2.75Å; M139-G141 VanDerWaalsContact O-N 3.11Å; M139-Q142 PolarHBondContact N-O 3.46Å; M139-Q142 PolarHBondContact O-N 2.84Å; M139-Q142 VanDerWaalsContact O-O 3.08Å; M139-I144 HydrophobicContact CB-CG2 3.79Å; M139-I144 HydrophobicContact CE-CD1 4.18Å; M139-I144 HydrophobicContact SD-CG2 4.19Å
140	M	92.7	Very high	96	Very high	95 Å²	95	56 Å²	56	47%	0.468	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	34.2	-176.4	-57.3	-179.1	74	0	0	113.8	H81 E83 A84	H81-M140 HydrophobicContact CB-CB 3.86Å; H81-M140 HydrophobicContact CB-CG 4.37Å; H81-M140 HydrophobicContact CB-SD 3.95Å; E83-M140 HydrophobicContact CB-CE 4.48Å; A84-M140 HydrophobicContact CB-SD 3.78Å
141	G	93.3	Very high	95.7	Very high	72 Å²	72	59.4 Å²	59.4	74%	0.742	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	10.8	-179.8	0	0	0	0	0	115.3	M139	M139-G141 PolarHBondContact O-N 2.75Å; M139-G141 VanDerWaalsContact O-N 3.11Å
142	Q	93.5	Very high	95.3	Very high	79 Å²	79	65.1 Å²	65.1	37%	0.369	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.5	172.8	-174.2	172.8	-36.2	0	0	110.2	G79 M139	G79-Q142 PolarHBondContact O-NE2 3Å; M139-Q142 PolarHBondContact N-O 3.46Å; M139-Q142 PolarHBondContact O-N 2.84Å; M139-Q142 VanDerWaalsContact O-O 3.08Å
143	P	96.5	Very high	94.4	Very high	76 Å²	76	61.2 Å²	61.2	49%	0.494	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	135.2	175.1	28.3	-34.3	0	0	0	110.5
144	I	97.5	Very high	93.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	38%	0.38	C	S	.	.			trans	-96	146	171.6	66.4	178.6	0	0	0	110.4	V77 T78 K92 F93 L134 G136 Q137 M139 V146	V77-I144 HydrophobicContact CG1-CB 4.23Å; V77-I144 HydrophobicContact CG1-CD1 4.25Å; T78-I144 CarbonylContact O-C 3.57Å; T78-I144 VanDerWaalsContact O-CA 3.31Å; T78-I144 WeakPolarHBondContact O-CA 3.47Å; K92-I144 HydrophobicContact CD-CD1 4.33Å; F93-I144 HydrophobicContact CE2-CD1 4.23Å; F93-I144 HydrophobicContact CZ-CD1 4.39Å; L134-I144 HydrophobicContact CB-CD1 4.49Å; G136-I144 VanDerWaalsContact CA-O 3.28Å; G136-I144 WeakPolarHBondContact CA-O 3.48Å; G136-I144 PolarHBondContact N-O 3.08Å; Q137-I144 WeakPolarHBondContact O-CG1 3.43Å; Q137-I144 PolarHBondContact O-N 2.61Å; M139-I144 HydrophobicContact CB-CG2 3.79Å; M139-I144 HydrophobicContact CE-CD1 4.18Å; M139-I144 HydrophobicContact SD-CG2 4.19Å; I144-V146 HydrophobicContact CD1-CG2 4.24Å; I144-V146 HydrophobicContact CG1-CG2 4.32Å
145	S	97.5	Very high	91.8	Very high	52 Å²	52	68.7 Å²	68.7	36%	0.364	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	136.2	168.9	-61.2	0	0	0	0	109.3	V77 T78 N135	V77-S145 CarbonylContact C-O 3.54Å; V77-S145 WeakPolarHBondContact CA-O 3.39Å; T78-S145 PolarHBondContact N-O 3.25Å; T78-S145 PolarHBondContact O-N 3.19Å; T78-S145 WeakPolarHBondContact OG1-CB 3.17Å; N135-S145 WeakPolarHBondContact OD1-CA 3.38Å
146	V	97.7	Very high	90.3	Very high	0 Å²	0	74 Å²	74	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.5	-176.7	-173.9	0	0	0	0	108.7	L75 V77 F93 M131 L134 N135 I144	L75-V146 HydrophobicContact CB-CG1 4.17Å; L75-V146 HydrophobicContact CD1-CG1 3.9Å; L75-V146 HydrophobicContact CG-CG1 4.44Å; V77-V146 HydrophobicContact CG1-CG2 4.3Å; V77-V146 HydrophobicContact CG2-CG1 4.4Å; V77-V146 HydrophobicContact CG2-CG2 4.41Å; F93-V146 HydrophobicContact CE1-CG1 4.37Å; F93-V146 HydrophobicContact CZ-CG2 4.06Å; M131-V146 HydrophobicContact CB-CG1 4.22Å; M131-V146 HydrophobicContact CG-CG1 4.36Å; M131-V146 WeakPolarHBondContact CG-O 2.95Å; L134-V146 HydrophobicContact CB-CG2 4.07Å; N135-V146 HydrophobicContact CB-CB 4.15Å; N135-V146 PolarHBondContact OD1-N 3.26Å; I144-V146 HydrophobicContact CD1-CG2 4.24Å; I144-V146 HydrophobicContact CG1-CG2 4.32Å
147	D	97.1	Very high	88.4	Confident	79 Å²	79	75.3 Å²	75.3	42%	0.422	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	169.9	-178.6	-69.2	-67.1	0	0	0	111	L75 F76 M131 G149	L75-D147 CarbonylContact C-O 3.45Å; L75-D147 VanDerWaalsContact CA-O 3.31Å; L75-D147 WeakPolarHBondContact CA-O 3.47Å; F76-D147 PolarHBondContact N-O 3.39Å; F76-D147 PolarHBondContact O-N 3.11Å; M131-D147 VanDerWaalsContact CE-C 3.46Å; D147-G149 PolarHBondContact O-N 2.9Å
148	W	97	Very high	86.4	Confident	51 Å²	51	79.9 Å²	79.9	19%	0.193	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	130.7	171.3	-66.5	111	0	0	0	109.8	P66 W73 L75 Y124 A127 Q128 M131 F150	P66-W148 HydrophobicContact CB-CB 4.19Å; P66-W148 HydrophobicContact CB-CD2 3.33Å; P66-W148 HydrophobicContact CB-CE3 3.71Å; P66-W148 HydrophobicContact CB-CG 3.54Å; P66-W148 HydrophobicContact CB-CH2 4.49Å; P66-W148 HydrophobicContact CB-CZ2 4.19Å; P66-W148 HydrophobicContact CB-CZ3 4.27Å; P66-W148 HydrophobicContact CG-CD2 3.9Å; P66-W148 HydrophobicContact CG-CE3 4.39Å; P66-W148 HydrophobicContact CG-CG 4.31Å; P66-W148 HydrophobicContact CG-CH2 4.35Å; P66-W148 HydrophobicContact CG-CZ2 3.84Å; W73-W148 HydrophobicContact CB-CZ3 4.27Å; W73-W148 HydrophobicContact CE3-CE3 4.48Å; W73-W148 AromaticContact CE3-CZ3 4Å; W73-W148 HydrophobicContact CE3-CZ3 4Å; L75-W148 HydrophobicContact CD2-CD2 4.45Å; L75-W148 HydrophobicContact CD2-CE3 3.84Å; L75-W148 HydrophobicContact CD2-CZ3 4.02Å; Y124-W148 AromaticContact CD2-CH2 3.72Å; Y124-W148 HydrophobicContact CD2-CH2 3.72Å; Y124-W148 HydrophobicContact CD2-CZ2 4.28Å; Y124-W148 HydrophobicContact CD2-CZ3 4.42Å; Y124-W148 AromaticContact CE2-CH2 3.45Å; Y124-W148 HydrophobicContact CE2-CH2 3.45Å; Y124-W148 VanDerWaalsContact CE2-CH2 3.45Å; Y124-W148 AromaticContact CE2-CZ2 3.53Å; Y124-W148 HydrophobicContact CE2-CZ2 3.53Å; Y124-W148 HydrophobicContact CE2-CZ3 4.4Å; Y124-W148 AromaticContact CZ-CZ2 4Å; A127-W148 HydrophobicContact CB-CH2 4.02Å; A127-W148 HydrophobicContact CB-CZ3 3.68Å; Q128-W148 HydrophobicContact CB-CH2 4.08Å; Q128-W148 HydrophobicContact CB-CZ2 4.13Å; Q128-W148 HydrophobicContact CG-CZ2 4.25Å; M131-W148 HydrophobicContact CE-CB 4.27Å; M131-W148 HydrophobicContact CE-CD2 3.35Å; M131-W148 HydrophobicContact CE-CE3 3.97Å; M131-W148 HydrophobicContact CE-CG 3.49Å; M131-W148 VanDerWaalsContact CE-CG 3.49Å; M131-W148 HydrophobicContact CE-CZ2 3.99Å; M131-W148 VanDerWaalsContact CE-N 3.32Å; W148-F150 VanDerWaalsContact C-N 3.28Å; W148-F150 PolarHBondContact O-N 2.97Å
149	G	95.5	Very high	84.3	Confident	23 Å²	23	83.3 Å²	83.3	24%	0.237	45%	0.452	C	S	.	.	S	Bend	trans	-68	-29.4	178.8	0	0	0	0	0	113.4	I74 D147	I74-G149 WeakPolarHBondContact O-CA 3.31Å; I74-G149 PolarHBondContact O-N 3.17Å; D147-G149 PolarHBondContact O-N 2.9Å
150	F	94.8	Very high	82.2	Confident	103 Å²	103	94.1 Å²	94.1	45%	0.452	49%	0.493	S	S	.	.			trans	-138.5	138.4	175.5	-54.6	-76.4	0	0	0	110.6	Q67 S69 I74 W148	Q67-F150 HydrophobicContact CB-CB 3.99Å; Q67-F150 HydrophobicContact CG-CB 4.44Å; Q67-F150 PolarHBondContact N-O 3.32Å; S69-F150 WeakPolarHBondContact OG-CD2 3.5Å; I74-F150 HydrophobicContact CB-CD2 4.23Å; I74-F150 HydrophobicContact CB-CE2 4.06Å; I74-F150 HydrophobicContact CD1-CE2 3.83Å; I74-F150 HydrophobicContact CG1-CE2 4.4Å; I74-F150 HydrophobicContact CG2-CE2 4.21Å; W148-F150 VanDerWaalsContact C-N 3.28Å; W148-F150 PolarHBondContact O-N 2.97Å
151	V	92.9	Very high	79.8	Confident	72 Å²	72	93 Å²	93	44%	0.436	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-111	158.9	172.8	-64.2	0	0	0	0	109.7	P64	P64-V151 HydrophobicContact CB-CB 4.31Å; P64-V151 HydrophobicContact CG-CB 3.99Å; P64-V151 HydrophobicContact CG-CG2 4Å
152	R	88.3	Confident	77.5	Confident	147 Å²	147	93.3 Å²	93.3	56%	0.555	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-60	151.9	169.8	-72.9	167.4	-175.5	-130.2	-0.1	109.7	P64 G65 Q67	P64-R152 HydrophobicContact CB-CB 3.94Å; P64-R152 WeakPolarHBondContact CB-O 3.47Å; P64-R152 WeakPolarHBondContact CG-O 3.37Å; G65-R152 WeakPolarHBondContact O-CB 3.5Å; G65-R152 WeakPolarHBondContact O-CD 3.26Å; G65-R152 WeakPolarHBondContact O-CG 3.33Å; G65-R152 PolarHBondContact O-N 3.33Å; Q67-R152 HydrophobicContact CB-CG 4.44Å
153	G	78.8	Confident	75.2	Confident	56 Å²	56	92.3 Å²	92.3	58%	0.577	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-57.5	157.5	173.9	0	0	0	0	0	111.5
154	P	74.5	Confident	72.8	Confident	98 Å²	98	100.6 Å²	100.6	64%	0.636	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-54.1	143	177.7	23.6	-33.4	0	0	0	110	K156	P154-K156 PolarHBondContact O-N 2.67Å
155	P	65.6	Low	70.7	Confident	97 Å²	97	111.5 Å²	111.5	63%	0.63	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-58.1	118.4	178.3	24.1	-32.3	0	0	0	108.1	S157	P155-S157 PolarHBondContact O-N 3.26Å
156	K	64.8	Low	68.2	Low	189 Å²	189	118.7 Å²	118.7	82%	0.822	60%	0.601	S	S	*	*			trans	-52.3	110	174.9	-70.3	-173.2	178.2	-176.7	0	107.2	P154 K158	P154-K156 PolarHBondContact O-N 2.67Å; K156-K158 PolarHBondContact O-N 2.63Å
157	S	57.9	Low	66.1	Low	74 Å²	74	124.3 Å²	124.3	52%	0.517	64%	0.641	S	S	.	*			trans	-59.4	110.4	175.4	90.3	0	0	0	0	105.3	D20 P155 R159	D20-S157 PolarHBondContact OD2-OG 2.77Å; P155-S157 PolarHBondContact O-N 3.26Å; S157-R159 PolarHBondContact O-N 2.94Å
158	K	53.1	Low	64	Low	193 Å²	193	130.8 Å²	130.8	84%	0.839	66%	0.659	S	S	*	*			trans	-62.8	96.2	165.5	-83	-178.7	-177.9	171	0	102.9	K156 R160	K156-K158 PolarHBondContact O-N 2.63Å; K158-R160 VanDerWaalsContact C-N 3.28Å; K158-R160 WeakPolarHBondContact O-CA 3.47Å; K158-R160 PolarHBondContact O-N 3.15Å
159	R	50.7	Low	62.1	Low	180 Å²	180	133.4 Å²	133.4	68%	0.679	69%	0.685	S	S	*	*			trans	-33.9	101	171.2	-79.8	-176	146.4	164.6	-4.9	106	E19 S157 G161	E19-R159 IonicContact OE2-CZ 3.9Å; E19-R159 IonicContact OE2-NH1 3.69Å; E19-R159 IonicContact OE2-NH2 2.77Å; E19-R159 PolarHBondContact OE2-NH2 2.77Å; S157-R159 PolarHBondContact O-N 2.94Å; R159-G161 VanDerWaalsContact C-N 3.31Å; R159-G161 PolarHBondContact O-N 2.64Å
160	R	46.8	Very low	60.5	Low	241 Å²	241	138 Å²	138	91%	0.909	71%	0.711	S	S	*	*			trans	-57.9	110.3	-178.2	-74.5	-177.7	90.4	173.9	9.8	102.3	K158 G162	K158-R160 VanDerWaalsContact C-N 3.28Å; K158-R160 WeakPolarHBondContact O-CA 3.47Å; K158-R160 PolarHBondContact O-N 3.15Å; R160-G162 PolarHBondContact O-N 3.15Å
161	G	42.2	Very low	58.9	Low	72 Å²	72	139.2 Å²	139.2	74%	0.742	72%	0.722	S	S	*	*			trans	-42.8	119	-169.4	0	0	0	0	0	107	R159 G163	R159-G161 VanDerWaalsContact C-N 3.31Å; R159-G161 PolarHBondContact O-N 2.64Å; G161-G163 PolarHBondContact O-N 2.66Å
162	G	45	Very low	57.2	Low	78 Å²	78	147.4 Å²	147.4	80%	0.804	75%	0.745	S	S	*	*			trans	-62	70.3	165.3	0	0	0	0	0	106.7	R160 R164	R160-G162 PolarHBondContact O-N 3.15Å; G162-R164 PolarHBondContact O-N 3.17Å
163	G	44.7	Very low	55.5	Low	58 Å²	58	150.5 Å²	150.5	60%	0.598	76%	0.757	S	S	*	*			trans	-62.2	91.4	164.7	0	0	0	0	0	103.1	G161 R165	G161-G163 PolarHBondContact O-N 2.66Å; G163-R165 PolarHBondContact O-N 3.03Å
164	R	46.5	Very low	54.5	Low	249 Å²	249	159.6 Å²	159.6	94%	0.94	77%	0.773	S	S	*	*			trans	-39.9	92.7	167	-92	173.9	163.9	167.2	-4.5	106.7	G162 R166	G162-R164 PolarHBondContact O-N 3.17Å; R164-R166 VanDerWaalsContact C-N 3.32Å; R164-R166 PolarHBondContact O-N 3.22Å
165	R	53.7	Low	53.7	Low	229 Å²	229	170.5 Å²	170.5	86%	0.864	80%	0.802	S	S	*	*			trans	-67.2	102.3	169.8	-80.9	-176.2	173.8	-169.2	-0.1	104.6	G163	G163-R165 PolarHBondContact O-N 3.03Å
166	R	45.2	Very low	53.1	Low	203 Å²	203	174.2 Å²	174.2	77%	0.766	81%	0.811	S	S	*	*			trans	60.2	82.7	139.9	-56.5	173.2	176.9	175.2	-1.8	115.3	R164 R168	R164-R166 VanDerWaalsContact C-N 3.32Å; R164-R166 PolarHBondContact O-N 3.22Å; R166-R168 VanDerWaalsContact C-N 3.32Å
167	S	52.5	Low	52.5	Low	119 Å²	119	173.4 Å²	173.4	83%	0.832	81%	0.81	S	S	*	*			trans	-88.8	82.8	132.1	47	0	0	0	0	107.8	S169	S167-S169 PolarHBondContact O-N 2.96Å
168	R	54.2	Low	52.2	Low	215 Å²	215	178.9 Å²	178.9	81%	0.811	83%	0.826	S	S	*	*			trans	-61.6	115.4	154.4	-86.6	178.4	168.4	170.4	-5.7	105.5	R166	R166-R168 VanDerWaalsContact C-N 3.32Å
169	S	56.7	Low	52.2	Low	105 Å²	105	178.1 Å²	178.1	73%	0.734	83%	0.825	S	S	*	*			trans	-46.3	142.1	180	-49.2	0	0	0	0	112.5	S167 D171	S167-S169 PolarHBondContact O-N 2.96Å; S169-D171 PolarHBondContact O-N 3.15Å
170	P	61.7	Low	52.3	Low	121 Å²	121	177.9 Å²	177.9	79%	0.786	84%	0.835	S	S	*	*			trans	-71.5	113.7	153.9	-10	26.4	0	0	0	108.3	R172	P170-R172 PolarHBondContact O-N 3.34Å; P170-R172 VanDerWaalsContact O-N 3.15Å
171	D	61.9	Low	52.6	Low	127 Å²	127	173.7 Å²	173.7	68%	0.679	83%	0.83	S	S	*	*			trans	-58.6	110.6	165.3	-177.3	55.1	0	0	0	108.8	S169 R173	S169-D171 PolarHBondContact O-N 3.15Å; D171-R173 VanDerWaalsContact C-N 3.34Å; D171-R173 PolarHBondContact O-N 3.28Å
172	R	57.1	Low	53.4	Low	245 Å²	245	181 Å²	181	93%	0.925	84%	0.836	S	S	*	*			trans	-88.8	77.3	169.5	-76.6	-167.9	-176.7	-166.8	2.7	109	P170	P170-R172 PolarHBondContact O-N 3.34Å; P170-R172 VanDerWaalsContact O-N 3.15Å
173	R	52.7	Low	54	Low	211 Å²	211	188.9 Å²	188.9	80%	0.796	84%	0.838	S	S	*	*			trans	-100.5	109.8	150.6	-78.6	-175.8	174	-167.5	-0.2	108.2	D171	D171-R173 VanDerWaalsContact C-N 3.34Å; D171-R173 PolarHBondContact O-N 3.28Å
174	R	58	Low	54.8	Low	247 Å²	247	199.8 Å²	199.8	93%	0.932	86%	0.858	S	S	*	*			trans	-164.9	119.8	155.3	-109.3	171.7	-166.6	-153.7	3.1	111.4
175	R	57.4	Low	55.5	Low	327 Å²	327	195.4 Å²	195.4	100%	1.234	85%	0.851	S	S	*	*			trans	80.4	0	173.3	-68.8	-168.8	176	-150.9	-1.2	117.2

Retrieved 175 of 175 residues in 43.6 ms (Link to these results)

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