A0A087XEY5_POEFO Loading...

12S rRNA N(4)-cytidine methyltransferase METTL15

N4-methylcytidine (m4C) methyltransferase responsible for the methylation of position C839 in mitochondrial 12S rRNA. Involved in the stabilization of 12S rRNA folding, therefore facilitating the assembly of the mitochondrial small ribosomal subunits.

AlphaFold DB , UniProt , Accession A0A087XEY5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 388 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.2	Very low	33.1	Very low	246 Å²	246	154.1 Å²	154.1	100%	1.212	77%	0.766	S	S	*	*				0	55.2	0	-158.9	176.6	-177	0	0	110.6
2	L	23.6	Very low	33.4	Very low	168 Å²	168	148.6 Å²	148.6	88%	0.88	75%	0.747	S	S	*	*			trans	-151	72	172.7	-90	166.2	0	0	0	106.8
3	F	31.2	Very low	34.2	Very low	210 Å²	210	142.8 Å²	142.8	92%	0.921	72%	0.72	S	S	*	*			trans	-153	61.6	176.4	-100.3	-79	0	0	0	108.6
4	I	33.9	Very low	34.5	Very low	167 Å²	167	139 Å²	139	86%	0.856	71%	0.71	S	S	*	*			trans	-142.3	75.9	169.8	-51.7	178.2	0	0	0	108
5	S	32.9	Very low	35	Very low	111 Å²	111	131.3 Å²	131.3	78%	0.776	68%	0.675	S	S	*	*	S	Bend	trans	-179.7	68.1	157.8	50.8	0	0	0	0	110.7
6	N	36.1	Very low	35.4	Very low	148 Å²	148	125.3 Å²	125.3	79%	0.791	65%	0.652	S	S	*	*			trans	168.1	106.7	148.7	-99.6	-45.6	0	0	0	103.9
7	I	37.3	Very low	35.7	Very low	110 Å²	110	125.6 Å²	125.6	56%	0.564	64%	0.642	S	S	*	*				-173.9	111.1	112.3	-57.8	110.7	0	0	0	107.2	I9 W10	I7-I9 VanDerWaalsContact C-N 3.31Å; I7-I9 HydrophobicContact CG2-CB 3.82Å; I7-W10 HydrophobicContact CB-CG 4.46Å; I7-W10 HydrophobicContact CD1-CZ2 4.28Å; I7-W10 HydrophobicContact CG2-CG 4.13Å
8	M	29.9	Very low	36	Very low	166 Å²	166	128.7 Å²	128.7	82%	0.818	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	23.1	173.5	-123.3	-175.7	-171	0	0	113.4
9	I	36.1	Very low	36.6	Very low	82 Å²	82	123.5 Å²	123.5	42%	0.421	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107	-6.5	176.8	-69.8	166.3	0	0	0	113.4	I7 K11 D327	I7-I9 VanDerWaalsContact C-N 3.31Å; I7-I9 HydrophobicContact CG2-CB 3.82Å; I9-K11 PolarHBondContact O-N 2.92Å; I9-D327 WeakPolarHBondContact CD1-OD2 3.41Å; I9-D327 WeakPolarHBondContact CG1-OD2 3.49Å; I9-D327 WeakPolarHBondContact CG2-OD2 3.02Å
10	W	41.6	Very low	36.9	Very low	111 Å²	111	123.2 Å²	123.2	42%	0.42	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.4	3	178.1	-51.3	90	0	0	0	115.2	I7 W20	I7-W10 HydrophobicContact CB-CG 4.46Å; I7-W10 HydrophobicContact CD1-CZ2 4.28Å; I7-W10 HydrophobicContact CG2-CG 4.13Å; W10-W20 HydrophobicContact CZ3-CG 4.26Å
11	K	32.8	Very low	37	Very low	176 Å²	176	124 Å²	124	77%	0.765	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-7.3	-175.1	-80.8	-169.3	176.8	-178	0	114.9	I9	I9-K11 PolarHBondContact O-N 2.92Å
12	T	37.6	Very low	37.7	Very low	88 Å²	88	114.1 Å²	114.1	54%	0.54	57%	0.566	S	S	.	*	S	Bend	trans	-120.2	2.2	-172.6	51.1	0	0	0	0	116.8	R328	T12-R328 VanDerWaalsContact CG2-NH2 3.29Å
13	N	43	Very low	38.7	Very low	73 Å²	73	108.3 Å²	108.3	39%	0.39	54%	0.535	S	S	.	.			trans	-130.2	93.4	170.9	-164.3	-21.8	0	0	0	112.4	A15 A16 R17	N13-A15 PolarHBondContact O-N 3.17Å; N13-A15 WeakPolarHBondContact OD1-CB 2.93Å; N13-A15 PolarHBondContact OD1-N 3.21Å; N13-A15 VanDerWaalsContact OD1-N 3.14Å; N13-A16 HydrophobicContact CB-CB 4.12Å; N13-A16 PolarHBondContact O-N 3.26Å; N13-A16 PolarHBondContact OD1-N 2.8Å; N13-R17 PolarHBondContact O-N 3.5Å
14	P	38.3	Very low	39.1	Very low	90 Å²	90	102.3 Å²	102.3	58%	0.584	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-20.9	179.6	-20.8	31.4	0	0	0	114.5	R18	P14-R18 WeakPolarHBondContact O-CG 3.35Å; P14-R18 PolarHBondContact O-N 3.34Å; P14-R18 PolarHBondContact O-NE 3.47Å
15	A	42.7	Very low	39.4	Very low	23 Å²	23	100.5 Å²	100.5	19%	0.19	50%	0.503	C	S	.	.	H	α-helix	trans	-77.3	-47.6	177.9	0	0	0	0	0	111.2	N13 R17 R18 A19	N13-A15 PolarHBondContact O-N 3.17Å; N13-A15 WeakPolarHBondContact OD1-CB 2.93Å; N13-A15 PolarHBondContact OD1-N 3.21Å; N13-A15 VanDerWaalsContact OD1-N 3.14Å; A15-R17 VanDerWaalsContact C-N 3.27Å; A15-R17 PolarHBondContact O-N 2.82Å; A15-R18 PolarHBondContact O-N 2.83Å; A15-R18 VanDerWaalsContact O-N 3.14Å; A15-A19 PolarHBondContact O-N 2.88Å
16	A	41.4	Very low	40	Very low	36 Å²	36	103.2 Å²	103.2	30%	0.298	50%	0.496	S	S	.	.	H	α-helix	trans	-59.8	-37.1	175.1	0	0	0	0	0	112.3	N13 W20	N13-A16 HydrophobicContact CB-CB 4.12Å; N13-A16 PolarHBondContact O-N 3.26Å; N13-A16 PolarHBondContact OD1-N 2.8Å; A16-W20 VanDerWaalsContact O-CB 3.31Å; A16-W20 WeakPolarHBondContact O-CB 3.48Å; A16-W20 PolarHBondContact O-N 3.43Å
17	R	39.4	Very low	40.2	Very low	130 Å²	130	101.5 Å²	101.5	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-66.9	-36.6	176.3	-169.9	177.2	178.3	-158.4	-0.3	113.3	N13 A15 R21	N13-R17 PolarHBondContact O-N 3.5Å; A15-R17 VanDerWaalsContact C-N 3.27Å; A15-R17 PolarHBondContact O-N 2.82Å; R17-R21 WeakPolarHBondContact O-CG 3.28Å; R17-R21 PolarHBondContact O-N 3.37Å; R17-R21 VanDerWaalsContact O-N 3.13Å
18	R	41.9	Very low	40.2	Very low	182 Å²	182	102.9 Å²	102.9	69%	0.687	50%	0.495	S	S	*	.	H	α-helix	trans	-74.4	-40.5	176.9	-78.7	-176.2	-73.7	-179.9	0.8	111.6	P14 A15 R21 S22	P14-R18 WeakPolarHBondContact O-CG 3.35Å; P14-R18 PolarHBondContact O-N 3.34Å; P14-R18 PolarHBondContact O-NE 3.47Å; A15-R18 PolarHBondContact O-N 2.83Å; A15-R18 VanDerWaalsContact O-N 3.14Å; R18-R21 PolarHBondContact O-N 2.97Å; R18-S22 WeakPolarHBondContact O-CB 3.21Å; R18-S22 PolarHBondContact O-N 2.9Å
19	A	46.5	Very low	40.5	Very low	30 Å²	30	99.4 Å²	99.4	25%	0.248	49%	0.486	C	S	.	.	H	α-helix	trans	-62.3	-44.2	174.4	0	0	0	0	0	111.8	A15 S22 L23	A15-A19 PolarHBondContact O-N 2.88Å; A19-S22 PolarHBondContact O-N 3.31Å; A19-L23 WeakPolarHBondContact O-CB 3.17Å; A19-L23 PolarHBondContact O-N 3.22Å
20	W	43.4	Very low	40.5	Very low	116 Å²	116	99.2 Å²	99.2	44%	0.439	50%	0.497	S	S	.	.	H	α-helix	trans	-66.4	-40.7	177.2	-173.7	78.4	0	0	0	113.2	W10 A16 S22 L23 M24	W10-W20 HydrophobicContact CZ3-CG 4.26Å; A16-W20 VanDerWaalsContact O-CB 3.31Å; A16-W20 WeakPolarHBondContact O-CB 3.48Å; A16-W20 PolarHBondContact O-N 3.43Å; W20-S22 VanDerWaalsContact C-N 3.31Å; W20-S22 PolarHBondContact O-N 2.67Å; W20-L23 PolarHBondContact O-N 3.31Å; W20-M24 HydrophobicContact CD2-CG 4.31Å; W20-M24 HydrophobicContact CH2-CE 4.15Å; W20-M24 HydrophobicContact CH2-CG 4.42Å; W20-M24 HydrophobicContact CZ2-CE 3.39Å; W20-M24 HydrophobicContact CZ2-CG 4.14Å; W20-M24 PolarHBondContact O-N 2.94Å
21	R	38.5	Very low	40	Very low	142 Å²	142	100.3 Å²	100.3	54%	0.536	52%	0.516	S	S	.	.	H	α-helix	trans	-62.2	-39.1	171.8	-78.9	-177.4	174.4	-158.3	-5.6	111.9	R17 R18 L25	R17-R21 WeakPolarHBondContact O-CG 3.28Å; R17-R21 PolarHBondContact O-N 3.37Å; R17-R21 VanDerWaalsContact O-N 3.13Å; R18-R21 PolarHBondContact O-N 2.97Å; R21-L25 WeakPolarHBondContact O-CB 3.36Å; R21-L25 WeakPolarHBondContact O-CD1 3.47Å; R21-L25 WeakPolarHBondContact O-CG 3.43Å; R21-L25 PolarHBondContact O-N 3.13Å
22	S	42.6	Very low	39.7	Very low	38 Å²	38	96.9 Å²	96.9	27%	0.266	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-33.4	176.5	-168.8	0	0	0	0	112.7	R18 A19 W20 R26	R18-S22 WeakPolarHBondContact O-CB 3.21Å; R18-S22 PolarHBondContact O-N 2.9Å; A19-S22 PolarHBondContact O-N 3.31Å; W20-S22 VanDerWaalsContact C-N 3.31Å; W20-S22 PolarHBondContact O-N 2.67Å; S22-R26 VanDerWaalsContact O-CG 3.28Å; S22-R26 WeakPolarHBondContact O-CG 3.34Å; S22-R26 PolarHBondContact O-N 3.18Å; S22-R26 PolarHBondContact O-NE 2.89Å; S22-R26 PolarHBondContact OG-NE 3.08Å; S22-R26 PolarHBondContact OG-NH2 2.92Å
23	L	45.5	Very low	39.2	Very low	45 Å²	45	96.2 Å²	96.2	24%	0.236	53%	0.531	C	S	.	.	H	α-helix	trans	-67.3	-48.4	173.7	178.2	59.3	0	0	0	111.3	A19 W20 L25 R26 L27 T198	A19-L23 WeakPolarHBondContact O-CB 3.17Å; A19-L23 PolarHBondContact O-N 3.22Å; W20-L23 PolarHBondContact O-N 3.31Å; L23-L25 VanDerWaalsContact C-N 3.3Å; L23-L25 PolarHBondContact O-N 3.48Å; L23-R26 PolarHBondContact O-N 2.92Å; L23-R26 VanDerWaalsContact O-N 3.15Å; L23-L27 HydrophobicContact CD1-CD1 3.85Å; L23-L27 HydrophobicContact CD1-CG 4.09Å; L23-L27 HydrophobicContact CG-CD1 3.88Å; L23-L27 WeakPolarHBondContact O-CG 3.07Å; L23-L27 PolarHBondContact O-N 3.17Å; L23-T198 HydrophobicContact CD1-CG2 4.08Å
24	M	39.4	Very low	38.5	Very low	85 Å²	85	101.5 Å²	101.5	42%	0.419	56%	0.559	S	S	.	*	H	α-helix	trans	-62.4	-35.7	176.9	-75.8	-65.5	-163.2	0	0	112.8	W20 N28	W20-M24 HydrophobicContact CD2-CG 4.31Å; W20-M24 HydrophobicContact CH2-CE 4.15Å; W20-M24 HydrophobicContact CH2-CG 4.42Å; W20-M24 HydrophobicContact CZ2-CE 3.39Å; W20-M24 HydrophobicContact CZ2-CG 4.14Å; W20-M24 PolarHBondContact O-N 2.94Å; M24-N28 PolarHBondContact O-N 2.84Å
25	L	39.6	Very low	37.8	Very low	129 Å²	129	102 Å²	102	68%	0.675	56%	0.564	S	S	*	*	H	α-helix	trans	-71	-29.6	176	-74.2	164.3	0	0	0	113	R21 L23 S29	R21-L25 WeakPolarHBondContact O-CB 3.36Å; R21-L25 WeakPolarHBondContact O-CD1 3.47Å; R21-L25 WeakPolarHBondContact O-CG 3.43Å; R21-L25 PolarHBondContact O-N 3.13Å; L23-L25 VanDerWaalsContact C-N 3.3Å; L23-L25 PolarHBondContact O-N 3.48Å; L25-S29 PolarHBondContact O-OG 3.21Å
26	R	45.8	Very low	37.1	Very low	168 Å²	168	106.4 Å²	106.4	63%	0.634	59%	0.593	S	S	*	*	H	α-helix	trans	-82.4	-34.4	177.5	-73.9	177.1	-137.5	-118.4	5.2	113.1	S22 L23 N28 S29	S22-R26 VanDerWaalsContact O-CG 3.28Å; S22-R26 WeakPolarHBondContact O-CG 3.34Å; S22-R26 PolarHBondContact O-N 3.18Å; S22-R26 PolarHBondContact O-NE 2.89Å; S22-R26 PolarHBondContact OG-NE 3.08Å; S22-R26 PolarHBondContact OG-NH2 2.92Å; L23-R26 PolarHBondContact O-N 2.92Å; L23-R26 VanDerWaalsContact O-N 3.15Å; R26-N28 VanDerWaalsContact C-N 3.31Å; R26-S29 PolarHBondContact O-N 2.78Å; R26-S29 PolarHBondContact O-OG 3.41Å
27	L	41.8	Very low	36.4	Very low	111 Å²	111	108.2 Å²	108.2	58%	0.581	62%	0.615	S	S	*	*	H	α-helix	trans	-68.4	-31.9	175.7	-70.9	169.3	0	0	0	111.7	L23 S29	L23-L27 HydrophobicContact CD1-CD1 3.85Å; L23-L27 HydrophobicContact CD1-CG 4.09Å; L23-L27 HydrophobicContact CG-CD1 3.88Å; L23-L27 WeakPolarHBondContact O-CG 3.07Å; L23-L27 PolarHBondContact O-N 3.17Å; L27-S29 VanDerWaalsContact C-N 3.3Å; L27-S29 PolarHBondContact O-N 2.86Å
28	N	37	Very low	36.1	Very low	140 Å²	140	108.7 Å²	108.7	75%	0.749	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-6.7	174.8	-77.8	-5.9	0	0	0	114.5	M24 R26	M24-N28 PolarHBondContact O-N 2.84Å; R26-N28 VanDerWaalsContact C-N 3.31Å
29	S	34.8	Very low	35.3	Very low	92 Å²	92	103.6 Å²	103.6	64%	0.643	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	7.9	-176.6	63.4	0	0	0	0	114.6	L25 R26 L27	L25-S29 PolarHBondContact O-OG 3.21Å; R26-S29 PolarHBondContact O-N 2.78Å; R26-S29 PolarHBondContact O-OG 3.41Å; L27-S29 VanDerWaalsContact C-N 3.3Å; L27-S29 PolarHBondContact O-N 2.86Å
30	A	36.3	Very low	34.3	Very low	79 Å²	79	107.7 Å²	107.7	65%	0.653	67%	0.667	S	S	*	*			trans	-123.8	77.8	179.5	0	0	0	0	0	110.7
31	T	30.8	Very low	33.4	Very low	134 Å²	134	113.5 Å²	113.5	82%	0.822	69%	0.689	S	S	*	*			trans	-134.9	102.6	163.7	41.4	0	0	0	0	109.3
32	A	27.8	Very low	32.9	Very low	104 Å²	104	114.7 Å²	114.7	86%	0.86	71%	0.706	S	S	*	*			trans	-166.1	115.6	161.1	0	0	0	0	0	111.7
33	G	25.6	Very low	32.1	Very low	73 Å²	73	123.5 Å²	123.5	75%	0.753	73%	0.733	S	S	*	*			trans	69.5	137.3	154.3	0	0	0	0	0	117.5
34	L	28.3	Very low	31.3	Very low	185 Å²	185	126.9 Å²	126.9	97%	0.969	76%	0.76	S	S	*	*			cis	-162.4	164.5	31.6	-95.1	124.5	0	0	0	110.6
35	S	25.5	Very low	30.9	Very low	99 Å²	99	131 Å²	131	69%	0.692	78%	0.784	S	S	*	*			trans	-97.2	154.1	-171.7	62.4	0	0	0	0	115.7
36	S	26.9	Very low	30.3	Very low	116 Å²	116	128.3 Å²	128.3	81%	0.811	79%	0.788	S	S	*	*			trans	52.3	132.5	136.8	67.4	0	0	0	0	123.6
37	G	26.2	Very low	29.5	Very low	74 Å²	74	128.4 Å²	128.4	76%	0.763	80%	0.8	S	S	*	*			trans	177.4	130.2	147.8	0	0	0	0	0	112.7
38	P	33	Very low	28.9	Very low	140 Å²	140	128.3 Å²	128.3	91%	0.909	81%	0.808	S	S	*	*			trans	-104.8	161.3	-165.2	39	-32.7	0	0	0	115.3
39	G	26	Very low	28.4	Very low	76 Å²	76	127 Å²	127	78%	0.784	81%	0.809	S	S	*	*			trans	161.8	149.9	164	0	0	0	0	0	110.6
40	S	25.2	Very low	28	Very low	116 Å²	116	129.4 Å²	129.4	81%	0.811	82%	0.819	S	S	*	*			cis	-162.4	151.4	-14.3	44.6	0	0	0	0	104.5
41	W	24.6	Very low	27.7	Very low	238 Å²	238	130.4 Å²	130.4	90%	0.902	82%	0.822	S	S	*	*			trans	-72.2	133.9	-177.3	-65.9	69.7	0	0	0	110.7
42	D	27.3	Very low	27.6	Very low	166 Å²	166	128.4 Å²	128.4	89%	0.888	82%	0.819	S	S	*	*			trans	-138.4	126.2	156.1	-126.3	-16.5	0	0	0	110.2
43	R	27	Very low	27.8	Very low	224 Å²	224	132.4 Å²	132.4	85%	0.845	82%	0.82	S	S	*	*			trans	-96	129.1	177.3	-76.9	179.6	177.8	-177.4	-0.9	107.5
44	S	29.2	Very low	28.4	Very low	115 Å²	115	136.9 Å²	136.9	80%	0.804	82%	0.819	S	S	*	*			trans	-137.2	113.2	159.3	56.8	0	0	0	0	109.1
45	D	30.5	Very low	29	Very low	172 Å²	172	133.2 Å²	133.2	92%	0.92	81%	0.806	S	S	*	*			trans	-55	130.1	170.1	-74	-45	0	0	0	110.8
46	G	26.8	Very low	30.4	Very low	73 Å²	73	134.3 Å²	134.3	75%	0.753	81%	0.81	S	S	*	*			trans	-140.5	113.4	176.4	0	0	0	0	0	109.8
47	L	28.2	Very low	32.3	Very low	169 Å²	169	132.8 Å²	132.8	89%	0.885	79%	0.79	S	S	*	*			trans	-44.5	138.9	-177.6	-94.9	63	0	0	0	114.6
48	S	30.5	Very low	34.8	Very low	109 Å²	109	134.3 Å²	134.3	76%	0.762	78%	0.779	S	S	*	*			trans	-36.1	124	167.6	55.7	0	0	0	0	115.4
49	C	25.3	Very low	37.5	Very low	114 Å²	114	128.9 Å²	128.9	77%	0.77	74%	0.743	S	S	*	*			trans	-111	110.1	140.9	62.4	0	0	0	0	107	S51	C49-S51 PolarHBondContact O-N 3.34Å
50	V	27.2	Very low	40.7	Very low	141 Å²	141	125.8 Å²	125.8	86%	0.855	71%	0.709	S	S	*	*			trans	-67.1	93.4	169.2	-179	0	0	0	0	105.5	A52	V50-A52 PolarHBondContact O-N 2.6Å
51	S	29.1	Very low	43.9	Very low	100 Å²	100	120.8 Å²	120.8	70%	0.699	67%	0.673	S	S	*	*			trans	-57.2	110.6	168.4	41.3	0	0	0	0	106.8	C49 E53	C49-S51 PolarHBondContact O-N 3.34Å; S51-E53 PolarHBondContact O-N 2.86Å
52	A	30	Very low	47.2	Very low	92 Å²	92	111.6 Å²	111.6	76%	0.76	64%	0.641	S	S	*	*			trans	-45.9	112	173	0	0	0	0	0	108.4	V50 K54	V50-A52 PolarHBondContact O-N 2.6Å; A52-K54 PolarHBondContact O-N 3.26Å
53	E	31.7	Very low	50.4	Low	188 Å²	188	110.3 Å²	110.3	88%	0.879	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-55.5	116.2	179	-72.4	-171.2	163.9	0	0	107.3	S51	S51-E53 PolarHBondContact O-N 2.86Å
54	K	38.3	Very low	53.6	Low	168 Å²	168	101 Å²	101	73%	0.73	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-54.4	130.3	168.9	-81.5	176.5	178	170.5	0	106.3	A52	A52-K54 PolarHBondContact O-N 3.26Å
55	P	40.7	Very low	56.8	Low	108 Å²	108	95.5 Å²	95.5	70%	0.701	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-52	138.3	-179.8	19.9	-31	0	0	0	108.8	H57	P55-H57 PolarHBondContact O-N 3.18Å
56	P	55.1	Low	59.9	Low	121 Å²	121	89.7 Å²	89.7	79%	0.786	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-51.1	129.7	-179	17.6	-29.2	0	0	0	108.8	M58	P56-M58 PolarHBondContact O-N 3.15Å; P56-M58 VanDerWaalsContact O-N 3.08Å
57	H	65.9	Low	63.2	Low	85 Å²	85	92.3 Å²	92.3	39%	0.394	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-55.1	120.9	-174.2	-75.5	-60.3	0	0	0	110.5	P55 D163 R376	P55-H57 PolarHBondContact O-N 3.18Å; H57-D163 IonicContact CD2-OD2 3.39Å; H57-D163 IonicContact CE1-OD2 3.4Å; H57-D163 IonicContact NE2-OD2 2.65Å; H57-D163 PolarHBondContact NE2-OD2 3.19Å; H57-R376 PolarHBondContact CD2-NH1 3.37Å; H57-R376 VanDerWaalsContact CD2-NH1 3.27Å; H57-R376 PolarHBondContact CE1-NH1 3.01Å; H57-R376 PolarHBondContact ND1-NH1 3.17Å; H57-R376 PolarHBondContact NE2-NH1 3.22Å
58	M	79.9	Confident	66.5	Low	106 Å²	106	85.9 Å²	85.9	52%	0.522	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-59.5	130.9	172.8	-81.7	176.6	41.9	0	0	109.7	P56 N374	P56-M58 PolarHBondContact O-N 3.15Å; P56-M58 VanDerWaalsContact O-N 3.08Å; M58-N374 PolarHBondContact O-ND2 2.98Å
59	P	89.6	Confident	69.5	Low	25 Å²	25	80.7 Å²	80.7	16%	0.162	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-60.3	148.4	172.6	-21.9	32.6	0	0	0	111.7	L62 H87	P59-L62 HydrophobicContact CB-CB 4.23Å; P59-L62 HydrophobicContact CB-CD1 4.16Å; P59-L62 HydrophobicContact CG-CD1 4.11Å; P59-L62 HydrophobicContact CG-CD2 4.4Å; P59-H87 VanDerWaalsContact CB-CE1 3.43Å; P59-H87 WeakPolarHBondContact CB-CE1 3.39Å; P59-H87 WeakPolarHBondContact CB-NE2 3.26Å
60	V	91.9	Very high	72.9	Confident	11 Å²	11	78 Å²	78	7%	0.067	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	132.1	178.8	169.5	0	0	0	0	109.3	L62 H87 I304 F306 R376 A380	V60-L62 PolarHBondContact O-N 2.99Å; V60-H87 PolarHBondContact O-CE1 2.86Å; V60-H87 PolarHBondContact O-NE2 2.92Å; V60-I304 HydrophobicContact CG1-CG2 4.41Å; V60-F306 HydrophobicContact CB-CE1 4.36Å; V60-F306 HydrophobicContact CB-CZ 4.38Å; V60-F306 HydrophobicContact CG1-CE1 4Å; V60-F306 HydrophobicContact CG1-CZ 4.31Å; V60-F306 HydrophobicContact CG2-CE1 4.13Å; V60-F306 HydrophobicContact CG2-CZ 4.4Å; V60-R376 HydrophobicContact CG2-CB 4.21Å; V60-A380 HydrophobicContact CG1-CB 3.42Å; V60-A380 VanDerWaalsContact CG1-CB 3.42Å
61	M	93.8	Very high	76.2	Confident	11 Å²	11	72 Å²	72	5%	0.054	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	35.8	179	-58.6	-175.7	75.2	0	0	113.6	K63 E64 V65 V364 P366 A380 L382	M61-K63 VanDerWaalsContact C-N 3.34Å; M61-K63 PolarHBondContact O-N 3.35Å; M61-E64 WeakPolarHBondContact CA-OE2 3.39Å; M61-E64 HydrophobicContact CB-CB 4.42Å; M61-E64 HydrophobicContact CE-CB 4.31Å; M61-E64 HydrophobicContact CE-CG 4.22Å; M61-E64 PolarHBondContact O-N 3.34Å; M61-V65 WeakPolarHBondContact O-CB 3.44Å; M61-V65 VanDerWaalsContact O-CG2 3.26Å; M61-V65 WeakPolarHBondContact O-CG2 3.04Å; M61-V65 PolarHBondContact O-N 3.25Å; M61-V364 HydrophobicContact CE-CB 4.1Å; M61-V364 HydrophobicContact CE-CG1 3.66Å; M61-P366 HydrophobicContact CG-CB 4.08Å; M61-P366 HydrophobicContact CG-CG 4.34Å; M61-P366 HydrophobicContact SD-CG 4.49Å; M61-A380 HydrophobicContact CG-CB 4.27Å; M61-A380 HydrophobicContact SD-CB 3.84Å; M61-L382 HydrophobicContact CE-CB 3.57Å; M61-L382 HydrophobicContact CE-CD2 4.21Å; M61-L382 HydrophobicContact SD-CB 3.76Å
62	L	94	Very high	79.5	Confident	45 Å²	45	71.6 Å²	71.6	24%	0.236	37%	0.372	C	S	.	.	H	α-helix	trans	-54.6	-47.9	-175.4	179.9	60.1	0	0	0	112.6	P59 V60 E64 V65 L66 A90	P59-L62 HydrophobicContact CB-CB 4.23Å; P59-L62 HydrophobicContact CB-CD1 4.16Å; P59-L62 HydrophobicContact CG-CD1 4.11Å; P59-L62 HydrophobicContact CG-CD2 4.4Å; V60-L62 PolarHBondContact O-N 2.99Å; L62-E64 PolarHBondContact O-N 2.82Å; L62-V65 PolarHBondContact O-N 2.95Å; L62-L66 HydrophobicContact CD1-CD1 4.26Å; L62-L66 HydrophobicContact CD1-CG 4.26Å; L62-L66 HydrophobicContact CG-CD1 4.29Å; L62-L66 WeakPolarHBondContact O-CG 3.28Å; L62-L66 PolarHBondContact O-N 2.91Å; L62-A90 HydrophobicContact CD1-CB 3.64Å; L62-A90 HydrophobicContact CD2-CB 4.24Å; L62-A90 HydrophobicContact CG-CB 4.41Å
63	K	93.7	Very high	82.7	Confident	140 Å²	140	70.9 Å²	70.9	61%	0.609	36%	0.359	S	S	*	.	H	α-helix	trans	-61.8	-45.4	-177.5	-64.3	172.3	-173	157.7	0	110.7	M61 L66 H67 D370	M61-K63 VanDerWaalsContact C-N 3.34Å; M61-K63 PolarHBondContact O-N 3.35Å; K63-L66 PolarHBondContact O-N 3.35Å; K63-H67 WeakPolarHBondContact O-CB 3.41Å; K63-H67 PolarHBondContact O-N 3.39Å; K63-D370 IonicContact NZ-OD1 2.72Å
64	E	95.2	Very high	85.7	Confident	28 Å²	28	64.9 Å²	64.9	13%	0.131	34%	0.342	C	S	.	.	H	α-helix	trans	-68	-40.9	-179.9	-58.6	95.3	135	0	0	111.5	M61 L62 H67 Y68 V364 L382	M61-E64 WeakPolarHBondContact CA-OE2 3.39Å; M61-E64 HydrophobicContact CB-CB 4.42Å; M61-E64 HydrophobicContact CE-CB 4.31Å; M61-E64 HydrophobicContact CE-CG 4.22Å; M61-E64 PolarHBondContact O-N 3.34Å; L62-E64 PolarHBondContact O-N 2.82Å; E64-H67 PolarHBondContact O-N 3.44Å; E64-Y68 HydrophobicContact CB-CD2 4.15Å; E64-Y68 HydrophobicContact CB-CE2 4.2Å; E64-Y68 WeakPolarHBondContact O-CB 3.49Å; E64-Y68 WeakPolarHBondContact O-CD2 3.42Å; E64-Y68 PolarHBondContact O-N 3.25Å; E64-V364 HydrophobicContact CG-CG1 4.28Å; E64-L382 HydrophobicContact CB-CD2 3.75Å
65	V	96.1	Very high	88.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.5	-49.6	175.8	168	0	0	0	0	110.7	M61 L62 H67 Y68 L69 L152 I304 L382	M61-V65 WeakPolarHBondContact O-CB 3.44Å; M61-V65 VanDerWaalsContact O-CG2 3.26Å; M61-V65 WeakPolarHBondContact O-CG2 3.04Å; M61-V65 PolarHBondContact O-N 3.25Å; L62-V65 PolarHBondContact O-N 2.95Å; V65-H67 VanDerWaalsContact C-N 3.35Å; V65-H67 PolarHBondContact O-N 3.39Å; V65-Y68 PolarHBondContact O-N 3.2Å; V65-L69 HydrophobicContact CG1-CD1 3.47Å; V65-L69 VanDerWaalsContact CG1-CD1 3.47Å; V65-L69 HydrophobicContact CG1-CG 4.09Å; V65-L69 WeakPolarHBondContact O-CB 3.5Å; V65-L69 WeakPolarHBondContact O-CG 3.42Å; V65-L69 PolarHBondContact O-N 3.07Å; V65-L152 HydrophobicContact CG1-CD1 3.84Å; V65-L152 HydrophobicContact CG1-CD2 4.06Å; V65-L152 HydrophobicContact CG2-CD1 4.28Å; V65-I304 HydrophobicContact CG2-CD1 3.68Å; V65-I304 HydrophobicContact CG2-CG1 4.26Å; V65-L382 HydrophobicContact CG2-CD1 4.43Å
66	L	95.7	Very high	91.3	Very high	49 Å²	49	55.2 Å²	55.2	26%	0.257	29%	0.293	S	S	.	.	H	α-helix	trans	-61.2	-44.2	177.8	-67.1	177.3	0	0	0	111.7	L62 K63 D70 A90 I91	L62-L66 HydrophobicContact CD1-CD1 4.26Å; L62-L66 HydrophobicContact CD1-CG 4.26Å; L62-L66 HydrophobicContact CG-CD1 4.29Å; L62-L66 WeakPolarHBondContact O-CG 3.28Å; L62-L66 PolarHBondContact O-N 2.91Å; K63-L66 PolarHBondContact O-N 3.35Å; L66-D70 PolarHBondContact O-N 3.27Å; L66-A90 HydrophobicContact CD1-CB 4.15Å; L66-A90 HydrophobicContact CD2-CB 4.28Å; L66-I91 HydrophobicContact CD2-CG1 3.61Å
67	H	95.9	Very high	93.4	Very high	128 Å²	128	49.4 Å²	49.4	59%	0.593	26%	0.255	S	S	*	.	H	α-helix	trans	-61.7	-45.9	178.8	176.4	71	0	0	0	112.7	K63 E64 V65	K63-H67 WeakPolarHBondContact O-CB 3.41Å; K63-H67 PolarHBondContact O-N 3.39Å; E64-H67 PolarHBondContact O-N 3.44Å; V65-H67 VanDerWaalsContact C-N 3.35Å; V65-H67 PolarHBondContact O-N 3.39Å
68	Y	96.3	Very high	94.9	Very high	34 Å²	34	45.4 Å²	45.4	13%	0.133	24%	0.236	C	C	.	.	H	α-helix	trans	-88.4	-28.8	-173.4	-72.3	-65	0	0	0	114.5	E64 V65 R300 V359 K360 V364 L382 I384	E64-Y68 HydrophobicContact CB-CD2 4.15Å; E64-Y68 HydrophobicContact CB-CE2 4.2Å; E64-Y68 WeakPolarHBondContact O-CB 3.49Å; E64-Y68 WeakPolarHBondContact O-CD2 3.42Å; E64-Y68 PolarHBondContact O-N 3.25Å; V65-Y68 PolarHBondContact O-N 3.2Å; Y68-R300 WeakPolarHBondContact O-CD 3.41Å; Y68-R300 PolarHBondContact O-NH1 2.8Å; Y68-V359 HydrophobicContact CD1-CG1 4.25Å; Y68-K360 PolarHBondContact OH-NZ 2.81Å; Y68-V364 HydrophobicContact CE2-CG1 4.41Å; Y68-V364 HydrophobicContact CE2-CG2 3.95Å; Y68-L382 HydrophobicContact CD2-CD2 3.86Å; Y68-L382 HydrophobicContact CE2-CD2 4.44Å; Y68-I384 HydrophobicContact CD1-CD1 4.24Å; Y68-I384 HydrophobicContact CD1-CG1 4.29Å; Y68-I384 HydrophobicContact CD2-CD1 3.79Å; Y68-I384 HydrophobicContact CD2-CG1 4.09Å; Y68-I384 HydrophobicContact CE2-CD1 4.14Å; Y68-I384 HydrophobicContact CG-CD1 3.88Å; Y68-I384 HydrophobicContact CG-CG1 3.79Å
69	L	95.1	Very high	95.8	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-32.9	167.9	-77.7	175.1	0	0	0	110.4	V65 V71 I91 A150 L152 R300 C302	V65-L69 HydrophobicContact CG1-CD1 3.47Å; V65-L69 VanDerWaalsContact CG1-CD1 3.47Å; V65-L69 HydrophobicContact CG1-CG 4.09Å; V65-L69 WeakPolarHBondContact O-CB 3.5Å; V65-L69 WeakPolarHBondContact O-CG 3.42Å; V65-L69 PolarHBondContact O-N 3.07Å; L69-V71 HydrophobicContact CB-CG2 3.77Å; L69-V71 PolarHBondContact O-N 2.96Å; L69-I91 HydrophobicContact CD1-CD1 3.89Å; L69-A150 HydrophobicContact CD2-CB 3.95Å; L69-L152 HydrophobicContact CD1-CB 4.28Å; L69-L152 HydrophobicContact CD1-CD2 4.49Å; L69-R300 WeakPolarHBondContact O-CD 3.25Å; L69-C302 HydrophobicContact CD2-CB 3.76Å; L69-C302 HydrophobicContact CG-CB 4.07Å
70	D	95.7	Very high	96.2	Very high	56 Å²	56	39.2 Å²	39.2	30%	0.299	20%	0.204	S	C	.	.			trans	48.6	40.8	171	-171.9	38.4	0	0	0	112.8	L66 K72 R300	L66-D70 PolarHBondContact O-N 3.27Å; D70-K72 VanDerWaalsContact O-CE 3.27Å; D70-K72 WeakPolarHBondContact O-CE 3.41Å; D70-K72 WeakPolarHBondContact OD1-CE 3.27Å; D70-K72 IonicContact OD1-NZ 3.3Å; D70-K72 PolarHBondContact OD1-NZ 3.35Å; D70-K72 IonicContact OD2-NZ 3.32Å; D70-K72 PolarHBondContact OD2-NZ 2.92Å; D70-R300 IonicContact OD2-CZ 3.52Å; D70-R300 IonicContact OD2-NE 3.76Å; D70-R300 IonicContact OD2-NH2 2.85Å; D70-R300 PolarHBondContact OD2-NH2 2.74Å
71	V	96.9	Very high	96.5	Very high	16 Å²	16	40 Å²	40	10%	0.097	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-66.5	135.6	-173.5	-172.2	0	0	0	0	109.6	L69 Q75 V77 V95 V98 A150	L69-V71 HydrophobicContact CB-CG2 3.77Å; L69-V71 PolarHBondContact O-N 2.96Å; V71-Q75 HydrophobicContact CG1-CB 4Å; V71-V77 HydrophobicContact CB-CG2 4.28Å; V71-V77 HydrophobicContact CG1-CG2 3.5Å; V71-V77 HydrophobicContact CG2-CG2 3.72Å; V71-V95 HydrophobicContact CB-CG2 4.25Å; V71-V95 HydrophobicContact CG1-CG1 4.22Å; V71-V98 HydrophobicContact CG1-CG2 3.64Å; V71-A150 HydrophobicContact CG2-CB 4.3Å
72	K	97.5	Very high	96.6	Very high	92 Å²	92	39.8 Å²	39.8	40%	0.4	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-103.3	161	179.3	-50.6	-55.8	178.9	-171.8	0	111	D70 Q75 V95	D70-K72 VanDerWaalsContact O-CE 3.27Å; D70-K72 WeakPolarHBondContact O-CE 3.41Å; D70-K72 WeakPolarHBondContact OD1-CE 3.27Å; D70-K72 IonicContact OD1-NZ 3.3Å; D70-K72 PolarHBondContact OD1-NZ 3.35Å; D70-K72 IonicContact OD2-NZ 3.32Å; D70-K72 PolarHBondContact OD2-NZ 2.92Å; K72-Q75 HydrophobicContact CB-CG 4.02Å; K72-Q75 VanDerWaalsContact O-CB 3.26Å; K72-Q75 WeakPolarHBondContact O-CB 3.45Å; K72-Q75 WeakPolarHBondContact O-CG 3.31Å; K72-Q75 PolarHBondContact O-N 3Å; K72-V95 VanDerWaalsContact C-CG1 3.42Å; K72-V95 WeakPolarHBondContact O-CG1 3.22Å
73	P	97.4	Very high	96.6	Very high	76 Å²	76	37.9 Å²	37.9	49%	0.494	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	148	174.6	-27.8	36.3	0	0	0	112.9	Q75 P96	P73-Q75 PolarHBondContact O-N 3.47Å; P73-P96 VanDerWaalsContact CA-O 3.23Å; P73-P96 WeakPolarHBondContact CA-O 3.32Å; P73-P96 HydrophobicContact CB-CG 4.12Å; P73-P96 HydrophobicContact CG-CG 3.92Å
74	A	95.5	Very high	96.6	Very high	63 Å²	63	32.8 Å²	32.8	52%	0.521	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	8.6	-179	0	0	0	0	0	116.2	P96 E97	A74-P96 PolarHBondContact N-O 2.85Å; A74-E97 WeakPolarHBondContact CA-O 2.93Å; A74-E97 HydrophobicContact CB-CB 4.23Å
75	Q	97.8	Very high	96.6	Very high	37 Å²	37	31.5 Å²	31.5	17%	0.173	18%	0.18	C	C	.	.			trans	-77.5	158.6	174.6	-72.7	-169.2	-24.4	0	0	112.8	V71 K72 P73 V98 T99 D149	V71-Q75 HydrophobicContact CG1-CB 4Å; K72-Q75 HydrophobicContact CB-CG 4.02Å; K72-Q75 VanDerWaalsContact O-CB 3.26Å; K72-Q75 WeakPolarHBondContact O-CB 3.45Å; K72-Q75 WeakPolarHBondContact O-CG 3.31Å; K72-Q75 PolarHBondContact O-N 3Å; P73-Q75 PolarHBondContact O-N 3.47Å; Q75-V98 WeakPolarHBondContact O-CA 3.46Å; Q75-V98 VanDerWaalsContact O-CG2 3.28Å; Q75-V98 WeakPolarHBondContact O-CG2 3.28Å; Q75-T99 PolarHBondContact O-N 3.39Å; Q75-D149 WeakPolarHBondContact CA-OD2 3.23Å; Q75-D149 HydrophobicContact CB-CB 3.75Å; Q75-D149 WeakPolarHBondContact CB-OD2 3.33Å; Q75-D149 HydrophobicContact CG-CB 3.91Å; Q75-D149 PolarHBondContact NE2-OD1 3.41Å
76	V	98.3	Very high	96.5	Very high	35 Å²	35	32.7 Å²	32.7	21%	0.212	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.1	174.4	-174.9	0	0	0	0	109.9	T99 L101 D149 A150	V76-T99 CarbonylContact C-O 3.34Å; V76-T99 WeakPolarHBondContact CA-O 3.5Å; V76-L101 HydrophobicContact CG1-CD1 4.22Å; V76-L101 HydrophobicContact CG1-CG 4.08Å; V76-D149 PolarHBondContact N-OD2 2.86Å; V76-D149 WeakPolarHBondContact O-CB 3.34Å; V76-D149 PolarHBondContact O-N 3.17Å; V76-A150 PolarHBondContact O-N 3.15Å
77	V	98.6	Very high	96.5	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.6	174.5	-176.5	0	0	0	0	109.2	V71 I91 V98 T99 V100 L101 A150	V71-V77 HydrophobicContact CB-CG2 4.28Å; V71-V77 HydrophobicContact CG1-CG2 3.5Å; V71-V77 HydrophobicContact CG2-CG2 3.72Å; V77-I91 HydrophobicContact CG1-CD1 4.31Å; V77-I91 HydrophobicContact CG2-CG2 4.42Å; V77-V98 HydrophobicContact CG2-CG2 3.73Å; V77-T99 PolarHBondContact N-O 3.22Å; V77-V100 HydrophobicContact CB-CG2 4.41Å; V77-V100 CarbonylContact O-C 3.51Å; V77-V100 VanDerWaalsContact O-CA 3.31Å; V77-V100 WeakPolarHBondContact O-CA 3.4Å; V77-L101 PolarHBondContact O-N 3.17Å; V77-A150 CarbonylContact C-O 3.48Å; V77-A150 WeakPolarHBondContact CA-O 3.39Å; V77-A150 HydrophobicContact CG1-CB 4.49Å; V77-A150 HydrophobicContact CG2-CB 4.33Å
78	L	98.8	Very high	96.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	104.6	168	169.4	62.5	0	0	0	108.7	M80 L101 L134 I148 A150 V151 L152	L78-M80 HydrophobicContact CD1-CG 4.16Å; L78-M80 HydrophobicContact CD2-CG 3.95Å; L78-M80 HydrophobicContact CD2-SD 4.22Å; L78-M80 HydrophobicContact CG-CG 3.67Å; L78-M80 PolarHBondContact O-N 3.45Å; L78-L101 HydrophobicContact CB-CB 4.48Å; L78-L101 HydrophobicContact CD1-CB 3.82Å; L78-L134 HydrophobicContact CD1-CD1 4.37Å; L78-L134 HydrophobicContact CD1-CD2 4.41Å; L78-L134 HydrophobicContact CD2-CD2 3.84Å; L78-I148 HydrophobicContact CB-CD1 3.88Å; L78-I148 HydrophobicContact CB-CG2 3.94Å; L78-I148 HydrophobicContact CD2-CD1 3.78Å; L78-I148 HydrophobicContact CG-CD1 4.4Å; L78-A150 PolarHBondContact N-O 2.9Å; L78-V151 HydrophobicContact CB-CG2 4.12Å; L78-V151 HydrophobicContact CD2-CG2 4.12Å; L78-V151 HydrophobicContact CG-CG2 4.47Å; L78-V151 CarbonylContact O-C 3.53Å; L78-V151 WeakPolarHBondContact O-CA 3.42Å; L78-L152 PolarHBondContact O-N 3Å
79	D	98.6	Very high	96.6	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.011	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	103.6	168.3	-173.4	-9.4	0	0	0	107.4	T81 T88 V100 L101 L103	D79-T81 PolarHBondContact O-N 3.02Å; D79-T81 PolarHBondContact OD1-N 3.5Å; D79-T88 PolarHBondContact OD2-OG1 3.38Å; D79-V100 HydrophobicContact CB-CG1 4.06Å; D79-L101 PolarHBondContact N-O 3.26Å; D79-L103 PolarHBondContact O-N 3.47Å
80	M	98.1	Very high	96.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-78.2	-9.1	-175.2	-66.8	-171.6	62.5	0	0	113.1	L78 L103 F131 L134 V151 L152 L153 G287 A291	L78-M80 HydrophobicContact CD1-CG 4.16Å; L78-M80 HydrophobicContact CD2-CG 3.95Å; L78-M80 HydrophobicContact CD2-SD 4.22Å; L78-M80 HydrophobicContact CG-CG 3.67Å; L78-M80 PolarHBondContact O-N 3.45Å; M80-L103 CarbonylContact C-O 3.57Å; M80-L103 VanDerWaalsContact C-O 3.24Å; M80-L103 HydrophobicContact CB-CD2 4.21Å; M80-L103 HydrophobicContact CE-CD2 4.33Å; M80-L103 HydrophobicContact CG-CD2 4.41Å; M80-F131 HydrophobicContact CB-CE1 4.26Å; M80-F131 HydrophobicContact CE-CB 4.19Å; M80-F131 HydrophobicContact CE-CD1 3.88Å; M80-F131 HydrophobicContact CE-CD2 4.38Å; M80-F131 HydrophobicContact CE-CE1 4.46Å; M80-F131 HydrophobicContact CE-CG 3.88Å; M80-F131 WeakPolarHBondContact O-CE1 3.47Å; M80-L134 HydrophobicContact CE-CD2 3.42Å; M80-L134 VanDerWaalsContact CE-CD2 3.42Å; M80-L134 HydrophobicContact CG-CD2 4.27Å; M80-L134 HydrophobicContact SD-CD2 4.08Å; M80-V151 HydrophobicContact CG-CG1 3.97Å; M80-V151 HydrophobicContact SD-CG1 3.64Å; M80-L152 WeakPolarHBondContact CB-O 3.28Å; M80-L152 PolarHBondContact N-O 3.24Å; M80-L153 HydrophobicContact CB-CD2 3.43Å; M80-L153 VanDerWaalsContact CB-CD2 3.43Å; M80-L153 HydrophobicContact CB-CG 3.77Å; M80-L153 HydrophobicContact CE-CD1 4.47Å; M80-L153 HydrophobicContact CE-CD2 4.04Å; M80-L153 HydrophobicContact CE-CG 4.47Å; M80-L153 HydrophobicContact CG-CD2 4.18Å; M80-L153 HydrophobicContact CG-CG 4.13Å; M80-L153 HydrophobicContact SD-CD1 3.77Å; M80-L153 HydrophobicContact SD-CD2 3.9Å; M80-L153 HydrophobicContact SD-CG 3.71Å; M80-G287 VanDerWaalsContact CE-CA 3.46Å; M80-A291 HydrophobicContact SD-CB 4.32Å
81	T	97.1	Very high	96.8	Very high	26 Å²	26	25.8 Å²	25.8	16%	0.16	16%	0.16	C	C	.	.			trans	-142.3	57.7	-170.3	47.2	0	0	0	0	108.9	D79 G83 L103 F131 L153 D154	D79-T81 PolarHBondContact O-N 3.02Å; D79-T81 PolarHBondContact OD1-N 3.5Å; T81-G83 VanDerWaalsContact C-N 3.26Å; T81-G83 PolarHBondContact O-N 3.35Å; T81-L103 PolarHBondContact N-O 2.75Å; T81-F131 HydrophobicContact CG2-CE1 4.13Å; T81-F131 HydrophobicContact CG2-CZ 3.6Å; T81-L153 HydrophobicContact CG2-CD2 4.18Å; T81-D154 WeakPolarHBondContact CB-O 3.41Å; T81-D154 WeakPolarHBondContact CG2-O 3.48Å; T81-D154 WeakPolarHBondContact OG1-CA 3.16Å; T81-D154 WeakPolarHBondContact OG1-CB 3.46Å; T81-D154 PolarHBondContact OG1-N 2.96Å
82	F	97.1	Very high	96.8	Very high	7 Å²	7	25.3 Å²	25.3	3%	0.031	16%	0.157	C	C	.	.			trans	-52.3	-45.1	-171	175.3	-96.7	0	0	0	112.4	G84 G85 T88 A102 L103 D104 A109 L112 A113 L116	F82-G84 PolarHBondContact O-N 3.43Å; F82-G85 WeakPolarHBondContact O-CA 3.22Å; F82-G85 PolarHBondContact O-N 2.85Å; F82-T88 HydrophobicContact CD2-CG2 4.29Å; F82-T88 HydrophobicContact CE2-CG2 3.88Å; F82-A102 HydrophobicContact CB-CB 4.21Å; F82-A102 HydrophobicContact CD2-CB 3.49Å; F82-A102 VanDerWaalsContact CD2-CB 3.49Å; F82-A102 HydrophobicContact CE2-CB 4.08Å; F82-A102 HydrophobicContact CG-CB 4Å; F82-L103 WeakPolarHBondContact CB-O 3.28Å; F82-L103 PolarHBondContact N-O 3.3Å; F82-D104 HydrophobicContact CB-CB 4.33Å; F82-A109 HydrophobicContact CD1-CB 4.47Å; F82-A109 WeakPolarHBondContact CD1-O 3.4Å; F82-A109 WeakPolarHBondContact CE1-O 3.41Å; F82-L112 HydrophobicContact CE1-CB 3.95Å; F82-A113 HydrophobicContact CD1-CB 3.82Å; F82-A113 HydrophobicContact CD2-CB 4.35Å; F82-A113 HydrophobicContact CE1-CB 3.57Å; F82-A113 VanDerWaalsContact CE1-N 3.32Å; F82-A113 HydrophobicContact CE2-CB 4.09Å; F82-A113 HydrophobicContact CG-CB 4.2Å; F82-A113 VanDerWaalsContact CZ-CA 3.44Å; F82-A113 HydrophobicContact CZ-CB 3.7Å; F82-L116 HydrophobicContact CE2-CD2 3.86Å; F82-L116 HydrophobicContact CZ-CD2 4.03Å
83	G	94.4	Very high	96.7	Very high	6 Å²	6	26.7 Å²	26.7	6%	0.062	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	-118.5	179	0	0	0	0	0	112.4	T81 G85 D104 A109	T81-G83 VanDerWaalsContact C-N 3.26Å; T81-G83 PolarHBondContact O-N 3.35Å; G83-G85 VanDerWaalsContact C-N 3.28Å; G83-D104 WeakPolarHBondContact CA-OD2 3.33Å; G83-D104 PolarHBondContact N-OD2 3.01Å; G83-A109 WeakPolarHBondContact O-CB 3.16Å
84	G	92.5	Very high	96.5	Very high	33 Å²	33	27.6 Å²	27.6	34%	0.34	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	0.7	175	0	0	0	0	0	114.6	F82 G86	F82-G84 PolarHBondContact O-N 3.43Å; G84-G86 VanDerWaalsContact C-N 3.34Å; G84-G86 PolarHBondContact O-N 3.05Å
85	G	94.6	Very high	96.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	76.5	10	176.9	0	0	0	0	0	115.6	F82 G83 H87 T88 K89	F82-G85 WeakPolarHBondContact O-CA 3.22Å; F82-G85 PolarHBondContact O-N 2.85Å; G83-G85 VanDerWaalsContact C-N 3.28Å; G85-H87 PolarHBondContact O-N 2.98Å; G85-T88 PolarHBondContact O-N 3.32Å; G85-K89 WeakPolarHBondContact O-CB 3.34Å; G85-K89 VanDerWaalsContact O-CG 3.3Å; G85-K89 WeakPolarHBondContact O-CG 3.09Å; G85-K89 PolarHBondContact O-N 2.82Å
86	G	94.5	Very high	96.4	Very high	26 Å²	26	27.2 Å²	27.2	27%	0.268	17%	0.168	S	C	.	.	H	α-helix	trans	-66.8	-37.8	-172	0	0	0	0	0	114.3	G84 A90	G84-G86 VanDerWaalsContact C-N 3.34Å; G84-G86 PolarHBondContact O-N 3.05Å; G86-A90 PolarHBondContact O-N 2.83Å
87	H	96.5	Very high	96.3	Very high	12 Å²	12	32 Å²	32	6%	0.056	19%	0.188	C	C	.	.	H	α-helix	trans	-66.4	-47.8	171.4	-75.3	-66.2	0	0	0	111.3	P59 V60 G85 K89 A90 I91 L152	P59-H87 VanDerWaalsContact CB-CE1 3.43Å; P59-H87 WeakPolarHBondContact CB-CE1 3.39Å; P59-H87 WeakPolarHBondContact CB-NE2 3.26Å; V60-H87 PolarHBondContact O-CE1 2.86Å; V60-H87 PolarHBondContact O-NE2 2.92Å; G85-H87 PolarHBondContact O-N 2.98Å; H87-K89 PolarHBondContact O-N 2.8Å; H87-A90 PolarHBondContact O-N 2.97Å; H87-I91 WeakPolarHBondContact O-CG1 3.47Å; H87-I91 PolarHBondContact O-N 2.78Å; H87-L152 HydrophobicContact CB-CD2 3.53Å
88	T	97.4	Very high	96.2	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-56.1	-47.7	176.6	-75.2	0	0	0	0	112.2	D79 F82 G85 A90 I91 L92 V100 L116	D79-T88 PolarHBondContact OD2-OG1 3.38Å; F82-T88 HydrophobicContact CD2-CG2 4.29Å; F82-T88 HydrophobicContact CE2-CG2 3.88Å; G85-T88 PolarHBondContact O-N 3.32Å; T88-A90 VanDerWaalsContact C-N 3.34Å; T88-A90 PolarHBondContact O-N 2.81Å; T88-I91 PolarHBondContact O-N 3.28Å; T88-L92 HydrophobicContact CG2-CD1 3.71Å; T88-L92 HydrophobicContact CG2-CG 4.33Å; T88-L92 WeakPolarHBondContact O-CG 3.24Å; T88-L92 PolarHBondContact O-N 2.98Å; T88-V100 HydrophobicContact CG2-CB 4.16Å; T88-V100 HydrophobicContact CG2-CG1 3.83Å; T88-V100 HydrophobicContact CG2-CG2 4.25Å; T88-L116 HydrophobicContact CG2-CD2 3.69Å
89	K	96.9	Very high	96.2	Very high	94 Å²	94	33.4 Å²	33.4	41%	0.409	20%	0.197	S	C	.	.	H	α-helix	trans	-57.3	-45.5	176.5	-77.5	174.6	176.5	-179.9	0	111.7	G85 H87 I91 L92 N93 L116	G85-K89 WeakPolarHBondContact O-CB 3.34Å; G85-K89 VanDerWaalsContact O-CG 3.3Å; G85-K89 WeakPolarHBondContact O-CG 3.09Å; G85-K89 PolarHBondContact O-N 2.82Å; H87-K89 PolarHBondContact O-N 2.8Å; K89-I91 PolarHBondContact O-N 3.04Å; K89-L92 PolarHBondContact O-N 2.8Å; K89-N93 WeakPolarHBondContact O-CB 3.34Å; K89-N93 PolarHBondContact O-N 3Å; K89-N93 PolarHBondContact O-ND2 2.94Å; K89-L116 HydrophobicContact CD-CD1 4.43Å; K89-L116 HydrophobicContact CG-CD1 3.79Å; K89-L116 HydrophobicContact CG-CD2 3.9Å
90	A	96.5	Very high	96.2	Very high	16 Å²	16	33.3 Å²	33.3	13%	0.132	20%	0.197	C	C	.	.	H	α-helix	trans	-65	-38.7	178.8	0	0	0	0	0	112.7	L62 L66 G86 H87 T88 T94	L62-A90 HydrophobicContact CD1-CB 3.64Å; L62-A90 HydrophobicContact CD2-CB 4.24Å; L62-A90 HydrophobicContact CG-CB 4.41Å; L66-A90 HydrophobicContact CD1-CB 4.15Å; L66-A90 HydrophobicContact CD2-CB 4.28Å; G86-A90 PolarHBondContact O-N 2.83Å; H87-A90 PolarHBondContact O-N 2.97Å; T88-A90 VanDerWaalsContact C-N 3.34Å; T88-A90 PolarHBondContact O-N 2.81Å; A90-T94 VanDerWaalsContact O-CB 3.31Å; A90-T94 WeakPolarHBondContact O-CB 3.33Å; A90-T94 PolarHBondContact O-N 3.48Å; A90-T94 VanDerWaalsContact O-N 3.1Å; A90-T94 PolarHBondContact O-OG1 3.04Å
91	I	97.1	Very high	96.2	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-62.9	-49.6	174.1	-68.1	166.9	0	0	0	110.3	L66 L69 V77 H87 T88 K89 N93 T94 V95 V98 V100	L66-I91 HydrophobicContact CD2-CG1 3.61Å; L69-I91 HydrophobicContact CD1-CD1 3.89Å; V77-I91 HydrophobicContact CG1-CD1 4.31Å; V77-I91 HydrophobicContact CG2-CG2 4.42Å; H87-I91 WeakPolarHBondContact O-CG1 3.47Å; H87-I91 PolarHBondContact O-N 2.78Å; T88-I91 PolarHBondContact O-N 3.28Å; K89-I91 PolarHBondContact O-N 3.04Å; I91-N93 VanDerWaalsContact C-N 3.3Å; I91-N93 PolarHBondContact O-N 3.41Å; I91-T94 PolarHBondContact O-N 3.09Å; I91-V95 PolarHBondContact O-N 3.47Å; I91-V98 HydrophobicContact CG2-CG1 3.91Å; I91-V98 HydrophobicContact CG2-CG2 4.07Å; I91-V100 HydrophobicContact CG2-CG2 4.37Å
92	L	97.1	Very high	96.3	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-59.7	-39.4	-179.9	-72	163.7	0	0	0	113	T88 K89 V98 V100 L116 R123 V124	T88-L92 HydrophobicContact CG2-CD1 3.71Å; T88-L92 HydrophobicContact CG2-CG 4.33Å; T88-L92 WeakPolarHBondContact O-CG 3.24Å; T88-L92 PolarHBondContact O-N 2.98Å; K89-L92 PolarHBondContact O-N 2.8Å; L92-V98 HydrophobicContact CD2-CG1 3.97Å; L92-V100 HydrophobicContact CD2-CG2 4.11Å; L92-V100 HydrophobicContact CG-CG2 4.27Å; L92-L116 HydrophobicContact CD1-CD1 4.46Å; L92-L116 HydrophobicContact CD1-CD2 3.84Å; L92-L116 HydrophobicContact CD1-CG 4.14Å; L92-R123 HydrophobicContact CD2-CB 4.06Å; L92-R123 PolarHBondContact O-NH2 3.02Å; L92-V124 HydrophobicContact CD1-CG2 3.48Å; L92-V124 VanDerWaalsContact CD1-CG2 3.48Å; L92-V124 HydrophobicContact CD2-CG2 3.94Å; L92-V124 HydrophobicContact CG-CG2 4.32Å
93	N	95	Very high	96.4	Very high	122 Å²	122	31.8 Å²	31.8	65%	0.652	19%	0.187	S	C	*	.	H	α-helix	trans	-73.4	-29.5	179.9	-70.8	-10.6	0	0	0	112.9	K89 I91	K89-N93 WeakPolarHBondContact O-CB 3.34Å; K89-N93 PolarHBondContact O-N 3Å; K89-N93 PolarHBondContact O-ND2 2.94Å; I91-N93 VanDerWaalsContact C-N 3.3Å; I91-N93 PolarHBondContact O-N 3.41Å
94	T	94.6	Very high	96.5	Very high	94 Å²	94	32.2 Å²	32.2	58%	0.577	19%	0.189	S	C	*	.	H	α-helix	trans	-94.4	-32.1	-175.2	-51	0	0	0	0	112.4	A90 I91	A90-T94 VanDerWaalsContact O-CB 3.31Å; A90-T94 WeakPolarHBondContact O-CB 3.33Å; A90-T94 PolarHBondContact O-N 3.48Å; A90-T94 VanDerWaalsContact O-N 3.1Å; A90-T94 PolarHBondContact O-OG1 3.04Å; I91-T94 PolarHBondContact O-N 3.09Å
95	V	96.4	Very high	96.8	Very high	17 Å²	17	31.8 Å²	31.8	10%	0.103	18%	0.177	C	C	.	.	S	Bend	trans	-116.9	109.7	-170.5	-172	0	0	0	0	110.4	V71 K72 I91 V98 R123	V71-V95 HydrophobicContact CB-CG2 4.25Å; V71-V95 HydrophobicContact CG1-CG1 4.22Å; K72-V95 VanDerWaalsContact C-CG1 3.42Å; K72-V95 WeakPolarHBondContact O-CG1 3.22Å; I91-V95 PolarHBondContact O-N 3.47Å; V95-V98 HydrophobicContact CB-CB 4.16Å; V95-V98 HydrophobicContact CB-CG1 4.29Å; V95-V98 HydrophobicContact CG1-CB 4.03Å; V95-V98 WeakPolarHBondContact O-CG1 3.49Å; V95-R123 PolarHBondContact O-NH2 2.91Å
96	P	94.4	Very high	96.8	Very high	75 Å²	75	32 Å²	32	49%	0.487	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	149.2	179.9	26.7	-33.3	0	0	0	111.2	P73 A74 V98	P73-P96 VanDerWaalsContact CA-O 3.23Å; P73-P96 WeakPolarHBondContact CA-O 3.32Å; P73-P96 HydrophobicContact CB-CG 4.12Å; P73-P96 HydrophobicContact CG-CG 3.92Å; A74-P96 PolarHBondContact N-O 2.85Å; P96-V98 PolarHBondContact O-N 3.3Å
97	E	95.5	Very high	96.9	Very high	136 Å²	136	31.8 Å²	31.8	64%	0.636	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	2.1	175.8	-58.5	173.8	-158.7	0	0	116.1	A74 T99	A74-E97 WeakPolarHBondContact CA-O 2.93Å; A74-E97 HydrophobicContact CB-CB 4.23Å; E97-T99 PolarHBondContact O-N 3.33Å
98	V	97.9	Very high	96.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.181	C	C	.	.			trans	-59.1	138	174.4	76.9	0	0	0	0	110.1	V71 Q75 V77 I91 L92 V95 P96 V100 R123	V71-V98 HydrophobicContact CG1-CG2 3.64Å; Q75-V98 WeakPolarHBondContact O-CA 3.46Å; Q75-V98 VanDerWaalsContact O-CG2 3.28Å; Q75-V98 WeakPolarHBondContact O-CG2 3.28Å; V77-V98 HydrophobicContact CG2-CG2 3.73Å; I91-V98 HydrophobicContact CG2-CG1 3.91Å; I91-V98 HydrophobicContact CG2-CG2 4.07Å; L92-V98 HydrophobicContact CD2-CG1 3.97Å; V95-V98 HydrophobicContact CB-CB 4.16Å; V95-V98 HydrophobicContact CB-CG1 4.29Å; V95-V98 HydrophobicContact CG1-CB 4.03Å; V95-V98 WeakPolarHBondContact O-CG1 3.49Å; P96-V98 PolarHBondContact O-N 3.3Å; V98-V100 HydrophobicContact CG1-CG2 4.36Å; V98-R123 WeakPolarHBondContact O-CB 3.27Å; V98-R123 PolarHBondContact O-NE 2.59Å
99	T	98.3	Very high	96.6	Very high	30 Å²	30	32.8 Å²	32.8	18%	0.184	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.8	169.7	-61.3	0	0	0	0	109	Q75 V76 V77 E97 R123 K125	Q75-T99 PolarHBondContact O-N 3.39Å; V76-T99 CarbonylContact C-O 3.34Å; V76-T99 WeakPolarHBondContact CA-O 3.5Å; V77-T99 PolarHBondContact N-O 3.22Å; E97-T99 PolarHBondContact O-N 3.33Å; T99-R123 CarbonylContact C-O 3.55Å; T99-R123 VanDerWaalsContact CA-O 3.32Å; T99-R123 WeakPolarHBondContact CA-O 3.32Å; T99-K125 HydrophobicContact CG2-CD 4.48Å
100	V	98.6	Very high	96.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.3	177.7	-173.7	0	0	0	0	110.1	V77 D79 T88 I91 L92 V98 R123 V124 K125	V77-V100 HydrophobicContact CB-CG2 4.41Å; V77-V100 CarbonylContact O-C 3.51Å; V77-V100 VanDerWaalsContact O-CA 3.31Å; V77-V100 WeakPolarHBondContact O-CA 3.4Å; D79-V100 HydrophobicContact CB-CG1 4.06Å; T88-V100 HydrophobicContact CG2-CB 4.16Å; T88-V100 HydrophobicContact CG2-CG1 3.83Å; T88-V100 HydrophobicContact CG2-CG2 4.25Å; I91-V100 HydrophobicContact CG2-CG2 4.37Å; L92-V100 HydrophobicContact CD2-CG2 4.11Å; L92-V100 HydrophobicContact CG-CG2 4.27Å; V98-V100 HydrophobicContact CG1-CG2 4.36Å; V100-R123 PolarHBondContact N-O 3.22Å; V100-V124 CarbonylContact O-C 3.54Å; V100-V124 WeakPolarHBondContact O-CA 3.34Å; V100-K125 PolarHBondContact O-N 3.28Å
101	L	98.6	Very high	96.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	108	164.2	-50.9	-175.2	0	0	0	107	V76 V77 L78 D79 K125 L127 L138 M141 I143 I148	V76-L101 HydrophobicContact CG1-CD1 4.22Å; V76-L101 HydrophobicContact CG1-CG 4.08Å; V77-L101 PolarHBondContact O-N 3.17Å; L78-L101 HydrophobicContact CB-CB 4.48Å; L78-L101 HydrophobicContact CD1-CB 3.82Å; D79-L101 PolarHBondContact N-O 3.26Å; L101-K125 HydrophobicContact CD2-CB 3.79Å; L101-K125 HydrophobicContact CD2-CD 3.73Å; L101-K125 HydrophobicContact CD2-CG 4.08Å; L101-L127 HydrophobicContact CB-CD1 4.01Å; L101-L138 HydrophobicContact CD1-CD2 3.64Å; L101-M141 HydrophobicContact CD2-CE 4.23Å; L101-I143 HydrophobicContact CD1-CG1 4.37Å; L101-I148 HydrophobicContact CD1-CD1 4.06Å
102	A	98.4	Very high	96.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	96.8	-172	0	0	0	0	0	110	F82 A113 V124 K125 P126 L127	F82-A102 HydrophobicContact CB-CB 4.21Å; F82-A102 HydrophobicContact CD2-CB 3.49Å; F82-A102 VanDerWaalsContact CD2-CB 3.49Å; F82-A102 HydrophobicContact CE2-CB 4.08Å; F82-A102 HydrophobicContact CG-CB 4Å; A102-A113 HydrophobicContact CB-CB 4.18Å; A102-V124 HydrophobicContact CB-CG1 4.11Å; A102-K125 PolarHBondContact N-O 2.95Å; A102-P126 CarbonylContact O-C 3.54Å; A102-P126 WeakPolarHBondContact O-CA 3.42Å; A102-L127 PolarHBondContact O-N 3.2Å
103	L	98.6	Very high	96.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.6	179.9	176.6	79.9	0	0	0	111	D79 M80 T81 F82 L127 G129 F131 L134 L137	D79-L103 PolarHBondContact O-N 3.47Å; M80-L103 CarbonylContact C-O 3.57Å; M80-L103 VanDerWaalsContact C-O 3.24Å; M80-L103 HydrophobicContact CB-CD2 4.21Å; M80-L103 HydrophobicContact CE-CD2 4.33Å; M80-L103 HydrophobicContact CG-CD2 4.41Å; T81-L103 PolarHBondContact N-O 2.75Å; F82-L103 WeakPolarHBondContact CB-O 3.28Å; F82-L103 PolarHBondContact N-O 3.3Å; L103-L127 WeakPolarHBondContact CA-O 3.34Å; L103-L127 HydrophobicContact CB-CB 4.16Å; L103-L127 HydrophobicContact CD1-CB 3.76Å; L103-L127 WeakPolarHBondContact CD1-O 3.45Å; L103-G129 WeakPolarHBondContact CD1-O 3.46Å; L103-F131 HydrophobicContact CD2-CD1 3.85Å; L103-F131 HydrophobicContact CD2-CE1 4.27Å; L103-L134 HydrophobicContact CD1-CD1 4.01Å; L103-L134 HydrophobicContact CD2-CB 4.33Å; L103-L134 HydrophobicContact CD2-CD1 3.86Å; L103-L134 HydrophobicContact CD2-CD2 3.76Å; L103-L134 HydrophobicContact CD2-CG 4.2Å; L103-L134 HydrophobicContact CG-CD1 4.41Å; L103-L137 HydrophobicContact CD1-CD1 4.03Å
104	D	98	Very high	96.8	Very high	16 Å²	16	32 Å²	32	9%	0.086	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	151	163.1	-151.8	-61.1	0	0	0	109.3	F82 G83 D106 A109 I110 L127 G129	F82-D104 HydrophobicContact CB-CB 4.33Å; G83-D104 WeakPolarHBondContact CA-OD2 3.33Å; G83-D104 PolarHBondContact N-OD2 3.01Å; D104-D106 WeakPolarHBondContact OD1-CB 3.45Å; D104-D106 PolarHBondContact OD1-N 3.35Å; D104-A109 HydrophobicContact CB-CB 3.7Å; D104-A109 VanDerWaalsContact CG-CB 3.47Å; D104-I110 HydrophobicContact CB-CD1 3.89Å; D104-I110 HydrophobicContact CB-CG1 4.27Å; D104-L127 PolarHBondContact N-O 3.07Å; D104-L127 VanDerWaalsContact N-O 3.15Å; D104-G129 CarbonylContact C-O 3.48Å; D104-G129 VanDerWaalsContact C-O 3.27Å; D104-G129 PolarHBondContact O-N 2.86Å
105	R	96.9	Very high	96.9	Very high	23 Å²	23	32.5 Å²	32.5	9%	0.087	18%	0.177	C	C	.	.	S	Bend	trans	-82.4	-24.8	174.5	67.4	-174.7	-70.5	-174.1	-7	111.9	P107 G129 R130 M181 D182 R185 N278	R105-P107 WeakPolarHBondContact O-CD 3.45Å; R105-G129 VanDerWaalsContact CA-O 3.27Å; R105-G129 WeakPolarHBondContact CA-O 3.38Å; R105-G129 PolarHBondContact N-O 2.72Å; R105-R130 HydrophobicContact CB-CG 4.02Å; R105-M181 HydrophobicContact CG-CB 3.94Å; R105-D182 HydrophobicContact CB-CB 4.25Å; R105-D182 HydrophobicContact CG-CB 4.25Å; R105-D182 IonicContact CZ-OD1 3.45Å; R105-D182 IonicContact CZ-OD2 3.95Å; R105-D182 IonicContact NE-OD1 3.85Å; R105-D182 PolarHBondContact NE-OD1 3.05Å; R105-D182 IonicContact NE-OD2 2.76Å; R105-D182 PolarHBondContact NE-OD2 2.96Å; R105-D182 IonicContact NH2-OD1 3.34Å; R105-D182 PolarHBondContact NH2-OD1 3.18Å; R105-D182 IonicContact NH2-OD2 3.37Å; R105-D182 PolarHBondContact NH2-OD2 3.13Å; R105-D182 VanDerWaalsContact NH2-OD2 3.12Å; R105-D182 VanDerWaalsContact O-CB 3.24Å; R105-D182 WeakPolarHBondContact O-CB 3.17Å; R105-R185 WeakPolarHBondContact O-CD 3.37Å; R105-R185 PolarHBondContact O-NH1 2.75Å; R105-R185 VanDerWaalsContact O-NH1 3.17Å; R105-N278 PolarHBondContact NH1-O 3.3Å
106	D	95.9	Very high	96.9	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.021	17%	0.173	C	C	.	.			trans	-80.4	117.3	-176.3	-166.3	-31.9	0	0	0	110.5	D104 A108 A109 I110 Q161 R167 M181	D104-D106 WeakPolarHBondContact OD1-CB 3.45Å; D104-D106 PolarHBondContact OD1-N 3.35Å; D106-A108 PolarHBondContact O-N 2.87Å; D106-A108 WeakPolarHBondContact OD1-CB 3.15Å; D106-A108 PolarHBondContact OD1-N 3.37Å; D106-A109 HydrophobicContact CB-CB 4.14Å; D106-A109 WeakPolarHBondContact O-CB 2.95Å; D106-A109 PolarHBondContact O-N 2.87Å; D106-A109 VanDerWaalsContact O-N 3.09Å; D106-I110 PolarHBondContact O-N 3.34Å; D106-Q161 PolarHBondContact OD2-NE2 2.75Å; D106-R167 IonicContact OD1-NH1 3.78Å; D106-R167 IonicContact OD2-CZ 2.91Å; D106-R167 VanDerWaalsContact OD2-CZ 3.32Å; D106-R167 IonicContact OD2-NH1 3.37Å; D106-R167 PolarHBondContact OD2-NH1 3.27Å; D106-R167 IonicContact OD2-NH2 3.88Å; D106-R167 PolarHBondContact OD2-NH2 3Å; D106-M181 WeakPolarHBondContact CA-O 3.4Å; D106-M181 WeakPolarHBondContact CB-O 3.26Å
107	P	95.3	Very high	97	Very high	23 Å²	23	29.2 Å²	29.2	15%	0.149	16%	0.157	C	C	.	.	H	α-helix	trans	-53.7	-35.4	176.9	-28.5	37.7	0	0	0	113.8	R105 A109 I110 S111 L128 E184 R185	R105-P107 WeakPolarHBondContact O-CD 3.45Å; P107-A109 VanDerWaalsContact C-N 3.34Å; P107-A109 PolarHBondContact O-N 3.32Å; P107-I110 PolarHBondContact O-N 3.46Å; P107-S111 PolarHBondContact O-N 3.41Å; P107-S111 PolarHBondContact O-OG 3.16Å; P107-L128 HydrophobicContact CG-CD1 4.32Å; P107-E184 HydrophobicContact CG-CB 4.32Å; P107-R185 HydrophobicContact CG-CG 3.74Å
108	A	93.9	Very high	97.1	Very high	30 Å²	30	31 Å²	31	25%	0.248	16%	0.163	C	C	.	.	H	α-helix	trans	-65.6	-37.7	179.5	0	0	0	0	0	112.1	D106 S111 L112 M160	D106-A108 PolarHBondContact O-N 2.87Å; D106-A108 WeakPolarHBondContact OD1-CB 3.15Å; D106-A108 PolarHBondContact OD1-N 3.37Å; A108-S111 PolarHBondContact O-N 3.29Å; A108-L112 PolarHBondContact O-N 3.28Å; A108-M160 HydrophobicContact CB-CE 4.49Å
109	A	95.4	Very high	97	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.017	19%	0.192	C	C	.	.	H	α-helix	trans	-67.2	-38.3	174.1	0	0	0	0	0	111.1	F82 G83 D104 D106 P107 L112 A113	F82-A109 HydrophobicContact CD1-CB 4.47Å; F82-A109 WeakPolarHBondContact CD1-O 3.4Å; F82-A109 WeakPolarHBondContact CE1-O 3.41Å; G83-A109 WeakPolarHBondContact O-CB 3.16Å; D104-A109 HydrophobicContact CB-CB 3.7Å; D104-A109 VanDerWaalsContact CG-CB 3.47Å; D106-A109 HydrophobicContact CB-CB 4.14Å; D106-A109 WeakPolarHBondContact O-CB 2.95Å; D106-A109 PolarHBondContact O-N 2.87Å; D106-A109 VanDerWaalsContact O-N 3.09Å; P107-A109 VanDerWaalsContact C-N 3.34Å; P107-A109 PolarHBondContact O-N 3.32Å; A109-L112 WeakPolarHBondContact O-CB 3.38Å; A109-L112 PolarHBondContact O-N 3.06Å; A109-A113 PolarHBondContact O-N 3.08Å
110	I	96.9	Very high	96.8	Very high	8 Å²	8	37.8 Å²	37.8	4%	0.041	19%	0.193	C	C	.	.	H	α-helix	trans	-68.7	-34.9	177.2	-66	-53.7	0	0	0	112.8	D104 D106 P107 L112 A113 Q114 P126 L127 L128	D104-I110 HydrophobicContact CB-CD1 3.89Å; D104-I110 HydrophobicContact CB-CG1 4.27Å; D106-I110 PolarHBondContact O-N 3.34Å; P107-I110 PolarHBondContact O-N 3.46Å; I110-L112 PolarHBondContact O-N 3.26Å; I110-A113 HydrophobicContact CD1-CB 4.47Å; I110-A113 PolarHBondContact O-N 3.24Å; I110-A113 VanDerWaalsContact O-N 3.14Å; I110-Q114 HydrophobicContact CG2-CG 4.3Å; I110-Q114 VanDerWaalsContact O-CG 3.29Å; I110-Q114 WeakPolarHBondContact O-CG 3.3Å; I110-Q114 PolarHBondContact O-N 2.94Å; I110-P126 HydrophobicContact CG2-CB 4.28Å; I110-L127 VanDerWaalsContact CD1-O 3.23Å; I110-L127 WeakPolarHBondContact CD1-O 3.28Å; I110-L128 HydrophobicContact CB-CD1 4.11Å; I110-L128 HydrophobicContact CG1-CB 3.97Å; I110-L128 HydrophobicContact CG1-CD1 3.5Å; I110-L128 VanDerWaalsContact CG1-CD1 3.5Å; I110-L128 HydrophobicContact CG1-CG 4.33Å; I110-L128 HydrophobicContact CG2-CB 4.26Å
111	S	96.6	Very high	96.3	Very high	59 Å²	59	43 Å²	43	41%	0.413	23%	0.229	S	C	.	.	H	α-helix	trans	-58.1	-39.9	171.2	-60.8	0	0	0	0	111.8	P107 A108 Q114 Q115	P107-S111 PolarHBondContact O-N 3.41Å; P107-S111 PolarHBondContact O-OG 3.16Å; A108-S111 PolarHBondContact O-N 3.29Å; S111-Q114 PolarHBondContact O-N 2.81Å; S111-Q115 WeakPolarHBondContact O-CG 3.4Å; S111-Q115 PolarHBondContact O-N 2.84Å
112	L	96.6	Very high	95.9	Very high	56 Å²	56	45.9 Å²	45.9	29%	0.293	26%	0.258	S	S	.	.	H	α-helix	trans	-67.7	-40	173.7	-65.1	-177.5	0	0	0	112.5	F82 A108 A109 I110 Q114 Q115 L116 M160	F82-L112 HydrophobicContact CE1-CB 3.95Å; A108-L112 PolarHBondContact O-N 3.28Å; A109-L112 WeakPolarHBondContact O-CB 3.38Å; A109-L112 PolarHBondContact O-N 3.06Å; I110-L112 PolarHBondContact O-N 3.26Å; L112-Q114 VanDerWaalsContact C-N 3.28Å; L112-Q114 PolarHBondContact O-N 2.93Å; L112-Q115 PolarHBondContact O-N 3.48Å; L112-L116 WeakPolarHBondContact O-CB 3.35Å; L112-L116 PolarHBondContact O-N 2.89Å; L112-M160 HydrophobicContact CD1-CE 3.39Å; L112-M160 HydrophobicContact CD1-SD 3.36Å; L112-M160 WeakPolarHBondContact CD1-SD 3.29Å; L112-M160 HydrophobicContact CG-CE 4.19Å
113	A	97.3	Very high	95.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.9	-38.4	175.3	0	0	0	0	0	111.7	F82 A102 A109 I110 L116 A117 P126	F82-A113 HydrophobicContact CD1-CB 3.82Å; F82-A113 HydrophobicContact CD2-CB 4.35Å; F82-A113 HydrophobicContact CE1-CB 3.57Å; F82-A113 VanDerWaalsContact CE1-N 3.32Å; F82-A113 HydrophobicContact CE2-CB 4.09Å; F82-A113 HydrophobicContact CG-CB 4.2Å; F82-A113 VanDerWaalsContact CZ-CA 3.44Å; F82-A113 HydrophobicContact CZ-CB 3.7Å; A102-A113 HydrophobicContact CB-CB 4.18Å; A109-A113 PolarHBondContact O-N 3.08Å; I110-A113 HydrophobicContact CD1-CB 4.47Å; I110-A113 PolarHBondContact O-N 3.24Å; I110-A113 VanDerWaalsContact O-N 3.14Å; A113-L116 PolarHBondContact O-N 2.83Å; A113-A117 WeakPolarHBondContact O-CB 3.22Å; A113-A117 PolarHBondContact O-N 3.3Å; A113-P126 HydrophobicContact CB-CB 3.84Å; A113-P126 HydrophobicContact CB-CG 3.98Å
114	Q	97.6	Very high	95.8	Very high	99 Å²	99	49.1 Å²	49.1	46%	0.463	27%	0.271	S	S	.	.	H	α-helix	trans	-66.2	-39.6	175.1	-72.1	170.6	-15.2	0	0	112.3	I110 S111 L112 A117 K118 P126	I110-Q114 HydrophobicContact CG2-CG 4.3Å; I110-Q114 VanDerWaalsContact O-CG 3.29Å; I110-Q114 WeakPolarHBondContact O-CG 3.3Å; I110-Q114 PolarHBondContact O-N 2.94Å; S111-Q114 PolarHBondContact O-N 2.81Å; L112-Q114 VanDerWaalsContact C-N 3.28Å; L112-Q114 PolarHBondContact O-N 2.93Å; Q114-A117 PolarHBondContact O-N 3.43Å; Q114-K118 WeakPolarHBondContact O-CG 3.34Å; Q114-K118 PolarHBondContact O-N 2.84Å; Q114-P126 HydrophobicContact CG-CB 4.13Å; Q114-P126 HydrophobicContact CG-CG 3.95Å
115	Q	96.9	Very high	95.8	Very high	105 Å²	105	52.2 Å²	52.2	49%	0.491	28%	0.284	S	S	.	.	H	α-helix	trans	-61.8	-48.2	172.4	-71.9	173	-9.1	0	0	110.7	S111 L112 A117 K118 E119	S111-Q115 WeakPolarHBondContact O-CG 3.4Å; S111-Q115 PolarHBondContact O-N 2.84Å; L112-Q115 PolarHBondContact O-N 3.48Å; Q115-A117 VanDerWaalsContact C-N 3.25Å; Q115-A117 PolarHBondContact O-N 2.91Å; Q115-K118 WeakPolarHBondContact O-CB 3.29Å; Q115-K118 PolarHBondContact O-N 2.89Å; Q115-E119 PolarHBondContact O-N 3.42Å
116	L	96.9	Very high	95.9	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-34.1	177.8	-169.8	65.1	0	0	0	112.6	F82 T88 K89 L92 L112 A113 K118 E119 H120 V124	F82-L116 HydrophobicContact CE2-CD2 3.86Å; F82-L116 HydrophobicContact CZ-CD2 4.03Å; T88-L116 HydrophobicContact CG2-CD2 3.69Å; K89-L116 HydrophobicContact CD-CD1 4.43Å; K89-L116 HydrophobicContact CG-CD1 3.79Å; K89-L116 HydrophobicContact CG-CD2 3.9Å; L92-L116 HydrophobicContact CD1-CD1 4.46Å; L92-L116 HydrophobicContact CD1-CD2 3.84Å; L92-L116 HydrophobicContact CD1-CG 4.14Å; L112-L116 WeakPolarHBondContact O-CB 3.35Å; L112-L116 PolarHBondContact O-N 2.89Å; A113-L116 PolarHBondContact O-N 2.83Å; L116-K118 VanDerWaalsContact C-N 3.31Å; L116-K118 PolarHBondContact O-N 2.89Å; L116-E119 PolarHBondContact O-N 3.38Å; L116-H120 PolarHBondContact O-N 3.19Å; L116-V124 HydrophobicContact CD2-CG2 4.43Å; L116-V124 HydrophobicContact CG-CG2 4.3Å
117	A	97.4	Very high	96	Very high	19 Å²	19	53.4 Å²	53.4	16%	0.157	30%	0.295	C	S	.	.	H	α-helix	trans	-66.9	-29.8	174.8	0	0	0	0	0	113.6	A113 Q114 Q115 H120 S121 V124 P126	A113-A117 WeakPolarHBondContact O-CB 3.22Å; A113-A117 PolarHBondContact O-N 3.3Å; Q114-A117 PolarHBondContact O-N 3.43Å; Q115-A117 VanDerWaalsContact C-N 3.25Å; Q115-A117 PolarHBondContact O-N 2.91Å; A117-H120 CarbonylContact O-C 3.16Å; A117-S121 PolarHBondContact O-N 3.39Å; A117-V124 HydrophobicContact CB-CB 3.95Å; A117-V124 HydrophobicContact CB-CG1 4.23Å; A117-V124 WeakPolarHBondContact CB-O 3.31Å; A117-P126 HydrophobicContact CB-CG 4.09Å
118	K	96.6	Very high	96.1	Very high	174 Å²	174	55.7 Å²	55.7	76%	0.757	31%	0.305	S	S	*	.	H	α-helix	trans	-70	-37.7	172.2	-65.5	172.2	-176.3	-179.4	0	111.3	Q114 Q115 L116	Q114-K118 WeakPolarHBondContact O-CG 3.34Å; Q114-K118 PolarHBondContact O-N 2.84Å; Q115-K118 WeakPolarHBondContact O-CB 3.29Å; Q115-K118 PolarHBondContact O-N 2.89Å; L116-K118 VanDerWaalsContact C-N 3.31Å; L116-K118 PolarHBondContact O-N 2.89Å
119	E	95.4	Very high	96.3	Very high	132 Å²	132	54.3 Å²	54.3	62%	0.617	29%	0.293	S	S	*	.	H	α-helix	trans	-70.2	-34.7	177.2	-65.1	168.4	-166.7	0	0	112.2	Q115 L116	Q115-E119 PolarHBondContact O-N 3.42Å; L116-E119 PolarHBondContact O-N 3.38Å
120	H	93.9	Very high	96.4	Very high	41 Å²	41	56.4 Å²	56.4	19%	0.19	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	66.6	-179.4	-63.6	-86.9	0	0	0	111.4	L116 A117 G122 R123 V124	L116-H120 PolarHBondContact O-N 3.19Å; A117-H120 CarbonylContact O-C 3.16Å; H120-G122 PolarHBondContact O-N 3.13Å; H120-R123 HydrophobicContact CB-CB 4.25Å; H120-R123 PolarHBondContact O-N 2.93Å; H120-V124 HydrophobicContact CB-CG2 4.17Å
121	S	89.7	Confident	96.5	Very high	110 Å²	110	57.5 Å²	57.5	77%	0.769	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	126.7	-175.5	-171.1	0	0	0	0	112.6	A117 R123	A117-S121 PolarHBondContact O-N 3.39Å; S121-R123 PolarHBondContact O-N 3.02Å
122	G	90.1	Very high	96.4	Very high	59 Å²	59	57 Å²	57	61%	0.608	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-13.7	179.7	0	0	0	0	0	115.9	H120	H120-G122 PolarHBondContact O-N 3.13Å
123	R	96.6	Very high	96.5	Very high	60 Å²	60	56.8 Å²	56.8	23%	0.226	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-15.1	-174.9	-69	178.7	66.3	-165.8	-3.3	114.4	L92 V95 V98 T99 V100 H120 S121	L92-R123 HydrophobicContact CD2-CB 4.06Å; L92-R123 PolarHBondContact O-NH2 3.02Å; V95-R123 PolarHBondContact O-NH2 2.91Å; V98-R123 WeakPolarHBondContact O-CB 3.27Å; V98-R123 PolarHBondContact O-NE 2.59Å; T99-R123 CarbonylContact C-O 3.55Å; T99-R123 VanDerWaalsContact CA-O 3.32Å; T99-R123 WeakPolarHBondContact CA-O 3.32Å; V100-R123 PolarHBondContact N-O 3.22Å; H120-R123 HydrophobicContact CB-CB 4.25Å; H120-R123 PolarHBondContact O-N 2.93Å; S121-R123 PolarHBondContact O-N 3.02Å
124	V	98.3	Very high	96.5	Very high	8 Å²	8	56.8 Å²	56.8	5%	0.048	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.4	175.2	-176.6	0	0	0	0	109.6	L92 V100 A102 L116 A117 H120	L92-V124 HydrophobicContact CD1-CG2 3.48Å; L92-V124 VanDerWaalsContact CD1-CG2 3.48Å; L92-V124 HydrophobicContact CD2-CG2 3.94Å; L92-V124 HydrophobicContact CG-CG2 4.32Å; V100-V124 CarbonylContact O-C 3.54Å; V100-V124 WeakPolarHBondContact O-CA 3.34Å; A102-V124 HydrophobicContact CB-CG1 4.11Å; L116-V124 HydrophobicContact CD2-CG2 4.43Å; L116-V124 HydrophobicContact CG-CG2 4.3Å; A117-V124 HydrophobicContact CB-CB 3.95Å; A117-V124 HydrophobicContact CB-CG1 4.23Å; A117-V124 WeakPolarHBondContact CB-O 3.31Å; H120-V124 HydrophobicContact CB-CG2 4.17Å
125	K	98.1	Very high	96.4	Very high	81 Å²	81	57.7 Å²	57.7	35%	0.352	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	99.6	177.7	-55	-170.5	-174.2	176.7	0	109.2	T99 V100 L101 A102 M141	T99-K125 HydrophobicContact CG2-CD 4.48Å; V100-K125 PolarHBondContact O-N 3.28Å; L101-K125 HydrophobicContact CD2-CB 3.79Å; L101-K125 HydrophobicContact CD2-CD 3.73Å; L101-K125 HydrophobicContact CD2-CG 4.08Å; A102-K125 PolarHBondContact N-O 2.95Å; K125-M141 HydrophobicContact CB-CE 3.82Å; K125-M141 HydrophobicContact CD-CE 3.43Å; K125-M141 VanDerWaalsContact CD-CE 3.43Å; K125-M141 HydrophobicContact CG-CE 4.21Å
126	P	98.3	Very high	96.4	Very high	42 Å²	42	55.5 Å²	55.5	27%	0.273	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	135.9	178.6	-21.3	34.1	0	0	0	112	A102 I110 A113 Q114 A117	A102-P126 CarbonylContact O-C 3.54Å; A102-P126 WeakPolarHBondContact O-CA 3.42Å; I110-P126 HydrophobicContact CG2-CB 4.28Å; A113-P126 HydrophobicContact CB-CB 3.84Å; A113-P126 HydrophobicContact CB-CG 3.98Å; Q114-P126 HydrophobicContact CG-CB 4.13Å; Q114-P126 HydrophobicContact CG-CG 3.95Å; A117-P126 HydrophobicContact CB-CG 4.09Å
127	L	98.1	Very high	96.4	Very high	11 Å²	11	57.3 Å²	57.3	6%	0.058	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	108.2	178.1	-52.4	179.5	0	0	0	109.6	L101 A102 L103 D104 I110 G129 L134 L138 M141	L101-L127 HydrophobicContact CB-CD1 4.01Å; A102-L127 PolarHBondContact O-N 3.2Å; L103-L127 WeakPolarHBondContact CA-O 3.34Å; L103-L127 HydrophobicContact CB-CB 4.16Å; L103-L127 HydrophobicContact CD1-CB 3.76Å; L103-L127 WeakPolarHBondContact CD1-O 3.45Å; D104-L127 PolarHBondContact N-O 3.07Å; D104-L127 VanDerWaalsContact N-O 3.15Å; I110-L127 VanDerWaalsContact CD1-O 3.23Å; I110-L127 WeakPolarHBondContact CD1-O 3.28Å; L127-G129 PolarHBondContact O-N 2.78Å; L127-L134 HydrophobicContact CD1-CD1 4.08Å; L127-L138 HydrophobicContact CD1-CD2 4.36Å; L127-M141 HydrophobicContact CD1-SD 4.43Å; L127-M141 HydrophobicContact CD2-CE 4.06Å; L127-M141 HydrophobicContact CD2-SD 3.17Å; L127-M141 WeakPolarHBondContact CD2-SD 3.46Å; L127-M141 HydrophobicContact CG-SD 4.39Å
128	L	98.3	Very high	96.4	Very high	71 Å²	71	56.9 Å²	56.9	37%	0.372	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	110.3	173.6	-176.4	62.9	0	0	0	109.8	P107 I110	P107-L128 HydrophobicContact CG-CD1 4.32Å; I110-L128 HydrophobicContact CB-CD1 4.11Å; I110-L128 HydrophobicContact CG1-CB 3.97Å; I110-L128 HydrophobicContact CG1-CD1 3.5Å; I110-L128 VanDerWaalsContact CG1-CD1 3.5Å; I110-L128 HydrophobicContact CG1-CG 4.33Å; I110-L128 HydrophobicContact CG2-CB 4.26Å
129	G	97.6	Very high	96.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.295	C	S	.	.			trans	179.3	159.5	-178.1	0	0	0	0	0	115	L103 D104 R105 L127 E133	L103-G129 WeakPolarHBondContact CD1-O 3.46Å; D104-G129 CarbonylContact C-O 3.48Å; D104-G129 VanDerWaalsContact C-O 3.27Å; D104-G129 PolarHBondContact O-N 2.86Å; R105-G129 VanDerWaalsContact CA-O 3.27Å; R105-G129 WeakPolarHBondContact CA-O 3.38Å; R105-G129 PolarHBondContact N-O 2.72Å; L127-G129 PolarHBondContact O-N 2.78Å; G129-E133 WeakPolarHBondContact CA-OE2 3.18Å
130	R	97.6	Very high	96.3	Very high	47 Å²	47	51.9 Å²	51.9	18%	0.177	30%	0.299	C	S	.	.			trans	-79.6	166.4	166.2	-60.7	176.8	174.9	177.3	-4.6	110.1	R105 S132 E133 L134 D182 Y186 M189 E283	R105-R130 HydrophobicContact CB-CG 4.02Å; R130-S132 WeakPolarHBondContact CB-OG 3.19Å; R130-S132 PolarHBondContact O-N 2.95Å; R130-E133 HydrophobicContact CB-CG 4.25Å; R130-E133 PolarHBondContact N-OE2 3.45Å; R130-E133 PolarHBondContact O-N 3.13Å; R130-L134 PolarHBondContact O-N 3.19Å; R130-D182 IonicContact CZ-OD2 3.73Å; R130-D182 IonicContact NE-OD2 3.98Å; R130-D182 PolarHBondContact NE-OD2 3.46Å; R130-D182 IonicContact NH2-OD1 2.76Å; R130-D182 PolarHBondContact NH2-OD1 2.87Å; R130-D182 VanDerWaalsContact NH2-OD1 3.14Å; R130-D182 IonicContact NH2-OD2 2.77Å; R130-D182 PolarHBondContact NH2-OD2 3.35Å; R130-D182 VanDerWaalsContact NH2-OD2 3.08Å; R130-Y186 VanDerWaalsContact CZ-CE2 3.49Å; R130-M189 PolarHBondContact NH2-SD 2.74Å; R130-E283 WeakPolarHBondContact CB-OE2 3.47Å
131	F	97.7	Very high	96.4	Very high	31 Å²	31	52.9 Å²	52.9	14%	0.136	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-64.9	-34.2	178.8	-59.8	-9.1	0	0	0	111.8	M80 T81 L103 E133 L134 L153 E283	M80-F131 HydrophobicContact CB-CE1 4.26Å; M80-F131 HydrophobicContact CE-CB 4.19Å; M80-F131 HydrophobicContact CE-CD1 3.88Å; M80-F131 HydrophobicContact CE-CD2 4.38Å; M80-F131 HydrophobicContact CE-CE1 4.46Å; M80-F131 HydrophobicContact CE-CG 3.88Å; M80-F131 WeakPolarHBondContact O-CE1 3.47Å; T81-F131 HydrophobicContact CG2-CE1 4.13Å; T81-F131 HydrophobicContact CG2-CZ 3.6Å; L103-F131 HydrophobicContact CD2-CD1 3.85Å; L103-F131 HydrophobicContact CD2-CE1 4.27Å; F131-E133 PolarHBondContact O-N 3.35Å; F131-L134 WeakPolarHBondContact O-CB 3.38Å; F131-L134 PolarHBondContact O-N 3.14Å; F131-L153 HydrophobicContact CD2-CD2 4.22Å; F131-L153 HydrophobicContact CE1-CD2 4.26Å; F131-L153 HydrophobicContact CE2-CD2 3.55Å; F131-L153 HydrophobicContact CZ-CD2 3.59Å; F131-E283 WeakPolarHBondContact CB-O 3.49Å; F131-E283 HydrophobicContact CD2-CB 4.36Å; F131-E283 VanDerWaalsContact CD2-O 3.29Å; F131-E283 WeakPolarHBondContact CD2-O 3.37Å; F131-E283 PolarHBondContact N-OE2 2.83Å
132	S	96.4	Very high	96.6	Very high	49 Å²	49	54.4 Å²	54.4	34%	0.343	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-59	-25.5	170.7	44	0	0	0	0	115.1	R130 E283 K286	R130-S132 WeakPolarHBondContact CB-OG 3.19Å; R130-S132 PolarHBondContact O-N 2.95Å; S132-E283 VanDerWaalsContact CB-OE1 3.28Å; S132-E283 WeakPolarHBondContact CB-OE1 3.36Å; S132-E283 WeakPolarHBondContact CB-OE2 3.23Å; S132-E283 PolarHBondContact N-OE2 3.24Å; S132-E283 VanDerWaalsContact OG-CD 3.24Å; S132-E283 PolarHBondContact OG-OE1 3.14Å; S132-E283 PolarHBondContact OG-OE2 3.36Å; S132-K286 VanDerWaalsContact CB-CD 3.45Å
133	E	97.5	Very high	96.8	Very high	50 Å²	50	53.3 Å²	53.3	23%	0.234	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-94.6	-12.2	-176.8	-62.2	164.3	173.3	0	0	111.4	G129 R130 F131 E135 A136 L137 R185 Y186	G129-E133 WeakPolarHBondContact CA-OE2 3.18Å; R130-E133 HydrophobicContact CB-CG 4.25Å; R130-E133 PolarHBondContact N-OE2 3.45Å; R130-E133 PolarHBondContact O-N 3.13Å; F131-E133 PolarHBondContact O-N 3.35Å; E133-E135 PolarHBondContact O-N 3.31Å; E133-A136 PolarHBondContact O-N 3.01Å; E133-L137 HydrophobicContact CB-CD1 4.43Å; E133-L137 WeakPolarHBondContact O-CG 3.19Å; E133-L137 PolarHBondContact O-N 3.4Å; E133-L137 VanDerWaalsContact O-N 3.13Å; E133-R185 IonicContact OE1-NH2 3.63Å; E133-R185 PolarHBondContact OE1-NH2 2.76Å; E133-R185 IonicContact OE2-CZ 2.92Å; E133-R185 IonicContact OE2-NH1 3.57Å; E133-R185 IonicContact OE2-NH2 2.86Å; E133-R185 PolarHBondContact OE2-NH2 3.37Å; E133-Y186 PolarHBondContact OE1-OH 3.14Å
134	L	96.9	Very high	96.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-37.9	-168.4	-177.9	57.8	0	0	0	113.9	L78 M80 L103 L127 R130 F131 A136 L137 L138 V290	L78-L134 HydrophobicContact CD1-CD1 4.37Å; L78-L134 HydrophobicContact CD1-CD2 4.41Å; L78-L134 HydrophobicContact CD2-CD2 3.84Å; M80-L134 HydrophobicContact CE-CD2 3.42Å; M80-L134 VanDerWaalsContact CE-CD2 3.42Å; M80-L134 HydrophobicContact CG-CD2 4.27Å; M80-L134 HydrophobicContact SD-CD2 4.08Å; L103-L134 HydrophobicContact CD1-CD1 4.01Å; L103-L134 HydrophobicContact CD2-CB 4.33Å; L103-L134 HydrophobicContact CD2-CD1 3.86Å; L103-L134 HydrophobicContact CD2-CD2 3.76Å; L103-L134 HydrophobicContact CD2-CG 4.2Å; L103-L134 HydrophobicContact CG-CD1 4.41Å; L127-L134 HydrophobicContact CD1-CD1 4.08Å; R130-L134 PolarHBondContact O-N 3.19Å; F131-L134 WeakPolarHBondContact O-CB 3.38Å; F131-L134 PolarHBondContact O-N 3.14Å; L134-A136 VanDerWaalsContact C-N 3.3Å; L134-A136 PolarHBondContact O-N 3.34Å; L134-L137 PolarHBondContact O-N 3.15Å; L134-L138 HydrophobicContact CD1-CD1 4.26Å; L134-L138 HydrophobicContact CD1-CD2 4.2Å; L134-L138 HydrophobicContact CD1-CG 3.88Å; L134-L138 HydrophobicContact CG-CD1 4.04Å; L134-L138 HydrophobicContact CG-CG 4.13Å; L134-L138 WeakPolarHBondContact O-CG 3.32Å; L134-L138 PolarHBondContact O-N 3.25Å; L134-V290 HydrophobicContact CB-CG1 4.1Å; L134-V290 HydrophobicContact CD2-CB 4.35Å; L134-V290 HydrophobicContact CD2-CG1 3.67Å; L134-V290 HydrophobicContact CG-CG1 3.77Å
135	E	95.7	Very high	96.3	Very high	119 Å²	119	62.6 Å²	62.6	56%	0.556	34%	0.337	S	S	*	.	H	α-helix	trans	-60.2	-42	178.9	-176.2	170	-159.1	0	0	111.9	E133 S139 V290	E133-E135 PolarHBondContact O-N 3.31Å; E135-S139 WeakPolarHBondContact O-CB 3.11Å; E135-S139 PolarHBondContact O-N 2.77Å; E135-S139 VanDerWaalsContact O-N 3.07Å; E135-S139 PolarHBondContact O-OG 2.78Å; E135-V290 HydrophobicContact CB-CG2 4.28Å
136	A	96.6	Very high	96.2	Very high	58 Å²	58	60.2 Å²	60.2	48%	0.479	34%	0.336	S	S	.	.	H	α-helix	trans	-67.7	-41.1	175.3	0	0	0	0	0	111.4	E133 L134 S139 N140	E133-A136 PolarHBondContact O-N 3.01Å; L134-A136 VanDerWaalsContact C-N 3.3Å; L134-A136 PolarHBondContact O-N 3.34Å; A136-S139 PolarHBondContact O-N 2.96Å; A136-N140 WeakPolarHBondContact O-CB 3.41Å; A136-N140 PolarHBondContact O-N 3.15Å; A136-N140 PolarHBondContact O-ND2 3.17Å
137	L	97.6	Very high	96.1	Very high	41 Å²	41	60.5 Å²	60.5	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-61.8	-45.6	177.3	-68.7	171.6	0	0	0	112.2	L103 E133 L134 S139 N140 M141	L103-L137 HydrophobicContact CD1-CD1 4.03Å; E133-L137 HydrophobicContact CB-CD1 4.43Å; E133-L137 WeakPolarHBondContact O-CG 3.19Å; E133-L137 PolarHBondContact O-N 3.4Å; E133-L137 VanDerWaalsContact O-N 3.13Å; L134-L137 PolarHBondContact O-N 3.15Å; L137-S139 VanDerWaalsContact C-N 3.34Å; L137-N140 PolarHBondContact O-N 3.15Å; L137-M141 WeakPolarHBondContact O-CG 3.34Å; L137-M141 PolarHBondContact O-N 3.21Å
138	L	96.9	Very high	96.2	Very high	10 Å²	10	60 Å²	60	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-42.1	176.7	-68.3	178.1	0	0	0	111.4	L101 L127 L134 M141 N142 I143 I148 V290 A294	L101-L138 HydrophobicContact CD1-CD2 3.64Å; L127-L138 HydrophobicContact CD1-CD2 4.36Å; L134-L138 HydrophobicContact CD1-CD1 4.26Å; L134-L138 HydrophobicContact CD1-CD2 4.2Å; L134-L138 HydrophobicContact CD1-CG 3.88Å; L134-L138 HydrophobicContact CG-CD1 4.04Å; L134-L138 HydrophobicContact CG-CG 4.13Å; L134-L138 WeakPolarHBondContact O-CG 3.32Å; L134-L138 PolarHBondContact O-N 3.25Å; L138-M141 PolarHBondContact O-N 2.83Å; L138-N142 PolarHBondContact O-N 2.9Å; L138-I143 HydrophobicContact CB-CB 4.24Å; L138-I143 HydrophobicContact CD2-CB 4.28Å; L138-I143 HydrophobicContact CD2-CG1 4.44Å; L138-I143 HydrophobicContact CD2-CG2 4.25Å; L138-I143 WeakPolarHBondContact O-CB 3.43Å; L138-I143 PolarHBondContact O-N 2.79Å; L138-I148 HydrophobicContact CD1-CD1 4.29Å; L138-I148 HydrophobicContact CD2-CD1 4.39Å; L138-V290 HydrophobicContact CD1-CG1 4.21Å; L138-A294 HydrophobicContact CD1-CB 4.09Å
139	S	95.3	Very high	96.2	Very high	70 Å²	70	57.6 Å²	57.6	49%	0.49	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-43.9	177.4	-59.8	0	0	0	0	112	E135 A136 L137 M141 N142	E135-S139 WeakPolarHBondContact O-CB 3.11Å; E135-S139 PolarHBondContact O-N 2.77Å; E135-S139 VanDerWaalsContact O-N 3.07Å; E135-S139 PolarHBondContact O-OG 2.78Å; A136-S139 PolarHBondContact O-N 2.96Å; L137-S139 VanDerWaalsContact C-N 3.34Å; S139-M141 PolarHBondContact O-N 2.72Å; S139-N142 WeakPolarHBondContact O-CA 3.43Å; S139-N142 PolarHBondContact O-N 2.94Å
140	N	95.9	Very high	96.2	Very high	131 Å²	131	57.6 Å²	57.6	70%	0.701	32%	0.324	S	S	*	.	H	α-helix	trans	-62.2	-25.3	177.3	-70.7	-16.3	0	0	0	113.1	A136 L137 N142	A136-N140 WeakPolarHBondContact O-CB 3.41Å; A136-N140 PolarHBondContact O-N 3.15Å; A136-N140 PolarHBondContact O-ND2 3.17Å; L137-N140 PolarHBondContact O-N 3.15Å; N140-N142 VanDerWaalsContact C-N 3.32Å
141	M	95	Very high	96.3	Very high	62 Å²	62	55.4 Å²	55.4	31%	0.305	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	4.4	174.7	-66.4	178.1	76.7	0	0	113.7	L101 K125 L127 L137 L138 S139 I143	L101-M141 HydrophobicContact CD2-CE 4.23Å; K125-M141 HydrophobicContact CB-CE 3.82Å; K125-M141 HydrophobicContact CD-CE 3.43Å; K125-M141 VanDerWaalsContact CD-CE 3.43Å; K125-M141 HydrophobicContact CG-CE 4.21Å; L127-M141 HydrophobicContact CD1-SD 4.43Å; L127-M141 HydrophobicContact CD2-CE 4.06Å; L127-M141 HydrophobicContact CD2-SD 3.17Å; L127-M141 WeakPolarHBondContact CD2-SD 3.46Å; L127-M141 HydrophobicContact CG-SD 4.39Å; L137-M141 WeakPolarHBondContact O-CG 3.34Å; L137-M141 PolarHBondContact O-N 3.21Å; L138-M141 PolarHBondContact O-N 2.83Å; S139-M141 PolarHBondContact O-N 2.72Å; M141-I143 HydrophobicContact CB-CG1 3.9Å; M141-I143 PolarHBondContact O-N 2.78Å
142	N	95.2	Very high	96.3	Very high	143 Å²	143	53.9 Å²	53.9	77%	0.765	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	28.6	-172.8	-56.3	-62.9	0	0	0	113.5	L138 S139 N140 K144	L138-N142 PolarHBondContact O-N 2.9Å; S139-N142 WeakPolarHBondContact O-CA 3.43Å; S139-N142 PolarHBondContact O-N 2.94Å; N140-N142 VanDerWaalsContact C-N 3.32Å; N142-K144 PolarHBondContact O-N 2.82Å
143	I	93.5	Very high	96.4	Very high	36 Å²	36	51.6 Å²	51.6	19%	0.185	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-80.2	117.4	171.7	-58.1	-62.6	0	0	0	107.9	L101 L138 M141 I148	L101-I143 HydrophobicContact CD1-CG1 4.37Å; L138-I143 HydrophobicContact CB-CB 4.24Å; L138-I143 HydrophobicContact CD2-CB 4.28Å; L138-I143 HydrophobicContact CD2-CG1 4.44Å; L138-I143 HydrophobicContact CD2-CG2 4.25Å; L138-I143 WeakPolarHBondContact O-CB 3.43Å; L138-I143 PolarHBondContact O-N 2.79Å; M141-I143 HydrophobicContact CB-CG1 3.9Å; M141-I143 PolarHBondContact O-N 2.78Å; I143-I148 HydrophobicContact CG2-CD1 4.41Å; I143-I148 HydrophobicContact CG2-CG1 4.28Å
144	K	91.8	Very high	96.3	Very high	165 Å²	165	50.7 Å²	50.7	72%	0.717	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-76	147.7	-176.6	-63.2	-179.3	-178.7	178.1	0	110.5	N142 S147	N142-K144 PolarHBondContact O-N 2.82Å; K144-S147 WeakPolarHBondContact O-CB 3.49Å; K144-S147 PolarHBondContact O-N 3.27Å; K144-S147 PolarHBondContact O-OG 2.75Å
145	S	93.4	Very high	96	Very high	97 Å²	97	51.5 Å²	51.5	68%	0.678	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	142.9	166.6	-52.5	0	0	0	0	110.2	S147	S145-S147 VanDerWaalsContact C-N 3.3Å; S145-S147 PolarHBondContact O-N 3.19Å
146	G	95.6	Very high	95.3	Very high	31 Å²	31	46.7 Å²	46.7	32%	0.32	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	21.8	-178.2	0	0	0	0	0	115.1	S293 A294 K296	G146-S293 PolarHBondContact N-O 3.28Å; G146-A294 CarbonylContact C-O 3.51Å; G146-A294 WeakPolarHBondContact CA-O 3.19Å; G146-A294 PolarHBondContact N-O 2.98Å; G146-K296 VanDerWaalsContact O-CA 3.28Å; G146-K296 WeakPolarHBondContact O-CA 3.47Å; G146-K296 WeakPolarHBondContact O-CB 3.49Å
147	S	96.6	Very high	94.6	Very high	48 Å²	48	45.1 Å²	45.1	34%	0.336	26%	0.264	S	S	.	.			trans	-110.3	-2.5	179.2	83.1	0	0	0	0	114.8	K144 S145 A294	K144-S147 WeakPolarHBondContact O-CB 3.49Å; K144-S147 PolarHBondContact O-N 3.27Å; K144-S147 PolarHBondContact O-OG 2.75Å; S145-S147 VanDerWaalsContact C-N 3.3Å; S145-S147 PolarHBondContact O-N 3.19Å; S147-A294 PolarHBondContact N-O 2.83Å; S147-A294 VanDerWaalsContact N-O 3.13Å
148	I	98.3	Very high	93.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	134.9	-179.8	-56.6	-168	0	0	0	109.8	L78 L101 L138 I143 A150 V151 A294 L295 K296	L78-I148 HydrophobicContact CB-CD1 3.88Å; L78-I148 HydrophobicContact CB-CG2 3.94Å; L78-I148 HydrophobicContact CD2-CD1 3.78Å; L78-I148 HydrophobicContact CG-CD1 4.4Å; L101-I148 HydrophobicContact CD1-CD1 4.06Å; L138-I148 HydrophobicContact CD1-CD1 4.29Å; L138-I148 HydrophobicContact CD2-CD1 4.39Å; I143-I148 HydrophobicContact CG2-CD1 4.41Å; I143-I148 HydrophobicContact CG2-CG1 4.28Å; I148-A150 VanDerWaalsContact CG2-O 3.28Å; I148-A150 WeakPolarHBondContact CG2-O 3.35Å; I148-V151 HydrophobicContact CG2-CG2 4.16Å; I148-A294 WeakPolarHBondContact CB-O 3.33Å; I148-A294 HydrophobicContact CD1-CB 3.71Å; I148-A294 HydrophobicContact CG1-CB 4.12Å; I148-A294 PolarHBondContact N-O 3.1Å; I148-L295 HydrophobicContact CG2-CD2 4.4Å; I148-L295 WeakPolarHBondContact O-CA 3.33Å; I148-K296 PolarHBondContact O-N 3.45Å
149	D	98.6	Very high	93.2	Very high	21 Å²	21	44.9 Å²	44.9	11%	0.112	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-39.2	-177.7	-62.9	-85.9	0	0	0	112.7	Q75 V76 K296 G299 R300	Q75-D149 WeakPolarHBondContact CA-OD2 3.23Å; Q75-D149 HydrophobicContact CB-CB 3.75Å; Q75-D149 WeakPolarHBondContact CB-OD2 3.33Å; Q75-D149 HydrophobicContact CG-CB 3.91Å; Q75-D149 PolarHBondContact NE2-OD1 3.41Å; V76-D149 PolarHBondContact N-OD2 2.86Å; V76-D149 WeakPolarHBondContact O-CB 3.34Å; V76-D149 PolarHBondContact O-N 3.17Å; D149-K296 WeakPolarHBondContact OD1-CE 3.25Å; D149-K296 IonicContact OD1-NZ 2.6Å; D149-K296 PolarHBondContact OD1-NZ 3.32Å; D149-G299 CarbonylContact O-C 3.48Å; D149-G299 WeakPolarHBondContact O-CA 3.41Å; D149-R300 PolarHBondContact O-N 2.98Å
150	A	98.5	Very high	92.6	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.008	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	146.6	-179.1	0	0	0	0	0	112.5	L69 V71 V76 V77 L78 I148 R300	L69-A150 HydrophobicContact CD2-CB 3.95Å; V71-A150 HydrophobicContact CG2-CB 4.3Å; V76-A150 PolarHBondContact O-N 3.15Å; V77-A150 CarbonylContact C-O 3.48Å; V77-A150 WeakPolarHBondContact CA-O 3.39Å; V77-A150 HydrophobicContact CG1-CB 4.49Å; V77-A150 HydrophobicContact CG2-CB 4.33Å; L78-A150 PolarHBondContact N-O 2.9Å; I148-A150 VanDerWaalsContact CG2-O 3.28Å; I148-A150 WeakPolarHBondContact CG2-O 3.35Å; A150-R300 CarbonylContact C-O 3.57Å; A150-R300 WeakPolarHBondContact CA-O 3.35Å; A150-R300 HydrophobicContact CB-CB 4.43Å
151	V	98.7	Very high	92.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.3	176	174.8	0	0	0	0	109.2	L78 M80 I148 A291 L295 R300 L301 C302	L78-V151 HydrophobicContact CB-CG2 4.12Å; L78-V151 HydrophobicContact CD2-CG2 4.12Å; L78-V151 HydrophobicContact CG-CG2 4.47Å; L78-V151 CarbonylContact O-C 3.53Å; L78-V151 WeakPolarHBondContact O-CA 3.42Å; M80-V151 HydrophobicContact CG-CG1 3.97Å; M80-V151 HydrophobicContact SD-CG1 3.64Å; I148-V151 HydrophobicContact CG2-CG2 4.16Å; V151-A291 HydrophobicContact CB-CB 4.35Å; V151-A291 HydrophobicContact CG1-CB 3.86Å; V151-A291 HydrophobicContact CG2-CB 4.22Å; V151-L295 HydrophobicContact CB-CD1 4.24Å; V151-L295 HydrophobicContact CB-CD2 4.35Å; V151-L295 HydrophobicContact CB-CG 4.38Å; V151-L295 HydrophobicContact CG2-CD1 3.96Å; V151-L295 HydrophobicContact CG2-CD2 3.7Å; V151-L295 HydrophobicContact CG2-CG 3.61Å; V151-R300 PolarHBondContact N-O 3.43Å; V151-L301 HydrophobicContact CB-CD1 3.85Å; V151-L301 HydrophobicContact CG1-CD1 3.69Å; V151-C302 PolarHBondContact O-N 3.05Å
152	L	98.6	Very high	91.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.6	170.6	177.9	61.8	0	0	0	109.8	V65 L69 L78 M80 H87 C302	V65-L152 HydrophobicContact CG1-CD1 3.84Å; V65-L152 HydrophobicContact CG1-CD2 4.06Å; V65-L152 HydrophobicContact CG2-CD1 4.28Å; L69-L152 HydrophobicContact CD1-CB 4.28Å; L69-L152 HydrophobicContact CD1-CD2 4.49Å; L78-L152 PolarHBondContact O-N 3Å; M80-L152 WeakPolarHBondContact CB-O 3.28Å; M80-L152 PolarHBondContact N-O 3.24Å; H87-L152 HydrophobicContact CB-CD2 3.53Å; L152-C302 WeakPolarHBondContact CA-O 3.29Å; L152-C302 HydrophobicContact CD1-CB 4.06Å
153	L	97.9	Very high	91.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	111.8	171.7	-90	161.3	0	0	0	109.3	M80 T81 F131 L288 L301 C302 V303 I304	M80-L153 HydrophobicContact CB-CD2 3.43Å; M80-L153 VanDerWaalsContact CB-CD2 3.43Å; M80-L153 HydrophobicContact CB-CG 3.77Å; M80-L153 HydrophobicContact CE-CD1 4.47Å; M80-L153 HydrophobicContact CE-CD2 4.04Å; M80-L153 HydrophobicContact CE-CG 4.47Å; M80-L153 HydrophobicContact CG-CD2 4.18Å; M80-L153 HydrophobicContact CG-CG 4.13Å; M80-L153 HydrophobicContact SD-CD1 3.77Å; M80-L153 HydrophobicContact SD-CD2 3.9Å; M80-L153 HydrophobicContact SD-CG 3.71Å; T81-L153 HydrophobicContact CG2-CD2 4.18Å; F131-L153 HydrophobicContact CD2-CD2 4.22Å; F131-L153 HydrophobicContact CE1-CD2 4.26Å; F131-L153 HydrophobicContact CE2-CD2 3.55Å; F131-L153 HydrophobicContact CZ-CD2 3.59Å; L153-L288 HydrophobicContact CD1-CD2 4.01Å; L153-L301 HydrophobicContact CD1-CD1 4.41Å; L153-C302 PolarHBondContact N-O 3.29Å; L153-V303 HydrophobicContact CB-CB 4.42Å; L153-V303 HydrophobicContact CB-CG1 3.97Å; L153-V303 HydrophobicContact CB-CG2 4.24Å; L153-V303 HydrophobicContact CD1-CG2 4.45Å; L153-V303 CarbonylContact O-C 3.59Å; L153-V303 VanDerWaalsContact O-CA 3.26Å; L153-V303 WeakPolarHBondContact O-CA 3.45Å; L153-I304 PolarHBondContact O-N 3.33Å
154	D	96.6	Very high	91.4	Very high	32 Å²	32	35.1 Å²	35.1	17%	0.171	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	87.2	172.2	-171.3	19.9	0	0	0	109.4	T81 G156 I304 F306	T81-D154 WeakPolarHBondContact CB-O 3.41Å; T81-D154 WeakPolarHBondContact CG2-O 3.48Å; T81-D154 WeakPolarHBondContact OG1-CA 3.16Å; T81-D154 WeakPolarHBondContact OG1-CB 3.46Å; T81-D154 PolarHBondContact OG1-N 2.96Å; D154-G156 PolarHBondContact O-N 3.03Å; D154-I304 HydrophobicContact CB-CD1 4.3Å; D154-I304 WeakPolarHBondContact OD1-CB 3.47Å; D154-F306 WeakPolarHBondContact OD1-CE2 3.27Å; D154-F306 WeakPolarHBondContact OD1-CZ 3.39Å
155	A	90.6	Very high	91.4	Very high	16 Å²	16	31.6 Å²	31.6	13%	0.132	19%	0.192	C	C	.	.			trans	-68.5	0.1	-163	0	0	0	0	0	115.7	L284 I304 E310	A155-L284 HydrophobicContact CB-CD1 4.14Å; A155-L284 HydrophobicContact CB-CD2 4.32Å; A155-I304 WeakPolarHBondContact CB-O 3.49Å; A155-I304 PolarHBondContact N-O 3.06Å; A155-E310 HydrophobicContact CB-CG 4.31Å
156	G	80.1	Confident	91.5	Very high	18 Å²	18	32.5 Å²	32.5	19%	0.186	19%	0.185	C	C	.	.	S	Bend	trans	-81.9	172.8	-178.3	0	0	0	0	0	113.9	D154 F306	D154-G156 PolarHBondContact O-N 3.03Å; G156-F306 VanDerWaalsContact CA-CE2 3.47Å
157	C	81.8	Confident	91.4	Very high	26 Å²	26	32.7 Å²	32.7	18%	0.176	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-71.6	141.7	166.3	-67.3	0	0	0	0	110.5	M162 M181 R274	C157-M162 HydrophobicContact CB-CG 4.22Å; C157-M162 HydrophobicContact CB-SD 4.19Å; C157-M181 VanDerWaalsContact SG-CE 3.5Å; C157-R274 WeakPolarHBondContact SG-CD 3.42Å; C157-R274 PolarHBondContact SG-NH1 3.41Å
158	S	83.1	Confident	91.4	Very high	19 Å²	19	30.4 Å²	30.4	13%	0.133	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-66.3	155.5	175.2	77	0	0	0	0	110.7	M160 Q161 M162	S158-M160 PolarHBondContact O-N 3.01Å; S158-Q161 VanDerWaalsContact N-OE1 3.08Å; S158-Q161 PolarHBondContact O-N 3.22Å; S158-Q161 WeakPolarHBondContact OG-CG 3.47Å; S158-Q161 PolarHBondContact OG-N 3.41Å; S158-M162 PolarHBondContact O-N 3.02Å
159	S	81.8	Confident	91.2	Very high	26 Å²	26	31 Å²	31	18%	0.182	16%	0.163	C	C	.	.	H	α-helix	trans	-55.3	-41.8	172.7	54.3	0	0	0	0	112	Q161 M162 D163	S159-Q161 VanDerWaalsContact C-N 3.28Å; S159-Q161 PolarHBondContact O-N 2.88Å; S159-M162 CarbonylContact O-C 3.58Å; S159-M162 PolarHBondContact O-N 2.72Å; S159-D163 VanDerWaalsContact O-CB 3.27Å; S159-D163 WeakPolarHBondContact O-CB 3.32Å; S159-D163 PolarHBondContact O-N 2.86Å
160	M	84.2	Confident	90.9	Very high	42 Å²	42	30.5 Å²	30.5	21%	0.207	16%	0.162	C	C	.	.	H	α-helix	trans	-58.4	-41.1	-178.9	-61.4	168.2	63.1	0	0	111.6	A108 L112 S158 D163 Q164	A108-M160 HydrophobicContact CB-CE 4.49Å; L112-M160 HydrophobicContact CD1-CE 3.39Å; L112-M160 HydrophobicContact CD1-SD 3.36Å; L112-M160 WeakPolarHBondContact CD1-SD 3.29Å; L112-M160 HydrophobicContact CG-CE 4.19Å; S158-M160 PolarHBondContact O-N 3.01Å; M160-D163 PolarHBondContact O-N 2.77Å; M160-Q164 WeakPolarHBondContact O-CB 3.22Å; M160-Q164 VanDerWaalsContact O-CG 3.28Å; M160-Q164 WeakPolarHBondContact O-CG 3.1Å; M160-Q164 PolarHBondContact O-N 3.36Å; M160-Q164 VanDerWaalsContact O-N 3.1Å
161	Q	89.7	Confident	90.3	Very high	6 Å²	6	32.2 Å²	32.2	3%	0.028	17%	0.171	C	C	.	.	H	α-helix	trans	-66.5	-37.5	176.3	-71.3	164.7	-11.3	0	0	112.5	D106 S158 S159 F169	D106-Q161 PolarHBondContact OD2-NE2 2.75Å; S158-Q161 VanDerWaalsContact N-OE1 3.08Å; S158-Q161 PolarHBondContact O-N 3.22Å; S158-Q161 WeakPolarHBondContact OG-CG 3.47Å; S158-Q161 PolarHBondContact OG-N 3.41Å; S159-Q161 VanDerWaalsContact C-N 3.28Å; S159-Q161 PolarHBondContact O-N 2.88Å; Q161-F169 HydrophobicContact CB-CD2 4.11Å; Q161-F169 HydrophobicContact CB-CE2 4.22Å; Q161-F169 HydrophobicContact CB-CG 4.39Å; Q161-F169 HydrophobicContact CG-CE2 4.47Å
162	M	86.3	Confident	89.7	Confident	63 Å²	63	37 Å²	37	31%	0.31	20%	0.204	S	C	.	.	H	α-helix	trans	-78.2	-27.2	179.4	-63.4	-65	-59.4	0	0	112.9	C157 S158 S159 F169	C157-M162 HydrophobicContact CB-CG 4.22Å; C157-M162 HydrophobicContact CB-SD 4.19Å; S158-M162 PolarHBondContact O-N 3.02Å; S159-M162 CarbonylContact O-C 3.58Å; S159-M162 PolarHBondContact O-N 2.72Å; M162-F169 HydrophobicContact SD-CB 3.68Å
163	D	87.4	Confident	89.3	Confident	55 Å²	55	40.2 Å²	40.2	29%	0.294	22%	0.218	S	C	.	.	H	α-helix	trans	-90.9	-22.8	-174.3	-66.5	-36.2	0	0	0	112.7	H57 S159 M160 K173 R376	H57-D163 IonicContact CD2-OD2 3.39Å; H57-D163 IonicContact CE1-OD2 3.4Å; H57-D163 IonicContact NE2-OD2 2.65Å; H57-D163 PolarHBondContact NE2-OD2 3.19Å; S159-D163 VanDerWaalsContact O-CB 3.27Å; S159-D163 WeakPolarHBondContact O-CB 3.32Å; S159-D163 PolarHBondContact O-N 2.86Å; M160-D163 PolarHBondContact O-N 2.77Å; D163-K173 PolarHBondContact O-NZ 3.32Å; D163-R376 IonicContact OD1-NH2 3.47Å; D163-R376 PolarHBondContact OD1-NH2 2.95Å; D163-R376 IonicContact OD2-CZ 3.99Å; D163-R376 IonicContact OD2-NH1 3.32Å; D163-R376 IonicContact OD2-NH2 3.5Å; D163-R376 PolarHBondContact OD2-NH2 3.38Å
164	Q	90.1	Very high	89.2	Confident	71 Å²	71	42.9 Å²	42.9	33%	0.332	23%	0.232	S	C	.	.			trans	-85.2	118.2	171.5	-67.8	170.8	12.4	0	0	110.1	M160 E166 R167	M160-Q164 WeakPolarHBondContact O-CB 3.22Å; M160-Q164 VanDerWaalsContact O-CG 3.28Å; M160-Q164 WeakPolarHBondContact O-CG 3.1Å; M160-Q164 PolarHBondContact O-N 3.36Å; M160-Q164 VanDerWaalsContact O-N 3.1Å; Q164-E166 VanDerWaalsContact C-N 3.34Å; Q164-R167 HydrophobicContact CB-CB 4.38Å; Q164-R167 HydrophobicContact CB-CG 3.64Å; Q164-R167 PolarHBondContact O-N 2.93Å
165	E	92.8	Very high	89.2	Confident	91 Å²	91	41.4 Å²	41.4	43%	0.425	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-70.2	-33.7	-176.2	59.3	-172.7	-149.4	0	0	112.3	R167 G168 K173 G175	E165-R167 PolarHBondContact O-N 3.2Å; E165-R167 VanDerWaalsContact O-N 3.11Å; E165-G168 PolarHBondContact O-N 3.02Å; E165-K173 HydrophobicContact CB-CB 3.85Å; E165-K173 HydrophobicContact CB-CD 4.34Å; E165-G175 WeakPolarHBondContact O-CA 3.41Å
166	E	94.3	Very high	89.6	Confident	116 Å²	116	43.3 Å²	43.3	54%	0.542	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-59.9	-24.6	179.2	-59.2	77.4	-169.8	0	0	112.4	Q164 G168	Q164-E166 VanDerWaalsContact C-N 3.34Å; E166-G168 VanDerWaalsContact C-N 3.35Å
167	R	94.7	Very high	90.5	Very high	35 Å²	35	42.6 Å²	42.6	13%	0.132	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-78	-18.4	178.9	-59.7	-64.7	-60.3	-86.9	0.8	113.1	D106 Q164 E165 F169 M179 R180 M181	D106-R167 IonicContact OD1-NH1 3.78Å; D106-R167 IonicContact OD2-CZ 2.91Å; D106-R167 VanDerWaalsContact OD2-CZ 3.32Å; D106-R167 IonicContact OD2-NH1 3.37Å; D106-R167 PolarHBondContact OD2-NH1 3.27Å; D106-R167 IonicContact OD2-NH2 3.88Å; D106-R167 PolarHBondContact OD2-NH2 3Å; Q164-R167 HydrophobicContact CB-CB 4.38Å; Q164-R167 HydrophobicContact CB-CG 3.64Å; Q164-R167 PolarHBondContact O-N 2.93Å; E165-R167 PolarHBondContact O-N 3.2Å; E165-R167 VanDerWaalsContact O-N 3.11Å; R167-F169 HydrophobicContact CB-CD2 3.68Å; R167-F169 HydrophobicContact CB-CE2 4.01Å; R167-F169 VanDerWaalsContact O-CD2 3.25Å; R167-F169 WeakPolarHBondContact O-CD2 3.46Å; R167-F169 PolarHBondContact O-N 2.88Å; R167-M179 PolarHBondContact O-N 3.28Å; R167-R180 PolarHBondContact NH2-O 3.47Å; R167-M181 PolarHBondContact NH2-O 2.96Å
168	G	96	Very high	91.2	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.01	23%	0.227	C	C	.	.			trans	74.5	14.6	172.3	0	0	0	0	0	116.6	E165 E166 P176 M179 T236	E165-G168 PolarHBondContact O-N 3.02Å; E166-G168 VanDerWaalsContact C-N 3.35Å; G168-P176 WeakPolarHBondContact CA-O 3.26Å; G168-M179 WeakPolarHBondContact O-CE 3.48Å; G168-M179 VanDerWaalsContact O-CG 3.25Å; G168-M179 WeakPolarHBondContact O-CG 3.39Å; G168-T236 VanDerWaalsContact O-CG2 3.29Å; G168-T236 WeakPolarHBondContact O-CG2 3.34Å
169	F	94.4	Very high	91.9	Very high	11 Å²	11	42 Å²	42	5%	0.048	22%	0.221	C	C	.	.			trans	-83.3	-24.4	-179.6	-73.3	-98.7	0	0	0	113.6	Q161 M162 R167 M179 M181 R274	Q161-F169 HydrophobicContact CB-CD2 4.11Å; Q161-F169 HydrophobicContact CB-CE2 4.22Å; Q161-F169 HydrophobicContact CB-CG 4.39Å; Q161-F169 HydrophobicContact CG-CE2 4.47Å; M162-F169 HydrophobicContact SD-CB 3.68Å; R167-F169 HydrophobicContact CB-CD2 3.68Å; R167-F169 HydrophobicContact CB-CE2 4.01Å; R167-F169 VanDerWaalsContact O-CD2 3.25Å; R167-F169 WeakPolarHBondContact O-CD2 3.46Å; R167-F169 PolarHBondContact O-N 2.88Å; F169-M179 HydrophobicContact CE1-CB 4.49Å; F169-M179 WeakPolarHBondContact CE1-O 3.36Å; F169-M179 WeakPolarHBondContact CZ-O 3.35Å; F169-M181 HydrophobicContact CE1-CG 4.28Å; F169-M181 HydrophobicContact CZ-CG 3.94Å; F169-R274 HydrophobicContact CD1-CG 3.82Å; F169-R274 HydrophobicContact CE1-CG 3.68Å
170	S	90.8	Very high	92.6	Very high	11 Å²	11	42.3 Å²	42.3	8%	0.077	22%	0.218	C	C	.	.			trans	-88.4	143.9	-172	-170.3	0	0	0	0	113.1	S172 K173	S170-S172 PolarHBondContact OG-N 3.45Å; S170-S172 VanDerWaalsContact OG-N 3.12Å; S170-S172 PolarHBondContact OG-OG 3.41Å; S170-S172 VanDerWaalsContact OG-OG 3.05Å; S170-K173 PolarHBondContact OG-N 3.48Å
171	L	86.6	Confident	93.1	Very high	38 Å²	38	41.1 Å²	41.1	20%	0.199	21%	0.212	C	C	.	.	S	Bend	trans	-84.8	-24.7	167.1	-83.4	171.1	0	0	0	112.8	Q237 A240 A266 T267 F270	L171-Q237 PolarHBondContact O-NE2 3.31Å; L171-A240 HydrophobicContact CD2-CB 3.92Å; L171-A266 HydrophobicContact CD2-CB 3.79Å; L171-T267 WeakPolarHBondContact CD1-OG1 3.49Å; L171-F270 HydrophobicContact CD1-CG 4.5Å; L171-F270 HydrophobicContact CD2-CD1 3.81Å; L171-F270 HydrophobicContact CD2-CD2 3.53Å; L171-F270 HydrophobicContact CD2-CE1 3.68Å; L171-F270 HydrophobicContact CD2-CE2 3.36Å; L171-F270 HydrophobicContact CD2-CG 3.77Å; L171-F270 HydrophobicContact CD2-CZ 3.45Å; L171-F270 VanDerWaalsContact CD2-CZ 3.45Å; L171-F270 HydrophobicContact CG-CD1 3.85Å; L171-F270 HydrophobicContact CG-CD2 4.2Å; L171-F270 HydrophobicContact CG-CE1 4.08Å; L171-F270 HydrophobicContact CG-CE2 4.39Å; L171-F270 HydrophobicContact CG-CG 3.94Å; L171-F270 HydrophobicContact CG-CZ 4.35Å
172	S	86.9	Confident	93.4	Very high	99 Å²	99	40.9 Å²	40.9	69%	0.692	21%	0.211	S	C	*	.	S	Bend	trans	-91.4	-17.9	-173.7	62.5	0	0	0	0	113	S170	S170-S172 PolarHBondContact OG-N 3.45Å; S170-S172 VanDerWaalsContact OG-N 3.12Å; S170-S172 PolarHBondContact OG-OG 3.41Å; S170-S172 VanDerWaalsContact OG-OG 3.05Å
173	K	89.4	Confident	93.7	Very high	69 Å²	69	38.4 Å²	38.4	30%	0.3	20%	0.202	S	C	.	.	S	Bend	trans	-116	131.5	177.6	-54.9	-172.8	-177.3	-171.2	0	108.7	D163 E165 S170 T236	D163-K173 PolarHBondContact O-NZ 3.32Å; E165-K173 HydrophobicContact CB-CB 3.85Å; E165-K173 HydrophobicContact CB-CD 4.34Å; S170-K173 PolarHBondContact OG-N 3.48Å; K173-T236 PolarHBondContact O-OG1 3.28Å
174	D	96.4	Very high	93.8	Very high	56 Å²	56	43.1 Å²	43.1	30%	0.299	22%	0.222	S	C	.	.			trans	-85.8	124.9	-178.1	-164.2	25.4	0	0	0	110.7	R235 T236 Q237	D174-R235 PolarHBondContact O-NH1 3.17Å; D174-R235 VanDerWaalsContact O-NH1 3.16Å; D174-R235 IonicContact OD1-NH1 2.78Å; D174-R235 PolarHBondContact OD1-NH1 3.37Å; D174-R235 IonicContact OD2-CZ 3.29Å; D174-R235 IonicContact OD2-NH1 3.93Å; D174-R235 PolarHBondContact OD2-NH1 2.94Å; D174-T236 WeakPolarHBondContact CA-OG1 3.43Å; D174-T236 PolarHBondContact OD1-OG1 2.85Å; D174-Q237 HydrophobicContact CB-CB 4.24Å; D174-Q237 HydrophobicContact CB-CG 3.43Å; D174-Q237 VanDerWaalsContact CB-CG 3.43Å; D174-Q237 WeakPolarHBondContact OD1-CB 3.31Å; D174-Q237 VanDerWaalsContact OD1-CG 3.26Å; D174-Q237 WeakPolarHBondContact OD1-CG 3.12Å; D174-Q237 PolarHBondContact OD1-N 3.45Å
175	G	97	Very high	94.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.			trans	-152.2	177.8	-179	0	0	0	0	0	112.3	E165 L177 R235 T236	E165-G175 WeakPolarHBondContact O-CA 3.41Å; G175-L177 PolarHBondContact O-N 2.9Å; G175-R235 CarbonylContact O-C 3.54Å; G175-R235 WeakPolarHBondContact O-CA 3.36Å; G175-R235 WeakPolarHBondContact O-CB 3.11Å; G175-T236 PolarHBondContact N-OG1 2.99Å; G175-T236 PolarHBondContact O-N 2.77Å
176	P	97.8	Very high	94.1	Very high	57 Å²	57	41.9 Å²	41.9	37%	0.37	21%	0.211	S	C	.	.	B	Isolated β-bridge	trans	-52.8	139.1	170.2	-20.8	33.1	0	0	0	110.4	G168 D178	G168-P176 WeakPolarHBondContact CA-O 3.26Å; P176-D178 PolarHBondContact O-N 2.9Å
177	L	98.3	Very high	93.9	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	21%	0.212	C	C	.	.	S	Bend	trans	-78.2	68.7	176.7	-176.2	61.4	0	0	0	109.9	G175 M179 A192 A193 V196 I233 T234 T236 L239	G175-L177 PolarHBondContact O-N 2.9Å; L177-M179 HydrophobicContact CD1-CE 3.84Å; L177-A192 HydrophobicContact CD1-CB 3.92Å; L177-A192 HydrophobicContact CG-CB 3.78Å; L177-A192 CarbonylContact O-C 3.29Å; L177-A192 PolarHBondContact O-N 2.82Å; L177-A193 HydrophobicContact CB-CB 4.1Å; L177-A193 HydrophobicContact CD2-CB 4.47Å; L177-A193 HydrophobicContact CG-CB 4.4Å; L177-A193 WeakPolarHBondContact O-CB 3.39Å; L177-A193 PolarHBondContact O-N 3.33Å; L177-V196 HydrophobicContact CD2-CG1 4.41Å; L177-V196 HydrophobicContact CD2-CG2 3.63Å; L177-I233 HydrophobicContact CD2-CG2 3.98Å; L177-T234 PolarHBondContact N-O 3.22Å; L177-T236 HydrophobicContact CD1-CG2 4.23Å; L177-L239 HydrophobicContact CD1-CD2 3.79Å; L177-L239 HydrophobicContact CD2-CB 4.18Å; L177-L239 HydrophobicContact CD2-CD2 3.94Å
178	D	97.6	Very high	93.8	Very high	32 Å²	32	46.4 Å²	46.4	17%	0.171	25%	0.246	C	C	.	.			trans	-93.9	-68.1	-175.8	-169	-52.9	0	0	0	112.4	P176 R180 A192	P176-D178 PolarHBondContact O-N 2.9Å; D178-R180 PolarHBondContact O-N 3.36Å; D178-R180 WeakPolarHBondContact OD1-CB 3.42Å; D178-R180 VanDerWaalsContact OD1-CG 3.22Å; D178-R180 WeakPolarHBondContact OD1-CG 3.45Å; D178-R180 IonicContact OD1-CZ 3.14Å; D178-R180 PolarHBondContact OD1-N 3.35Å; D178-R180 IonicContact OD1-NE 3.43Å; D178-R180 PolarHBondContact OD1-NE 2.98Å; D178-R180 IonicContact OD1-NH2 2.73Å; D178-R180 IonicContact OD2-CZ 3.08Å; D178-R180 IonicContact OD2-NE 2.73Å; D178-R180 PolarHBondContact OD2-NE 3.45Å; D178-R180 IonicContact OD2-NH2 3.12Å; D178-R180 PolarHBondContact OD2-NH2 3.24Å; D178-A192 WeakPolarHBondContact O-CB 3.4Å; D178-A192 PolarHBondContact O-N 3.35Å
179	M	97.1	Very high	93.7	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	25%	0.254	C	S	.	.			trans	63.1	8.8	-178.1	-56.1	-176.5	173.4	0	0	116.5	R167 G168 F169 L177 A192 F270 L273 R274 N278	R167-M179 PolarHBondContact O-N 3.28Å; G168-M179 WeakPolarHBondContact O-CE 3.48Å; G168-M179 VanDerWaalsContact O-CG 3.25Å; G168-M179 WeakPolarHBondContact O-CG 3.39Å; F169-M179 HydrophobicContact CE1-CB 4.49Å; F169-M179 WeakPolarHBondContact CE1-O 3.36Å; F169-M179 WeakPolarHBondContact CZ-O 3.35Å; L177-M179 HydrophobicContact CD1-CE 3.84Å; M179-A192 HydrophobicContact CB-CB 4.03Å; M179-A192 HydrophobicContact CG-CB 3.85Å; M179-A192 HydrophobicContact SD-CB 3.75Å; M179-F270 HydrophobicContact CE-CB 4.06Å; M179-F270 HydrophobicContact CE-CD1 3.12Å; M179-F270 HydrophobicContact CE-CE1 3.52Å; M179-F270 HydrophobicContact CE-CG 3.68Å; M179-F270 HydrophobicContact CE-CZ 4.36Å; M179-L273 HydrophobicContact SD-CB 3.9Å; M179-R274 HydrophobicContact SD-CB 4.26Å; M179-N278 PolarHBondContact O-ND2 3Å
180	R	97	Very high	93.7	Very high	32 Å²	32	50.5 Å²	50.5	12%	0.121	27%	0.271	C	S	.	.			trans	-79	129.8	174.4	-61.6	173.1	-65.8	175	4.6	110.7	R167 D178 D182 P187 M189 C191 V277	R167-R180 PolarHBondContact NH2-O 3.47Å; D178-R180 PolarHBondContact O-N 3.36Å; D178-R180 WeakPolarHBondContact OD1-CB 3.42Å; D178-R180 VanDerWaalsContact OD1-CG 3.22Å; D178-R180 WeakPolarHBondContact OD1-CG 3.45Å; D178-R180 IonicContact OD1-CZ 3.14Å; D178-R180 PolarHBondContact OD1-N 3.35Å; D178-R180 IonicContact OD1-NE 3.43Å; D178-R180 PolarHBondContact OD1-NE 2.98Å; D178-R180 IonicContact OD1-NH2 2.73Å; D178-R180 IonicContact OD2-CZ 3.08Å; D178-R180 IonicContact OD2-NE 2.73Å; D178-R180 PolarHBondContact OD2-NE 3.45Å; D178-R180 IonicContact OD2-NH2 3.12Å; D178-R180 PolarHBondContact OD2-NH2 3.24Å; R180-D182 VanDerWaalsContact C-N 3.34Å; R180-P187 PolarHBondContact NH1-O 3.12Å; R180-M189 HydrophobicContact CB-CE 4.09Å; R180-M189 WeakPolarHBondContact CD-O 3.33Å; R180-M189 HydrophobicContact CG-CE 3.71Å; R180-M189 PolarHBondContact NH1-O 3.47Å; R180-C191 HydrophobicContact CG-CB 4.32Å; R180-V277 HydrophobicContact CB-CG1 4.44Å; R180-V277 HydrophobicContact CG-CG1 3.53Å
181	M	95.8	Very high	94.1	Very high	18 Å²	18	50.7 Å²	50.7	9%	0.089	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-30	175.3	-71.1	175.5	174.1	0	0	112.1	R105 D106 C157 R167 F169 N278 E280	R105-M181 HydrophobicContact CG-CB 3.94Å; D106-M181 WeakPolarHBondContact CA-O 3.4Å; D106-M181 WeakPolarHBondContact CB-O 3.26Å; C157-M181 VanDerWaalsContact SG-CE 3.5Å; R167-M181 PolarHBondContact NH2-O 2.96Å; F169-M181 HydrophobicContact CE1-CG 4.28Å; F169-M181 HydrophobicContact CZ-CG 3.94Å; M181-N278 WeakPolarHBondContact CB-OD1 3.4Å; M181-N278 HydrophobicContact CG-CB 4.49Å; M181-N278 WeakPolarHBondContact CG-OD1 3.34Å; M181-N278 PolarHBondContact N-OD1 2.82Å; M181-N278 HydrophobicContact SD-CB 4.17Å; M181-E280 HydrophobicContact CE-CG 4.38Å
182	D	94.7	Very high	94.7	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	38.2	-176.7	60.6	-5.3	0	0	0	112.3	R105 R130 R180 E184 R185 Y186	R105-D182 HydrophobicContact CB-CB 4.25Å; R105-D182 HydrophobicContact CG-CB 4.25Å; R105-D182 IonicContact CZ-OD1 3.45Å; R105-D182 IonicContact CZ-OD2 3.95Å; R105-D182 IonicContact NE-OD1 3.85Å; R105-D182 PolarHBondContact NE-OD1 3.05Å; R105-D182 IonicContact NE-OD2 2.76Å; R105-D182 PolarHBondContact NE-OD2 2.96Å; R105-D182 IonicContact NH2-OD1 3.34Å; R105-D182 PolarHBondContact NH2-OD1 3.18Å; R105-D182 IonicContact NH2-OD2 3.37Å; R105-D182 PolarHBondContact NH2-OD2 3.13Å; R105-D182 VanDerWaalsContact NH2-OD2 3.12Å; R105-D182 VanDerWaalsContact O-CB 3.24Å; R105-D182 WeakPolarHBondContact O-CB 3.17Å; R130-D182 IonicContact CZ-OD2 3.73Å; R130-D182 IonicContact NE-OD2 3.98Å; R130-D182 PolarHBondContact NE-OD2 3.46Å; R130-D182 IonicContact NH2-OD1 2.76Å; R130-D182 PolarHBondContact NH2-OD1 2.87Å; R130-D182 VanDerWaalsContact NH2-OD1 3.14Å; R130-D182 IonicContact NH2-OD2 2.77Å; R130-D182 PolarHBondContact NH2-OD2 3.35Å; R130-D182 VanDerWaalsContact NH2-OD2 3.08Å; R180-D182 VanDerWaalsContact C-N 3.34Å; D182-E184 PolarHBondContact O-N 3.28Å; D182-R185 HydrophobicContact CB-CB 4.44Å; D182-R185 WeakPolarHBondContact O-CB 3.46Å; D182-R185 PolarHBondContact O-N 2.94Å; D182-R185 IonicContact OD2-NH1 3.53Å; D182-Y186 HydrophobicContact CB-CD2 4.47Å; D182-Y186 PolarHBondContact O-N 3.32Å; D182-Y186 WeakPolarHBondContact OD2-CE2 3.31Å
183	G	92.2	Very high	95.2	Very high	11 Å²	11	44.9 Å²	44.9	11%	0.113	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-34.3	-176.5	0	0	0	0	0	113.8	R185 Y186 P187	G183-R185 VanDerWaalsContact C-N 3.32Å; G183-R185 PolarHBondContact O-N 2.86Å; G183-Y186 CarbonylContact O-C 3.56Å; G183-Y186 PolarHBondContact O-N 3.08Å; G183-P187 WeakPolarHBondContact O-CA 3.29Å; G183-P187 VanDerWaalsContact O-N 3.16Å
184	E	91	Very high	95.6	Very high	154 Å²	154	45 Å²	45	72%	0.72	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-32.8	176.2	-68	179.3	-162.9	0	0	113.3	P107 D182 Y186	P107-E184 HydrophobicContact CG-CB 4.32Å; D182-E184 PolarHBondContact O-N 3.28Å; E184-Y186 VanDerWaalsContact C-N 3.34Å
185	R	95.2	Very high	95.7	Very high	60 Å²	60	42.7 Å²	42.7	23%	0.226	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-26.3	177.4	-69.1	174.7	56.9	-158	-1.5	112.2	R105 P107 E133 D182 G183	R105-R185 WeakPolarHBondContact O-CD 3.37Å; R105-R185 PolarHBondContact O-NH1 2.75Å; R105-R185 VanDerWaalsContact O-NH1 3.17Å; P107-R185 HydrophobicContact CG-CG 3.74Å; E133-R185 IonicContact OE1-NH2 3.63Å; E133-R185 PolarHBondContact OE1-NH2 2.76Å; E133-R185 IonicContact OE2-CZ 2.92Å; E133-R185 IonicContact OE2-NH1 3.57Å; E133-R185 IonicContact OE2-NH2 2.86Å; E133-R185 PolarHBondContact OE2-NH2 3.37Å; D182-R185 HydrophobicContact CB-CB 4.44Å; D182-R185 WeakPolarHBondContact O-CB 3.46Å; D182-R185 PolarHBondContact O-N 2.94Å; D182-R185 IonicContact OD2-NH1 3.53Å; G183-R185 VanDerWaalsContact C-N 3.32Å; G183-R185 PolarHBondContact O-N 2.86Å
186	Y	93.8	Very high	95.8	Very high	75 Å²	75	42.7 Å²	42.7	29%	0.294	23%	0.227	S	C	.	.			trans	-137.8	67.6	-172.3	-57.8	-69.5	0	0	0	110.4	R130 E133 D182 G183 E184 D188 M189	R130-Y186 VanDerWaalsContact CZ-CE2 3.49Å; E133-Y186 PolarHBondContact OE1-OH 3.14Å; D182-Y186 HydrophobicContact CB-CD2 4.47Å; D182-Y186 PolarHBondContact O-N 3.32Å; D182-Y186 WeakPolarHBondContact OD2-CE2 3.31Å; G183-Y186 CarbonylContact O-C 3.56Å; G183-Y186 PolarHBondContact O-N 3.08Å; E184-Y186 VanDerWaalsContact C-N 3.34Å; Y186-D188 PolarHBondContact O-N 2.73Å; Y186-M189 VanDerWaalsContact O-CB 3.24Å; Y186-M189 WeakPolarHBondContact O-CB 3.43Å; Y186-M189 PolarHBondContact O-N 2.73Å
187	P	90.3	Very high	95.8	Very high	86 Å²	86	42 Å²	42	56%	0.558	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-30.6	-174	24.2	-34.3	0	0	0	112.7	R180 G183 M189	R180-P187 PolarHBondContact NH1-O 3.12Å; G183-P187 WeakPolarHBondContact O-CA 3.29Å; G183-P187 VanDerWaalsContact O-N 3.16Å; P187-M189 VanDerWaalsContact C-N 3.29Å; P187-M189 PolarHBondContact O-N 2.96Å
188	D	91.9	Very high	95.7	Very high	160 Å²	160	45.1 Å²	45.1	86%	0.856	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.1	178.5	-54.2	-43.9	0	0	0	113.6	Y186	Y186-D188 PolarHBondContact O-N 2.73Å
189	M	93.4	Very high	95.7	Very high	38 Å²	38	45.1 Å²	45.1	19%	0.187	24%	0.239	C	C	.	.	S	Bend	trans	-70.9	129.7	177.3	-172	174.4	76.7	0	0	109.4	R130 R180 Y186 P187 C191	R130-M189 PolarHBondContact NH2-SD 2.74Å; R180-M189 HydrophobicContact CB-CE 4.09Å; R180-M189 WeakPolarHBondContact CD-O 3.33Å; R180-M189 HydrophobicContact CG-CE 3.71Å; R180-M189 PolarHBondContact NH1-O 3.47Å; Y186-M189 VanDerWaalsContact O-CB 3.24Å; Y186-M189 WeakPolarHBondContact O-CB 3.43Å; Y186-M189 PolarHBondContact O-N 2.73Å; P187-M189 VanDerWaalsContact C-N 3.29Å; P187-M189 PolarHBondContact O-N 2.96Å; M189-C191 PolarHBondContact O-N 3.17Å
190	P	95.6	Very high	95.7	Very high	60 Å²	60	47.7 Å²	47.7	39%	0.39	25%	0.253	S	S	.	.			trans	-54.5	128.9	-179.8	-27.4	34.7	0	0	0	112.4	D194	P190-D194 WeakPolarHBondContact CA-OD2 3.21Å; P190-D194 HydrophobicContact CB-CB 4.02Å
191	C	98.1	Very high	95.7	Very high	16 Å²	16	50 Å²	50	11%	0.108	27%	0.266	C	S	.	.			trans	-88	174.6	173	75.3	0	0	0	0	111.2	R180 M189 A193 D194 V195	R180-C191 HydrophobicContact CG-CB 4.32Å; M189-C191 PolarHBondContact O-N 3.17Å; C191-A193 PolarHBondContact O-N 3.42Å; C191-D194 PolarHBondContact N-OD2 3.31Å; C191-D194 WeakPolarHBondContact O-CB 3.48Å; C191-D194 PolarHBondContact O-N 3.22Å; C191-D194 VanDerWaalsContact O-N 3.09Å; C191-D194 PolarHBondContact SG-OD2 3.1Å; C191-V195 WeakPolarHBondContact O-CG2 3.34Å; C191-V195 PolarHBondContact O-N 2.91Å; C191-V195 VanDerWaalsContact O-N 3.11Å
192	A	98.4	Very high	95.7	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.1	-33.3	179.9	0	0	0	0	0	112.6	L177 D178 M179 V195 V196 V277	L177-A192 HydrophobicContact CD1-CB 3.92Å; L177-A192 HydrophobicContact CG-CB 3.78Å; L177-A192 CarbonylContact O-C 3.29Å; L177-A192 PolarHBondContact O-N 2.82Å; D178-A192 WeakPolarHBondContact O-CB 3.4Å; D178-A192 PolarHBondContact O-N 3.35Å; M179-A192 HydrophobicContact CB-CB 4.03Å; M179-A192 HydrophobicContact CG-CB 3.85Å; M179-A192 HydrophobicContact SD-CB 3.75Å; A192-V195 PolarHBondContact O-N 2.82Å; A192-V196 WeakPolarHBondContact O-CG1 3.38Å; A192-V196 WeakPolarHBondContact O-CG2 3.46Å; A192-V196 PolarHBondContact O-N 3.35Å; A192-V277 HydrophobicContact CB-CG2 4.23Å
193	A	98.6	Very high	95.7	Very high	14 Å²	14	56.6 Å²	56.6	12%	0.116	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-44.9	173.6	0	0	0	0	0	111.3	L177 C191 V195 V196 N197	L177-A193 HydrophobicContact CB-CB 4.1Å; L177-A193 HydrophobicContact CD2-CB 4.47Å; L177-A193 HydrophobicContact CG-CB 4.4Å; L177-A193 WeakPolarHBondContact O-CB 3.39Å; L177-A193 PolarHBondContact O-N 3.33Å; C191-A193 PolarHBondContact O-N 3.42Å; A193-V195 VanDerWaalsContact C-N 3.29Å; A193-V195 PolarHBondContact O-N 2.92Å; A193-V196 WeakPolarHBondContact O-CG2 3.31Å; A193-V196 PolarHBondContact O-N 3.11Å; A193-N197 VanDerWaalsContact O-CB 3.29Å; A193-N197 WeakPolarHBondContact O-CB 3.45Å; A193-N197 PolarHBondContact O-N 3.39Å; A193-N197 PolarHBondContact O-ND2 2.88Å
194	D	98.3	Very high	96	Very high	72 Å²	72	56.1 Å²	56.1	39%	0.385	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-42.2	177.9	-58.9	-47.4	0	0	0	111	P190 C191 N197 T198	P190-D194 WeakPolarHBondContact CA-OD2 3.21Å; P190-D194 HydrophobicContact CB-CB 4.02Å; C191-D194 PolarHBondContact N-OD2 3.31Å; C191-D194 WeakPolarHBondContact O-CB 3.48Å; C191-D194 PolarHBondContact O-N 3.22Å; C191-D194 VanDerWaalsContact O-N 3.09Å; C191-D194 PolarHBondContact SG-OD2 3.1Å; D194-N197 PolarHBondContact O-N 2.87Å; D194-T198 WeakPolarHBondContact O-CB 3.46Å; D194-T198 PolarHBondContact O-N 3.38Å; D194-T198 PolarHBondContact O-OG1 2.73Å
195	V	98.2	Very high	96.2	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-52.5	178.2	175	0	0	0	0	110.8	C191 A192 A193 N197 L199 L204 I207 L273 F276 V277	C191-V195 WeakPolarHBondContact O-CG2 3.34Å; C191-V195 PolarHBondContact O-N 2.91Å; C191-V195 VanDerWaalsContact O-N 3.11Å; A192-V195 PolarHBondContact O-N 2.82Å; A193-V195 VanDerWaalsContact C-N 3.29Å; A193-V195 PolarHBondContact O-N 2.92Å; V195-N197 VanDerWaalsContact C-N 3.34Å; V195-N197 PolarHBondContact O-N 3.28Å; V195-L199 HydrophobicContact CG1-CD1 3.72Å; V195-L199 HydrophobicContact CG1-CG 4.34Å; V195-L199 WeakPolarHBondContact O-CB 3.44Å; V195-L199 WeakPolarHBondContact O-CG 3.37Å; V195-L199 PolarHBondContact O-N 3.47Å; V195-L204 HydrophobicContact CG1-CD2 4.25Å; V195-I207 HydrophobicContact CG1-CD1 4.29Å; V195-L273 HydrophobicContact CB-CD2 4.48Å; V195-L273 HydrophobicContact CG1-CD2 3.72Å; V195-F276 HydrophobicContact CG1-CD1 3.94Å; V195-F276 HydrophobicContact CG1-CE1 3.91Å; V195-F276 HydrophobicContact CG2-CD1 3.93Å; V195-F276 HydrophobicContact CG2-CE1 3.71Å; V195-V277 HydrophobicContact CG2-CG2 3.99Å
196	V	98.4	Very high	96.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-71.5	-28.3	-177.1	-59.3	0	0	0	0	112.9	L177 A192 A193 I224 R228 I233 L239 L273	L177-V196 HydrophobicContact CD2-CG1 4.41Å; L177-V196 HydrophobicContact CD2-CG2 3.63Å; A192-V196 WeakPolarHBondContact O-CG1 3.38Å; A192-V196 WeakPolarHBondContact O-CG2 3.46Å; A192-V196 PolarHBondContact O-N 3.35Å; A193-V196 WeakPolarHBondContact O-CG2 3.31Å; A193-V196 PolarHBondContact O-N 3.11Å; V196-I224 HydrophobicContact CB-CG2 3.94Å; V196-R228 WeakPolarHBondContact O-CD 3.45Å; V196-R228 PolarHBondContact O-NH1 3.24Å; V196-I233 HydrophobicContact CG2-CB 4.07Å; V196-I233 HydrophobicContact CG2-CG2 4.3Å; V196-L239 HydrophobicContact CG1-CD1 4.36Å; V196-L239 HydrophobicContact CG1-CD2 4.49Å; V196-L273 HydrophobicContact CG1-CD1 3.68Å; V196-L273 HydrophobicContact CG1-CD2 3.98Å
197	N	98.5	Very high	96.2	Very high	42 Å²	42	46.1 Å²	46.1	23%	0.225	26%	0.26	C	S	.	.	H	α-helix	trans	-87.3	-22.2	-179.1	-69	-53.1	0	0	0	113.6	A193 D194 V195 R228 I233	A193-N197 VanDerWaalsContact O-CB 3.29Å; A193-N197 WeakPolarHBondContact O-CB 3.45Å; A193-N197 PolarHBondContact O-N 3.39Å; A193-N197 PolarHBondContact O-ND2 2.88Å; D194-N197 PolarHBondContact O-N 2.87Å; V195-N197 VanDerWaalsContact C-N 3.34Å; V195-N197 PolarHBondContact O-N 3.28Å; N197-R228 VanDerWaalsContact C-NH1 3.3Å; N197-R228 WeakPolarHBondContact O-CD 3.24Å; N197-R228 PolarHBondContact O-NE 3.16Å; N197-R228 PolarHBondContact O-NH1 3.47Å; N197-I233 PolarHBondContact ND2-O 3.25Å; N197-I233 PolarHBondContact OD1-N 2.93Å
198	T	96.5	Very high	96.5	Very high	68 Å²	68	42.1 Å²	42.1	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-108.4	-41.7	-171.9	-51	0	0	0	0	114	L23 D194	L23-T198 HydrophobicContact CD1-CG2 4.08Å; D194-T198 WeakPolarHBondContact O-CB 3.46Å; D194-T198 PolarHBondContact O-N 3.38Å; D194-T198 PolarHBondContact O-OG1 2.73Å
199	L	96.9	Very high	96.5	Very high	32 Å²	32	37.8 Å²	37.8	17%	0.168	21%	0.213	C	C	.	.	S	Bend	trans	-66.1	146.6	-172.1	-68.8	-171.4	0	0	0	112.1	V195 A203 L204 I207 R228 F276	V195-L199 HydrophobicContact CG1-CD1 3.72Å; V195-L199 HydrophobicContact CG1-CG 4.34Å; V195-L199 WeakPolarHBondContact O-CB 3.44Å; V195-L199 WeakPolarHBondContact O-CG 3.37Å; V195-L199 PolarHBondContact O-N 3.47Å; L199-A203 HydrophobicContact CB-CB 4.22Å; L199-A203 HydrophobicContact CD1-CB 4.34Å; L199-L204 HydrophobicContact CB-CD2 4.09Å; L199-L204 HydrophobicContact CB-CG 3.92Å; L199-L204 HydrophobicContact CD1-CD2 4.41Å; L199-I207 HydrophobicContact CD1-CD1 3.34Å; L199-R228 VanDerWaalsContact O-CZ 3.23Å; L199-R228 PolarHBondContact O-NH1 2.93Å; L199-R228 PolarHBondContact O-NH2 2.72Å; L199-F276 HydrophobicContact CD1-CE1 4.25Å; L199-F276 HydrophobicContact CD1-CZ 4.35Å
200	D	96.9	Very high	96.3	Very high	56 Å²	56	37.1 Å²	37.1	30%	0.299	21%	0.214	S	C	.	.			trans	-66.8	163.1	172.7	69.4	48.6	0	0	0	111.6	Q202 A203 L204	D200-Q202 PolarHBondContact O-N 2.87Å; D200-Q202 WeakPolarHBondContact OD1-CA 3.31Å; D200-Q202 WeakPolarHBondContact OD1-CB 3.46Å; D200-Q202 PolarHBondContact OD1-N 3.32Å; D200-A203 PolarHBondContact O-N 2.67Å; D200-A203 WeakPolarHBondContact OD1-CB 3.34Å; D200-A203 PolarHBondContact OD1-N 2.99Å; D200-L204 PolarHBondContact O-N 2.97Å
201	Q	97.4	Very high	96.2	Very high	81 Å²	81	35.7 Å²	35.7	38%	0.379	20%	0.201	S	C	.	.	H	α-helix	trans	-57.9	-36	-177.8	-171.6	-179.6	-13.6	0	0	112.6	A205 A221 S222 V225	Q201-A205 WeakPolarHBondContact O-CB 3.38Å; Q201-A205 PolarHBondContact O-N 3.22Å; Q201-A221 HydrophobicContact CG-CB 4.03Å; Q201-S222 VanDerWaalsContact NE2-CB 3.34Å; Q201-S222 PolarHBondContact NE2-OG 2.98Å; Q201-V225 HydrophobicContact CB-CG2 3.98Å; Q201-V225 HydrophobicContact CG-CG2 4.39Å
202	Q	96.1	Very high	95.9	Very high	142 Å²	142	34.9 Å²	34.9	66%	0.664	20%	0.196	S	C	*	.	H	α-helix	trans	-71.9	-42.1	-177.2	-175.6	177.6	13.4	0	0	111.2	D200 A205 S206	D200-Q202 PolarHBondContact O-N 2.87Å; D200-Q202 WeakPolarHBondContact OD1-CA 3.31Å; D200-Q202 WeakPolarHBondContact OD1-CB 3.46Å; D200-Q202 PolarHBondContact OD1-N 3.32Å; Q202-A205 PolarHBondContact O-N 3.12Å; Q202-S206 WeakPolarHBondContact O-CB 3.37Å; Q202-S206 PolarHBondContact O-N 3.25Å; Q202-S206 PolarHBondContact O-OG 3.09Å
203	A	95.1	Very high	95.6	Very high	14 Å²	14	36.9 Å²	36.9	12%	0.116	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-47.2	174.3	0	0	0	0	0	110.8	L199 D200 A205 S206 I207	L199-A203 HydrophobicContact CB-CB 4.22Å; L199-A203 HydrophobicContact CD1-CB 4.34Å; D200-A203 PolarHBondContact O-N 2.67Å; D200-A203 WeakPolarHBondContact OD1-CB 3.34Å; D200-A203 PolarHBondContact OD1-N 2.99Å; A203-A205 PolarHBondContact O-N 3.47Å; A203-S206 WeakPolarHBondContact O-CB 3.44Å; A203-S206 PolarHBondContact O-N 3.31Å; A203-S206 VanDerWaalsContact O-N 3.12Å; A203-I207 WeakPolarHBondContact O-CG1 3.49Å; A203-I207 PolarHBondContact O-N 3.32Å
204	L	97.2	Very high	95.3	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-57.8	-49.6	174.5	-74.4	173.3	0	0	0	111.7	V195 L199 D200 S206 I207 L208 A221 I224 V225	V195-L204 HydrophobicContact CG1-CD2 4.25Å; L199-L204 HydrophobicContact CB-CD2 4.09Å; L199-L204 HydrophobicContact CB-CG 3.92Å; L199-L204 HydrophobicContact CD1-CD2 4.41Å; D200-L204 PolarHBondContact O-N 2.97Å; L204-S206 PolarHBondContact O-N 3.34Å; L204-I207 PolarHBondContact O-N 2.71Å; L204-L208 VanDerWaalsContact O-CG 3.26Å; L204-L208 WeakPolarHBondContact O-CG 3.24Å; L204-L208 PolarHBondContact O-N 3.2Å; L204-A221 HydrophobicContact CB-CB 3.83Å; L204-I224 HydrophobicContact CD1-CG2 3.96Å; L204-V225 HydrophobicContact CD1-CG2 4Å
205	A	96.3	Very high	94.9	Very high	10 Å²	10	44.1 Å²	44.1	8%	0.083	22%	0.224	C	C	.	.	H	α-helix	trans	-59.9	-35.1	177.4	0	0	0	0	0	112.2	Q201 Q202 A203 T209 S217 R218 A221	Q201-A205 WeakPolarHBondContact O-CB 3.38Å; Q201-A205 PolarHBondContact O-N 3.22Å; Q202-A205 PolarHBondContact O-N 3.12Å; A203-A205 PolarHBondContact O-N 3.47Å; A205-T209 WeakPolarHBondContact O-CB 3.4Å; A205-T209 PolarHBondContact O-N 2.9Å; A205-T209 PolarHBondContact O-OG1 3.29Å; A205-S217 WeakPolarHBondContact O-CB 3.38Å; A205-R218 HydrophobicContact CB-CG 4.24Å; A205-A221 HydrophobicContact CB-CB 3.89Å
206	S	94.4	Very high	94.7	Very high	56 Å²	56	47.9 Å²	47.9	39%	0.392	24%	0.241	S	C	.	.	H	α-helix	trans	-66.6	-45.1	177.3	-59	0	0	0	0	111.7	Q202 A203 L204 T209 A210	Q202-S206 WeakPolarHBondContact O-CB 3.37Å; Q202-S206 PolarHBondContact O-N 3.25Å; Q202-S206 PolarHBondContact O-OG 3.09Å; A203-S206 WeakPolarHBondContact O-CB 3.44Å; A203-S206 PolarHBondContact O-N 3.31Å; A203-S206 VanDerWaalsContact O-N 3.12Å; L204-S206 PolarHBondContact O-N 3.34Å; S206-T209 PolarHBondContact O-N 3.22Å; S206-A210 VanDerWaalsContact O-CB 3.29Å; S206-A210 WeakPolarHBondContact O-CB 3.41Å; S206-A210 PolarHBondContact O-N 3.06Å
207	I	94.8	Very high	94.6	Very high	12 Å²	12	48.3 Å²	48.3	6%	0.062	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-51.1	174.9	-71.7	165.9	0	0	0	110.6	V195 L199 A203 L204 T209 A210 Y211 A272 F276	V195-I207 HydrophobicContact CG1-CD1 4.29Å; L199-I207 HydrophobicContact CD1-CD1 3.34Å; A203-I207 WeakPolarHBondContact O-CG1 3.49Å; A203-I207 PolarHBondContact O-N 3.32Å; L204-I207 PolarHBondContact O-N 2.71Å; I207-T209 VanDerWaalsContact C-N 3.27Å; I207-T209 PolarHBondContact O-N 2.77Å; I207-A210 PolarHBondContact O-N 3.28Å; I207-Y211 HydrophobicContact CG2-CD2 4.09Å; I207-Y211 PolarHBondContact O-N 2.77Å; I207-A272 HydrophobicContact CG2-CB 4.33Å; I207-F276 HydrophobicContact CD1-CD1 3.81Å; I207-F276 HydrophobicContact CD1-CD2 3.89Å; I207-F276 HydrophobicContact CD1-CE1 3.71Å; I207-F276 HydrophobicContact CD1-CE2 3.78Å; I207-F276 HydrophobicContact CD1-CG 3.88Å; I207-F276 HydrophobicContact CD1-CZ 3.69Å; I207-F276 HydrophobicContact CG1-CD2 3.86Å; I207-F276 HydrophobicContact CG1-CE2 4.03Å; I207-F276 HydrophobicContact CG1-CG 4.11Å; I207-F276 HydrophobicContact CG1-CZ 4.44Å; I207-F276 HydrophobicContact CG2-CB 3.94Å; I207-F276 HydrophobicContact CG2-CG 4.15Å
208	L	95.7	Very high	94.5	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-60.9	-37.2	-179.9	-63.3	175.7	0	0	0	112.2	L204 G212 E213 E214 I220 A221 T269 A272	L204-L208 VanDerWaalsContact O-CG 3.26Å; L204-L208 WeakPolarHBondContact O-CG 3.24Å; L204-L208 PolarHBondContact O-N 3.2Å; L208-G212 CarbonylContact O-C 3.56Å; L208-G212 VanDerWaalsContact O-CA 3.26Å; L208-G212 WeakPolarHBondContact O-CA 3.34Å; L208-G212 PolarHBondContact O-N 3.13Å; L208-G212 VanDerWaalsContact O-N 3.13Å; L208-E213 PolarHBondContact O-N 2.79Å; L208-E214 HydrophobicContact CB-CB 4.36Å; L208-E214 WeakPolarHBondContact O-CB 3.46Å; L208-E214 PolarHBondContact O-N 3.18Å; L208-I220 HydrophobicContact CD1-CB 3.96Å; L208-I220 HydrophobicContact CD1-CG2 3.65Å; L208-A221 HydrophobicContact CD1-CB 4.33Å; L208-T269 HydrophobicContact CD2-CG2 3.76Å; L208-A272 HydrophobicContact CD2-CB 3.98Å
209	T	92.8	Very high	94.5	Very high	69 Å²	69	57.4 Å²	57.4	42%	0.423	27%	0.27	S	S	.	.	H	α-helix	trans	-70.2	-49.7	176.9	-55.7	0	0	0	0	111.2	A205 S206 I207 E213 S217	A205-T209 WeakPolarHBondContact O-CB 3.4Å; A205-T209 PolarHBondContact O-N 2.9Å; A205-T209 PolarHBondContact O-OG1 3.29Å; S206-T209 PolarHBondContact O-N 3.22Å; I207-T209 VanDerWaalsContact C-N 3.27Å; I207-T209 PolarHBondContact O-N 2.77Å; T209-E213 WeakPolarHBondContact O-CA 3.38Å; T209-E213 PolarHBondContact O-N 2.65Å; T209-S217 WeakPolarHBondContact OG1-CB 3.47Å; T209-S217 PolarHBondContact OG1-OG 2.8Å
210	A	88.9	Confident	94.6	Very high	24 Å²	24	55.9 Å²	55.9	20%	0.198	26%	0.262	C	S	.	.	H	α-helix	trans	-71	-46	-172.7	0	0	0	0	0	112.5	S206 I207 L309 F331	S206-A210 VanDerWaalsContact O-CB 3.29Å; S206-A210 WeakPolarHBondContact O-CB 3.41Å; S206-A210 PolarHBondContact O-N 3.06Å; I207-A210 PolarHBondContact O-N 3.28Å; A210-L309 VanDerWaalsContact O-CD1 3.3Å; A210-L309 WeakPolarHBondContact O-CD1 3.24Å; A210-F331 HydrophobicContact CB-CB 4.25Å
211	Y	93	Very high	94.7	Very high	30 Å²	30	53.2 Å²	53.2	12%	0.118	25%	0.248	C	C	.	.	H	α-helix	trans	-102.3	-26.7	-171.3	-57.5	-55.4	0	0	0	113.7	I207 Q271 I275 F276 L281 L309	I207-Y211 HydrophobicContact CG2-CD2 4.09Å; I207-Y211 PolarHBondContact O-N 2.77Å; Y211-Q271 PolarHBondContact O-NE2 3.46Å; Y211-I275 HydrophobicContact CD1-CB 4.41Å; Y211-I275 HydrophobicContact CD1-CG2 3.38Å; Y211-I275 HydrophobicContact CD2-CG2 4.46Å; Y211-I275 HydrophobicContact CE1-CG2 3.98Å; Y211-I275 HydrophobicContact CG-CB 4.23Å; Y211-I275 HydrophobicContact CG-CG2 3.66Å; Y211-I275 WeakPolarHBondContact O-CD1 3.26Å; Y211-F276 HydrophobicContact CD2-CB 4Å; Y211-F276 HydrophobicContact CD2-CD2 4.43Å; Y211-F276 HydrophobicContact CE2-CB 4.12Å; Y211-F276 AromaticContact CE2-CD2 3.79Å; Y211-F276 HydrophobicContact CE2-CD2 3.79Å; Y211-F276 HydrophobicContact CE2-CG 4.43Å; Y211-L281 HydrophobicContact CD1-CD1 3.87Å; Y211-L281 HydrophobicContact CE1-CD1 4.02Å; Y211-L309 VanDerWaalsContact O-CD1 3.3Å; Y211-L309 WeakPolarHBondContact O-CD1 3.27Å
212	G	92.1	Very high	94.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-91.1	-16.2	175.5	0	0	0	0	0	113.9	L208 E214 K268	L208-G212 CarbonylContact O-C 3.56Å; L208-G212 VanDerWaalsContact O-CA 3.26Å; L208-G212 WeakPolarHBondContact O-CA 3.34Å; L208-G212 PolarHBondContact O-N 3.13Å; L208-G212 VanDerWaalsContact O-N 3.13Å; G212-E214 PolarHBondContact O-N 3.38Å; G212-K268 WeakPolarHBondContact CA-O 3.39Å; G212-K268 WeakPolarHBondContact O-CD 3.46Å; G212-K268 WeakPolarHBondContact O-CE 3.04Å; G212-K268 WeakPolarHBondContact O-CG 3.43Å
213	E	91	Very high	94.8	Very high	41 Å²	41	45.6 Å²	45.6	19%	0.192	22%	0.221	C	C	.	.			trans	47	41.3	-163.8	-58.2	-174.4	132.9	0	0	110.4	L208 T209 K268 S308 L309 R312 Q333	L208-E213 PolarHBondContact O-N 2.79Å; T209-E213 WeakPolarHBondContact O-CA 3.38Å; T209-E213 PolarHBondContact O-N 2.65Å; E213-K268 PolarHBondContact O-NZ 3.29Å; E213-S308 PolarHBondContact OE2-OG 3.18Å; E213-L309 HydrophobicContact CG-CD2 3.96Å; E213-L309 HydrophobicContact CG-CG 4.42Å; E213-L309 WeakPolarHBondContact OE1-CD2 3.38Å; E213-R312 IonicContact OE1-CZ 3.63Å; E213-R312 IonicContact OE1-NH1 3.72Å; E213-R312 IonicContact OE1-NH2 2.72Å; E213-R312 PolarHBondContact OE1-NH2 2.94Å; E213-Q333 PolarHBondContact OE1-NE2 3Å
214	E	92.8	Very high	95	Very high	9 Å²	9	45 Å²	45	4%	0.042	22%	0.216	C	C	.	.			trans	-87.9	120.2	-173.3	-177.2	45.7	-100.9	0	0	111.3	L208 G212 H216 S217 I220 R255 K268	L208-E214 HydrophobicContact CB-CB 4.36Å; L208-E214 WeakPolarHBondContact O-CB 3.46Å; L208-E214 PolarHBondContact O-N 3.18Å; G212-E214 PolarHBondContact O-N 3.38Å; E214-H216 VanDerWaalsContact C-N 3.35Å; E214-H216 IonicContact OE1-CD2 2.85Å; E214-H216 IonicContact OE1-CG 3.68Å; E214-H216 PolarHBondContact OE1-N 3.22Å; E214-S217 WeakPolarHBondContact O-CB 3.33Å; E214-S217 PolarHBondContact O-N 2.78Å; E214-I220 HydrophobicContact CG-CD1 3.59Å; E214-R255 IonicContact OE2-CZ 3.43Å; E214-R255 IonicContact OE2-NH1 2.77Å; E214-R255 PolarHBondContact OE2-NH1 3.05Å; E214-K268 HydrophobicContact CB-CB 4.4Å; E214-K268 WeakPolarHBondContact OE2-CB 3.28Å
215	R	90.4	Very high	95	Very high	229 Å²	229	45.4 Å²	45.4	86%	0.864	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-31.3	-177.5	-67	-176.8	177.7	179.6	-1.4	111.9	S217	R215-S217 VanDerWaalsContact C-N 3.29Å
216	H	94.1	Very high	95.1	Very high	86 Å²	86	49.1 Å²	49.1	40%	0.398	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	23.7	179.5	-55.5	-68.8	0	0	0	112.7	E214 R218 K219 I220 F247	E214-H216 VanDerWaalsContact C-N 3.35Å; E214-H216 IonicContact OE1-CD2 2.85Å; E214-H216 IonicContact OE1-CG 3.68Å; E214-H216 PolarHBondContact OE1-N 3.22Å; H216-R218 VanDerWaalsContact C-N 3.32Å; H216-R218 PolarHBondContact O-N 3.29Å; H216-K219 HydrophobicContact CB-CB 4.47Å; H216-K219 WeakPolarHBondContact O-CB 3.48Å; H216-K219 PolarHBondContact O-N 3.43Å; H216-I220 HydrophobicContact CB-CD1 4.25Å; H216-I220 HydrophobicContact CB-CG1 4.46Å; H216-I220 WeakPolarHBondContact O-CG1 3.46Å; H216-I220 PolarHBondContact O-N 2.92Å; H216-F247 HydrophobicContact CB-CE1 3.73Å; H216-F247 HydrophobicContact CB-CZ 3.52Å; H216-F247 AromaticContact CD2-CE1 3.81Å; H216-F247 AromaticContact CG-CE1 3.56Å; H216-F247 AromaticContact CG-CZ 3.89Å; H216-F247 AromaticContact ND1-CE1 3.99Å
217	S	95.1	Very high	95.3	Very high	9 Å²	9	47.9 Å²	47.9	6%	0.063	23%	0.227	C	C	.	.	H	α-helix	trans	-51.3	-45.6	-173.8	57.2	0	0	0	0	113.6	A205 T209 E214 R215 I220 A221	A205-S217 WeakPolarHBondContact O-CB 3.38Å; T209-S217 WeakPolarHBondContact OG1-CB 3.47Å; T209-S217 PolarHBondContact OG1-OG 2.8Å; E214-S217 WeakPolarHBondContact O-CB 3.33Å; E214-S217 PolarHBondContact O-N 2.78Å; R215-S217 VanDerWaalsContact C-N 3.29Å; S217-I220 PolarHBondContact O-N 2.95Å; S217-A221 VanDerWaalsContact O-CB 3.24Å; S217-A221 WeakPolarHBondContact O-CB 3.36Å; S217-A221 PolarHBondContact O-N 3.31Å
218	R	96.8	Very high	95.4	Very high	199 Å²	199	49.8 Å²	49.8	75%	0.751	23%	0.233	S	C	*	.	H	α-helix	trans	-64	-41.1	178.1	-61.9	-172.9	-169.2	110.1	0.2	113	A205 H216 S222	A205-R218 HydrophobicContact CB-CG 4.24Å; H216-R218 VanDerWaalsContact C-N 3.32Å; H216-R218 PolarHBondContact O-N 3.29Å; R218-S222 WeakPolarHBondContact O-CB 3.34Å; R218-S222 PolarHBondContact O-N 3.22Å
219	K	97.7	Very high	95.5	Very high	103 Å²	103	58 Å²	58	45%	0.448	26%	0.264	S	S	.	.	H	α-helix	trans	-66.6	-46.1	179.6	-167.3	-177.2	-167.1	-170	0	110.5	H216 S222 A223 A246 F247	H216-K219 HydrophobicContact CB-CB 4.47Å; H216-K219 WeakPolarHBondContact O-CB 3.48Å; H216-K219 PolarHBondContact O-N 3.43Å; K219-S222 WeakPolarHBondContact O-CB 3.22Å; K219-S222 PolarHBondContact O-N 3.46Å; K219-A223 PolarHBondContact O-N 3.35Å; K219-A246 WeakPolarHBondContact CE-O 3.39Å; K219-A246 PolarHBondContact NZ-O 3.39Å; K219-F247 HydrophobicContact CD-CD1 4.41Å; K219-F247 HydrophobicContact CD-CE1 3.86Å; K219-F247 HydrophobicContact CD-CZ 4.08Å
220	I	98.1	Very high	95.6	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-46.7	177.5	-67.6	168.3	0	0	0	110.7	L208 E214 H216 S217 S222 A223 I224 V243 F247 T269	L208-I220 HydrophobicContact CD1-CB 3.96Å; L208-I220 HydrophobicContact CD1-CG2 3.65Å; E214-I220 HydrophobicContact CG-CD1 3.59Å; H216-I220 HydrophobicContact CB-CD1 4.25Å; H216-I220 HydrophobicContact CB-CG1 4.46Å; H216-I220 WeakPolarHBondContact O-CG1 3.46Å; H216-I220 PolarHBondContact O-N 2.92Å; S217-I220 PolarHBondContact O-N 2.95Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 3.2Å; I220-A223 PolarHBondContact O-N 3.44Å; I220-I224 HydrophobicContact CG2-CD1 3.84Å; I220-I224 HydrophobicContact CG2-CG1 4.46Å; I220-I224 WeakPolarHBondContact O-CG1 3.26Å; I220-I224 PolarHBondContact O-N 2.79Å; I220-V243 HydrophobicContact CD1-CG1 4.15Å; I220-V243 HydrophobicContact CG1-CG1 4.18Å; I220-V243 HydrophobicContact CG2-CG1 4.35Å; I220-V243 HydrophobicContact CG2-CG2 3.96Å; I220-F247 HydrophobicContact CD1-CE2 4.23Å; I220-F247 HydrophobicContact CD1-CZ 4.14Å; I220-F247 HydrophobicContact CG1-CE2 3.75Å; I220-F247 HydrophobicContact CG1-CZ 3.79Å; I220-T269 HydrophobicContact CG2-CG2 4.36Å
221	A	98.4	Very high	96	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.9	-40.3	176.5	0	0	0	0	0	112.1	Q201 L204 A205 L208 S217 I224 V225	Q201-A221 HydrophobicContact CG-CB 4.03Å; L204-A221 HydrophobicContact CB-CB 3.83Å; A205-A221 HydrophobicContact CB-CB 3.89Å; L208-A221 HydrophobicContact CD1-CB 4.33Å; S217-A221 VanDerWaalsContact O-CB 3.24Å; S217-A221 WeakPolarHBondContact O-CB 3.36Å; S217-A221 PolarHBondContact O-N 3.31Å; A221-I224 PolarHBondContact O-N 2.99Å; A221-V225 WeakPolarHBondContact O-CG2 3.39Å; A221-V225 PolarHBondContact O-N 3.47Å
222	S	98.4	Very high	96.2	Very high	40 Å²	40	67 Å²	67	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-48.9	173.7	-159.2	0	0	0	0	111.3	Q201 R218 K219 I220 I224 V225 E226	Q201-S222 VanDerWaalsContact NE2-CB 3.34Å; Q201-S222 PolarHBondContact NE2-OG 2.98Å; R218-S222 WeakPolarHBondContact O-CB 3.34Å; R218-S222 PolarHBondContact O-N 3.22Å; K219-S222 WeakPolarHBondContact O-CB 3.22Å; K219-S222 PolarHBondContact O-N 3.46Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 3.2Å; S222-I224 VanDerWaalsContact C-N 3.32Å; S222-I224 PolarHBondContact O-N 2.92Å; S222-V225 PolarHBondContact O-N 3.21Å; S222-E226 WeakPolarHBondContact O-CG 3.3Å; S222-E226 PolarHBondContact O-N 3.41Å
223	A	98.4	Very high	96.5	Very high	23 Å²	23	67.2 Å²	67.2	19%	0.19	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-40.2	180	0	0	0	0	0	112.4	K219 I220 E226 A227 V242 A246	K219-A223 PolarHBondContact O-N 3.35Å; I220-A223 PolarHBondContact O-N 3.44Å; A223-E226 PolarHBondContact O-N 3.4Å; A223-A227 VanDerWaalsContact O-CB 3.25Å; A223-A227 WeakPolarHBondContact O-CB 3.3Å; A223-A227 PolarHBondContact O-N 2.61Å; A223-V242 HydrophobicContact CB-CG1 4.12Å; A223-V242 WeakPolarHBondContact O-CG1 3.35Å; A223-A246 HydrophobicContact CB-CB 3.77Å
224	I	98.5	Very high	96.9	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-61.8	-46.4	174.8	-69.4	168.1	0	0	0	111	V196 L204 I220 A221 S222 A227 R228 I233 L239 V242	V196-I224 HydrophobicContact CB-CG2 3.94Å; L204-I224 HydrophobicContact CD1-CG2 3.96Å; I220-I224 HydrophobicContact CG2-CD1 3.84Å; I220-I224 HydrophobicContact CG2-CG1 4.46Å; I220-I224 WeakPolarHBondContact O-CG1 3.26Å; I220-I224 PolarHBondContact O-N 2.79Å; A221-I224 PolarHBondContact O-N 2.99Å; S222-I224 VanDerWaalsContact C-N 3.32Å; S222-I224 PolarHBondContact O-N 2.92Å; I224-A227 PolarHBondContact O-N 2.82Å; I224-R228 WeakPolarHBondContact O-CG 3.41Å; I224-R228 PolarHBondContact O-N 2.88Å; I224-I233 HydrophobicContact CG2-CD1 4.03Å; I224-L239 HydrophobicContact CD1-CD1 3.87Å; I224-L239 HydrophobicContact CG1-CD1 3.95Å; I224-V242 HydrophobicContact CG1-CG1 4.18Å
225	V	98.4	Very high	97.1	Very high	10 Å²	10	72.6 Å²	72.6	6%	0.061	34%	0.344	C	S	.	.	H	α-helix	trans	-66.3	-38.7	-179.6	170.4	0	0	0	0	112	Q201 L204 A221 S222 R228 R229	Q201-V225 HydrophobicContact CB-CG2 3.98Å; Q201-V225 HydrophobicContact CG-CG2 4.39Å; L204-V225 HydrophobicContact CD1-CG2 4Å; A221-V225 WeakPolarHBondContact O-CG2 3.39Å; A221-V225 PolarHBondContact O-N 3.47Å; S222-V225 PolarHBondContact O-N 3.21Å; V225-R228 VanDerWaalsContact O-CG 3.32Å; V225-R228 WeakPolarHBondContact O-CG 3.38Å; V225-R229 WeakPolarHBondContact O-CG 2.96Å
226	E	98.2	Very high	97.5	Very high	89 Å²	89	61.7 Å²	61.7	42%	0.416	30%	0.303	S	S	.	.	H	α-helix	trans	-69.1	-44.2	175.1	-66.6	-50.6	142.4	0	0	111.7	S222 A223 R228 R229	S222-E226 WeakPolarHBondContact O-CG 3.3Å; S222-E226 PolarHBondContact O-N 3.41Å; A223-E226 PolarHBondContact O-N 3.4Å; E226-R228 PolarHBondContact O-N 3.29Å; E226-R229 WeakPolarHBondContact O-CB 3.12Å; E226-R229 PolarHBondContact O-N 3.1Å; E226-R229 IonicContact OE1-CZ 3.78Å; E226-R229 IonicContact OE1-NH1 3.57Å; E226-R229 PolarHBondContact OE1-NH1 3.35Å; E226-R229 IonicContact OE1-NH2 2.96Å; E226-R229 IonicContact OE2-CZ 3.63Å; E226-R229 IonicContact OE2-NH1 2.95Å; E226-R229 PolarHBondContact OE2-NH1 3.48Å
227	A	98.1	Very high	97.6	Very high	29 Å²	29	61 Å²	61	24%	0.24	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-44.3	179.6	0	0	0	0	0	112.3	A223 I224 R229 V230 N231 I233 V242	A223-A227 VanDerWaalsContact O-CB 3.25Å; A223-A227 WeakPolarHBondContact O-CB 3.3Å; A223-A227 PolarHBondContact O-N 2.61Å; I224-A227 PolarHBondContact O-N 2.82Å; A227-R229 PolarHBondContact O-N 2.85Å; A227-V230 PolarHBondContact O-N 3.29Å; A227-V230 VanDerWaalsContact O-N 3.07Å; A227-N231 PolarHBondContact O-N 3.43Å; A227-I233 HydrophobicContact CB-CD1 4.22Å; A227-V242 HydrophobicContact CB-CB 4.3Å; A227-V242 HydrophobicContact CB-CG1 3.75Å; A227-V242 HydrophobicContact CB-CG2 3.48Å; A227-V242 VanDerWaalsContact CB-CG2 3.48Å
228	R	97.4	Very high	97.7	Very high	53 Å²	53	64.2 Å²	64.2	20%	0.2	31%	0.314	C	S	.	.	H	α-helix	trans	-68.5	-16.4	-179.3	75	177.8	-173.6	-164	8.4	114.6	V196 N197 L199 I224 V225 E226 V230 N231 I233	V196-R228 WeakPolarHBondContact O-CD 3.45Å; V196-R228 PolarHBondContact O-NH1 3.24Å; N197-R228 VanDerWaalsContact C-NH1 3.3Å; N197-R228 WeakPolarHBondContact O-CD 3.24Å; N197-R228 PolarHBondContact O-NE 3.16Å; N197-R228 PolarHBondContact O-NH1 3.47Å; L199-R228 VanDerWaalsContact O-CZ 3.23Å; L199-R228 PolarHBondContact O-NH1 2.93Å; L199-R228 PolarHBondContact O-NH2 2.72Å; I224-R228 WeakPolarHBondContact O-CG 3.41Å; I224-R228 PolarHBondContact O-N 2.88Å; V225-R228 VanDerWaalsContact O-CG 3.32Å; V225-R228 WeakPolarHBondContact O-CG 3.38Å; E226-R228 PolarHBondContact O-N 3.29Å; R228-V230 VanDerWaalsContact C-N 3.26Å; R228-N231 WeakPolarHBondContact CA-O 3.42Å; R228-I233 HydrophobicContact CB-CD1 4.46Å; R228-I233 HydrophobicContact CB-CG1 4.45Å
229	R	96.6	Very high	97.8	Very high	175 Å²	175	54.8 Å²	54.8	66%	0.66	28%	0.278	S	S	*	.	H	α-helix	trans	-70.1	-27.8	172.6	-74	173.8	177.2	165.3	3.2	111.8	V225 E226 A227	V225-R229 WeakPolarHBondContact O-CG 2.96Å; E226-R229 WeakPolarHBondContact O-CB 3.12Å; E226-R229 PolarHBondContact O-N 3.1Å; E226-R229 IonicContact OE1-CZ 3.78Å; E226-R229 IonicContact OE1-NH1 3.57Å; E226-R229 PolarHBondContact OE1-NH1 3.35Å; E226-R229 IonicContact OE1-NH2 2.96Å; E226-R229 IonicContact OE2-CZ 3.63Å; E226-R229 IonicContact OE2-NH1 2.95Å; E226-R229 PolarHBondContact OE2-NH1 3.48Å; A227-R229 PolarHBondContact O-N 2.85Å
230	V	96.4	Very high	97.8	Very high	115 Å²	115	50 Å²	50	70%	0.697	26%	0.258	S	S	*	.	H	α-helix	trans	-84.9	-55.6	177.5	-176.2	0	0	0	0	109.6	A227 R228	A227-V230 PolarHBondContact O-N 3.29Å; A227-V230 VanDerWaalsContact O-N 3.07Å; R228-V230 VanDerWaalsContact C-N 3.26Å
231	N	95.9	Very high	97.7	Very high	114 Å²	114	53.6 Å²	53.6	61%	0.61	28%	0.283	S	S	*	.	S	Bend	trans	-145.9	138.9	178.4	-75.1	-56	0	0	0	110.5	A227 R228 I233	A227-N231 PolarHBondContact O-N 3.43Å; R228-N231 WeakPolarHBondContact CA-O 3.42Å; N231-I233 PolarHBondContact O-N 3.29Å
232	P	97.9	Very high	97.7	Very high	82 Å²	82	55.1 Å²	55.1	53%	0.532	29%	0.293	S	S	.	.			trans	-54.1	138.9	173	-25.3	34.3	0	0	0	112.3	T234	P232-T234 HydrophobicContact CB-CG2 4.24Å; P232-T234 PolarHBondContact O-N 3.43Å
233	I	98.6	Very high	97.6	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.026	28%	0.279	C	S	.	.			trans	-88.5	105.5	177.9	-56.6	171	0	0	0	107.8	L177 V196 N197 I224 A227 R228 N231 Q238 L239 V242	L177-I233 HydrophobicContact CD2-CG2 3.98Å; V196-I233 HydrophobicContact CG2-CB 4.07Å; V196-I233 HydrophobicContact CG2-CG2 4.3Å; N197-I233 PolarHBondContact ND2-O 3.25Å; N197-I233 PolarHBondContact OD1-N 2.93Å; I224-I233 HydrophobicContact CG2-CD1 4.03Å; A227-I233 HydrophobicContact CB-CD1 4.22Å; R228-I233 HydrophobicContact CB-CD1 4.46Å; R228-I233 HydrophobicContact CB-CG1 4.45Å; N231-I233 PolarHBondContact O-N 3.29Å; I233-Q238 HydrophobicContact CG2-CB 4.12Å; I233-L239 HydrophobicContact CG2-CB 3.89Å; I233-V242 HydrophobicContact CD1-CG2 4.35Å
234	T	98.3	Very high	97.4	Very high	73 Å²	73	52.9 Å²	52.9	45%	0.448	28%	0.277	S	S	.	.			trans	-114.4	-14.2	-173.6	59.9	0	0	0	0	113.4	L177 P232 Q238	L177-T234 PolarHBondContact N-O 3.22Å; P232-T234 HydrophobicContact CB-CG2 4.24Å; P232-T234 PolarHBondContact O-N 3.43Å; T234-Q238 PolarHBondContact OG1-OE1 3.45Å
235	R	98.3	Very high	97.3	Very high	90 Å²	90	56.1 Å²	56.1	34%	0.34	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-122.4	155.8	-178.8	-55.8	-162	112.9	-115.4	-4.4	114.3	D174 G175 Q238 L239	D174-R235 PolarHBondContact O-NH1 3.17Å; D174-R235 VanDerWaalsContact O-NH1 3.16Å; D174-R235 IonicContact OD1-NH1 2.78Å; D174-R235 PolarHBondContact OD1-NH1 3.37Å; D174-R235 IonicContact OD2-CZ 3.29Å; D174-R235 IonicContact OD2-NH1 3.93Å; D174-R235 PolarHBondContact OD2-NH1 2.94Å; G175-R235 CarbonylContact O-C 3.54Å; G175-R235 WeakPolarHBondContact O-CA 3.36Å; G175-R235 WeakPolarHBondContact O-CB 3.11Å; R235-Q238 HydrophobicContact CB-CG 4.15Å; R235-Q238 WeakPolarHBondContact O-CB 3.28Å; R235-Q238 PolarHBondContact O-N 2.95Å; R235-L239 PolarHBondContact O-N 3.15Å
236	T	97.9	Very high	97.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-44.2	179.5	54.7	0	0	0	0	112.1	G168 K173 D174 G175 L177 Q238 L239 A240 F270	G168-T236 VanDerWaalsContact O-CG2 3.29Å; G168-T236 WeakPolarHBondContact O-CG2 3.34Å; K173-T236 PolarHBondContact O-OG1 3.28Å; D174-T236 WeakPolarHBondContact CA-OG1 3.43Å; D174-T236 PolarHBondContact OD1-OG1 2.85Å; G175-T236 PolarHBondContact N-OG1 2.99Å; G175-T236 PolarHBondContact O-N 2.77Å; L177-T236 HydrophobicContact CD1-CG2 4.23Å; T236-Q238 VanDerWaalsContact C-N 3.32Å; T236-Q238 PolarHBondContact O-N 2.82Å; T236-L239 PolarHBondContact O-N 2.98Å; T236-A240 WeakPolarHBondContact O-CB 3.39Å; T236-A240 PolarHBondContact O-N 3.02Å; T236-F270 HydrophobicContact CG2-CE1 3.96Å; T236-F270 HydrophobicContact CG2-CZ 4.48Å; T236-F270 WeakPolarHBondContact O-CZ 3.49Å
237	Q	96.9	Very high	96.9	Very high	70 Å²	70	53.3 Å²	53.3	33%	0.327	30%	0.299	S	S	.	.	H	α-helix	trans	-69.4	-29.8	179	-69.8	-66.6	13.9	0	0	113.4	L171 D174 A240 S241	L171-Q237 PolarHBondContact O-NE2 3.31Å; D174-Q237 HydrophobicContact CB-CB 4.24Å; D174-Q237 HydrophobicContact CB-CG 3.43Å; D174-Q237 VanDerWaalsContact CB-CG 3.43Å; D174-Q237 WeakPolarHBondContact OD1-CB 3.31Å; D174-Q237 VanDerWaalsContact OD1-CG 3.26Å; D174-Q237 WeakPolarHBondContact OD1-CG 3.12Å; D174-Q237 PolarHBondContact OD1-N 3.45Å; Q237-A240 PolarHBondContact O-N 3.19Å; Q237-S241 VanDerWaalsContact O-CB 3.24Å; Q237-S241 WeakPolarHBondContact O-CB 3.13Å; Q237-S241 PolarHBondContact O-N 3.21Å; Q237-S241 PolarHBondContact O-OG 3.25Å
238	Q	97.7	Very high	96.5	Very high	78 Å²	78	55.3 Å²	55.3	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-61.9	-49.8	173	-68.1	174.4	-27.8	0	0	110.1	I233 T234 R235 T236 A240 S241 V242	I233-Q238 HydrophobicContact CG2-CB 4.12Å; T234-Q238 PolarHBondContact OG1-OE1 3.45Å; R235-Q238 HydrophobicContact CB-CG 4.15Å; R235-Q238 WeakPolarHBondContact O-CB 3.28Å; R235-Q238 PolarHBondContact O-N 2.95Å; T236-Q238 VanDerWaalsContact C-N 3.32Å; T236-Q238 PolarHBondContact O-N 2.82Å; Q238-A240 PolarHBondContact O-N 2.93Å; Q238-S241 PolarHBondContact O-N 3.43Å; Q238-V242 VanDerWaalsContact O-CG2 3.32Å; Q238-V242 WeakPolarHBondContact O-CG2 3.28Å; Q238-V242 PolarHBondContact O-N 3.49Å
239	L	98.2	Very high	96	Very high	0 Å²	0	58 Å²	58	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-45.1	176.1	179.4	62.1	0	0	0	111.5	L177 V196 I224 I233 R235 T236 S241 V242 V243 T269 F270 L273	L177-L239 HydrophobicContact CD1-CD2 3.79Å; L177-L239 HydrophobicContact CD2-CB 4.18Å; L177-L239 HydrophobicContact CD2-CD2 3.94Å; V196-L239 HydrophobicContact CG1-CD1 4.36Å; V196-L239 HydrophobicContact CG1-CD2 4.49Å; I224-L239 HydrophobicContact CD1-CD1 3.87Å; I224-L239 HydrophobicContact CG1-CD1 3.95Å; I233-L239 HydrophobicContact CG2-CB 3.89Å; R235-L239 PolarHBondContact O-N 3.15Å; T236-L239 PolarHBondContact O-N 2.98Å; L239-S241 VanDerWaalsContact C-N 3.29Å; L239-S241 PolarHBondContact O-N 3.18Å; L239-V242 PolarHBondContact O-N 2.81Å; L239-V243 HydrophobicContact CD1-CG2 4.24Å; L239-V243 HydrophobicContact CG-CG2 4.49Å; L239-V243 VanDerWaalsContact O-CG2 3.23Å; L239-V243 WeakPolarHBondContact O-CG2 3.21Å; L239-V243 PolarHBondContact O-N 3.19Å; L239-T269 HydrophobicContact CD2-CG2 4.47Å; L239-F270 HydrophobicContact CB-CE2 4.22Å; L239-F270 HydrophobicContact CB-CZ 4.29Å; L239-F270 HydrophobicContact CD2-CD2 4.15Å; L239-F270 HydrophobicContact CD2-CE2 3.58Å; L239-F270 HydrophobicContact CD2-CZ 3.99Å; L239-F270 HydrophobicContact CG-CE2 3.81Å; L239-F270 HydrophobicContact CG-CZ 4.32Å; L239-L273 HydrophobicContact CD2-CD1 3.52Å
240	A	97.1	Very high	95.5	Very high	4 Å²	4	54.5 Å²	54.5	3%	0.033	34%	0.337	C	S	.	.	H	α-helix	trans	-59.5	-41.6	178.4	0	0	0	0	0	111.9	L171 T236 Q237 Q238 V243 A244 A266 F270	L171-A240 HydrophobicContact CD2-CB 3.92Å; T236-A240 WeakPolarHBondContact O-CB 3.39Å; T236-A240 PolarHBondContact O-N 3.02Å; Q237-A240 PolarHBondContact O-N 3.19Å; Q238-A240 PolarHBondContact O-N 2.93Å; A240-V243 PolarHBondContact O-N 3.23Å; A240-A244 VanDerWaalsContact O-CB 3.29Å; A240-A244 WeakPolarHBondContact O-CB 3.37Å; A240-A244 PolarHBondContact O-N 3.45Å; A240-A266 HydrophobicContact CB-CB 4.36Å; A240-F270 HydrophobicContact CB-CE2 4.44Å
241	S	96.3	Very high	95	Very high	75 Å²	75	51.1 Å²	51.1	52%	0.524	32%	0.316	S	S	.	.	H	α-helix	trans	-67.4	-42.5	178.1	-60.4	0	0	0	0	112.2	Q237 Q238 L239 V243 A244 G245	Q237-S241 VanDerWaalsContact O-CB 3.24Å; Q237-S241 WeakPolarHBondContact O-CB 3.13Å; Q237-S241 PolarHBondContact O-N 3.21Å; Q237-S241 PolarHBondContact O-OG 3.25Å; Q238-S241 PolarHBondContact O-N 3.43Å; L239-S241 VanDerWaalsContact C-N 3.29Å; L239-S241 PolarHBondContact O-N 3.18Å; S241-V243 VanDerWaalsContact C-N 3.34Å; S241-V243 PolarHBondContact O-N 3.17Å; S241-A244 PolarHBondContact O-N 3.41Å; S241-G245 PolarHBondContact O-N 3.06Å
242	V	97.4	Very high	94.3	Very high	32 Å²	32	47.3 Å²	47.3	19%	0.194	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-45.5	174.6	169.2	0	0	0	0	110.8	A223 I224 A227 I233 Q238 L239 A246	A223-V242 HydrophobicContact CB-CG1 4.12Å; A223-V242 WeakPolarHBondContact O-CG1 3.35Å; I224-V242 HydrophobicContact CG1-CG1 4.18Å; A227-V242 HydrophobicContact CB-CB 4.3Å; A227-V242 HydrophobicContact CB-CG1 3.75Å; A227-V242 HydrophobicContact CB-CG2 3.48Å; A227-V242 VanDerWaalsContact CB-CG2 3.48Å; I233-V242 HydrophobicContact CD1-CG2 4.35Å; Q238-V242 VanDerWaalsContact O-CG2 3.32Å; Q238-V242 WeakPolarHBondContact O-CG2 3.28Å; Q238-V242 PolarHBondContact O-N 3.49Å; L239-V242 PolarHBondContact O-N 2.81Å; V242-A246 PolarHBondContact O-N 3.14Å
243	V	96.9	Very high	93.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-43.9	177.4	179.3	0	0	0	0	110.5	I220 L239 A240 S241 A246 F247 I265 A266 T269	I220-V243 HydrophobicContact CD1-CG1 4.15Å; I220-V243 HydrophobicContact CG1-CG1 4.18Å; I220-V243 HydrophobicContact CG2-CG1 4.35Å; I220-V243 HydrophobicContact CG2-CG2 3.96Å; L239-V243 HydrophobicContact CD1-CG2 4.24Å; L239-V243 HydrophobicContact CG-CG2 4.49Å; L239-V243 VanDerWaalsContact O-CG2 3.23Å; L239-V243 WeakPolarHBondContact O-CG2 3.21Å; L239-V243 PolarHBondContact O-N 3.19Å; A240-V243 PolarHBondContact O-N 3.23Å; S241-V243 VanDerWaalsContact C-N 3.34Å; S241-V243 PolarHBondContact O-N 3.17Å; V243-A246 PolarHBondContact O-N 3.36Å; V243-F247 WeakPolarHBondContact O-CD2 3.33Å; V243-F247 WeakPolarHBondContact O-CE2 3.24Å; V243-I265 HydrophobicContact CG1-CG2 4.22Å; V243-A266 HydrophobicContact CB-CB 4.04Å; V243-A266 HydrophobicContact CG1-CB 4.02Å; V243-A266 HydrophobicContact CG2-CB 4.38Å; V243-T269 HydrophobicContact CG2-CG2 3.99Å
244	A	95.3	Very high	92.7	Very high	16 Å²	16	51.9 Å²	51.9	13%	0.132	32%	0.317	C	S	.	.	H	α-helix	trans	-64.7	-46.6	179.9	0	0	0	0	0	112.4	A240 S241 A246 F247 L252 I265	A240-A244 VanDerWaalsContact O-CB 3.29Å; A240-A244 WeakPolarHBondContact O-CB 3.37Å; A240-A244 PolarHBondContact O-N 3.45Å; S241-A244 PolarHBondContact O-N 3.41Å; A244-A246 PolarHBondContact O-N 3.23Å; A244-A246 VanDerWaalsContact O-N 3.11Å; A244-F247 PolarHBondContact O-N 2.99Å; A244-L252 HydrophobicContact CB-CD2 3.63Å; A244-L252 WeakPolarHBondContact O-CD2 3.48Å; A244-I265 HydrophobicContact CB-CG2 4.39Å
245	G	95	Very high	91.8	Very high	69 Å²	69	51.5 Å²	51.5	71%	0.711	31%	0.308	S	S	*	.	H	α-helix	trans	-62.5	-18.3	-179.3	0	0	0	0	0	114.1	S241 F247	S241-G245 PolarHBondContact O-N 3.06Å; G245-F247 PolarHBondContact O-N 2.85Å
246	A	94.4	Very high	90.9	Very high	20 Å²	20	53.5 Å²	53.5	17%	0.165	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-5.3	173	0	0	0	0	0	113.8	K219 A223 V242 V243 A244	K219-A246 WeakPolarHBondContact CE-O 3.39Å; K219-A246 PolarHBondContact NZ-O 3.39Å; A223-A246 HydrophobicContact CB-CB 3.77Å; V242-A246 PolarHBondContact O-N 3.14Å; V243-A246 PolarHBondContact O-N 3.36Å; A244-A246 PolarHBondContact O-N 3.23Å; A244-A246 VanDerWaalsContact O-N 3.11Å
247	F	94.1	Very high	89.6	Confident	19 Å²	19	54.7 Å²	54.7	8%	0.083	33%	0.325	C	S	.	.	S	Bend	trans	-133.7	153.2	-175.3	-59.2	-92.6	0	0	0	113.1	H216 K219 I220 V243 A244 G245 V251 I265	H216-F247 HydrophobicContact CB-CE1 3.73Å; H216-F247 HydrophobicContact CB-CZ 3.52Å; H216-F247 AromaticContact CD2-CE1 3.81Å; H216-F247 AromaticContact CG-CE1 3.56Å; H216-F247 AromaticContact CG-CZ 3.89Å; H216-F247 AromaticContact ND1-CE1 3.99Å; K219-F247 HydrophobicContact CD-CD1 4.41Å; K219-F247 HydrophobicContact CD-CE1 3.86Å; K219-F247 HydrophobicContact CD-CZ 4.08Å; I220-F247 HydrophobicContact CD1-CE2 4.23Å; I220-F247 HydrophobicContact CD1-CZ 4.14Å; I220-F247 HydrophobicContact CG1-CE2 3.75Å; I220-F247 HydrophobicContact CG1-CZ 3.79Å; V243-F247 WeakPolarHBondContact O-CD2 3.33Å; V243-F247 WeakPolarHBondContact O-CE2 3.24Å; A244-F247 PolarHBondContact O-N 2.99Å; G245-F247 PolarHBondContact O-N 2.85Å; F247-V251 HydrophobicContact CB-CB 4.25Å; F247-V251 HydrophobicContact CD1-CG1 4.36Å; F247-I265 HydrophobicContact CB-CD1 4.03Å; F247-I265 HydrophobicContact CD1-CD1 3.79Å; F247-I265 HydrophobicContact CD2-CD1 3.4Å; F247-I265 VanDerWaalsContact CD2-CD1 3.4Å; F247-I265 HydrophobicContact CD2-CG1 4.13Å; F247-I265 HydrophobicContact CE1-CD1 4.05Å; F247-I265 HydrophobicContact CE2-CD1 3.7Å; F247-I265 HydrophobicContact CE2-CG1 4.14Å; F247-I265 HydrophobicContact CG-CD1 3.46Å; F247-I265 VanDerWaalsContact CG-CD1 3.46Å; F247-I265 HydrophobicContact CZ-CD1 4.02Å
248	P	89.9	Confident	88.1	Confident	71 Å²	71	58.3 Å²	58.3	46%	0.461	34%	0.336	S	S	.	.			trans	-59.5	149.4	170	-21.8	32.9	0	0	0	112	S250 V251	P248-S250 PolarHBondContact O-N 3.24Å; P248-V251 HydrophobicContact CB-CG2 4.46Å; P248-V251 HydrophobicContact CG-CG2 4.49Å; P248-V251 PolarHBondContact O-N 3Å
249	P	86.6	Confident	86.6	Confident	111 Å²	111	57.9 Å²	57.9	72%	0.721	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-52.5	-32.4	179.8	-29.9	36	0	0	0	114.6	V251 L252	P249-V251 PolarHBondContact O-N 2.73Å; P249-L252 PolarHBondContact O-N 2.89Å
250	S	85.8	Confident	85.5	Confident	100 Å²	100	63.8 Å²	63.8	70%	0.699	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-62.2	-24	178.4	57.1	0	0	0	0	114.1	P248	P248-S250 PolarHBondContact O-N 3.24Å
251	V	85.6	Confident	84.4	Confident	45 Å²	45	68.2 Å²	68.2	27%	0.273	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-93.3	-21.8	-175.4	-168.4	0	0	0	0	112.1	F247 P248 P249 Y253 A254 I265	F247-V251 HydrophobicContact CB-CB 4.25Å; F247-V251 HydrophobicContact CD1-CG1 4.36Å; P248-V251 HydrophobicContact CB-CG2 4.46Å; P248-V251 HydrophobicContact CG-CG2 4.49Å; P248-V251 PolarHBondContact O-N 3Å; P249-V251 PolarHBondContact O-N 2.73Å; V251-Y253 PolarHBondContact O-N 2.84Å; V251-A254 PolarHBondContact O-N 2.76Å; V251-I265 HydrophobicContact CG1-CD1 3.88Å
252	L	82.2	Confident	83.7	Confident	34 Å²	34	73.8 Å²	73.8	18%	0.178	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-33.8	-173.3	-64.4	-177.9	0	0	0	113.6	A244 P249 H264 I265	A244-L252 HydrophobicContact CB-CD2 3.63Å; A244-L252 WeakPolarHBondContact O-CD2 3.48Å; P249-L252 PolarHBondContact O-N 2.89Å; L252-H264 CarbonylContact O-C 3.5Å; L252-H264 WeakPolarHBondContact O-CA 3.46Å; L252-I265 HydrophobicContact CD2-CG2 3.73Å; L252-I265 PolarHBondContact O-N 2.99Å
253	Y	84.2	Confident	83.1	Confident	115 Å²	115	73.5 Å²	73.5	45%	0.451	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.3	17.6	-175.2	-69.6	-70.9	0	0	0	112.8	V251 R255 R262 H264	V251-Y253 PolarHBondContact O-N 2.84Å; Y253-R255 PolarHBondContact O-N 2.95Å; Y253-R262 HydrophobicContact CD1-CB 4.02Å; Y253-R262 HydrophobicContact CG-CB 4.35Å; Y253-R262 WeakPolarHBondContact O-CG 3.49Å; Y253-H264 HydrophobicContact CE1-CB 4.19Å; Y253-H264 AromaticContact CE1-CD2 3.83Å; Y253-H264 AromaticContact CZ-CD2 3.71Å
254	A	78.7	Confident	82.8	Confident	67 Å²	67	75.2 Å²	75.2	55%	0.554	40%	0.398	S	S	*	.			trans	-67.7	-25.6	-179.2	0	0	0	0	0	112.6	V251	V251-A254 PolarHBondContact O-N 2.76Å
255	R	80.4	Confident	82.7	Confident	66 Å²	66	74.7 Å²	74.7	25%	0.249	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	133.1	177.7	-61.8	-169.7	-63.1	-157.5	8.4	109.7	E214 Y253 R262 A263 H264 I265	E214-R255 IonicContact OE2-CZ 3.43Å; E214-R255 IonicContact OE2-NH1 2.77Å; E214-R255 PolarHBondContact OE2-NH1 3.05Å; Y253-R255 PolarHBondContact O-N 2.95Å; R255-R262 CarbonylContact O-C 3.27Å; R255-R262 WeakPolarHBondContact O-CA 3.46Å; R255-A263 HydrophobicContact CB-CB 4.26Å; R255-A263 PolarHBondContact O-N 3Å; R255-H264 PolarHBondContact NH2-O 3.25Å; R255-I265 PolarHBondContact NH2-O 3.24Å
256	K	77.7	Confident	82.7	Confident	132 Å²	132	71.4 Å²	71.4	57%	0.574	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.9	173	-66	-174.1	-177.1	-179.2	0	110.6	Q260 R261	K256-Q260 HydrophobicContact CD-CB 4.37Å; K256-R261 CarbonylContact C-O 3.57Å; K256-R261 VanDerWaalsContact CA-O 3.25Å; K256-R261 WeakPolarHBondContact CA-O 3.41Å
257	D	70.6	Confident	82.6	Confident	24 Å²	24	73 Å²	73	13%	0.128	37%	0.366	C	S	.	.			trans	-76	-179.1	168.3	78.5	0.5	0	0	0	110.9	L259 Q260 R261 R378	D257-L259 PolarHBondContact O-N 2.92Å; D257-L259 VanDerWaalsContact OD1-C 3.26Å; D257-L259 VanDerWaalsContact OD1-CA 3.27Å; D257-L259 WeakPolarHBondContact OD1-CA 3.29Å; D257-L259 WeakPolarHBondContact OD1-CB 3.22Å; D257-L259 PolarHBondContact OD1-N 3.17Å; D257-Q260 PolarHBondContact O-N 3.09Å; D257-Q260 PolarHBondContact OD1-N 2.97Å; D257-R261 PolarHBondContact N-O 3.42Å; D257-R261 WeakPolarHBondContact OD1-CB 3.14Å; D257-R261 PolarHBondContact OD1-N 3.2Å; D257-R261 IonicContact OD1-NE 3.62Å; D257-R261 IonicContact OD2-CZ 3.96Å; D257-R261 IonicContact OD2-NE 3Å; D257-R261 PolarHBondContact OD2-NE 2.97Å; D257-R261 IonicContact OD2-NH2 3.74Å; D257-R261 PolarHBondContact OD2-NH2 2.78Å; D257-R378 WeakPolarHBondContact OD2-CD 3.32Å; D257-R378 IonicContact OD2-CZ 2.71Å; D257-R378 IonicContact OD2-NE 2.77Å; D257-R378 PolarHBondContact OD2-NE 3.37Å
258	R	65.3	Low	82.6	Confident	146 Å²	146	75 Å²	75	55%	0.551	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.8	179.4	-64.1	-179.3	100.7	-175.8	2.9	113.3	Q260 R378	R258-Q260 VanDerWaalsContact C-N 3.27Å; R258-R378 WeakPolarHBondContact CD-O 3.41Å
259	L	66.6	Low	82.9	Confident	69 Å²	69	71.7 Å²	71.7	36%	0.361	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	14.3	175.3	-58.4	179.4	0	0	0	112.1	D257 R261 V371 R378	D257-L259 PolarHBondContact O-N 2.92Å; D257-L259 VanDerWaalsContact OD1-C 3.26Å; D257-L259 VanDerWaalsContact OD1-CA 3.27Å; D257-L259 WeakPolarHBondContact OD1-CA 3.29Å; D257-L259 WeakPolarHBondContact OD1-CB 3.22Å; D257-L259 PolarHBondContact OD1-N 3.17Å; L259-R261 HydrophobicContact CB-CG 4.14Å; L259-R261 PolarHBondContact O-N 3.4Å; L259-R261 VanDerWaalsContact O-N 3.14Å; L259-V371 HydrophobicContact CD1-CG1 3.43Å; L259-V371 VanDerWaalsContact CD1-CG1 3.43Å; L259-V371 HydrophobicContact CD2-CG1 3.7Å; L259-V371 HydrophobicContact CG-CG1 3.95Å; L259-R378 HydrophobicContact CD1-CB 4.14Å; L259-R378 HydrophobicContact CG-CB 4.32Å
260	Q	75	Confident	83.4	Confident	125 Å²	125	66.9 Å²	66.9	58%	0.584	32%	0.321	S	S	*	.	S	Bend	trans	62.3	14.3	-176.8	-58	-61	-47	0	0	114.4	K256 D257 R258	K256-Q260 HydrophobicContact CD-CB 4.37Å; D257-Q260 PolarHBondContact O-N 3.09Å; D257-Q260 PolarHBondContact OD1-N 2.97Å; R258-Q260 VanDerWaalsContact C-N 3.27Å
261	R	75.6	Confident	83.9	Confident	97 Å²	97	64.1 Å²	64.1	37%	0.366	30%	0.297	S	S	.	.			trans	-81.4	141.8	177.9	-59.7	-178.3	-61.2	-173.4	-2.1	110.3	K256 D257 L259 A263 R378	K256-R261 CarbonylContact C-O 3.57Å; K256-R261 VanDerWaalsContact CA-O 3.25Å; K256-R261 WeakPolarHBondContact CA-O 3.41Å; D257-R261 PolarHBondContact N-O 3.42Å; D257-R261 WeakPolarHBondContact OD1-CB 3.14Å; D257-R261 PolarHBondContact OD1-N 3.2Å; D257-R261 IonicContact OD1-NE 3.62Å; D257-R261 IonicContact OD2-CZ 3.96Å; D257-R261 IonicContact OD2-NE 3Å; D257-R261 PolarHBondContact OD2-NE 2.97Å; D257-R261 IonicContact OD2-NH2 3.74Å; D257-R261 PolarHBondContact OD2-NH2 2.78Å; L259-R261 HydrophobicContact CB-CG 4.14Å; L259-R261 PolarHBondContact O-N 3.4Å; L259-R261 VanDerWaalsContact O-N 3.14Å; R261-A263 PolarHBondContact O-N 2.93Å; R261-R378 VanDerWaalsContact NH2-CD 3.29Å
262	R	81.1	Confident	84.4	Confident	191 Å²	191	62 Å²	62	72%	0.721	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	126.4	177.7	-70.6	176.3	174.9	-169.6	2.9	110.2	Y253 R255	Y253-R262 HydrophobicContact CD1-CB 4.02Å; Y253-R262 HydrophobicContact CG-CB 4.35Å; Y253-R262 WeakPolarHBondContact O-CG 3.49Å; R255-R262 CarbonylContact O-C 3.27Å; R255-R262 WeakPolarHBondContact O-CA 3.46Å
263	A	84.1	Confident	85.1	Confident	26 Å²	26	60.5 Å²	60.5	22%	0.215	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.3	175.5	0	0	0	0	0	109.6	R255 R261	R255-A263 HydrophobicContact CB-CB 4.26Å; R255-A263 PolarHBondContact O-N 3Å; R261-A263 PolarHBondContact O-N 2.93Å
264	H	90.4	Very high	85.8	Confident	37 Å²	37	56.8 Å²	56.8	17%	0.171	26%	0.261	C	S	.	.			trans	-59.7	146.4	179.4	-169.2	-100.8	0	0	0	111.5	L252 Y253 R255 A266 T267	L252-H264 CarbonylContact O-C 3.5Å; L252-H264 WeakPolarHBondContact O-CA 3.46Å; Y253-H264 HydrophobicContact CE1-CB 4.19Å; Y253-H264 AromaticContact CE1-CD2 3.83Å; Y253-H264 AromaticContact CZ-CD2 3.71Å; R255-H264 PolarHBondContact NH2-O 3.25Å; H264-A266 VanDerWaalsContact ND1-CB 3.32Å; H264-A266 WeakPolarHBondContact ND1-CB 3.47Å; H264-A266 PolarHBondContact ND1-N 3Å; H264-A266 VanDerWaalsContact ND1-N 3.13Å; H264-A266 PolarHBondContact O-N 3.01Å; H264-T267 WeakPolarHBondContact O-CB 3.37Å; H264-T267 PolarHBondContact O-N 3.23Å; H264-T267 VanDerWaalsContact O-N 3.13Å; H264-T267 PolarHBondContact O-OG1 2.93Å
265	I	92.8	Very high	86.6	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.021	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.7	-178.4	-168.8	148.6	0	0	0	113.6	V243 A244 F247 V251 L252 R255 T267	V243-I265 HydrophobicContact CG1-CG2 4.22Å; A244-I265 HydrophobicContact CB-CG2 4.39Å; F247-I265 HydrophobicContact CB-CD1 4.03Å; F247-I265 HydrophobicContact CD1-CD1 3.79Å; F247-I265 HydrophobicContact CD2-CD1 3.4Å; F247-I265 VanDerWaalsContact CD2-CD1 3.4Å; F247-I265 HydrophobicContact CD2-CG1 4.13Å; F247-I265 HydrophobicContact CE1-CD1 4.05Å; F247-I265 HydrophobicContact CE2-CD1 3.7Å; F247-I265 HydrophobicContact CE2-CG1 4.14Å; F247-I265 HydrophobicContact CG-CD1 3.46Å; F247-I265 VanDerWaalsContact CG-CD1 3.46Å; F247-I265 HydrophobicContact CZ-CD1 4.02Å; V251-I265 HydrophobicContact CG1-CD1 3.88Å; L252-I265 HydrophobicContact CD2-CG2 3.73Å; L252-I265 PolarHBondContact O-N 2.99Å; R255-I265 PolarHBondContact NH2-O 3.24Å; I265-T267 PolarHBondContact O-N 3.04Å
266	A	95.1	Very high	87.3	Confident	0 Å²	0	54 Å²	54	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-10.2	176.9	0	0	0	0	0	115	L171 A240 V243 H264 K268 T269 F270	L171-A266 HydrophobicContact CD2-CB 3.79Å; A240-A266 HydrophobicContact CB-CB 4.36Å; V243-A266 HydrophobicContact CB-CB 4.04Å; V243-A266 HydrophobicContact CG1-CB 4.02Å; V243-A266 HydrophobicContact CG2-CB 4.38Å; H264-A266 VanDerWaalsContact ND1-CB 3.32Å; H264-A266 WeakPolarHBondContact ND1-CB 3.47Å; H264-A266 PolarHBondContact ND1-N 3Å; H264-A266 VanDerWaalsContact ND1-N 3.13Å; H264-A266 PolarHBondContact O-N 3.01Å; A266-K268 PolarHBondContact O-N 3.47Å; A266-T269 WeakPolarHBondContact O-CB 3.42Å; A266-T269 PolarHBondContact O-N 3.37Å; A266-F270 HydrophobicContact CB-CD2 4.12Å; A266-F270 HydrophobicContact CB-CE2 4.16Å; A266-F270 WeakPolarHBondContact O-CD2 3.42Å; A266-F270 PolarHBondContact O-N 2.95Å
267	T	93.3	Very high	88.2	Confident	53 Å²	53	48.4 Å²	48.4	33%	0.325	22%	0.216	S	C	.	.	H	α-helix	trans	-56.5	-44.9	-175	-56.1	0	0	0	0	113.5	L171 H264 I265 T269 F270 Q271	L171-T267 WeakPolarHBondContact CD1-OG1 3.49Å; H264-T267 WeakPolarHBondContact O-CB 3.37Å; H264-T267 PolarHBondContact O-N 3.23Å; H264-T267 VanDerWaalsContact O-N 3.13Å; H264-T267 PolarHBondContact O-OG1 2.93Å; I265-T267 PolarHBondContact O-N 3.04Å; T267-T269 VanDerWaalsContact C-N 3.35Å; T267-F270 PolarHBondContact O-N 3.4Å; T267-Q271 WeakPolarHBondContact O-CB 3.38Å; T267-Q271 PolarHBondContact O-N 3.49Å
268	K	93.9	Very high	89.5	Confident	63 Å²	63	47.3 Å²	47.3	27%	0.274	21%	0.21	S	C	.	.	H	α-helix	trans	-69.4	-31.3	177.4	-75.2	-172.7	157.2	-164.8	0	113.3	G212 E213 E214 A266 A272	G212-K268 WeakPolarHBondContact CA-O 3.39Å; G212-K268 WeakPolarHBondContact O-CD 3.46Å; G212-K268 WeakPolarHBondContact O-CE 3.04Å; G212-K268 WeakPolarHBondContact O-CG 3.43Å; E213-K268 PolarHBondContact O-NZ 3.29Å; E214-K268 HydrophobicContact CB-CB 4.4Å; E214-K268 WeakPolarHBondContact OE2-CB 3.28Å; A266-K268 PolarHBondContact O-N 3.47Å; K268-A272 WeakPolarHBondContact O-CB 3.42Å; K268-A272 PolarHBondContact O-N 3.34Å
269	T	96.9	Very high	90.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-48.4	173.7	-58.5	0	0	0	0	110.7	L208 I220 L239 V243 A266 T267 A272 L273	L208-T269 HydrophobicContact CD2-CG2 3.76Å; I220-T269 HydrophobicContact CG2-CG2 4.36Å; L239-T269 HydrophobicContact CD2-CG2 4.47Å; V243-T269 HydrophobicContact CG2-CG2 3.99Å; A266-T269 WeakPolarHBondContact O-CB 3.42Å; A266-T269 PolarHBondContact O-N 3.37Å; T267-T269 VanDerWaalsContact C-N 3.35Å; T269-A272 PolarHBondContact O-N 3.45Å; T269-L273 HydrophobicContact CG2-CD1 4.28Å; T269-L273 WeakPolarHBondContact O-CG 3.35Å; T269-L273 PolarHBondContact O-N 3.29Å
270	F	96.9	Very high	92.3	Very high	10 Å²	10	40.9 Å²	40.9	4%	0.044	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-45.6	178.3	-84.9	-121.4	0	0	0	111.2	L171 M179 T236 L239 A240 A266 T267 A272 L273 R274	L171-F270 HydrophobicContact CD1-CG 4.5Å; L171-F270 HydrophobicContact CD2-CD1 3.81Å; L171-F270 HydrophobicContact CD2-CD2 3.53Å; L171-F270 HydrophobicContact CD2-CE1 3.68Å; L171-F270 HydrophobicContact CD2-CE2 3.36Å; L171-F270 HydrophobicContact CD2-CG 3.77Å; L171-F270 HydrophobicContact CD2-CZ 3.45Å; L171-F270 VanDerWaalsContact CD2-CZ 3.45Å; L171-F270 HydrophobicContact CG-CD1 3.85Å; L171-F270 HydrophobicContact CG-CD2 4.2Å; L171-F270 HydrophobicContact CG-CE1 4.08Å; L171-F270 HydrophobicContact CG-CE2 4.39Å; L171-F270 HydrophobicContact CG-CG 3.94Å; L171-F270 HydrophobicContact CG-CZ 4.35Å; M179-F270 HydrophobicContact CE-CB 4.06Å; M179-F270 HydrophobicContact CE-CD1 3.12Å; M179-F270 HydrophobicContact CE-CE1 3.52Å; M179-F270 HydrophobicContact CE-CG 3.68Å; M179-F270 HydrophobicContact CE-CZ 4.36Å; T236-F270 HydrophobicContact CG2-CE1 3.96Å; T236-F270 HydrophobicContact CG2-CZ 4.48Å; T236-F270 WeakPolarHBondContact O-CZ 3.49Å; L239-F270 HydrophobicContact CB-CE2 4.22Å; L239-F270 HydrophobicContact CB-CZ 4.29Å; L239-F270 HydrophobicContact CD2-CD2 4.15Å; L239-F270 HydrophobicContact CD2-CE2 3.58Å; L239-F270 HydrophobicContact CD2-CZ 3.99Å; L239-F270 HydrophobicContact CG-CE2 3.81Å; L239-F270 HydrophobicContact CG-CZ 4.32Å; A240-F270 HydrophobicContact CB-CE2 4.44Å; A266-F270 HydrophobicContact CB-CD2 4.12Å; A266-F270 HydrophobicContact CB-CE2 4.16Å; A266-F270 WeakPolarHBondContact O-CD2 3.42Å; A266-F270 PolarHBondContact O-N 2.95Å; T267-F270 PolarHBondContact O-N 3.4Å; F270-A272 VanDerWaalsContact C-N 3.31Å; F270-A272 PolarHBondContact O-N 3.22Å; F270-L273 PolarHBondContact O-N 2.95Å; F270-R274 VanDerWaalsContact O-CB 3.24Å; F270-R274 WeakPolarHBondContact O-CB 3.34Å; F270-R274 PolarHBondContact O-N 2.99Å
271	Q	95.4	Very high	93.2	Very high	43 Å²	43	35.1 Å²	35.1	20%	0.201	16%	0.159	C	C	.	.	H	α-helix	trans	-56.1	-45.3	173.9	-173.8	-168.1	-64.9	0	0	111.8	Y211 T267 R274 I275	Y211-Q271 PolarHBondContact O-NE2 3.46Å; T267-Q271 WeakPolarHBondContact O-CB 3.38Å; T267-Q271 PolarHBondContact O-N 3.49Å; Q271-R274 PolarHBondContact O-N 2.89Å; Q271-I275 HydrophobicContact CG-CD1 3.76Å; Q271-I275 HydrophobicContact CG-CG1 4.49Å; Q271-I275 WeakPolarHBondContact O-CB 3.5Å; Q271-I275 WeakPolarHBondContact O-CD1 3.48Å; Q271-I275 VanDerWaalsContact O-CG1 3.24Å; Q271-I275 WeakPolarHBondContact O-CG1 3.24Å; Q271-I275 PolarHBondContact O-N 2.76Å
272	A	96.5	Very high	94	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-44.3	-178.8	0	0	0	0	0	112.8	I207 L208 K268 T269 F270 F276	I207-A272 HydrophobicContact CG2-CB 4.33Å; L208-A272 HydrophobicContact CD2-CB 3.98Å; K268-A272 WeakPolarHBondContact O-CB 3.42Å; K268-A272 PolarHBondContact O-N 3.34Å; T269-A272 PolarHBondContact O-N 3.45Å; F270-A272 VanDerWaalsContact C-N 3.31Å; F270-A272 PolarHBondContact O-N 3.22Å; A272-F276 VanDerWaalsContact O-CB 3.31Å; A272-F276 WeakPolarHBondContact O-CB 3.47Å; A272-F276 PolarHBondContact O-N 3.29Å
273	L	97.8	Very high	94.8	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-65.7	-44.1	178.7	-69.3	173.9	0	0	0	111.1	M179 V195 V196 L239 T269 F270 F276 V277	M179-L273 HydrophobicContact SD-CB 3.9Å; V195-L273 HydrophobicContact CB-CD2 4.48Å; V195-L273 HydrophobicContact CG1-CD2 3.72Å; V196-L273 HydrophobicContact CG1-CD1 3.68Å; V196-L273 HydrophobicContact CG1-CD2 3.98Å; L239-L273 HydrophobicContact CD2-CD1 3.52Å; T269-L273 HydrophobicContact CG2-CD1 4.28Å; T269-L273 WeakPolarHBondContact O-CG 3.35Å; T269-L273 PolarHBondContact O-N 3.29Å; F270-L273 PolarHBondContact O-N 2.95Å; L273-F276 PolarHBondContact O-N 2.83Å; L273-V277 WeakPolarHBondContact O-CB 3.24Å; L273-V277 VanDerWaalsContact O-CG2 3.28Å; L273-V277 WeakPolarHBondContact O-CG2 3.37Å; L273-V277 PolarHBondContact O-N 3.06Å
274	R	96.9	Very high	95.4	Very high	37 Å²	37	21.9 Å²	21.9	14%	0.14	11%	0.106	C	C	.	.	H	α-helix	trans	-57.3	-51.7	176.7	-167.9	-157.3	83.7	178.3	-7	112.2	C157 F169 M179 F270 Q271 F276 V277 N278 E280 E310	C157-R274 WeakPolarHBondContact SG-CD 3.42Å; C157-R274 PolarHBondContact SG-NH1 3.41Å; F169-R274 HydrophobicContact CD1-CG 3.82Å; F169-R274 HydrophobicContact CE1-CG 3.68Å; M179-R274 HydrophobicContact SD-CB 4.26Å; F270-R274 VanDerWaalsContact O-CB 3.24Å; F270-R274 WeakPolarHBondContact O-CB 3.34Å; F270-R274 PolarHBondContact O-N 2.99Å; Q271-R274 PolarHBondContact O-N 2.89Å; R274-F276 VanDerWaalsContact C-N 3.27Å; R274-F276 PolarHBondContact O-N 2.93Å; R274-V277 PolarHBondContact O-N 3.22Å; R274-N278 WeakPolarHBondContact O-CB 3.34Å; R274-N278 PolarHBondContact O-N 3.12Å; R274-N278 VanDerWaalsContact O-N 3.1Å; R274-N278 PolarHBondContact O-ND2 2.85Å; R274-E280 VanDerWaalsContact CG-OE1 3.24Å; R274-E280 WeakPolarHBondContact CG-OE1 3.49Å; R274-E280 IonicContact CZ-OE1 3.84Å; R274-E280 IonicContact CZ-OE2 3.89Å; R274-E280 IonicContact NE-OE1 2.92Å; R274-E280 PolarHBondContact NE-OE1 3.28Å; R274-E280 IonicContact NE-OE2 2.76Å; R274-E280 PolarHBondContact NE-OE2 3.47Å; R274-E280 IonicContact NH2-OE1 3.76Å; R274-E280 IonicContact NH2-OE2 3.28Å; R274-E280 PolarHBondContact NH2-OE2 2.94Å; R274-E280 VanDerWaalsContact O-OE1 3.13Å; R274-E310 IonicContact NH2-OE1 2.94Å
275	I	95.8	Very high	95.6	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-57.8	-43.2	177	-69.4	165.4	0	0	0	110.9	Y211 Q271 D279 E280 L281 H307 L309	Y211-I275 HydrophobicContact CD1-CB 4.41Å; Y211-I275 HydrophobicContact CD1-CG2 3.38Å; Y211-I275 HydrophobicContact CD2-CG2 4.46Å; Y211-I275 HydrophobicContact CE1-CG2 3.98Å; Y211-I275 HydrophobicContact CG-CB 4.23Å; Y211-I275 HydrophobicContact CG-CG2 3.66Å; Y211-I275 WeakPolarHBondContact O-CD1 3.26Å; Q271-I275 HydrophobicContact CG-CD1 3.76Å; Q271-I275 HydrophobicContact CG-CG1 4.49Å; Q271-I275 WeakPolarHBondContact O-CB 3.5Å; Q271-I275 WeakPolarHBondContact O-CD1 3.48Å; Q271-I275 VanDerWaalsContact O-CG1 3.24Å; Q271-I275 WeakPolarHBondContact O-CG1 3.24Å; Q271-I275 PolarHBondContact O-N 2.76Å; I275-D279 PolarHBondContact O-N 3.46Å; I275-D279 VanDerWaalsContact O-N 3.11Å; I275-E280 WeakPolarHBondContact CA-OE1 3.33Å; I275-E280 WeakPolarHBondContact CG1-OE2 3.33Å; I275-E280 HydrophobicContact CG2-CB 4.33Å; I275-E280 PolarHBondContact N-OE1 3.48Å; I275-E280 PolarHBondContact O-N 3.22Å; I275-E280 VanDerWaalsContact O-N 3.09Å; I275-L281 HydrophobicContact CG2-CD1 4.09Å; I275-L281 HydrophobicContact CG2-CG 3.94Å; I275-H307 WeakPolarHBondContact CD1-NE2 3.42Å; I275-L309 HydrophobicContact CD1-CD1 4.41Å
276	F	96.4	Very high	95.7	Very high	74 Å²	74	25.2 Å²	25.2	33%	0.325	12%	0.12	S	C	.	.	H	α-helix	trans	-68.5	-49.3	-178.6	177	-104.4	0	0	0	112.8	V195 L199 I207 Y211 A272 L273 R274 N278 D279	V195-F276 HydrophobicContact CG1-CD1 3.94Å; V195-F276 HydrophobicContact CG1-CE1 3.91Å; V195-F276 HydrophobicContact CG2-CD1 3.93Å; V195-F276 HydrophobicContact CG2-CE1 3.71Å; L199-F276 HydrophobicContact CD1-CE1 4.25Å; L199-F276 HydrophobicContact CD1-CZ 4.35Å; I207-F276 HydrophobicContact CD1-CD1 3.81Å; I207-F276 HydrophobicContact CD1-CD2 3.89Å; I207-F276 HydrophobicContact CD1-CE1 3.71Å; I207-F276 HydrophobicContact CD1-CE2 3.78Å; I207-F276 HydrophobicContact CD1-CG 3.88Å; I207-F276 HydrophobicContact CD1-CZ 3.69Å; I207-F276 HydrophobicContact CG1-CD2 3.86Å; I207-F276 HydrophobicContact CG1-CE2 4.03Å; I207-F276 HydrophobicContact CG1-CG 4.11Å; I207-F276 HydrophobicContact CG1-CZ 4.44Å; I207-F276 HydrophobicContact CG2-CB 3.94Å; I207-F276 HydrophobicContact CG2-CG 4.15Å; Y211-F276 HydrophobicContact CD2-CB 4Å; Y211-F276 HydrophobicContact CD2-CD2 4.43Å; Y211-F276 HydrophobicContact CE2-CB 4.12Å; Y211-F276 AromaticContact CE2-CD2 3.79Å; Y211-F276 HydrophobicContact CE2-CD2 3.79Å; Y211-F276 HydrophobicContact CE2-CG 4.43Å; A272-F276 VanDerWaalsContact O-CB 3.31Å; A272-F276 WeakPolarHBondContact O-CB 3.47Å; A272-F276 PolarHBondContact O-N 3.29Å; L273-F276 PolarHBondContact O-N 2.83Å; R274-F276 VanDerWaalsContact C-N 3.27Å; R274-F276 PolarHBondContact O-N 2.93Å; F276-N278 VanDerWaalsContact C-N 3.25Å; F276-N278 PolarHBondContact O-N 2.95Å; F276-D279 PolarHBondContact O-N 3.48Å
277	V	96.9	Very high	95.8	Very high	13 Å²	13	25.2 Å²	25.2	8%	0.079	12%	0.12	C	C	.	.	H	α-helix	trans	-60.8	-36.4	-179.1	166.1	0	0	0	0	111.3	R180 A192 V195 L273 R274	R180-V277 HydrophobicContact CB-CG1 4.44Å; R180-V277 HydrophobicContact CG-CG1 3.53Å; A192-V277 HydrophobicContact CB-CG2 4.23Å; V195-V277 HydrophobicContact CG2-CG2 3.99Å; L273-V277 WeakPolarHBondContact O-CB 3.24Å; L273-V277 VanDerWaalsContact O-CG2 3.28Å; L273-V277 WeakPolarHBondContact O-CG2 3.37Å; L273-V277 PolarHBondContact O-N 3.06Å; R274-V277 PolarHBondContact O-N 3.22Å
278	N	96.5	Very high	96	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.011	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	0.7	-175.4	-65.6	-70.6	0	0	0	114.4	R105 M179 M181 R274 F276 E280	R105-N278 PolarHBondContact NH1-O 3.3Å; M179-N278 PolarHBondContact O-ND2 3Å; M181-N278 WeakPolarHBondContact CB-OD1 3.4Å; M181-N278 HydrophobicContact CG-CB 4.49Å; M181-N278 WeakPolarHBondContact CG-OD1 3.34Å; M181-N278 PolarHBondContact N-OD1 2.82Å; M181-N278 HydrophobicContact SD-CB 4.17Å; R274-N278 WeakPolarHBondContact O-CB 3.34Å; R274-N278 PolarHBondContact O-N 3.12Å; R274-N278 VanDerWaalsContact O-N 3.1Å; R274-N278 PolarHBondContact O-ND2 2.85Å; F276-N278 VanDerWaalsContact C-N 3.25Å; F276-N278 PolarHBondContact O-N 2.95Å; N278-E280 HydrophobicContact CB-CG 3.63Å; N278-E280 PolarHBondContact O-N 3.38Å
279	D	94.9	Very high	96.1	Very high	63 Å²	63	22.2 Å²	22.2	34%	0.337	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	36.9	-174.2	-161.6	28.5	0	0	0	113	I275 F276 L281 N282 E283	I275-D279 PolarHBondContact O-N 3.46Å; I275-D279 VanDerWaalsContact O-N 3.11Å; F276-D279 PolarHBondContact O-N 3.48Å; D279-L281 VanDerWaalsContact C-N 3.31Å; D279-L281 PolarHBondContact O-N 2.84Å; D279-L281 VanDerWaalsContact O-N 3.15Å; D279-N282 PolarHBondContact O-N 2.93Å; D279-N282 VanDerWaalsContact O-N 3.15Å; D279-N282 WeakPolarHBondContact OD1-CB 3.3Å; D279-N282 PolarHBondContact OD1-ND2 3.11Å; D279-N282 WeakPolarHBondContact OD2-CB 3.36Å; D279-E283 PolarHBondContact O-N 3.09Å
280	E	95.8	Very high	96.1	Very high	17 Å²	17	22.8 Å²	22.8	8%	0.079	11%	0.112	C	C	.	.	H	α-helix	trans	-58.3	-39.7	-161	-64.8	176.9	-156.6	0	0	113.1	M181 R274 I275 N278 L284	M181-E280 HydrophobicContact CE-CG 4.38Å; R274-E280 VanDerWaalsContact CG-OE1 3.24Å; R274-E280 WeakPolarHBondContact CG-OE1 3.49Å; R274-E280 IonicContact CZ-OE1 3.84Å; R274-E280 IonicContact CZ-OE2 3.89Å; R274-E280 IonicContact NE-OE1 2.92Å; R274-E280 PolarHBondContact NE-OE1 3.28Å; R274-E280 IonicContact NE-OE2 2.76Å; R274-E280 PolarHBondContact NE-OE2 3.47Å; R274-E280 IonicContact NH2-OE1 3.76Å; R274-E280 IonicContact NH2-OE2 3.28Å; R274-E280 PolarHBondContact NH2-OE2 2.94Å; R274-E280 VanDerWaalsContact O-OE1 3.13Å; I275-E280 WeakPolarHBondContact CA-OE1 3.33Å; I275-E280 WeakPolarHBondContact CG1-OE2 3.33Å; I275-E280 HydrophobicContact CG2-CB 4.33Å; I275-E280 PolarHBondContact N-OE1 3.48Å; I275-E280 PolarHBondContact O-N 3.22Å; I275-E280 VanDerWaalsContact O-N 3.09Å; N278-E280 HydrophobicContact CB-CG 3.63Å; N278-E280 PolarHBondContact O-N 3.38Å; E280-L284 WeakPolarHBondContact O-CB 3.14Å; E280-L284 PolarHBondContact O-N 3.38Å
281	L	94	Very high	96.1	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.016	11%	0.11	C	C	.	.	H	α-helix	trans	-74.4	-35.7	-176	-62.5	179.4	0	0	0	112.3	Y211 I275 D279 H285 L309 E310 L313 F331	Y211-L281 HydrophobicContact CD1-CD1 3.87Å; Y211-L281 HydrophobicContact CE1-CD1 4.02Å; I275-L281 HydrophobicContact CG2-CD1 4.09Å; I275-L281 HydrophobicContact CG2-CG 3.94Å; D279-L281 VanDerWaalsContact C-N 3.31Å; D279-L281 PolarHBondContact O-N 2.84Å; D279-L281 VanDerWaalsContact O-N 3.15Å; L281-H285 PolarHBondContact O-N 3.11Å; L281-H285 VanDerWaalsContact O-N 3.08Å; L281-L309 HydrophobicContact CD1-CB 3.96Å; L281-L309 HydrophobicContact CD1-CD1 4.09Å; L281-L309 HydrophobicContact CD2-CB 4.17Å; L281-E310 HydrophobicContact CD2-CG 4.07Å; L281-L313 HydrophobicContact CB-CD1 4.1Å; L281-L313 HydrophobicContact CD2-CD1 4.4Å; L281-L313 WeakPolarHBondContact O-CD1 3.46Å; L281-F331 HydrophobicContact CB-CZ 4.22Å; L281-F331 HydrophobicContact CD1-CD1 4.25Å; L281-F331 HydrophobicContact CD1-CE1 3.36Å; L281-F331 HydrophobicContact CD1-CE2 4.19Å; L281-F331 HydrophobicContact CD1-CZ 3.32Å; L281-F331 HydrophobicContact CG-CZ 4.34Å
282	N	93.5	Very high	96.1	Very high	19 Å²	19	22.1 Å²	22.1	10%	0.102	11%	0.11	C	C	.	.	H	α-helix	trans	-73.5	-40.3	175.5	-71.9	-49.7	0	0	0	110.7	D279 H285 K286	D279-N282 PolarHBondContact O-N 2.93Å; D279-N282 VanDerWaalsContact O-N 3.15Å; D279-N282 WeakPolarHBondContact OD1-CB 3.3Å; D279-N282 PolarHBondContact OD1-ND2 3.11Å; D279-N282 WeakPolarHBondContact OD2-CB 3.36Å; N282-H285 PolarHBondContact O-N 3.4Å; N282-K286 WeakPolarHBondContact O-CG 3.39Å; N282-K286 PolarHBondContact O-N 3.35Å
283	E	96.2	Very high	96.1	Very high	13 Å²	13	24.4 Å²	24.4	6%	0.061	13%	0.126	C	C	.	.	H	α-helix	trans	-60.9	-48.5	172.2	-74.3	-56.4	114.8	0	0	111	R130 F131 S132 D279 H285 K286 G287	R130-E283 WeakPolarHBondContact CB-OE2 3.47Å; F131-E283 WeakPolarHBondContact CB-O 3.49Å; F131-E283 HydrophobicContact CD2-CB 4.36Å; F131-E283 VanDerWaalsContact CD2-O 3.29Å; F131-E283 WeakPolarHBondContact CD2-O 3.37Å; F131-E283 PolarHBondContact N-OE2 2.83Å; S132-E283 VanDerWaalsContact CB-OE1 3.28Å; S132-E283 WeakPolarHBondContact CB-OE1 3.36Å; S132-E283 WeakPolarHBondContact CB-OE2 3.23Å; S132-E283 PolarHBondContact N-OE2 3.24Å; S132-E283 VanDerWaalsContact OG-CD 3.24Å; S132-E283 PolarHBondContact OG-OE1 3.14Å; S132-E283 PolarHBondContact OG-OE2 3.36Å; D279-E283 PolarHBondContact O-N 3.09Å; E283-H285 VanDerWaalsContact C-N 3.27Å; E283-H285 PolarHBondContact O-N 3.27Å; E283-K286 PolarHBondContact O-N 2.76Å; E283-K286 IonicContact OE1-NZ 2.59Å; E283-K286 PolarHBondContact OE1-NZ 2.84Å; E283-G287 PolarHBondContact O-N 3.19Å
284	L	96.5	Very high	96.1	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-54	-44	175.7	178.8	60.6	0	0	0	111.8	A155 E280 G287 L288 E310 L313 V314	A155-L284 HydrophobicContact CB-CD1 4.14Å; A155-L284 HydrophobicContact CB-CD2 4.32Å; E280-L284 WeakPolarHBondContact O-CB 3.14Å; E280-L284 PolarHBondContact O-N 3.38Å; L284-G287 PolarHBondContact O-N 3.03Å; L284-L288 HydrophobicContact CD1-CG 4.47Å; L284-L288 HydrophobicContact CG-CD1 4.38Å; L284-L288 VanDerWaalsContact O-CG 3.3Å; L284-L288 WeakPolarHBondContact O-CG 3.41Å; L284-L288 PolarHBondContact O-N 3.01Å; L284-E310 HydrophobicContact CD2-CB 3.98Å; L284-E310 HydrophobicContact CD2-CG 3.95Å; L284-L313 HydrophobicContact CD2-CD2 4.21Å; L284-L313 HydrophobicContact CG-CD2 4.15Å; L284-V314 HydrophobicContact CD2-CG2 4.11Å
285	H	95.4	Very high	96.1	Very high	34 Å²	34	22.9 Å²	22.9	16%	0.157	12%	0.121	C	C	.	.	H	α-helix	trans	-61.7	-46.6	175.8	176.4	-120.2	0	0	0	112.6	L281 N282 E283 G287 L288 C289 L313 L323 L326	L281-H285 PolarHBondContact O-N 3.11Å; L281-H285 VanDerWaalsContact O-N 3.08Å; N282-H285 PolarHBondContact O-N 3.4Å; E283-H285 VanDerWaalsContact C-N 3.27Å; E283-H285 PolarHBondContact O-N 3.27Å; H285-G287 VanDerWaalsContact C-N 3.28Å; H285-G287 PolarHBondContact O-N 2.74Å; H285-L288 PolarHBondContact O-N 2.78Å; H285-C289 PolarHBondContact O-N 3.25Å; H285-C289 PolarHBondContact O-SG 3.36Å; H285-C289 VanDerWaalsContact O-SG 3.38Å; H285-L313 HydrophobicContact CB-CD1 4.34Å; H285-L313 HydrophobicContact CB-CD2 4.29Å; H285-L323 WeakPolarHBondContact NE2-CB 3.45Å; H285-L326 HydrophobicContact CB-CD1 3.61Å
286	K	95.8	Very high	96.2	Very high	77 Å²	77	26.3 Å²	26.3	34%	0.335	14%	0.135	S	C	.	.	H	α-helix	trans	-60.7	-40.4	175.2	-66.5	173.7	-164.3	161.8	0	111.3	S132 N282 E283 L288 C289 V290	S132-K286 VanDerWaalsContact CB-CD 3.45Å; N282-K286 WeakPolarHBondContact O-CG 3.39Å; N282-K286 PolarHBondContact O-N 3.35Å; E283-K286 PolarHBondContact O-N 2.76Å; E283-K286 IonicContact OE1-NZ 2.59Å; E283-K286 PolarHBondContact OE1-NZ 2.84Å; K286-L288 PolarHBondContact O-N 3.28Å; K286-C289 WeakPolarHBondContact O-CB 3.46Å; K286-C289 PolarHBondContact O-N 2.92Å; K286-C289 VanDerWaalsContact O-N 3.16Å; K286-V290 WeakPolarHBondContact O-CG2 3.31Å; K286-V290 PolarHBondContact O-N 3.45Å
287	G	97.2	Very high	96.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.7	-42.5	175.9	0	0	0	0	0	112.9	M80 E283 L284 H285 C289 V290 A291	M80-G287 VanDerWaalsContact CE-CA 3.46Å; E283-G287 PolarHBondContact O-N 3.19Å; L284-G287 PolarHBondContact O-N 3.03Å; H285-G287 VanDerWaalsContact C-N 3.28Å; H285-G287 PolarHBondContact O-N 2.74Å; G287-C289 PolarHBondContact O-N 3.02Å; G287-V290 PolarHBondContact O-N 3.32Å; G287-A291 WeakPolarHBondContact O-CB 3.38Å; G287-A291 PolarHBondContact O-N 2.95Å
288	L	97.1	Very high	96.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-39.4	173.7	-69	169.6	0	0	0	112.4	L153 L284 H285 K286 A291 Q292 L301 V303 L313 V314 F317	L153-L288 HydrophobicContact CD1-CD2 4.01Å; L284-L288 HydrophobicContact CD1-CG 4.47Å; L284-L288 HydrophobicContact CG-CD1 4.38Å; L284-L288 VanDerWaalsContact O-CG 3.3Å; L284-L288 WeakPolarHBondContact O-CG 3.41Å; L284-L288 PolarHBondContact O-N 3.01Å; H285-L288 PolarHBondContact O-N 2.78Å; K286-L288 PolarHBondContact O-N 3.28Å; L288-A291 PolarHBondContact O-N 2.82Å; L288-Q292 PolarHBondContact O-N 3.49Å; L288-L301 HydrophobicContact CD2-CD2 4.13Å; L288-V303 HydrophobicContact CD2-CG2 3.96Å; L288-L313 HydrophobicContact CD1-CD2 3.44Å; L288-L313 VanDerWaalsContact CD1-CD2 3.44Å; L288-V314 HydrophobicContact CD1-CG2 4.11Å; L288-F317 VanDerWaalsContact C-CZ 3.46Å; L288-F317 HydrophobicContact CB-CD1 3.81Å; L288-F317 HydrophobicContact CB-CD2 4.03Å; L288-F317 HydrophobicContact CB-CE1 3.66Å; L288-F317 HydrophobicContact CB-CE2 3.89Å; L288-F317 HydrophobicContact CB-CG 3.99Å; L288-F317 HydrophobicContact CB-CZ 3.71Å; L288-F317 HydrophobicContact CD1-CB 3.95Å; L288-F317 HydrophobicContact CD1-CD1 4.07Å; L288-F317 HydrophobicContact CD1-CD2 4.39Å; L288-F317 HydrophobicContact CD1-CG 3.87Å; L288-F317 HydrophobicContact CD2-CD1 4.27Å; L288-F317 HydrophobicContact CD2-CE1 4.5Å; L288-F317 HydrophobicContact CG-CD1 4.28Å; L288-F317 HydrophobicContact CG-CG 4.46Å; L288-F317 VanDerWaalsContact O-CZ 3.27Å; L288-F317 WeakPolarHBondContact O-CZ 3.44Å
289	C	95.8	Very high	96.2	Very high	54 Å²	54	28.9 Å²	28.9	37%	0.365	17%	0.169	S	C	.	.	H	α-helix	trans	-62.6	-45.6	174.3	-68.3	0	0	0	0	111.9	H285 K286 G287 Q292 S293	H285-C289 PolarHBondContact O-N 3.25Å; H285-C289 PolarHBondContact O-SG 3.36Å; H285-C289 VanDerWaalsContact O-SG 3.38Å; K286-C289 WeakPolarHBondContact O-CB 3.46Å; K286-C289 PolarHBondContact O-N 2.92Å; K286-C289 VanDerWaalsContact O-N 3.16Å; G287-C289 PolarHBondContact O-N 3.02Å; C289-Q292 WeakPolarHBondContact O-CB 3.37Å; C289-Q292 PolarHBondContact O-N 2.87Å; C289-S293 PolarHBondContact O-N 2.96Å
290	V	96.5	Very high	96.4	Very high	11 Å²	11	28.7 Å²	28.7	7%	0.067	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-39.9	176.8	178.9	0	0	0	0	111	L134 E135 L138 K286 G287 Q292 S293 A294	L134-V290 HydrophobicContact CB-CG1 4.1Å; L134-V290 HydrophobicContact CD2-CB 4.35Å; L134-V290 HydrophobicContact CD2-CG1 3.67Å; L134-V290 HydrophobicContact CG-CG1 3.77Å; E135-V290 HydrophobicContact CB-CG2 4.28Å; L138-V290 HydrophobicContact CD1-CG1 4.21Å; K286-V290 WeakPolarHBondContact O-CG2 3.31Å; K286-V290 PolarHBondContact O-N 3.45Å; G287-V290 PolarHBondContact O-N 3.32Å; V290-Q292 VanDerWaalsContact C-N 3.27Å; V290-Q292 PolarHBondContact O-N 3.43Å; V290-S293 PolarHBondContact O-N 3.18Å; V290-S293 PolarHBondContact O-OG 3.24Å; V290-A294 WeakPolarHBondContact O-CB 3.4Å; V290-A294 PolarHBondContact O-N 3.31Å
291	A	97.2	Very high	96.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.1	-40.3	173.8	0	0	0	0	0	111.6	M80 V151 G287 L288 S293 L295 L301	M80-A291 HydrophobicContact SD-CB 4.32Å; V151-A291 HydrophobicContact CB-CB 4.35Å; V151-A291 HydrophobicContact CG1-CB 3.86Å; V151-A291 HydrophobicContact CG2-CB 4.22Å; G287-A291 WeakPolarHBondContact O-CB 3.38Å; G287-A291 PolarHBondContact O-N 2.95Å; L288-A291 PolarHBondContact O-N 2.82Å; A291-S293 PolarHBondContact O-N 3.05Å; A291-L295 VanDerWaalsContact O-CB 3.31Å; A291-L295 WeakPolarHBondContact O-CB 3.1Å; A291-L295 WeakPolarHBondContact O-CD1 3.46Å; A291-L295 VanDerWaalsContact O-CG 3.28Å; A291-L295 WeakPolarHBondContact O-CG 3.4Å; A291-L295 PolarHBondContact O-N 3.39Å; A291-L301 HydrophobicContact CB-CD1 4.14Å
292	Q	96.2	Very high	96.7	Very high	40 Å²	40	27.8 Å²	27.8	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-38.7	177.3	-167.1	-179.8	-78.4	0	0	113.1	L288 C289 V290 F317 Y355 W356 R387	L288-Q292 PolarHBondContact O-N 3.49Å; C289-Q292 WeakPolarHBondContact O-CB 3.37Å; C289-Q292 PolarHBondContact O-N 2.87Å; V290-Q292 VanDerWaalsContact C-N 3.27Å; V290-Q292 PolarHBondContact O-N 3.43Å; Q292-F317 HydrophobicContact CB-CZ 4.19Å; Q292-Y355 HydrophobicContact CG-CG 4.21Å; Q292-W356 HydrophobicContact CB-CH2 4.4Å; Q292-W356 HydrophobicContact CB-CZ2 3.66Å; Q292-W356 HydrophobicContact CG-CZ2 3.77Å; Q292-R387 WeakPolarHBondContact O-CD 3.29Å; Q292-R387 PolarHBondContact O-NE 2.87Å
293	S	95.4	Very high	96.9	Very high	48 Å²	48	26.9 Å²	26.9	34%	0.336	15%	0.154	S	C	.	.	H	α-helix	trans	-81.8	-32.9	179.9	62.2	0	0	0	0	112.7	G146 C289 V290 A291	G146-S293 PolarHBondContact N-O 3.28Å; C289-S293 PolarHBondContact O-N 2.96Å; V290-S293 PolarHBondContact O-N 3.18Å; V290-S293 PolarHBondContact O-OG 3.24Å; A291-S293 PolarHBondContact O-N 3.05Å
294	A	96.9	Very high	97	Very high	3 Å²	3	26.3 Å²	26.3	3%	0.025	15%	0.151	C	C	.	.	H	α-helix	trans	-78.9	-34.3	-177.6	0	0	0	0	0	113.1	L138 G146 S147 I148 V290	L138-A294 HydrophobicContact CD1-CB 4.09Å; G146-A294 CarbonylContact C-O 3.51Å; G146-A294 WeakPolarHBondContact CA-O 3.19Å; G146-A294 PolarHBondContact N-O 2.98Å; S147-A294 PolarHBondContact N-O 2.83Å; S147-A294 VanDerWaalsContact N-O 3.13Å; I148-A294 WeakPolarHBondContact CB-O 3.33Å; I148-A294 HydrophobicContact CD1-CB 3.71Å; I148-A294 HydrophobicContact CG1-CB 4.12Å; I148-A294 PolarHBondContact N-O 3.1Å; V290-A294 WeakPolarHBondContact O-CB 3.4Å; V290-A294 PolarHBondContact O-N 3.31Å
295	L	98.3	Very high	97	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.021	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	133.3	179.1	-79.6	167.8	0	0	0	112.2	I148 V151 A291 L301 W356 R387	I148-L295 HydrophobicContact CG2-CD2 4.4Å; I148-L295 WeakPolarHBondContact O-CA 3.33Å; V151-L295 HydrophobicContact CB-CD1 4.24Å; V151-L295 HydrophobicContact CB-CD2 4.35Å; V151-L295 HydrophobicContact CB-CG 4.38Å; V151-L295 HydrophobicContact CG2-CD1 3.96Å; V151-L295 HydrophobicContact CG2-CD2 3.7Å; V151-L295 HydrophobicContact CG2-CG 3.61Å; A291-L295 VanDerWaalsContact O-CB 3.31Å; A291-L295 WeakPolarHBondContact O-CB 3.1Å; A291-L295 WeakPolarHBondContact O-CD1 3.46Å; A291-L295 VanDerWaalsContact O-CG 3.28Å; A291-L295 WeakPolarHBondContact O-CG 3.4Å; A291-L295 PolarHBondContact O-N 3.39Å; L295-L301 HydrophobicContact CD1-CB 3.89Å; L295-W356 HydrophobicContact CD1-CH2 3.74Å; L295-W356 HydrophobicContact CD1-CZ3 3.84Å; L295-R387 HydrophobicContact CB-CB 3.98Å; L295-R387 HydrophobicContact CB-CG 4.07Å
296	K	97.5	Very high	96.9	Very high	74 Å²	74	26.6 Å²	26.6	32%	0.322	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	158.2	169	75.1	-178	-164.4	178	0	111.3	G146 I148 D149 G298 G299 R387	G146-K296 VanDerWaalsContact O-CA 3.28Å; G146-K296 WeakPolarHBondContact O-CA 3.47Å; G146-K296 WeakPolarHBondContact O-CB 3.49Å; I148-K296 PolarHBondContact O-N 3.45Å; D149-K296 WeakPolarHBondContact OD1-CE 3.25Å; D149-K296 IonicContact OD1-NZ 2.6Å; D149-K296 PolarHBondContact OD1-NZ 3.32Å; K296-G298 PolarHBondContact O-N 2.95Å; K296-G299 WeakPolarHBondContact O-CA 3.42Å; K296-G299 PolarHBondContact O-N 3.01Å; K296-R387 WeakPolarHBondContact O-CB 3.22Å
297	P	96.4	Very high	96.7	Very high	95 Å²	95	23.8 Å²	23.8	62%	0.617	14%	0.14	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-53.4	131.5	167	-25.2	35.2	0	0	0	111.3	G299	P297-G299 PolarHBondContact O-N 3.03Å
298	G	96.1	Very high	96.4	Very high	46 Å²	46	25.7 Å²	25.7	47%	0.474	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	79.1	-4.7	-172.1	0	0	0	0	0	115.2	K296 L386 R387	K296-G298 PolarHBondContact O-N 2.95Å; G298-L386 WeakPolarHBondContact O-CD2 3.26Å; G298-R387 WeakPolarHBondContact CA-O 3.43Å; G298-R387 PolarHBondContact N-O 3Å
299	G	97.6	Very high	96.1	Very high	2 Å²	2	25.8 Å²	25.8	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	153.3	176	0	0	0	0	0	112.7	D149 K296 P297 L386 R387	D149-G299 CarbonylContact O-C 3.48Å; D149-G299 WeakPolarHBondContact O-CA 3.41Å; K296-G299 WeakPolarHBondContact O-CA 3.42Å; K296-G299 PolarHBondContact O-N 3.01Å; P297-G299 PolarHBondContact O-N 3.03Å; G299-L386 CarbonylContact O-C 3.51Å; G299-L386 WeakPolarHBondContact O-CA 3.42Å; G299-R387 PolarHBondContact O-N 3.28Å
300	R	98.1	Very high	96.1	Very high	58 Å²	58	23.3 Å²	23.3	22%	0.219	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.4	-170.3	-72.9	165.9	177.8	-93.6	12.1	112.1	Y68 L69 D70 D149 A150 V151 L386	Y68-R300 WeakPolarHBondContact O-CD 3.41Å; Y68-R300 PolarHBondContact O-NH1 2.8Å; L69-R300 WeakPolarHBondContact O-CD 3.25Å; D70-R300 IonicContact OD2-CZ 3.52Å; D70-R300 IonicContact OD2-NE 3.76Å; D70-R300 IonicContact OD2-NH2 2.85Å; D70-R300 PolarHBondContact OD2-NH2 2.74Å; D149-R300 PolarHBondContact O-N 2.98Å; A150-R300 CarbonylContact C-O 3.57Å; A150-R300 WeakPolarHBondContact CA-O 3.35Å; A150-R300 HydrophobicContact CB-CB 4.43Å; V151-R300 PolarHBondContact N-O 3.43Å; R300-L386 HydrophobicContact CG-CD2 3.37Å
301	L	98.3	Very high	96	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	122	170.2	175.4	62.2	0	0	0	109.4	V151 L153 L288 A291 L295 V303 L318 W356 I384 A385	V151-L301 HydrophobicContact CB-CD1 3.85Å; V151-L301 HydrophobicContact CG1-CD1 3.69Å; L153-L301 HydrophobicContact CD1-CD1 4.41Å; L288-L301 HydrophobicContact CD2-CD2 4.13Å; A291-L301 HydrophobicContact CB-CD1 4.14Å; L295-L301 HydrophobicContact CD1-CB 3.89Å; L301-V303 HydrophobicContact CD1-CG2 3.75Å; L301-V303 HydrophobicContact CD2-CG2 4.01Å; L301-V303 HydrophobicContact CG-CG2 3.73Å; L301-L318 HydrophobicContact CD2-CD2 4.1Å; L301-W356 HydrophobicContact CB-CE3 4.46Å; L301-W356 HydrophobicContact CB-CH2 3.96Å; L301-W356 HydrophobicContact CB-CZ3 3.62Å; L301-W356 HydrophobicContact CD2-CE3 4.42Å; L301-W356 HydrophobicContact CD2-CH2 3.49Å; L301-W356 VanDerWaalsContact CD2-CH2 3.49Å; L301-W356 HydrophobicContact CD2-CZ2 3.88Å; L301-W356 HydrophobicContact CD2-CZ3 3.81Å; L301-W356 HydrophobicContact CG-CH2 4.31Å; L301-W356 HydrophobicContact CG-CZ3 4.36Å; L301-I384 WeakPolarHBondContact O-CA 3.21Å; L301-A385 PolarHBondContact N-O 2.93Å; L301-A385 PolarHBondContact O-N 3.31Å
302	C	98.1	Very high	95.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.4	167.7	-74.7	0	0	0	0	109.9	L69 V151 L152 L153 L382	L69-C302 HydrophobicContact CD2-CB 3.76Å; L69-C302 HydrophobicContact CG-CB 4.07Å; V151-C302 PolarHBondContact O-N 3.05Å; L152-C302 WeakPolarHBondContact CA-O 3.29Å; L152-C302 HydrophobicContact CD1-CB 4.06Å; L153-C302 PolarHBondContact N-O 3.29Å; C302-L382 HydrophobicContact CB-CD1 3.97Å
303	V	98.1	Very high	95.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119.3	177.8	-168	0	0	0	0	110.2	L153 L288 L301 T305 V314 L382 R383	L153-V303 HydrophobicContact CB-CB 4.42Å; L153-V303 HydrophobicContact CB-CG1 3.97Å; L153-V303 HydrophobicContact CB-CG2 4.24Å; L153-V303 HydrophobicContact CD1-CG2 4.45Å; L153-V303 CarbonylContact O-C 3.59Å; L153-V303 VanDerWaalsContact O-CA 3.26Å; L153-V303 WeakPolarHBondContact O-CA 3.45Å; L288-V303 HydrophobicContact CD2-CG2 3.96Å; L301-V303 HydrophobicContact CD1-CG2 3.75Å; L301-V303 HydrophobicContact CD2-CG2 4.01Å; L301-V303 HydrophobicContact CG-CG2 3.73Å; V303-T305 HydrophobicContact CG1-CG2 4.1Å; V303-V314 HydrophobicContact CB-CG1 3.99Å; V303-V314 HydrophobicContact CB-CG2 4.49Å; V303-V314 HydrophobicContact CG1-CG1 4.1Å; V303-V314 HydrophobicContact CG1-CG2 3.7Å; V303-V314 HydrophobicContact CG2-CG1 4.13Å; V303-L382 WeakPolarHBondContact O-CA 3.36Å; V303-R383 PolarHBondContact N-O 3.27Å; V303-R383 PolarHBondContact O-N 3.2Å
304	I	97.9	Very high	95.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.8	171.7	-47.8	172.1	0	0	0	108.1	V60 V65 L153 D154 A155 F306 A380 K381 L382	V60-I304 HydrophobicContact CG1-CG2 4.41Å; V65-I304 HydrophobicContact CG2-CD1 3.68Å; V65-I304 HydrophobicContact CG2-CG1 4.26Å; L153-I304 PolarHBondContact O-N 3.33Å; D154-I304 HydrophobicContact CB-CD1 4.3Å; D154-I304 WeakPolarHBondContact OD1-CB 3.47Å; A155-I304 WeakPolarHBondContact CB-O 3.49Å; A155-I304 PolarHBondContact N-O 3.06Å; I304-F306 HydrophobicContact CG2-CE2 4.19Å; I304-F306 HydrophobicContact CG2-CZ 3.98Å; I304-A380 HydrophobicContact CG2-CB 4.1Å; I304-K381 WeakPolarHBondContact CA-O 3.47Å; I304-L382 HydrophobicContact CG1-CD1 3.85Å
305	T	96.6	Very high	95.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148.1	178.6	56.3	0	0	0	0	109.8	V303 E310 D311 V314 A380 K381	V303-T305 HydrophobicContact CG1-CG2 4.1Å; T305-E310 HydrophobicContact CG2-CB 3.66Å; T305-D311 WeakPolarHBondContact OG1-CB 3.35Å; T305-V314 HydrophobicContact CG2-CG2 3.82Å; T305-A380 CarbonylContact O-C 3.56Å; T305-A380 VanDerWaalsContact O-CA 3.28Å; T305-A380 WeakPolarHBondContact O-CA 3.5Å; T305-K381 PolarHBondContact N-O 3.16Å; T305-K381 PolarHBondContact O-N 3.27Å; T305-K381 WeakPolarHBondContact OG1-CB 3.32Å; T305-K381 PolarHBondContact OG1-O 2.65Å
306	F	92.9	Very high	95.1	Very high	45 Å²	45	29.5 Å²	29.5	20%	0.197	15%	0.153	C	C	.	.			trans	-115.1	-14.9	-174.3	-63.3	-87.4	0	0	0	113.4	V60 D154 G156 I304 E310 S379 A380	V60-F306 HydrophobicContact CB-CE1 4.36Å; V60-F306 HydrophobicContact CB-CZ 4.38Å; V60-F306 HydrophobicContact CG1-CE1 4Å; V60-F306 HydrophobicContact CG1-CZ 4.31Å; V60-F306 HydrophobicContact CG2-CE1 4.13Å; V60-F306 HydrophobicContact CG2-CZ 4.4Å; D154-F306 WeakPolarHBondContact OD1-CE2 3.27Å; D154-F306 WeakPolarHBondContact OD1-CZ 3.39Å; G156-F306 VanDerWaalsContact CA-CE2 3.47Å; I304-F306 HydrophobicContact CG2-CE2 4.19Å; I304-F306 HydrophobicContact CG2-CZ 3.98Å; F306-E310 PolarHBondContact N-OE2 3.29Å; F306-S379 WeakPolarHBondContact O-CB 3.39Å; F306-A380 HydrophobicContact CD1-CB 4.3Å; F306-A380 HydrophobicContact CE1-CB 4.09Å
307	H	91.6	Very high	95	Very high	18 Å²	18	26.7 Å²	26.7	8%	0.083	14%	0.141	C	C	.	.	S	Bend	trans	-135	166.9	174.6	61	75.6	0	0	0	113.8	I275 L309 E310 D311	I275-H307 WeakPolarHBondContact CD1-NE2 3.42Å; H307-L309 VanDerWaalsContact C-N 3.29Å; H307-L309 PolarHBondContact ND1-N 3.18Å; H307-L309 PolarHBondContact O-N 2.7Å; H307-E310 VanDerWaalsContact CD2-CD 3.46Å; H307-E310 IonicContact CD2-OE1 3.24Å; H307-E310 PolarHBondContact CD2-OE1 3.01Å; H307-E310 VanDerWaalsContact CD2-OE1 3.29Å; H307-E310 IonicContact CD2-OE2 2.93Å; H307-E310 VanDerWaalsContact CE1-CD 3.48Å; H307-E310 WeakPolarHBondContact CE1-CG 3.46Å; H307-E310 IonicContact CE1-OE1 3.77Å; H307-E310 IonicContact CG-OE2 3.89Å; H307-E310 PolarHBondContact N-OE2 3.08Å; H307-E310 PolarHBondContact ND1-N 3.21Å; H307-E310 VanDerWaalsContact NE2-CD 3.26Å; H307-E310 IonicContact NE2-OE1 3.65Å; H307-E310 PolarHBondContact NE2-OE1 3.13Å; H307-E310 IonicContact NE2-OE2 2.74Å; H307-D311 PolarHBondContact O-N 3.36Å
308	S	90.9	Very high	94.8	Very high	39 Å²	39	23.2 Å²	23.2	27%	0.273	12%	0.117	S	C	.	.	H	α-helix	trans	-57.8	-38	-175.4	49.7	0	0	0	0	113.3	E213 R312	E213-S308 PolarHBondContact OE2-OG 3.18Å; S308-R312 WeakPolarHBondContact O-CB 3.42Å; S308-R312 PolarHBondContact O-N 2.79Å
309	L	91.7	Very high	94.6	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-66.7	-50.4	-177.3	-56.2	-178.2	0	0	0	112.7	A210 Y211 E213 I275 L281 H307 R312 L313 F331	A210-L309 VanDerWaalsContact O-CD1 3.3Å; A210-L309 WeakPolarHBondContact O-CD1 3.24Å; Y211-L309 VanDerWaalsContact O-CD1 3.3Å; Y211-L309 WeakPolarHBondContact O-CD1 3.27Å; E213-L309 HydrophobicContact CG-CD2 3.96Å; E213-L309 HydrophobicContact CG-CG 4.42Å; E213-L309 WeakPolarHBondContact OE1-CD2 3.38Å; I275-L309 HydrophobicContact CD1-CD1 4.41Å; L281-L309 HydrophobicContact CD1-CB 3.96Å; L281-L309 HydrophobicContact CD1-CD1 4.09Å; L281-L309 HydrophobicContact CD2-CB 4.17Å; H307-L309 VanDerWaalsContact C-N 3.29Å; H307-L309 PolarHBondContact ND1-N 3.18Å; H307-L309 PolarHBondContact O-N 2.7Å; L309-R312 PolarHBondContact O-N 3.48Å; L309-L313 WeakPolarHBondContact O-CB 3.26Å; L309-L313 PolarHBondContact O-N 2.75Å; L309-F331 HydrophobicContact CB-CE1 4.22Å; L309-F331 HydrophobicContact CD1-CD1 4.38Å; L309-F331 HydrophobicContact CD2-CD1 3.8Å; L309-F331 HydrophobicContact CD2-CE1 4.15Å
310	E	94.8	Very high	94.1	Very high	3 Å²	3	28 Å²	28	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-57.2	-53.6	174	-71.5	157.5	179.1	0	0	110.9	A155 R274 L281 L284 T305 F306 H307 R312 L313 V314	A155-E310 HydrophobicContact CB-CG 4.31Å; R274-E310 IonicContact NH2-OE1 2.94Å; L281-E310 HydrophobicContact CD2-CG 4.07Å; L284-E310 HydrophobicContact CD2-CB 3.98Å; L284-E310 HydrophobicContact CD2-CG 3.95Å; T305-E310 HydrophobicContact CG2-CB 3.66Å; F306-E310 PolarHBondContact N-OE2 3.29Å; H307-E310 VanDerWaalsContact CD2-CD 3.46Å; H307-E310 IonicContact CD2-OE1 3.24Å; H307-E310 PolarHBondContact CD2-OE1 3.01Å; H307-E310 VanDerWaalsContact CD2-OE1 3.29Å; H307-E310 IonicContact CD2-OE2 2.93Å; H307-E310 VanDerWaalsContact CE1-CD 3.48Å; H307-E310 WeakPolarHBondContact CE1-CG 3.46Å; H307-E310 IonicContact CE1-OE1 3.77Å; H307-E310 IonicContact CG-OE2 3.89Å; H307-E310 PolarHBondContact N-OE2 3.08Å; H307-E310 PolarHBondContact ND1-N 3.21Å; H307-E310 VanDerWaalsContact NE2-CD 3.26Å; H307-E310 IonicContact NE2-OE1 3.65Å; H307-E310 PolarHBondContact NE2-OE1 3.13Å; H307-E310 IonicContact NE2-OE2 2.74Å; E310-R312 PolarHBondContact O-N 3.24Å; E310-L313 WeakPolarHBondContact O-CA 3.1Å; E310-L313 WeakPolarHBondContact O-CB 3.25Å; E310-L313 PolarHBondContact O-N 2.91Å; E310-V314 WeakPolarHBondContact O-CG2 3.42Å; E310-V314 PolarHBondContact O-N 2.83Å
311	D	94.7	Very high	93.4	Very high	17 Å²	17	29.9 Å²	29.9	9%	0.091	15%	0.149	C	C	.	.	H	α-helix	trans	-58	-38.8	-177.7	178	45.6	0	0	0	111.9	T305 H307 K315 K381 R383	T305-D311 WeakPolarHBondContact OG1-CB 3.35Å; H307-D311 PolarHBondContact O-N 3.36Å; D311-K315 WeakPolarHBondContact O-CB 3.36Å; D311-K315 PolarHBondContact O-N 3.14Å; D311-K381 HydrophobicContact CB-CD 3.95Å; D311-K381 VanDerWaalsContact CG-CD 3.43Å; D311-K381 VanDerWaalsContact OD2-CD 3.29Å; D311-K381 WeakPolarHBondContact OD2-CD 3.4Å; D311-K381 IonicContact OD2-NZ 3.79Å; D311-K381 PolarHBondContact OD2-NZ 3.4Å; D311-R383 IonicContact OD1-CZ 2.78Å; D311-R383 IonicContact OD1-NE 3.17Å; D311-R383 PolarHBondContact OD1-NE 2.74Å; D311-R383 IonicContact OD1-NH2 3.56Å; D311-R383 PolarHBondContact OD1-NH2 2.85Å; D311-R383 IonicContact OD2-NH2 2.75Å
312	R	92.7	Very high	92.6	Very high	57 Å²	57	35.8 Å²	35.8	22%	0.215	18%	0.18	C	C	.	.	H	α-helix	trans	-67.3	-41.3	176.6	-171.4	-171.7	-55.6	134.8	6.6	111.5	E213 S308 L309 E310 R316 H330	E213-R312 IonicContact OE1-CZ 3.63Å; E213-R312 IonicContact OE1-NH1 3.72Å; E213-R312 IonicContact OE1-NH2 2.72Å; E213-R312 PolarHBondContact OE1-NH2 2.94Å; S308-R312 WeakPolarHBondContact O-CB 3.42Å; S308-R312 PolarHBondContact O-N 2.79Å; L309-R312 PolarHBondContact O-N 3.48Å; E310-R312 PolarHBondContact O-N 3.24Å; R312-R316 WeakPolarHBondContact O-CB 3.39Å; R312-R316 WeakPolarHBondContact O-CG 3.43Å; R312-R316 PolarHBondContact O-N 3.18Å; R312-R316 VanDerWaalsContact O-N 3.09Å; R312-H330 PolarHBondContact NH1-O 3.2Å
313	L	93.4	Very high	91.9	Very high	7 Å²	7	36 Å²	36	4%	0.037	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-53.8	176.9	-174.7	160	0	0	0	110.3	L281 L284 H285 L288 L309 E310 K315 R316 F317 L323 L326	L281-L313 HydrophobicContact CB-CD1 4.1Å; L281-L313 HydrophobicContact CD2-CD1 4.4Å; L281-L313 WeakPolarHBondContact O-CD1 3.46Å; L284-L313 HydrophobicContact CD2-CD2 4.21Å; L284-L313 HydrophobicContact CG-CD2 4.15Å; H285-L313 HydrophobicContact CB-CD1 4.34Å; H285-L313 HydrophobicContact CB-CD2 4.29Å; L288-L313 HydrophobicContact CD1-CD2 3.44Å; L288-L313 VanDerWaalsContact CD1-CD2 3.44Å; L309-L313 WeakPolarHBondContact O-CB 3.26Å; L309-L313 PolarHBondContact O-N 2.75Å; E310-L313 WeakPolarHBondContact O-CA 3.1Å; E310-L313 WeakPolarHBondContact O-CB 3.25Å; E310-L313 PolarHBondContact O-N 2.91Å; L313-K315 VanDerWaalsContact C-N 3.34Å; L313-K315 PolarHBondContact O-N 3.01Å; L313-R316 PolarHBondContact O-N 2.95Å; L313-F317 WeakPolarHBondContact O-CB 3.42Å; L313-F317 PolarHBondContact O-N 2.85Å; L313-L323 HydrophobicContact CG-CD1 4.49Å; L313-L326 HydrophobicContact CD1-CD1 4.37Å; L313-L326 HydrophobicContact CD1-CD2 3.46Å; L313-L326 VanDerWaalsContact CD1-CD2 3.46Å; L313-L326 HydrophobicContact CG-CD2 4.08Å
314	V	95.1	Very high	90.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.1	-45.2	179	179.2	0	0	0	0	110.9	L284 L288 V303 T305 E310 R316 F317 L318 R383	L284-V314 HydrophobicContact CD2-CG2 4.11Å; L288-V314 HydrophobicContact CD1-CG2 4.11Å; V303-V314 HydrophobicContact CB-CG1 3.99Å; V303-V314 HydrophobicContact CB-CG2 4.49Å; V303-V314 HydrophobicContact CG1-CG1 4.1Å; V303-V314 HydrophobicContact CG1-CG2 3.7Å; V303-V314 HydrophobicContact CG2-CG1 4.13Å; T305-V314 HydrophobicContact CG2-CG2 3.82Å; E310-V314 WeakPolarHBondContact O-CG2 3.42Å; E310-V314 PolarHBondContact O-N 2.83Å; V314-R316 PolarHBondContact O-N 2.94Å; V314-F317 PolarHBondContact O-N 3.18Å; V314-L318 HydrophobicContact CG1-CD1 4.02Å; V314-L318 HydrophobicContact CG1-CG 4.35Å; V314-L318 WeakPolarHBondContact O-CG 3.27Å; V314-L318 PolarHBondContact O-N 2.82Å; V314-R383 HydrophobicContact CG1-CB 4.26Å
315	K	93.4	Very high	89.1	Confident	94 Å²	94	43 Å²	43	41%	0.409	23%	0.225	S	C	.	.	H	α-helix	trans	-56.6	-48.9	177.3	-176.9	-176.7	171.8	-175.3	0	111.8	D311 L313 L318 Q319	D311-K315 WeakPolarHBondContact O-CB 3.36Å; D311-K315 PolarHBondContact O-N 3.14Å; L313-K315 VanDerWaalsContact C-N 3.34Å; L313-K315 PolarHBondContact O-N 3.01Å; K315-L318 PolarHBondContact O-N 2.85Å; K315-Q319 VanDerWaalsContact O-CG 3.24Å; K315-Q319 WeakPolarHBondContact O-CG 3.41Å; K315-Q319 PolarHBondContact O-N 2.85Å; K315-Q319 VanDerWaalsContact O-N 3.15Å
316	R	92.2	Very high	87.8	Confident	60 Å²	60	43.2 Å²	43.2	23%	0.226	23%	0.226	C	C	.	.	H	α-helix	trans	-66.9	-38.9	-178.6	-76.1	177.2	173.5	156.4	-1.1	111.7	R312 L313 V314 Q319 G320 H321 L323 H330	R312-R316 WeakPolarHBondContact O-CB 3.39Å; R312-R316 WeakPolarHBondContact O-CG 3.43Å; R312-R316 PolarHBondContact O-N 3.18Å; R312-R316 VanDerWaalsContact O-N 3.09Å; L313-R316 PolarHBondContact O-N 2.95Å; V314-R316 PolarHBondContact O-N 2.94Å; R316-Q319 CarbonylContact O-C 3.48Å; R316-Q319 PolarHBondContact O-N 2.93Å; R316-G320 PolarHBondContact O-N 2.82Å; R316-H321 HydrophobicContact CB-CB 4.06Å; R316-H321 WeakPolarHBondContact O-CB 3.32Å; R316-H321 PolarHBondContact O-N 2.77Å; R316-H321 VanDerWaalsContact O-N 3.08Å; R316-L323 HydrophobicContact CB-CD2 3.96Å; R316-H330 VanDerWaalsContact NH1-CG 3.25Å; R316-H330 PolarHBondContact NH1-ND1 2.84Å
317	F	93.4	Very high	86.1	Confident	15 Å²	15	43.8 Å²	43.8	7%	0.066	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-50.8	175.2	-178.4	-94	0	0	0	111.2	L288 Q292 L313 V314 Q319 G320 L323 W356	L288-F317 VanDerWaalsContact C-CZ 3.46Å; L288-F317 HydrophobicContact CB-CD1 3.81Å; L288-F317 HydrophobicContact CB-CD2 4.03Å; L288-F317 HydrophobicContact CB-CE1 3.66Å; L288-F317 HydrophobicContact CB-CE2 3.89Å; L288-F317 HydrophobicContact CB-CG 3.99Å; L288-F317 HydrophobicContact CB-CZ 3.71Å; L288-F317 HydrophobicContact CD1-CB 3.95Å; L288-F317 HydrophobicContact CD1-CD1 4.07Å; L288-F317 HydrophobicContact CD1-CD2 4.39Å; L288-F317 HydrophobicContact CD1-CG 3.87Å; L288-F317 HydrophobicContact CD2-CD1 4.27Å; L288-F317 HydrophobicContact CD2-CE1 4.5Å; L288-F317 HydrophobicContact CG-CD1 4.28Å; L288-F317 HydrophobicContact CG-CG 4.46Å; L288-F317 VanDerWaalsContact O-CZ 3.27Å; L288-F317 WeakPolarHBondContact O-CZ 3.44Å; Q292-F317 HydrophobicContact CB-CZ 4.19Å; L313-F317 WeakPolarHBondContact O-CB 3.42Å; L313-F317 PolarHBondContact O-N 2.85Å; V314-F317 PolarHBondContact O-N 3.18Å; F317-Q319 PolarHBondContact O-N 2.99Å; F317-G320 PolarHBondContact O-N 2.98Å; F317-L323 HydrophobicContact CB-CD1 3.69Å; F317-L323 HydrophobicContact CD2-CD1 4.12Å; F317-L323 HydrophobicContact CG-CD1 4.42Å; F317-W356 AromaticContact CD1-NE1 3.88Å; F317-W356 AromaticContact CE1-CE2 3.74Å; F317-W356 AromaticContact CE1-CZ2 3.76Å; F317-W356 HydrophobicContact CE1-CZ2 3.76Å; F317-W356 AromaticContact CE1-NE1 3.3Å; F317-W356 VanDerWaalsContact CE1-NE1 3.3Å; F317-W356 HydrophobicContact CZ-CZ2 4.47Å
318	L	93.3	Very high	84.3	Confident	23 Å²	23	50.1 Å²	50.1	12%	0.12	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-21.2	177.8	-65.1	178.1	0	0	0	113.5	L301 V314 K315 G320 S354 W356 R383 A385	L301-L318 HydrophobicContact CD2-CD2 4.1Å; V314-L318 HydrophobicContact CG1-CD1 4.02Å; V314-L318 HydrophobicContact CG1-CG 4.35Å; V314-L318 WeakPolarHBondContact O-CG 3.27Å; V314-L318 PolarHBondContact O-N 2.82Å; K315-L318 PolarHBondContact O-N 2.85Å; L318-G320 VanDerWaalsContact C-N 3.33Å; L318-S354 PolarHBondContact O-OG 2.99Å; L318-W356 HydrophobicContact CD2-CB 4.13Å; L318-W356 HydrophobicContact CD2-CD2 3.69Å; L318-W356 HydrophobicContact CD2-CE3 4.25Å; L318-W356 HydrophobicContact CD2-CG 3.59Å; L318-R383 HydrophobicContact CD1-CB 4.12Å; L318-A385 HydrophobicContact CD1-CB 4.3Å; L318-A385 HydrophobicContact CD2-CB 3.73Å
319	Q	91	Very high	82.2	Confident	107 Å²	107	55.7 Å²	55.7	50%	0.5	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-1.9	173.8	-71.3	177.7	-37.7	0	0	113.2	K315 R316 F317	K315-Q319 VanDerWaalsContact O-CG 3.24Å; K315-Q319 WeakPolarHBondContact O-CG 3.41Å; K315-Q319 PolarHBondContact O-N 2.85Å; K315-Q319 VanDerWaalsContact O-N 3.15Å; R316-Q319 CarbonylContact O-C 3.48Å; R316-Q319 PolarHBondContact O-N 2.93Å; F317-Q319 PolarHBondContact O-N 2.99Å
320	G	87.3	Confident	80.3	Confident	41 Å²	41	56.9 Å²	56.9	42%	0.423	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	22.8	179	0	0	0	0	0	114.3	R316 F317 L318	R316-G320 PolarHBondContact O-N 2.82Å; F317-G320 PolarHBondContact O-N 2.98Å; L318-G320 VanDerWaalsContact C-N 3.33Å
321	H	85	Confident	78.3	Confident	97 Å²	97	57.8 Å²	57.8	45%	0.449	28%	0.28	S	S	.	.			trans	-67.1	145	173.3	-74.2	-125.6	0	0	0	110.3	R316 L323	R316-H321 HydrophobicContact CB-CB 4.06Å; R316-H321 WeakPolarHBondContact O-CB 3.32Å; R316-H321 PolarHBondContact O-N 2.77Å; R316-H321 VanDerWaalsContact O-N 3.08Å; H321-L323 HydrophobicContact CB-CD2 4.3Å; H321-L323 PolarHBondContact O-N 3.2Å
322	D	81.3	Confident	76	Confident	125 Å²	125	60.9 Å²	60.9	67%	0.668	30%	0.303	S	S	*	.			trans	-70.2	115.4	167.9	-179.8	6.3	0	0	0	109.6	S324	D322-S324 WeakPolarHBondContact OD1-CB 3.34Å; D322-S324 PolarHBondContact OD1-N 2.72Å; D322-S324 PolarHBondContact OD1-OG 3.23Å; D322-S324 PolarHBondContact OD2-OG 3.41Å
323	L	82.4	Confident	73.7	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.026	32%	0.32	C	S	.	.			trans	-110.3	11.8	-179.2	-62.1	-175.1	0	0	0	112.6	H285 L313 R316 F317 H321 N325 L326 H330	H285-L323 WeakPolarHBondContact NE2-CB 3.45Å; L313-L323 HydrophobicContact CG-CD1 4.49Å; R316-L323 HydrophobicContact CB-CD2 3.96Å; F317-L323 HydrophobicContact CB-CD1 3.69Å; F317-L323 HydrophobicContact CD2-CD1 4.12Å; F317-L323 HydrophobicContact CG-CD1 4.42Å; H321-L323 HydrophobicContact CB-CD2 4.3Å; H321-L323 PolarHBondContact O-N 3.2Å; L323-N325 PolarHBondContact O-N 3.03Å; L323-L326 PolarHBondContact O-N 2.92Å; L323-H330 WeakPolarHBondContact CD2-NE2 3.28Å
324	S	69.8	Low	71.1	Confident	74 Å²	74	70.5 Å²	70.5	52%	0.517	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-19.8	179.8	58.7	0	0	0	0	114.2	D322	D322-S324 WeakPolarHBondContact OD1-CB 3.34Å; D322-S324 PolarHBondContact OD1-N 2.72Å; D322-S324 PolarHBondContact OD1-OG 3.23Å; D322-S324 PolarHBondContact OD2-OG 3.41Å
325	N	67.7	Low	68.6	Low	73 Å²	73	78.9 Å²	78.9	39%	0.39	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	56.1	-177.2	-70.3	-79.6	0	0	0	112.5	L323 D327 R328 Y329	L323-N325 PolarHBondContact O-N 3.03Å; N325-D327 VanDerWaalsContact C-N 3.29Å; N325-D327 PolarHBondContact O-N 2.91Å; N325-R328 HydrophobicContact CB-CB 4.42Å; N325-R328 PolarHBondContact O-N 3.42Å; N325-R328 VanDerWaalsContact O-N 3.15Å; N325-Y329 HydrophobicContact CB-CD2 3.88Å; N325-Y329 HydrophobicContact CB-CE2 4.13Å; N325-Y329 PolarHBondContact O-N 3.49Å
326	L	69	Low	66	Low	5 Å²	5	83.7 Å²	83.7	3%	0.026	42%	0.415	C	S	.	.	H	α-helix	trans	-47.9	-45.4	-179.1	-95.5	140.2	0	0	0	113.9	H285 L313 L323 R328 H330 F331	H285-L326 HydrophobicContact CB-CD1 3.61Å; L313-L326 HydrophobicContact CD1-CD1 4.37Å; L313-L326 HydrophobicContact CD1-CD2 3.46Å; L313-L326 VanDerWaalsContact CD1-CD2 3.46Å; L313-L326 HydrophobicContact CG-CD2 4.08Å; L323-L326 PolarHBondContact O-N 2.92Å; L326-R328 VanDerWaalsContact C-N 3.33Å; L326-R328 PolarHBondContact O-N 3.33Å; L326-H330 PolarHBondContact O-N 3.48Å; L326-F331 HydrophobicContact CB-CE2 4.26Å; L326-F331 HydrophobicContact CD2-CE2 3.94Å; L326-F331 HydrophobicContact CD2-CZ 3.69Å
327	D	58	Low	63.3	Low	58 Å²	58	84.3 Å²	84.3	31%	0.31	44%	0.44	S	S	.	.	H	α-helix	trans	-68.5	-30.3	-175.8	-57	-43.7	0	0	0	114	I9 N325	I9-D327 WeakPolarHBondContact CD1-OD2 3.41Å; I9-D327 WeakPolarHBondContact CG1-OD2 3.49Å; I9-D327 WeakPolarHBondContact CG2-OD2 3.02Å; N325-D327 VanDerWaalsContact C-N 3.29Å; N325-D327 PolarHBondContact O-N 2.91Å
328	R	53.7	Low	60.5	Low	151 Å²	151	88.8 Å²	88.8	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-86	-27.5	-171.5	-162.7	-179.6	-73.6	-176.7	0.6	112.3	T12 N325 L326	T12-R328 VanDerWaalsContact CG2-NH2 3.29Å; N325-R328 HydrophobicContact CB-CB 4.42Å; N325-R328 PolarHBondContact O-N 3.42Å; N325-R328 VanDerWaalsContact O-N 3.15Å; L326-R328 VanDerWaalsContact C-N 3.33Å; L326-R328 PolarHBondContact O-N 3.33Å
329	Y	46.3	Very low	57.7	Low	156 Å²	156	97.4 Å²	97.4	61%	0.612	50%	0.504	S	S	*	.	H	α-helix	trans	-123.4	-13.6	-166.3	-69	-79.1	0	0	0	116.1	N325	N325-Y329 HydrophobicContact CB-CD2 3.88Å; N325-Y329 HydrophobicContact CB-CE2 4.13Å; N325-Y329 PolarHBondContact O-N 3.49Å
330	H	51.7	Low	55	Low	27 Å²	27	102.7 Å²	102.7	13%	0.125	53%	0.525	C	S	.	.	S	Bend	trans	-118.5	-14.2	-162.7	-64.8	-31.6	0	0	0	117.4	R312 R316 L323 L326	R312-H330 PolarHBondContact NH1-O 3.2Å; R316-H330 VanDerWaalsContact NH1-CG 3.25Å; R316-H330 PolarHBondContact NH1-ND1 2.84Å; L323-H330 WeakPolarHBondContact CD2-NE2 3.28Å; L326-H330 PolarHBondContact O-N 3.48Å
331	F	53.2	Low	52.4	Low	22 Å²	22	108.9 Å²	108.9	10%	0.096	54%	0.541	C	S	.	.	S	Bend	trans	-112.2	-1.1	-177.2	-54.1	-60.8	0	0	0	114.9	A210 L281 L309 L326 Q333	A210-F331 HydrophobicContact CB-CB 4.25Å; L281-F331 HydrophobicContact CB-CZ 4.22Å; L281-F331 HydrophobicContact CD1-CD1 4.25Å; L281-F331 HydrophobicContact CD1-CE1 3.36Å; L281-F331 HydrophobicContact CD1-CE2 4.19Å; L281-F331 HydrophobicContact CD1-CZ 3.32Å; L281-F331 HydrophobicContact CG-CZ 4.34Å; L309-F331 HydrophobicContact CB-CE1 4.22Å; L309-F331 HydrophobicContact CD1-CD1 4.38Å; L309-F331 HydrophobicContact CD2-CD1 3.8Å; L309-F331 HydrophobicContact CD2-CE1 4.15Å; L326-F331 HydrophobicContact CB-CE2 4.26Å; L326-F331 HydrophobicContact CD2-CE2 3.94Å; L326-F331 HydrophobicContact CD2-CZ 3.69Å; F331-Q333 PolarHBondContact O-N 3.48Å
332	S	46	Very low	49.9	Very low	82 Å²	82	114.1 Å²	114.1	57%	0.573	56%	0.562	S	S	*	*			trans	-83	104.8	169.9	-172.8	0	0	0	0	110.5	N334	S332-N334 PolarHBondContact O-N 3.11Å; S332-N334 VanDerWaalsContact O-N 3.13Å
333	Q	44.4	Very low	47.6	Very low	124 Å²	124	116.1 Å²	116.1	58%	0.579	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-5.9	171.4	-78	-91.2	-4.5	0	0	113.5	E213 F331	E213-Q333 PolarHBondContact OE1-NE2 3Å; F331-Q333 PolarHBondContact O-N 3.48Å
334	N	39.1	Very low	45.1	Very low	142 Å²	142	121.5 Å²	121.5	76%	0.759	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.4	31.1	-163	-99.1	1.9	0	0	0	116.8	S332	S332-N334 PolarHBondContact O-N 3.11Å; S332-N334 VanDerWaalsContact O-N 3.13Å
335	K	42.3	Very low	43.4	Very low	175 Å²	175	124.6 Å²	124.6	76%	0.761	62%	0.615	S	S	*	*	S	Bend	trans	-123.2	25.4	169.2	-96	-173.8	-178.1	174.5	0	115.5
336	Q	39.4	Very low	41.7	Very low	195 Å²	195	129.5 Å²	129.5	91%	0.911	64%	0.636	S	S	*	*	S	Bend	trans	-99.8	-4	164	-87	177.8	-16	0	0	113.9
337	G	35.6	Very low	40.1	Very low	73 Å²	73	134.3 Å²	134.3	75%	0.753	67%	0.67	S	S	*	*	S	Bend	trans	-99.3	-17.6	-174.4	0	0	0	0	0	117.8
338	S	33.9	Very low	39.2	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	69%	0.685	S	S	*	*	S	Bend	trans	-159.6	55.4	-169.8	36.7	0	0	0	0	114.1
339	R	34.9	Very low	38.6	Very low	205 Å²	205	137.2 Å²	137.2	77%	0.774	70%	0.698	S	S	*	*			trans	-158.4	74.9	151.2	-112.6	174.5	-169.1	174.4	4.5	109	K341	R339-K341 PolarHBondContact O-N 3.42Å
340	K	34.6	Very low	38.1	Very low	218 Å²	218	140.7 Å²	140.7	95%	0.948	71%	0.71	S	S	*	*			trans	-70.4	60.6	156.5	-152.5	178.5	-170.3	-179.8	0	107.7
341	K	31.8	Very low	37.8	Very low	171 Å²	171	147.7 Å²	147.7	74%	0.743	75%	0.749	S	S	*	*			trans	-87.6	107.8	164.5	-127.3	-177.5	-178.3	-172.8	0	103.9	R339 L343	R339-K341 PolarHBondContact O-N 3.42Å; K341-L343 VanDerWaalsContact C-N 3.27Å; K341-L343 PolarHBondContact O-N 3.4Å
342	K	32.3	Very low	37.6	Very low	206 Å²	206	155.5 Å²	155.5	90%	0.896	78%	0.782	S	S	*	*			trans	-44	96.7	164.5	-83.5	177	169.2	-179	0	107.6
343	L	33.1	Very low	37.8	Very low	167 Å²	167	155.4 Å²	155.4	87%	0.874	78%	0.782	S	S	*	*			trans	-89.7	121.3	150.1	-86.6	162.5	0	0	0	103.4	K341 D345	K341-L343 VanDerWaalsContact C-N 3.27Å; K341-L343 PolarHBondContact O-N 3.4Å; L343-D345 PolarHBondContact O-N 2.99Å
344	V	31.4	Very low	39.2	Very low	118 Å²	118	150.5 Å²	150.5	72%	0.715	76%	0.761	S	S	*	*			trans	-50.3	136	-174.9	179.3	0	0	0	0	109.3	E346	V344-E346 HydrophobicContact CG1-CG 4.17Å; V344-E346 PolarHBondContact O-N 3.45Å
345	D	32.8	Very low	41.6	Very low	139 Å²	139	149.6 Å²	149.6	74%	0.743	75%	0.748	S	S	*	*			trans	-65.2	82.5	172.3	-157.3	3.3	0	0	0	108.2	L343	L343-D345 PolarHBondContact O-N 2.99Å
346	E	32.8	Very low	44	Very low	177 Å²	177	141.4 Å²	141.4	83%	0.827	71%	0.712	S	S	*	*			trans	-125.2	60.5	170.1	-83.8	-171.1	175.3	0	0	109.2	V344	V344-E346 HydrophobicContact CG1-CG 4.17Å; V344-E346 PolarHBondContact O-N 3.45Å
347	S	35.5	Very low	46.6	Very low	106 Å²	106	137 Å²	137	74%	0.741	69%	0.691	S	S	*	*			trans	-169.1	49.1	146.1	67.4	0	0	0	0	111.2
348	S	39.2	Very low	49.2	Very low	89 Å²	89	137.5 Å²	137.5	62%	0.622	68%	0.68	S	S	*	*	S	Bend	trans	-64.2	127.5	138	47.8	0	0	0	0	106.6
349	E	40.2	Very low	51.9	Low	180 Å²	180	135 Å²	135	84%	0.841	66%	0.661	S	S	*	*			trans	84.9	93.6	-176.7	-52.8	-175	172.7	0	0	116.5
350	R	35.8	Very low	54.4	Low	230 Å²	230	130 Å²	130	87%	0.868	64%	0.644	S	S	*	*				-164	117.9	116	-98.9	165.7	-145.9	-141.3	6.3	109.1	K352	R350-K352 PolarHBondContact O-N 3.4Å
351	N	46.5	Very low	56.6	Low	174 Å²	174	131.3 Å²	131.3	93%	0.93	64%	0.643	S	S	*	*			trans	-16.7	111.1	158.9	-86.3	-30.4	0	0	0	113
352	K	49.3	Very low	59.2	Low	185 Å²	185	131.4 Å²	131.4	80%	0.804	64%	0.643	S	S	*	*			trans	-122.6	94.8	165.2	-77.6	-177.9	-179.4	178.5	0	107.8	R350 S354	R350-K352 PolarHBondContact O-N 3.4Å; K352-S354 VanDerWaalsContact C-N 3.28Å; K352-S354 PolarHBondContact O-N 2.92Å
353	S	49.7	Very low	62	Low	80 Å²	80	123.9 Å²	123.9	56%	0.559	62%	0.615	S	S	*	*			trans	-47.9	100.4	161.2	-178.3	0	0	0	0	107.1	Y355 R388	S353-Y355 PolarHBondContact O-N 3.06Å; S353-R388 PolarHBondContact OG-NH1 2.83Å
354	S	72.7	Confident	65	Low	22 Å²	22	116.6 Å²	116.6	15%	0.154	58%	0.577	C	S	.	*			trans	-56.9	127.9	168.3	176.8	0	0	0	0	105.4	L318 K352 W356 R388	L318-S354 PolarHBondContact O-OG 2.99Å; K352-S354 VanDerWaalsContact C-N 3.28Å; K352-S354 PolarHBondContact O-N 2.92Å; S354-W356 PolarHBondContact O-N 3.39Å; S354-W356 PolarHBondContact OG-N 3.29Å; S354-W356 PolarHBondContact OG-O 3.31Å; S354-R388 WeakPolarHBondContact O-CD 3.44Å; S354-R388 WeakPolarHBondContact O-CG 3.46Å; S354-R388 VanDerWaalsContact O-CZ 3.27Å; S354-R388 PolarHBondContact O-NE 3.34Å; S354-R388 PolarHBondContact O-NH1 3.03Å
355	Y	89.1	Confident	67.9	Low	123 Å²	123	113.1 Å²	113.1	48%	0.482	56%	0.558	S	S	.	*	S	Bend	trans	-58.6	-3	174.5	-67.5	-81.4	0	0	0	112.9	Q292 S353 R387 R388	Q292-Y355 HydrophobicContact CG-CG 4.21Å; S353-Y355 PolarHBondContact O-N 3.06Å; Y355-R387 PolarHBondContact O-NH1 2.94Å; Y355-R388 PolarHBondContact O-N 3.05Å
356	W	93.9	Very high	70.6	Confident	3 Å²	3	107.5 Å²	107.5	1%	0.011	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.2	-172.3	-57.2	104.5	0	0	0	113	Q292 L295 L301 F317 L318 S354 A385 L386 R387	Q292-W356 HydrophobicContact CB-CH2 4.4Å; Q292-W356 HydrophobicContact CB-CZ2 3.66Å; Q292-W356 HydrophobicContact CG-CZ2 3.77Å; L295-W356 HydrophobicContact CD1-CH2 3.74Å; L295-W356 HydrophobicContact CD1-CZ3 3.84Å; L301-W356 HydrophobicContact CB-CE3 4.46Å; L301-W356 HydrophobicContact CB-CH2 3.96Å; L301-W356 HydrophobicContact CB-CZ3 3.62Å; L301-W356 HydrophobicContact CD2-CE3 4.42Å; L301-W356 HydrophobicContact CD2-CH2 3.49Å; L301-W356 VanDerWaalsContact CD2-CH2 3.49Å; L301-W356 HydrophobicContact CD2-CZ2 3.88Å; L301-W356 HydrophobicContact CD2-CZ3 3.81Å; L301-W356 HydrophobicContact CG-CH2 4.31Å; L301-W356 HydrophobicContact CG-CZ3 4.36Å; F317-W356 AromaticContact CD1-NE1 3.88Å; F317-W356 AromaticContact CE1-CE2 3.74Å; F317-W356 AromaticContact CE1-CZ2 3.76Å; F317-W356 HydrophobicContact CE1-CZ2 3.76Å; F317-W356 AromaticContact CE1-NE1 3.3Å; F317-W356 VanDerWaalsContact CE1-NE1 3.3Å; F317-W356 HydrophobicContact CZ-CZ2 4.47Å; L318-W356 HydrophobicContact CD2-CB 4.13Å; L318-W356 HydrophobicContact CD2-CD2 3.69Å; L318-W356 HydrophobicContact CD2-CE3 4.25Å; L318-W356 HydrophobicContact CD2-CG 3.59Å; S354-W356 PolarHBondContact O-N 3.39Å; S354-W356 PolarHBondContact OG-N 3.29Å; S354-W356 PolarHBondContact OG-O 3.31Å; W356-A385 HydrophobicContact CB-CB 4.09Å; W356-A385 HydrophobicContact CD2-CB 4.25Å; W356-A385 HydrophobicContact CE3-CB 3.72Å; W356-A385 HydrophobicContact CG-CB 4.43Å; W356-L386 CarbonylContact C-O 3.48Å; W356-L386 VanDerWaalsContact CA-O 3.28Å; W356-L386 WeakPolarHBondContact CA-O 3.24Å; W356-R387 HydrophobicContact CZ3-CB 4.16Å
357	F	93.1	Very high	73.2	Confident	103 Å²	103	105.6 Å²	105.6	45%	0.452	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	113.9	158.9	-72.5	-69.4	0	0	0	109.2	V359 A385 L386 R388	F357-V359 PolarHBondContact O-N 3.15Å; F357-A385 CarbonylContact O-C 3.24Å; F357-A385 WeakPolarHBondContact O-CA 3.32Å; F357-L386 HydrophobicContact CB-CB 4.26Å; F357-L386 PolarHBondContact N-O 3.34Å; F357-L386 PolarHBondContact O-N 2.81Å; F357-R388 HydrophobicContact CD2-CB 4.45Å; F357-R388 HydrophobicContact CD2-CG 3.46Å; F357-R388 VanDerWaalsContact CD2-CG 3.46Å; F357-R388 VanDerWaalsContact CE1-CZ 3.41Å; F357-R388 HydrophobicContact CE2-CB 4.2Å; F357-R388 HydrophobicContact CE2-CG 3.39Å; F357-R388 VanDerWaalsContact CE2-NE 3.34Å; F357-R388 HydrophobicContact CG-CG 4.16Å; F357-R388 VanDerWaalsContact CZ-CD 3.47Å; F357-R388 HydrophobicContact CZ-CG 4.06Å
358	P	91.4	Very high	75.5	Confident	82 Å²	82	108.7 Å²	108.7	53%	0.532	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	122.6	177.5	27.2	-32.7	0	0	0	109.9	K360	P358-K360 PolarHBondContact O-N 3.41Å
359	V	89.4	Confident	77.6	Confident	58 Å²	58	108.7 Å²	108.7	35%	0.352	51%	0.513	S	S	.	.	S	Bend	trans	-66.1	-34.9	176.5	176.6	0	0	0	0	110.2	Y68 F357 I384 L386	Y68-V359 HydrophobicContact CD1-CG1 4.25Å; F357-V359 PolarHBondContact O-N 3.15Å; V359-I384 HydrophobicContact CB-CB 4.08Å; V359-I384 HydrophobicContact CB-CG2 3.82Å; V359-I384 HydrophobicContact CG1-CG2 4.39Å; V359-I384 HydrophobicContact CG2-CB 4.39Å; V359-I384 HydrophobicContact CG2-CG2 3.67Å; V359-I384 PolarHBondContact N-O 2.89Å; V359-L386 HydrophobicContact CG2-CD1 4.15Å; V359-L386 HydrophobicContact CG2-CD2 4.45Å; V359-L386 HydrophobicContact CG2-CG 3.76Å
360	K	87.9	Confident	79.7	Confident	100 Å²	100	101.6 Å²	101.6	44%	0.435	48%	0.481	S	S	.	.			trans	-131.1	132	175.4	-143.7	-178.3	-169.6	169.7	0	110.4	Y68 P358 V364	Y68-K360 PolarHBondContact OH-NZ 2.81Å; P358-K360 PolarHBondContact O-N 3.41Å; K360-V364 HydrophobicContact CD-CG2 3.63Å
361	R	80.5	Confident	82	Confident	245 Å²	245	91.1 Å²	91.1	93%	0.925	44%	0.443	S	S	*	.	S	Bend	trans	-66.3	-39	176.6	-71.9	-176.5	176.8	169.2	-0.5	112.3
362	K	86.4	Confident	83.8	Confident	172 Å²	172	91.6 Å²	91.6	75%	0.748	43%	0.431	S	S	*	.	S	Bend	trans	-94.8	142.1	177.8	-68	-176.1	-179.9	177.7	0	109.8
363	V	92.4	Very high	85.4	Confident	48 Å²	48	89 Å²	89	29%	0.291	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-60.2	141.2	171.6	66.9	0	0	0	0	109.8	K381 L382 R383	V363-K381 HydrophobicContact CG2-CB 3.61Å; V363-K381 HydrophobicContact CG2-CD 4.33Å; V363-K381 HydrophobicContact CG2-CG 3.97Å; V363-L382 WeakPolarHBondContact CG2-O 3.42Å; V363-R383 HydrophobicContact CG2-CG 4.09Å
364	V	94.4	Very high	87.1	Confident	14 Å²	14	86.2 Å²	86.2	9%	0.085	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-87.3	137.2	174.2	-173.6	0	0	0	0	107.9	M61 E64 Y68 K360 K381 L382 I384	M61-V364 HydrophobicContact CE-CB 4.1Å; M61-V364 HydrophobicContact CE-CG1 3.66Å; E64-V364 HydrophobicContact CG-CG1 4.28Å; Y68-V364 HydrophobicContact CE2-CG1 4.41Å; Y68-V364 HydrophobicContact CE2-CG2 3.95Å; K360-V364 HydrophobicContact CD-CG2 3.63Å; V364-K381 WeakPolarHBondContact O-CA 3.04Å; V364-L382 HydrophobicContact CB-CB 4.18Å; V364-L382 PolarHBondContact N-O 2.93Å; V364-L382 PolarHBondContact O-N 2.69Å; V364-I384 HydrophobicContact CG2-CD1 3.86Å
365	S	92.5	Very high	87.6	Confident	46 Å²	46	87.6 Å²	87.6	32%	0.322	41%	0.41	S	S	.	.			trans	-126.9	147.5	175.1	-67.4	0	0	0	0	108.1
366	P	89.2	Confident	87.4	Confident	20 Å²	20	85.7 Å²	85.7	13%	0.13	40%	0.402	C	S	.	.			trans	-64.6	152.2	-179	24	-29.6	0	0	0	111.1	M61 D370 V371 G377 A380	M61-P366 HydrophobicContact CG-CB 4.08Å; M61-P366 HydrophobicContact CG-CG 4.34Å; M61-P366 HydrophobicContact SD-CG 4.49Å; P366-D370 HydrophobicContact CB-CB 4.33Å; P366-V371 HydrophobicContact CB-CG2 3.82Å; P366-V371 HydrophobicContact CG-CG2 3.58Å; P366-G377 WeakPolarHBondContact CG-O 3.47Å; P366-A380 VanDerWaalsContact CD-O 3.31Å; P366-A380 WeakPolarHBondContact CD-O 3.48Å; P366-A380 HydrophobicContact CG-CB 4.31Å
367	E	87.4	Confident	86.9	Confident	137 Å²	137	85.7 Å²	85.7	64%	0.64	40%	0.403	S	S	*	.			trans	-72	163.4	177.5	-58.8	-168.6	169.5	0	0	111.3	D369 D370 V371	E367-D369 PolarHBondContact O-N 3.41Å; E367-D370 PolarHBondContact N-OD2 3.47Å; E367-D370 PolarHBondContact O-N 3.11Å; E367-V371 VanDerWaalsContact O-CG2 3.31Å; E367-V371 WeakPolarHBondContact O-CG2 3.23Å; E367-V371 PolarHBondContact O-N 2.88Å
368	K	84.1	Confident	86.5	Confident	171 Å²	171	84.9 Å²	84.9	74%	0.743	40%	0.396	S	S	*	.	H	α-helix	trans	-60.9	-36.7	-176.6	-72.8	-178.2	-179.6	174.5	0	112.2	V371 R372	K368-V371 PolarHBondContact O-N 3.47Å; K368-R372 WeakPolarHBondContact O-CG 3.25Å; K368-R372 PolarHBondContact O-N 3.28Å; K368-R372 VanDerWaalsContact O-N 3.12Å
369	D	83.9	Confident	86.4	Confident	89 Å²	89	82.8 Å²	82.8	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-75.5	-40.9	-178.7	-64.7	-32.9	0	0	0	111.4	E367 V371 R372 E373	E367-D369 PolarHBondContact O-N 3.41Å; D369-V371 PolarHBondContact O-N 3.43Å; D369-R372 WeakPolarHBondContact O-CB 3.42Å; D369-R372 PolarHBondContact O-N 3.05Å; D369-R372 IonicContact OD1-CZ 3.72Å; D369-R372 IonicContact OD1-NH1 3.89Å; D369-R372 PolarHBondContact OD1-NH1 3.12Å; D369-E373 PolarHBondContact O-N 3.46Å
370	D	84.1	Confident	86.5	Confident	32 Å²	32	80 Å²	80	17%	0.171	37%	0.367	C	S	.	.	H	α-helix	trans	-58.4	-36	171.5	-61.3	-45.8	0	0	0	111.8	K63 P366 E367 N374	K63-D370 IonicContact NZ-OD1 2.72Å; P366-D370 HydrophobicContact CB-CB 4.33Å; E367-D370 PolarHBondContact N-OD2 3.47Å; E367-D370 PolarHBondContact O-N 3.11Å; D370-N374 PolarHBondContact O-N 3Å
371	V	84.3	Confident	86.9	Confident	9 Å²	9	77.5 Å²	77.5	6%	0.055	36%	0.356	C	S	.	.	H	α-helix	trans	-73.4	-27.7	176.7	176.3	0	0	0	0	112.6	L259 P366 E367 K368 D369 N374 P375 R378	L259-V371 HydrophobicContact CD1-CG1 3.43Å; L259-V371 VanDerWaalsContact CD1-CG1 3.43Å; L259-V371 HydrophobicContact CD2-CG1 3.7Å; L259-V371 HydrophobicContact CG-CG1 3.95Å; P366-V371 HydrophobicContact CB-CG2 3.82Å; P366-V371 HydrophobicContact CG-CG2 3.58Å; E367-V371 VanDerWaalsContact O-CG2 3.31Å; E367-V371 WeakPolarHBondContact O-CG2 3.23Å; E367-V371 PolarHBondContact O-N 2.88Å; K368-V371 PolarHBondContact O-N 3.47Å; D369-V371 PolarHBondContact O-N 3.43Å; V371-N374 CarbonylContact O-C 3.49Å; V371-N374 VanDerWaalsContact O-C 3.29Å; V371-P375 VanDerWaalsContact O-CA 3.26Å; V371-P375 WeakPolarHBondContact O-CA 3.45Å; V371-R378 HydrophobicContact CG1-CB 3.68Å
372	R	82.9	Confident	87.7	Confident	184 Å²	184	65.8 Å²	65.8	69%	0.694	31%	0.312	S	S	*	.	H	α-helix	trans	-70.5	-43.9	172.9	-74.8	166.9	171.7	174	-10	110.7	K368 D369	K368-R372 WeakPolarHBondContact O-CG 3.25Å; K368-R372 PolarHBondContact O-N 3.28Å; K368-R372 VanDerWaalsContact O-N 3.12Å; D369-R372 WeakPolarHBondContact O-CB 3.42Å; D369-R372 PolarHBondContact O-N 3.05Å; D369-R372 IonicContact OD1-CZ 3.72Å; D369-R372 IonicContact OD1-NH1 3.89Å; D369-R372 PolarHBondContact OD1-NH1 3.12Å
373	E	83.6	Confident	88.2	Confident	131 Å²	131	59.4 Å²	59.4	61%	0.612	28%	0.283	S	S	*	.	H	α-helix	trans	-68.2	-40.9	176.8	-68.1	179.5	-179.1	0	0	111.9	D369	D369-E373 PolarHBondContact O-N 3.46Å
374	N	85.9	Confident	88.4	Confident	21 Å²	21	57.4 Å²	57.4	11%	0.112	27%	0.271	C	S	.	.			trans	-127	87.3	177.4	-170.8	-5	0	0	0	112.1	M58 D370 V371 R376 G377	M58-N374 PolarHBondContact O-ND2 2.98Å; D370-N374 PolarHBondContact O-N 3Å; V371-N374 CarbonylContact O-C 3.49Å; V371-N374 VanDerWaalsContact O-C 3.29Å; N374-R376 PolarHBondContact O-N 3.13Å; N374-R376 WeakPolarHBondContact OD1-CB 3.48Å; N374-R376 PolarHBondContact OD1-N 2.7Å; N374-G377 PolarHBondContact O-N 3.2Å
375	P	83.8	Confident	88.5	Confident	52 Å²	52	56.8 Å²	56.8	34%	0.338	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-10	-179	-26	35.3	0	0	0	116	V371 G377 R378	V371-P375 VanDerWaalsContact O-CA 3.26Å; V371-P375 WeakPolarHBondContact O-CA 3.45Å; P375-G377 VanDerWaalsContact C-N 3.33Å; P375-R378 WeakPolarHBondContact O-CG 3.15Å; P375-R378 PolarHBondContact O-NH1 3.44Å
376	R	83.2	Confident	88.7	Confident	83 Å²	83	57 Å²	57	31%	0.313	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-28.4	173.4	-61.8	179.9	169.3	152.2	-6.7	111.3	H57 V60 D163 N374 R378	H57-R376 PolarHBondContact CD2-NH1 3.37Å; H57-R376 VanDerWaalsContact CD2-NH1 3.27Å; H57-R376 PolarHBondContact CE1-NH1 3.01Å; H57-R376 PolarHBondContact ND1-NH1 3.17Å; H57-R376 PolarHBondContact NE2-NH1 3.22Å; V60-R376 HydrophobicContact CG2-CB 4.21Å; D163-R376 IonicContact OD1-NH2 3.47Å; D163-R376 PolarHBondContact OD1-NH2 2.95Å; D163-R376 IonicContact OD2-CZ 3.99Å; D163-R376 IonicContact OD2-NH1 3.32Å; D163-R376 IonicContact OD2-NH2 3.5Å; D163-R376 PolarHBondContact OD2-NH2 3.38Å; N374-R376 PolarHBondContact O-N 3.13Å; N374-R376 WeakPolarHBondContact OD1-CB 3.48Å; N374-R376 PolarHBondContact OD1-N 2.7Å; R376-R378 VanDerWaalsContact C-N 3.26Å; R376-R378 PolarHBondContact O-N 2.92Å
377	G	84.1	Confident	89.1	Confident	3 Å²	3	58.3 Å²	58.3	3%	0.031	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-72.3	-8.8	176.6	0	0	0	0	0	115.1	P366 N374 P375 S379 A380	P366-G377 WeakPolarHBondContact CG-O 3.47Å; N374-G377 PolarHBondContact O-N 3.2Å; P375-G377 VanDerWaalsContact C-N 3.33Å; G377-S379 PolarHBondContact O-N 3.07Å; G377-A380 WeakPolarHBondContact O-CB 3.29Å; G377-A380 PolarHBondContact O-N 2.91Å
378	R	85.4	Confident	89.2	Confident	85 Å²	85	57.2 Å²	57.2	32%	0.321	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-51.9	-31.4	-171	65.9	164.1	171.3	-83.4	12.4	116.4	D257 R258 L259 R261 V371 P375 R376	D257-R378 WeakPolarHBondContact OD2-CD 3.32Å; D257-R378 IonicContact OD2-CZ 2.71Å; D257-R378 IonicContact OD2-NE 2.77Å; D257-R378 PolarHBondContact OD2-NE 3.37Å; R258-R378 WeakPolarHBondContact CD-O 3.41Å; L259-R378 HydrophobicContact CD1-CB 4.14Å; L259-R378 HydrophobicContact CG-CB 4.32Å; R261-R378 VanDerWaalsContact NH2-CD 3.29Å; V371-R378 HydrophobicContact CG1-CB 3.68Å; P375-R378 WeakPolarHBondContact O-CG 3.15Å; P375-R378 PolarHBondContact O-NH1 3.44Å; R376-R378 VanDerWaalsContact C-N 3.26Å; R376-R378 PolarHBondContact O-N 2.92Å
379	S	88.1	Confident	89.5	Confident	39 Å²	39	51.6 Å²	51.6	27%	0.273	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-110.2	1.9	-178	-60.9	0	0	0	0	111.9	F306 G377	F306-S379 WeakPolarHBondContact O-CB 3.39Å; G377-S379 PolarHBondContact O-N 3.07Å
380	A	93.4	Very high	89.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	22%	0.22	C	C	.	.			trans	-63.7	140.7	-177.2	0	0	0	0	0	110.8	V60 M61 I304 T305 F306 P366 G377	V60-A380 HydrophobicContact CG1-CB 3.42Å; V60-A380 VanDerWaalsContact CG1-CB 3.42Å; M61-A380 HydrophobicContact CG-CB 4.27Å; M61-A380 HydrophobicContact SD-CB 3.84Å; I304-A380 HydrophobicContact CG2-CB 4.1Å; T305-A380 CarbonylContact O-C 3.56Å; T305-A380 VanDerWaalsContact O-CA 3.28Å; T305-A380 WeakPolarHBondContact O-CA 3.5Å; F306-A380 HydrophobicContact CD1-CB 4.3Å; F306-A380 HydrophobicContact CE1-CB 4.09Å; P366-A380 VanDerWaalsContact CD-O 3.31Å; P366-A380 WeakPolarHBondContact CD-O 3.48Å; P366-A380 HydrophobicContact CG-CB 4.31Å; G377-A380 WeakPolarHBondContact O-CB 3.29Å; G377-A380 PolarHBondContact O-N 2.91Å
381	K	95.4	Very high	90.1	Very high	46 Å²	46	50.6 Å²	50.6	20%	0.2	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	114.5	-179.1	-79.8	-179.4	-175.5	175.9	0	107.7	I304 T305 D311 V363 V364	I304-K381 WeakPolarHBondContact CA-O 3.47Å; T305-K381 PolarHBondContact N-O 3.16Å; T305-K381 PolarHBondContact O-N 3.27Å; T305-K381 WeakPolarHBondContact OG1-CB 3.32Å; T305-K381 PolarHBondContact OG1-O 2.65Å; D311-K381 HydrophobicContact CB-CD 3.95Å; D311-K381 VanDerWaalsContact CG-CD 3.43Å; D311-K381 VanDerWaalsContact OD2-CD 3.29Å; D311-K381 WeakPolarHBondContact OD2-CD 3.4Å; D311-K381 IonicContact OD2-NZ 3.79Å; D311-K381 PolarHBondContact OD2-NZ 3.4Å; V363-K381 HydrophobicContact CG2-CB 3.61Å; V363-K381 HydrophobicContact CG2-CD 4.33Å; V363-K381 HydrophobicContact CG2-CG 3.97Å; V364-K381 WeakPolarHBondContact O-CA 3.04Å
382	L	97.3	Very high	90.4	Very high	0 Å²	0	53 Å²	53	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.6	178.2	174.1	68.4	0	0	0	110.1	M61 E64 V65 Y68 C302 V303 I304 V363 V364 I384	M61-L382 HydrophobicContact CE-CB 3.57Å; M61-L382 HydrophobicContact CE-CD2 4.21Å; M61-L382 HydrophobicContact SD-CB 3.76Å; E64-L382 HydrophobicContact CB-CD2 3.75Å; V65-L382 HydrophobicContact CG2-CD1 4.43Å; Y68-L382 HydrophobicContact CD2-CD2 3.86Å; Y68-L382 HydrophobicContact CE2-CD2 4.44Å; C302-L382 HydrophobicContact CB-CD1 3.97Å; V303-L382 WeakPolarHBondContact O-CA 3.36Å; I304-L382 HydrophobicContact CG1-CD1 3.85Å; V363-L382 WeakPolarHBondContact CG2-O 3.42Å; V364-L382 HydrophobicContact CB-CB 4.18Å; V364-L382 PolarHBondContact N-O 2.93Å; V364-L382 PolarHBondContact O-N 2.69Å; L382-I384 HydrophobicContact CD1-CG1 4.29Å; L382-I384 HydrophobicContact CD2-CD1 3.93Å; L382-I384 HydrophobicContact CD2-CG1 4.22Å; L382-I384 HydrophobicContact CG-CD1 3.7Å; L382-I384 HydrophobicContact CG-CG1 3.97Å
383	R	97.2	Very high	90.9	Very high	38 Å²	38	44.8 Å²	44.8	14%	0.143	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	137.9	170.4	-67.5	-174.8	175.8	-73.3	-11.9	109.5	V303 D311 V314 L318 V363	V303-R383 PolarHBondContact N-O 3.27Å; V303-R383 PolarHBondContact O-N 3.2Å; D311-R383 IonicContact OD1-CZ 2.78Å; D311-R383 IonicContact OD1-NE 3.17Å; D311-R383 PolarHBondContact OD1-NE 2.74Å; D311-R383 IonicContact OD1-NH2 3.56Å; D311-R383 PolarHBondContact OD1-NH2 2.85Å; D311-R383 IonicContact OD2-NH2 2.75Å; V314-R383 HydrophobicContact CG1-CB 4.26Å; L318-R383 HydrophobicContact CD1-CB 4.12Å; V363-R383 HydrophobicContact CG2-CG 4.09Å
384	I	96.5	Very high	91.4	Very high	6 Å²	6	39.1 Å²	39.1	3%	0.031	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130.5	-176.3	-48.1	96.1	0	0	0	109.7	Y68 L301 V359 V364 L382	Y68-I384 HydrophobicContact CD1-CD1 4.24Å; Y68-I384 HydrophobicContact CD1-CG1 4.29Å; Y68-I384 HydrophobicContact CD2-CD1 3.79Å; Y68-I384 HydrophobicContact CD2-CG1 4.09Å; Y68-I384 HydrophobicContact CE2-CD1 4.14Å; Y68-I384 HydrophobicContact CG-CD1 3.88Å; Y68-I384 HydrophobicContact CG-CG1 3.79Å; L301-I384 WeakPolarHBondContact O-CA 3.21Å; V359-I384 HydrophobicContact CB-CB 4.08Å; V359-I384 HydrophobicContact CB-CG2 3.82Å; V359-I384 HydrophobicContact CG1-CG2 4.39Å; V359-I384 HydrophobicContact CG2-CB 4.39Å; V359-I384 HydrophobicContact CG2-CG2 3.67Å; V359-I384 PolarHBondContact N-O 2.89Å; V364-I384 HydrophobicContact CG2-CD1 3.86Å; L382-I384 HydrophobicContact CD1-CG1 4.29Å; L382-I384 HydrophobicContact CD2-CD1 3.93Å; L382-I384 HydrophobicContact CD2-CG1 4.22Å; L382-I384 HydrophobicContact CG-CD1 3.7Å; L382-I384 HydrophobicContact CG-CG1 3.97Å
385	A	96.8	Very high	91.8	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.008	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	149.8	176.6	0	0	0	0	0	111.9	L301 L318 W356 F357	L301-A385 PolarHBondContact N-O 2.93Å; L301-A385 PolarHBondContact O-N 3.31Å; L318-A385 HydrophobicContact CD1-CB 4.3Å; L318-A385 HydrophobicContact CD2-CB 3.73Å; W356-A385 HydrophobicContact CB-CB 4.09Å; W356-A385 HydrophobicContact CD2-CB 4.25Å; W356-A385 HydrophobicContact CE3-CB 3.72Å; W356-A385 HydrophobicContact CG-CB 4.43Å; F357-A385 CarbonylContact O-C 3.24Å; F357-A385 WeakPolarHBondContact O-CA 3.32Å
386	L	96.8	Very high	92.4	Very high	50 Å²	50	39.5 Å²	39.5	26%	0.262	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	138.4	169.4	-64.7	165	0	0	0	109.4	G298 G299 R300 W356 F357 V359	G298-L386 WeakPolarHBondContact O-CD2 3.26Å; G299-L386 CarbonylContact O-C 3.51Å; G299-L386 WeakPolarHBondContact O-CA 3.42Å; R300-L386 HydrophobicContact CG-CD2 3.37Å; W356-L386 CarbonylContact C-O 3.48Å; W356-L386 VanDerWaalsContact CA-O 3.28Å; W356-L386 WeakPolarHBondContact CA-O 3.24Å; F357-L386 HydrophobicContact CB-CB 4.26Å; F357-L386 PolarHBondContact N-O 3.34Å; F357-L386 PolarHBondContact O-N 2.81Å; V359-L386 HydrophobicContact CG2-CD1 4.15Å; V359-L386 HydrophobicContact CG2-CD2 4.45Å; V359-L386 HydrophobicContact CG2-CG 3.76Å
387	R	96	Very high	93.2	Very high	48 Å²	48	35.8 Å²	35.8	18%	0.181	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	128.4	171.2	-178.5	67.7	-174.8	72	18.2	109.4	Q292 L295 K296 G298 G299 Y355 W356	Q292-R387 WeakPolarHBondContact O-CD 3.29Å; Q292-R387 PolarHBondContact O-NE 2.87Å; L295-R387 HydrophobicContact CB-CB 3.98Å; L295-R387 HydrophobicContact CB-CG 4.07Å; K296-R387 WeakPolarHBondContact O-CB 3.22Å; G298-R387 WeakPolarHBondContact CA-O 3.43Å; G298-R387 PolarHBondContact N-O 3Å; G299-R387 PolarHBondContact O-N 3.28Å; Y355-R387 PolarHBondContact O-NH1 2.94Å; W356-R387 HydrophobicContact CZ3-CB 4.16Å
388	R	91.1	Very high	94	Very high	114 Å²	114	38.8 Å²	38.8	43%	0.43	17%	0.168	S	C	.	.			trans	-68.2	0	175.7	-67.8	-145.6	-179.9	160	-6.8	114.2	S353 S354 Y355 F357	S353-R388 PolarHBondContact OG-NH1 2.83Å; S354-R388 WeakPolarHBondContact O-CD 3.44Å; S354-R388 WeakPolarHBondContact O-CG 3.46Å; S354-R388 VanDerWaalsContact O-CZ 3.27Å; S354-R388 PolarHBondContact O-NE 3.34Å; S354-R388 PolarHBondContact O-NH1 3.03Å; Y355-R388 PolarHBondContact O-N 3.05Å; F357-R388 HydrophobicContact CD2-CB 4.45Å; F357-R388 HydrophobicContact CD2-CG 3.46Å; F357-R388 VanDerWaalsContact CD2-CG 3.46Å; F357-R388 VanDerWaalsContact CE1-CZ 3.41Å; F357-R388 HydrophobicContact CE2-CB 4.2Å; F357-R388 HydrophobicContact CE2-CG 3.39Å; F357-R388 VanDerWaalsContact CE2-NE 3.34Å; F357-R388 HydrophobicContact CG-CG 4.16Å; F357-R388 VanDerWaalsContact CZ-CD 3.47Å; F357-R388 HydrophobicContact CZ-CG 4.06Å

Retrieved 388 of 388 residues in 174.5 ms (Link to these results)

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