A0A087XUN9_POEFO Loading...

RNA helicase

ATP-dependent RNA helicase. Involved in pre-mRNA splicing as component of the spliceosome. Core component of the splicing-dependent multiprotein exon junction complex (EJC) deposited at splice junctions on mRNAs. The EJC is a dynamic structure consisting of core proteins and several peripheral nuclear and cytoplasmic associated factors that join the complex only transiently either during EJC assembly or during subsequent mRNA metabolism. The EJC marks the position of the exon-exon junction in the mature mRNA for the gene expression machinery and the core components remain bound to spliced mRNAs throughout all stages of mRNA metabolism thereby influencing downstream processes including nuclear mRNA export, subcellular mRNA localization, translation efficiency and nonsense-mediated mRNA decay (NMD). Binds spliced mRNA in sequence-independent manner, 20-24 nucleotides upstream of mRNA exon-exon junctions. Involved in craniofacial development.

AlphaFold DB , UniProt , Accession A0A087XUN9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 416 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	I	52.7	Low	42.2	Very low	222 Å²	222	125 Å²	125	100%	1.138	68%	0.675	S	S	*	*				0	48.6	0	-49.6	173.9	0	0	0	109.3
2	S	52.6	Low	42.2	Very low	98 Å²	98	119.8 Å²	119.8	69%	0.685	66%	0.662	S	S	*	*			trans	-151.2	22.6	-176.1	67.2	0	0	0	0	113.7
3	A	39.1	Very low	41.8	Very low	67 Å²	67	114.6 Å²	114.6	55%	0.554	64%	0.644	S	S	*	*	S	Bend	trans	-121.2	-40	173.5	0	0	0	0	0	111.1	A5 E6 T7	A3-A5 VanDerWaalsContact C-N 3.28Å; A3-A5 PolarHBondContact O-N 3.33Å; A3-E6 PolarHBondContact O-N 3.48Å; A3-T7 PolarHBondContact O-N 3.24Å; A3-T7 PolarHBondContact O-OG1 2.85Å
4	E	38.6	Very low	41.2	Very low	159 Å²	159	110.8 Å²	110.8	74%	0.743	63%	0.634	S	S	*	*	H	α-helix	trans	-68	-22.2	176.2	-72.4	-178.3	137.5	0	0	114.4	R8	E4-R8 WeakPolarHBondContact O-CG 3.35Å; E4-R8 PolarHBondContact O-N 3.42Å
5	A	42.2	Very low	40.6	Very low	60 Å²	60	106.9 Å²	106.9	50%	0.496	63%	0.628	S	S	.	*	H	α-helix	trans	-74.8	-37.3	175.8	0	0	0	0	0	111.9	A3 I9	A3-A5 VanDerWaalsContact C-N 3.28Å; A3-A5 PolarHBondContact O-N 3.33Å; A5-I9 WeakPolarHBondContact O-CD1 3.46Å; A5-I9 VanDerWaalsContact O-CG1 3.31Å; A5-I9 WeakPolarHBondContact O-CG1 3.45Å; A5-I9 PolarHBondContact O-N 3.21Å
6	E	39.3	Very low	40.5	Very low	144 Å²	144	106.8 Å²	106.8	67%	0.673	63%	0.628	S	S	*	*	H	α-helix	trans	-74.4	-34.4	178.6	-75.3	-176.2	154.2	0	0	112.1	A3 R8 I9 S10	A3-E6 PolarHBondContact O-N 3.48Å; E6-R8 VanDerWaalsContact C-N 3.33Å; E6-R8 PolarHBondContact O-N 2.71Å; E6-I9 PolarHBondContact O-N 3.37Å; E6-S10 PolarHBondContact O-N 2.98Å
7	T	38.9	Very low	40.1	Very low	85 Å²	85	109.8 Å²	109.8	52%	0.521	64%	0.635	S	S	.	*	H	α-helix	trans	-68.3	-32.3	176.2	-31.1	0	0	0	0	112.3	A3 M11	A3-T7 PolarHBondContact O-N 3.24Å; A3-T7 PolarHBondContact O-OG1 2.85Å; T7-M11 PolarHBondContact O-N 3.37Å; T7-M11 VanDerWaalsContact O-N 3.15Å
8	R	43.4	Very low	39.6	Very low	197 Å²	197	107.6 Å²	107.6	74%	0.743	64%	0.639	S	S	*	*	H	α-helix	trans	-72.5	-32.8	174.7	-76.3	-177.5	178.5	-176.7	1.9	113.1	E4 E6 A12	E4-R8 WeakPolarHBondContact O-CG 3.35Å; E4-R8 PolarHBondContact O-N 3.42Å; E6-R8 VanDerWaalsContact C-N 3.33Å; E6-R8 PolarHBondContact O-N 2.71Å; R8-A12 WeakPolarHBondContact O-CB 3.31Å; R8-A12 PolarHBondContact O-N 3.44Å; R8-A12 VanDerWaalsContact O-N 3.11Å
9	I	44.2	Very low	39.4	Very low	119 Å²	119	113.6 Å²	113.6	61%	0.61	65%	0.65	S	S	*	*	H	α-helix	trans	-70.3	-37.7	174.8	-66.1	165.6	0	0	0	110.6	A5 E6 A12 A13	A5-I9 WeakPolarHBondContact O-CD1 3.46Å; A5-I9 VanDerWaalsContact O-CG1 3.31Å; A5-I9 WeakPolarHBondContact O-CG1 3.45Å; A5-I9 PolarHBondContact O-N 3.21Å; E6-I9 PolarHBondContact O-N 3.37Å; I9-A12 PolarHBondContact O-N 2.92Å; I9-A13 WeakPolarHBondContact O-CB 3.22Å; I9-A13 PolarHBondContact O-N 2.95Å
10	S	37.3	Very low	39	Very low	77 Å²	77	117.6 Å²	117.6	54%	0.538	66%	0.659	S	S	.	*	H	α-helix	trans	-63	-44.7	174.5	162.5	0	0	0	0	112.9	E6 A13 A14	E6-S10 PolarHBondContact O-N 2.98Å; S10-A13 PolarHBondContact O-N 3.49Å; S10-A14 PolarHBondContact O-N 3.48Å
11	M	35.9	Very low	38.8	Very low	147 Å²	147	122.8 Å²	122.8	72%	0.724	67%	0.669	S	S	*	*	H	α-helix	trans	-71.5	-31.9	177.7	-77.9	-173.4	149.3	0	0	113.3	T7 G15	T7-M11 PolarHBondContact O-N 3.37Å; T7-M11 VanDerWaalsContact O-N 3.15Å; M11-G15 PolarHBondContact O-N 3.07Å; M11-G15 VanDerWaalsContact O-N 3.11Å
12	A	41.8	Very low	37.8	Very low	63 Å²	63	120 Å²	120	52%	0.521	66%	0.656	S	S	.	*	H	α-helix	trans	-67.6	-37.8	171.2	0	0	0	0	0	111.8	R8 I9 V16	R8-A12 WeakPolarHBondContact O-CB 3.31Å; R8-A12 PolarHBondContact O-N 3.44Å; R8-A12 VanDerWaalsContact O-N 3.11Å; I9-A12 PolarHBondContact O-N 2.92Å; A12-V16 WeakPolarHBondContact O-CG2 3.47Å; A12-V16 PolarHBondContact O-N 3.11Å
13	A	36.8	Very low	36.9	Very low	52 Å²	52	123.4 Å²	123.4	43%	0.43	67%	0.665	S	S	.	*	H	α-helix	trans	-69.4	-37.2	176.1	0	0	0	0	0	112.9	I9 S10 V16 Q17	I9-A13 WeakPolarHBondContact O-CB 3.22Å; I9-A13 PolarHBondContact O-N 2.95Å; S10-A13 PolarHBondContact O-N 3.49Å; A13-V16 PolarHBondContact O-N 3.44Å; A13-Q17 PolarHBondContact O-N 3.13Å
14	A	34.2	Very low	36.6	Very low	61 Å²	61	128.1 Å²	128.1	50%	0.504	67%	0.673	S	S	.	*	H	α-helix	trans	-69.6	-34.1	176.1	0	0	0	0	0	112.7	S10 V16 Q17	S10-A14 PolarHBondContact O-N 3.48Å; A14-V16 VanDerWaalsContact C-N 3.27Å; A14-V16 PolarHBondContact O-N 2.86Å; A14-Q17 PolarHBondContact O-N 3.34Å
15	G	32.8	Very low	36.6	Very low	52 Å²	52	130.1 Å²	130.1	54%	0.536	68%	0.682	S	S	.	*	H	α-helix	trans	-69.5	-21.3	172.1	0	0	0	0	0	114.2	M11	M11-G15 PolarHBondContact O-N 3.07Å; M11-G15 VanDerWaalsContact O-N 3.11Å
16	V	38.4	Very low	36.8	Very low	105 Å²	105	133.6 Å²	133.6	64%	0.636	69%	0.688	S	S	*	*	H	α-helix	trans	-86.3	-25.7	176.7	172.8	0	0	0	0	111.9	A12 A13 A14	A12-V16 WeakPolarHBondContact O-CG2 3.47Å; A12-V16 PolarHBondContact O-N 3.11Å; A13-V16 PolarHBondContact O-N 3.44Å; A14-V16 VanDerWaalsContact C-N 3.27Å; A14-V16 PolarHBondContact O-N 2.86Å
17	Q	33.7	Very low	37.2	Very low	159 Å²	159	131.1 Å²	131.1	74%	0.743	68%	0.68	S	S	*	*	H	α-helix	trans	-75.9	-21.3	176.5	-88.8	172.6	-24.6	0	0	114.2	A13 A14	A13-Q17 PolarHBondContact O-N 3.13Å; A14-Q17 PolarHBondContact O-N 3.34Å
18	G	31.2	Very low	37.8	Very low	69 Å²	69	129.8 Å²	129.8	71%	0.711	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-1.4	177	0	0	0	0	0	115.9
19	R	35	Very low	37.9	Very low	223 Å²	223	124.6 Å²	124.6	84%	0.842	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	31.3	179.3	-100.4	-178.9	-179	171	0.1	113.3	R21	R19-R21 PolarHBondContact O-N 3.18Å
20	K	32.7	Very low	37.9	Very low	192 Å²	192	126.9 Å²	126.9	84%	0.835	66%	0.664	S	S	*	*			trans	-73.4	61.6	153.5	-79.8	-173.8	175.3	-177.8	0	109.8	L22	K20-L22 PolarHBondContact O-N 2.86Å
21	R	34.5	Very low	38.9	Very low	227 Å²	227	125.6 Å²	125.6	86%	0.857	65%	0.653	S	S	*	*			trans	-74.6	113.2	155.4	-160.7	176.1	-175.3	-175.3	0.5	104	R19 L23	R19-R21 PolarHBondContact O-N 3.18Å; R21-L23 PolarHBondContact O-N 2.98Å
22	L	31.8	Very low	40.1	Very low	165 Å²	165	126.6 Å²	126.6	86%	0.864	66%	0.656	S	S	*	*			trans	-32.8	93.2	177.8	-69.7	131.7	0	0	0	112.3	K20 K24	K20-L22 PolarHBondContact O-N 2.86Å; L22-K24 VanDerWaalsContact C-N 3.27Å; L22-K24 PolarHBondContact O-N 3.34Å
23	L	34.1	Very low	41.1	Very low	169 Å²	169	125.7 Å²	125.7	89%	0.885	64%	0.64	S	S	*	*			trans	-75.2	97	150.7	-76.5	162.7	0	0	0	103.1	R21 E25	R21-L23 PolarHBondContact O-N 2.98Å; L23-E25 PolarHBondContact O-N 3.29Å
24	K	32.7	Very low	42.9	Very low	165 Å²	165	130 Å²	130	72%	0.717	65%	0.652	S	S	*	*			trans	-51.5	125.3	156.2	-75.7	177.3	175	178.9	0	104.9	L22 E26	L22-K24 VanDerWaalsContact C-N 3.27Å; L22-K24 PolarHBondContact O-N 3.34Å; K24-E26 HydrophobicContact CB-CG 4.15Å; K24-E26 PolarHBondContact O-N 3.09Å
25	E	38.4	Very low	45	Very low	201 Å²	201	130 Å²	130	94%	0.939	65%	0.645	S	S	*	*			trans	-61.3	85.9	155.7	-79	177.3	152.5	0	0	104.8	L23 D27	L23-E25 PolarHBondContact O-N 3.29Å; E25-D27 PolarHBondContact O-N 3.26Å
26	E	45.3	Very low	47.3	Very low	133 Å²	133	129 Å²	129	62%	0.621	63%	0.629	S	S	*	*			trans	-62.5	129.2	168.5	-77	-178.1	163.2	0	0	106.2	K24 M28	K24-E26 HydrophobicContact CB-CG 4.15Å; K24-E26 PolarHBondContact O-N 3.09Å; E26-M28 PolarHBondContact O-N 2.89Å
27	D	47.4	Very low	48.9	Very low	92 Å²	92	133.6 Å²	133.6	49%	0.492	64%	0.644	S	S	.	*			trans	-62.5	89.6	172.3	-178.4	7	0	0	0	107.5	E25 T29 K30	E25-D27 PolarHBondContact O-N 3.26Å; D27-T29 VanDerWaalsContact CG-OG1 3.31Å; D27-T29 PolarHBondContact O-N 3.06Å; D27-T29 VanDerWaalsContact O-N 3.09Å; D27-T29 WeakPolarHBondContact OD1-CB 3.24Å; D27-T29 WeakPolarHBondContact OD1-CG2 3.34Å; D27-T29 PolarHBondContact OD1-N 3.04Å; D27-T29 PolarHBondContact OD1-OG1 3.4Å; D27-K30 PolarHBondContact O-N 3.05Å
28	M	51.3	Low	50.7	Low	58 Å²	58	131.7 Å²	131.7	29%	0.286	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-60.4	-23.7	-173.4	-70.7	-61.7	-58.8	0	0	111.1	E26 K30 V31 F33 H228 E232	E26-M28 PolarHBondContact O-N 2.89Å; M28-K30 PolarHBondContact O-N 3.15Å; M28-V31 HydrophobicContact CE-CB 4.4Å; M28-V31 HydrophobicContact CE-CG2 3.96Å; M28-V31 WeakPolarHBondContact O-CB 3.45Å; M28-V31 PolarHBondContact O-N 3.29Å; M28-V31 HydrophobicContact SD-CG2 4.03Å; M28-F33 HydrophobicContact CE-CZ 4.26Å; M28-H228 VanDerWaalsContact C-CE1 3.47Å; M28-H228 PolarHBondContact O-CE1 2.84Å; M28-H228 PolarHBondContact O-NE2 2.84Å; M28-E232 HydrophobicContact CB-CG 4.13Å
29	T	45.8	Very low	53	Low	87 Å²	87	129.4 Å²	129.4	53%	0.534	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-58.8	-15.4	-177.6	69.8	0	0	0	0	114.5	D27 H228	D27-T29 VanDerWaalsContact CG-OG1 3.31Å; D27-T29 PolarHBondContact O-N 3.06Å; D27-T29 VanDerWaalsContact O-N 3.09Å; D27-T29 WeakPolarHBondContact OD1-CB 3.24Å; D27-T29 WeakPolarHBondContact OD1-CG2 3.34Å; D27-T29 PolarHBondContact OD1-N 3.04Å; D27-T29 PolarHBondContact OD1-OG1 3.4Å; T29-H228 VanDerWaalsContact CA-CE1 3.44Å; T29-H228 WeakPolarHBondContact CA-CE1 3.38Å
30	K	45.9	Very low	55.3	Low	167 Å²	167	122.8 Å²	122.8	73%	0.726	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-110.8	5.4	-179.8	-63.8	-178.1	-175.6	172.7	0	114.1	D27 M28 E32	D27-K30 PolarHBondContact O-N 3.05Å; M28-K30 PolarHBondContact O-N 3.15Å; K30-E32 PolarHBondContact O-N 3.33Å
31	V	58	Low	58	Low	50 Å²	50	117.2 Å²	117.2	30%	0.303	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-73.7	119.6	-179.9	175.9	0	0	0	0	109.4	M28 F33	M28-V31 HydrophobicContact CE-CB 4.4Å; M28-V31 HydrophobicContact CE-CG2 3.96Å; M28-V31 WeakPolarHBondContact O-CB 3.45Å; M28-V31 PolarHBondContact O-N 3.29Å; M28-V31 HydrophobicContact SD-CG2 4.03Å; V31-F33 HydrophobicContact CB-CE2 4.33Å; V31-F33 HydrophobicContact CB-CZ 4.37Å; V31-F33 HydrophobicContact CG1-CD1 4.41Å; V31-F33 HydrophobicContact CG1-CE1 4.18Å; V31-F33 HydrophobicContact CG1-CE2 4.35Å; V31-F33 HydrophobicContact CG1-CZ 4.16Å; V31-F33 WeakPolarHBondContact O-CD2 3.34Å; V31-F33 PolarHBondContact O-N 2.98Å
32	E	60	Low	60.7	Low	169 Å²	169	106.9 Å²	106.9	79%	0.79	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-75.3	116.1	169.4	-70.2	-172.5	166	0	0	109	K30	K30-E32 PolarHBondContact O-N 3.33Å
33	F	63	Low	63.4	Low	43 Å²	43	102.4 Å²	102.4	19%	0.189	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-91.1	118.2	177	-68	-82.1	0	0	0	110.1	M28 V31 H228 L231 L245	M28-F33 HydrophobicContact CE-CZ 4.26Å; V31-F33 HydrophobicContact CB-CE2 4.33Å; V31-F33 HydrophobicContact CB-CZ 4.37Å; V31-F33 HydrophobicContact CG1-CD1 4.41Å; V31-F33 HydrophobicContact CG1-CE1 4.18Å; V31-F33 HydrophobicContact CG1-CE2 4.35Å; V31-F33 HydrophobicContact CG1-CZ 4.16Å; V31-F33 WeakPolarHBondContact O-CD2 3.34Å; V31-F33 PolarHBondContact O-N 2.98Å; F33-H228 AromaticContact CE2-CD2 3.75Å; F33-H228 AromaticContact CE2-CE1 3.98Å; F33-H228 AromaticContact CE2-NE2 3.41Å; F33-H228 WeakPolarHBondContact CE2-NE2 3.46Å; F33-L231 HydrophobicContact CB-CD1 3.95Å; F33-L231 HydrophobicContact CD1-CD1 4.35Å; F33-L231 HydrophobicContact CD2-CB 4.13Å; F33-L231 HydrophobicContact CD2-CD1 3.39Å; F33-L231 HydrophobicContact CD2-CG 4.38Å; F33-L231 HydrophobicContact CE1-CB 4.23Å; F33-L231 HydrophobicContact CE2-CB 3.73Å; F33-L231 HydrophobicContact CE2-CD1 3.87Å; F33-L231 HydrophobicContact CE2-CG 4.45Å; F33-L231 HydrophobicContact CG-CD1 3.65Å; F33-L231 HydrophobicContact CZ-CB 3.79Å; F33-L245 HydrophobicContact CB-CD1 3.64Å; F33-L245 WeakPolarHBondContact O-CD1 3.27Å
34	E	74.6	Confident	66.3	Low	144 Å²	144	96.9 Å²	96.9	67%	0.673	49%	0.487	S	S	*	.			trans	-111.7	165.5	177.1	-60.9	-168.7	154.7	0	0	112
35	T	78.6	Confident	69.3	Low	61 Å²	61	89 Å²	89	37%	0.374	45%	0.453	S	S	.	.			trans	-66.4	131.7	170.7	-69.4	0	0	0	0	109.2	V39 R243 L245	T35-V39 HydrophobicContact CG2-CG2 4.36Å; T35-R243 CarbonylContact C-O 3.46Å; T35-R243 VanDerWaalsContact CA-O 3.31Å; T35-R243 WeakPolarHBondContact CA-O 3.46Å; T35-R243 WeakPolarHBondContact CG2-O 3.44Å; T35-L245 PolarHBondContact OG1-N 3.33Å; T35-L245 PolarHBondContact OG1-O 2.93Å; T35-L245 VanDerWaalsContact OG1-O 3.09Å
36	S	80	Confident	72	Confident	29 Å²	29	84 Å²	84	20%	0.203	43%	0.432	C	S	.	.			trans	-60	139.7	179.2	-59.9	0	0	0	0	111.6	E38 V39 R243	S36-E38 PolarHBondContact O-N 2.82Å; S36-V39 VanDerWaalsContact O-CG2 3.31Å; S36-V39 WeakPolarHBondContact O-CG2 3.43Å; S36-R243 PolarHBondContact N-O 2.75Å; S36-R243 PolarHBondContact OG-N 2.82Å
37	E	73	Confident	74.4	Confident	202 Å²	202	81.6 Å²	81.6	94%	0.944	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.2	-178.7	-63.6	-175.2	174.1	0	0	113.4	V39	E37-V39 PolarHBondContact O-N 3.05Å; E37-V39 VanDerWaalsContact O-N 3.07Å
38	E	70.6	Confident	76.7	Confident	119 Å²	119	77.7 Å²	77.7	56%	0.556	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	16	-175.6	-56.1	-173.9	161.1	0	0	115.2	S36 D40 Q76 R81 I242	S36-E38 PolarHBondContact O-N 2.82Å; E38-D40 PolarHBondContact O-N 3.06Å; E38-Q76 PolarHBondContact O-NE2 2.81Å; E38-R81 IonicContact OE2-CZ 2.75Å; E38-R81 IonicContact OE2-NH1 2.77Å; E38-R81 PolarHBondContact OE2-NH1 2.87Å; E38-R81 IonicContact OE2-NH2 3.75Å; E38-I242 HydrophobicContact CB-CD1 4.25Å
39	V	79.4	Confident	78.8	Confident	22 Å²	22	77.7 Å²	77.7	13%	0.133	42%	0.42	C	S	.	.			trans	-97.2	91.2	-172.9	-176.4	0	0	0	0	111.4	T35 S36 E37 R72 I242 I244	T35-V39 HydrophobicContact CG2-CG2 4.36Å; S36-V39 VanDerWaalsContact O-CG2 3.31Å; S36-V39 WeakPolarHBondContact O-CG2 3.43Å; E37-V39 PolarHBondContact O-N 3.05Å; E37-V39 VanDerWaalsContact O-N 3.07Å; V39-R72 HydrophobicContact CG1-CB 3.56Å; V39-R72 HydrophobicContact CG1-CG 3.79Å; V39-I242 HydrophobicContact CG2-CG2 3.71Å; V39-I244 HydrophobicContact CG1-CD1 4.17Å; V39-I244 HydrophobicContact CG1-CG1 4.13Å; V39-I244 HydrophobicContact CG2-CG1 4.01Å
40	D	85.1	Confident	81.3	Confident	84 Å²	84	74.2 Å²	74.2	45%	0.449	40%	0.398	S	S	.	.			trans	-64.7	143.2	170.2	-59.1	-28.6	0	0	0	112	E38 K75	E38-D40 PolarHBondContact O-N 3.06Å; D40-K75 IonicContact OD2-NZ 2.62Å; D40-K75 PolarHBondContact OD2-NZ 3.26Å
41	V	89.2	Confident	83.8	Confident	75 Å²	75	70 Å²	70	46%	0.455	38%	0.378	S	S	.	.			trans	-91.1	118.2	170.1	-179.1	0	0	0	0	109.7	Q71 R72	V41-Q71 HydrophobicContact CG1-CB 4.1Å; V41-R72 HydrophobicContact CG2-CG 4.29Å
42	T	90.3	Very high	85.7	Confident	10 Å²	10	75.6 Å²	75.6	6%	0.061	40%	0.401	C	S	.	.			trans	-105.2	110.9	175.9	-50.7	0	0	0	0	110	T44 T47 M48 Q71	T42-T44 PolarHBondContact O-N 3.43Å; T42-T47 WeakPolarHBondContact CG2-O 3.46Å; T42-T47 VanDerWaalsContact CG2-OG1 3.26Å; T42-T47 WeakPolarHBondContact CG2-OG1 3.44Å; T42-M48 HydrophobicContact CG2-CB 4.36Å; T42-M48 HydrophobicContact CG2-CG 3.51Å; T42-Q71 PolarHBondContact N-O 3.24Å; T42-Q71 WeakPolarHBondContact O-CA 3.37Å; T42-Q71 WeakPolarHBondContact O-CB 3.48Å; T42-Q71 VanDerWaalsContact O-CG 3.27Å; T42-Q71 WeakPolarHBondContact O-CG 3.47Å
43	P	88.4	Confident	87.5	Confident	71 Å²	71	71 Å²	71	46%	0.461	38%	0.382	S	S	.	.			trans	-77.5	-21.7	-160.6	29.2	-36.3	0	0	0	115.3	P66	P43-P66 VanDerWaalsContact O-CG 3.29Å; P43-P66 WeakPolarHBondContact O-CG 3.31Å
44	T	94.4	Very high	89.1	Confident	52 Å²	52	68.9 Å²	68.9	32%	0.319	37%	0.373	S	S	.	.	S	Bend	trans	-136.8	153.5	-175.9	66.4	0	0	0	0	111	T42 D46 T47 M48	T42-T44 PolarHBondContact O-N 3.43Å; T44-D46 VanDerWaalsContact C-N 3.28Å; T44-D46 PolarHBondContact O-N 2.71Å; T44-T47 PolarHBondContact N-OG1 3.32Å; T44-T47 PolarHBondContact O-N 3.33Å; T44-T47 PolarHBondContact O-OG1 3.28Å; T44-T47 WeakPolarHBondContact OG1-CG2 3.37Å; T44-T47 PolarHBondContact OG1-N 2.62Å; T44-T47 PolarHBondContact OG1-OG1 3.32Å; T44-M48 WeakPolarHBondContact O-CG 3.47Å
45	F	96.3	Very high	90.3	Very high	1 Å²	1	63 Å²	63	0%	0.004	35%	0.346	C	S	.	.	S	Bend	trans	-61.3	-36.8	177	-69.4	-65.7	0	0	0	112.2	T47 M48 L50 L55 I58 F63 P66 I74 I99	F45-T47 VanDerWaalsContact C-N 3.27Å; F45-T47 PolarHBondContact O-N 3.12Å; F45-M48 HydrophobicContact CD1-CE 4.39Å; F45-M48 HydrophobicContact CD1-SD 3.95Å; F45-M48 WeakPolarHBondContact O-CB 3.46Å; F45-M48 PolarHBondContact O-N 3.41Å; F45-M48 VanDerWaalsContact O-N 3.12Å; F45-L50 HydrophobicContact CD1-CD1 4.42Å; F45-L55 HydrophobicContact CB-CD2 4.41Å; F45-I58 HydrophobicContact CD1-CD1 4.26Å; F45-I58 HydrophobicContact CD1-CG2 4.21Å; F45-I58 HydrophobicContact CD2-CG2 3.75Å; F45-I58 HydrophobicContact CE1-CG2 4.31Å; F45-I58 HydrophobicContact CE2-CG2 3.86Å; F45-I58 HydrophobicContact CG-CG2 3.93Å; F45-I58 HydrophobicContact CZ-CG2 4.14Å; F45-F63 HydrophobicContact CE2-CB 3.91Å; F45-F63 HydrophobicContact CZ-CB 4.31Å; F45-P66 HydrophobicContact CD1-CB 4.24Å; F45-P66 HydrophobicContact CE1-CB 3.79Å; F45-P66 HydrophobicContact CE2-CB 4.11Å; F45-P66 HydrophobicContact CZ-CB 3.73Å; F45-I74 HydrophobicContact CE1-CD1 4.15Å; F45-I99 HydrophobicContact CE1-CD1 3.87Å; F45-I99 HydrophobicContact CZ-CD1 4.5Å
46	D	95.1	Very high	91.2	Very high	94 Å²	94	67.2 Å²	67.2	50%	0.503	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-59.4	-38.7	178.3	-52.7	-65.1	0	0	0	112.1	T44 M48 L55 Y59	T44-D46 VanDerWaalsContact C-N 3.28Å; T44-D46 PolarHBondContact O-N 2.71Å; D46-M48 VanDerWaalsContact C-N 3.26Å; D46-M48 PolarHBondContact O-N 3.24Å; D46-L55 WeakPolarHBondContact OD1-CD2 3.34Å; D46-Y59 VanDerWaalsContact CG-OH 3.24Å; D46-Y59 PolarHBondContact OD1-OH 2.87Å; D46-Y59 PolarHBondContact OD2-OH 3.41Å
47	T	95.4	Very high	92	Very high	83 Å²	83	65.8 Å²	65.8	51%	0.509	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-78.9	-2.1	-179.5	54.8	0	0	0	0	114.5	T42 T44 F45 G49	T42-T47 WeakPolarHBondContact CG2-O 3.46Å; T42-T47 VanDerWaalsContact CG2-OG1 3.26Å; T42-T47 WeakPolarHBondContact CG2-OG1 3.44Å; T44-T47 PolarHBondContact N-OG1 3.32Å; T44-T47 PolarHBondContact O-N 3.33Å; T44-T47 PolarHBondContact O-OG1 3.28Å; T44-T47 WeakPolarHBondContact OG1-CG2 3.37Å; T44-T47 PolarHBondContact OG1-N 2.62Å; T44-T47 PolarHBondContact OG1-OG1 3.32Å; F45-T47 VanDerWaalsContact C-N 3.27Å; F45-T47 PolarHBondContact O-N 3.12Å; T47-G49 VanDerWaalsContact C-N 3.33Å
48	M	96.2	Very high	93.2	Very high	11 Å²	11	56.2 Å²	56.2	5%	0.054	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-83.5	-6.5	179.9	-68.6	178.4	-177	0	0	113.6	T42 T44 F45 D46 L50 P66 I74	T42-M48 HydrophobicContact CG2-CB 4.36Å; T42-M48 HydrophobicContact CG2-CG 3.51Å; T44-M48 WeakPolarHBondContact O-CG 3.47Å; F45-M48 HydrophobicContact CD1-CE 4.39Å; F45-M48 HydrophobicContact CD1-SD 3.95Å; F45-M48 WeakPolarHBondContact O-CB 3.46Å; F45-M48 PolarHBondContact O-N 3.41Å; F45-M48 VanDerWaalsContact O-N 3.12Å; D46-M48 VanDerWaalsContact C-N 3.26Å; D46-M48 PolarHBondContact O-N 3.24Å; M48-L50 VanDerWaalsContact C-N 3.35Å; M48-L50 HydrophobicContact CB-CD1 4.23Å; M48-L50 HydrophobicContact CB-CD2 4.36Å; M48-L50 HydrophobicContact CB-CG 3.87Å; M48-L50 HydrophobicContact SD-CD1 4.5Å; M48-P66 HydrophobicContact CE-CB 3.72Å; M48-P66 HydrophobicContact CE-CG 3.83Å; M48-I74 HydrophobicContact CE-CD1 4.33Å; M48-I74 HydrophobicContact SD-CB 4.03Å; M48-I74 HydrophobicContact SD-CD1 3.81Å; M48-I74 HydrophobicContact SD-CG1 4.49Å; M48-I74 HydrophobicContact SD-CG2 3.93Å
49	G	96.2	Very high	94.4	Very high	57 Å²	57	54.8 Å²	54.8	59%	0.588	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	33.2	-177.4	0	0	0	0	0	112.9	T47 Q103	T47-G49 VanDerWaalsContact C-N 3.33Å; G49-Q103 PolarHBondContact O-NE2 3.49Å
50	L	97.8	Very high	95.2	Very high	14 Å²	14	56.8 Å²	56.8	7%	0.073	31%	0.309	C	S	.	.			trans	-77	150.7	177	-57.8	175.6	0	0	0	110.4	F45 M48 L54 L55 I58 I74 I99 Q103	F45-L50 HydrophobicContact CD1-CD1 4.42Å; M48-L50 VanDerWaalsContact C-N 3.35Å; M48-L50 HydrophobicContact CB-CD1 4.23Å; M48-L50 HydrophobicContact CB-CD2 4.36Å; M48-L50 HydrophobicContact CB-CG 3.87Å; M48-L50 HydrophobicContact SD-CD1 4.5Å; L50-L54 HydrophobicContact CD2-CD2 4.41Å; L50-L55 HydrophobicContact CB-CD1 3.96Å; L50-L55 HydrophobicContact CB-CG 4.3Å; L50-I58 HydrophobicContact CD1-CD1 3.63Å; L50-I74 HydrophobicContact CD2-CG2 4.19Å; L50-I99 HydrophobicContact CD1-CG2 3.83Å; L50-I99 HydrophobicContact CD2-CG2 4.11Å; L50-Q103 HydrophobicContact CD2-CB 4.23Å; L50-Q103 HydrophobicContact CD2-CG 4.05Å
51	R	97.7	Very high	95.6	Very high	78 Å²	78	57.5 Å²	57.5	29%	0.294	31%	0.306	S	S	.	.			trans	-62.8	143.8	174.2	66.5	-165.8	-58.1	163.3	8.5	110.9	D53 L54 L55 L105 M138	R51-D53 VanDerWaalsContact C-N 3.34Å; R51-D53 PolarHBondContact O-N 3.42Å; R51-L54 HydrophobicContact CG-CB 3.36Å; R51-L54 HydrophobicContact CG-CD2 4.35Å; R51-L54 WeakPolarHBondContact O-CB 3.44Å; R51-L54 PolarHBondContact O-N 3.4Å; R51-L54 VanDerWaalsContact O-N 3.09Å; R51-L55 PolarHBondContact O-N 3.34Å; R51-L105 PolarHBondContact NH1-O 3.34Å; R51-M138 VanDerWaalsContact NH1-CE 3.3Å
52	E	97.8	Very high	95.8	Very high	169 Å²	169	56.5 Å²	56.5	79%	0.79	31%	0.311	S	S	*	.	H	α-helix	trans	-56.6	-43.8	-174.3	-65.8	-179	179.1	0	0	113	L54 L55 R56	E52-L54 VanDerWaalsContact C-N 3.3Å; E52-L54 PolarHBondContact O-N 2.93Å; E52-L55 WeakPolarHBondContact O-CB 3.45Å; E52-L55 PolarHBondContact O-N 3.49Å; E52-R56 WeakPolarHBondContact O-CB 3.41Å; E52-R56 PolarHBondContact O-N 2.91Å
53	D	97.9	Very high	95.9	Very high	71 Å²	71	57.4 Å²	57.4	38%	0.38	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-38.7	179.1	-56.1	-29.3	0	0	0	112.6	R51 G57 M138	R51-D53 VanDerWaalsContact C-N 3.34Å; R51-D53 PolarHBondContact O-N 3.42Å; D53-G57 PolarHBondContact O-N 2.96Å; D53-G57 VanDerWaalsContact O-N 3.11Å; D53-M138 HydrophobicContact CB-CG 3.78Å
54	L	98.2	Very high	95.9	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-71.5	-42.2	177	178.1	56.2	0	0	0	110.8	L50 R51 E52 R56 G57 I58 I99 L102 Q103 M138	L50-L54 HydrophobicContact CD2-CD2 4.41Å; R51-L54 HydrophobicContact CG-CB 3.36Å; R51-L54 HydrophobicContact CG-CD2 4.35Å; R51-L54 WeakPolarHBondContact O-CB 3.44Å; R51-L54 PolarHBondContact O-N 3.4Å; R51-L54 VanDerWaalsContact O-N 3.09Å; E52-L54 VanDerWaalsContact C-N 3.3Å; E52-L54 PolarHBondContact O-N 2.93Å; L54-R56 VanDerWaalsContact C-N 3.29Å; L54-R56 PolarHBondContact O-N 3.35Å; L54-G57 CarbonylContact O-C 3.59Å; L54-G57 WeakPolarHBondContact O-CA 3.35Å; L54-G57 PolarHBondContact O-N 3.24Å; L54-I58 HydrophobicContact CD1-CD1 4.44Å; L54-I58 HydrophobicContact CD1-CG1 4.44Å; L54-I58 HydrophobicContact CG-CD1 4.1Å; L54-I58 WeakPolarHBondContact O-CG1 3.12Å; L54-I58 PolarHBondContact O-N 2.96Å; L54-I99 HydrophobicContact CD2-CG2 4.14Å; L54-I99 WeakPolarHBondContact CD2-O 3.42Å; L54-L102 HydrophobicContact CD1-CB 3.74Å; L54-L102 HydrophobicContact CD1-CD1 3.58Å; L54-L102 HydrophobicContact CD1-CG 4.3Å; L54-L102 HydrophobicContact CD2-CB 4.02Å; L54-Q103 HydrophobicContact CD2-CB 3.9Å; L54-M138 HydrophobicContact CB-SD 3.78Å; L54-M138 HydrophobicContact CD1-SD 4.07Å; L54-M138 HydrophobicContact CG-SD 4.41Å
55	L	97.8	Very high	95.7	Very high	21 Å²	21	67 Å²	67	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-60.2	-42.5	177.8	-126.3	153.4	0	0	0	110.9	F45 D46 L50 R51 E52 G57 I58 Y59	F45-L55 HydrophobicContact CB-CD2 4.41Å; D46-L55 WeakPolarHBondContact OD1-CD2 3.34Å; L50-L55 HydrophobicContact CB-CD1 3.96Å; L50-L55 HydrophobicContact CB-CG 4.3Å; R51-L55 PolarHBondContact O-N 3.34Å; E52-L55 WeakPolarHBondContact O-CB 3.45Å; E52-L55 PolarHBondContact O-N 3.49Å; L55-G57 VanDerWaalsContact C-N 3.35Å; L55-G57 PolarHBondContact O-N 3.3Å; L55-I58 PolarHBondContact O-N 2.97Å; L55-Y59 HydrophobicContact CD2-CD2 3.79Å; L55-Y59 HydrophobicContact CD2-CE2 3.17Å; L55-Y59 VanDerWaalsContact O-CD2 3.31Å; L55-Y59 WeakPolarHBondContact O-CD2 3.39Å; L55-Y59 PolarHBondContact O-N 3.47Å; L55-Y59 VanDerWaalsContact O-N 3.13Å
56	R	97.6	Very high	95.5	Very high	148 Å²	148	67.2 Å²	67.2	56%	0.558	35%	0.348	S	S	*	.	H	α-helix	trans	-60.2	-42.6	171.3	-172.7	-176.1	170.6	-175.6	-2.5	112	E52 L54 Y59 A60 Y137	E52-R56 WeakPolarHBondContact O-CB 3.41Å; E52-R56 PolarHBondContact O-N 2.91Å; L54-R56 VanDerWaalsContact C-N 3.29Å; L54-R56 PolarHBondContact O-N 3.35Å; R56-Y59 PolarHBondContact O-N 3.49Å; R56-A60 VanDerWaalsContact O-CB 3.24Å; R56-A60 WeakPolarHBondContact O-CB 3.32Å; R56-A60 PolarHBondContact O-N 2.9Å; R56-Y137 HydrophobicContact CB-CD2 4.03Å; R56-Y137 HydrophobicContact CB-CE2 4.38Å; R56-Y137 HydrophobicContact CG-CD2 3.71Å; R56-Y137 HydrophobicContact CG-CE2 3.67Å; R56-Y137 HydrophobicContact CG-CG 4.21Å; R56-Y137 VanDerWaalsContact CZ-CD1 3.47Å; R56-Y137 VanDerWaalsContact NE-CE1 3.31Å; R56-Y137 VanDerWaalsContact NH2-CE1 3.29Å
57	G	98	Very high	95.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-63.9	-40.8	176.5	0	0	0	0	0	113.4	D53 L54 L55 A60 Y61 L134	D53-G57 PolarHBondContact O-N 2.96Å; D53-G57 VanDerWaalsContact O-N 3.11Å; L54-G57 CarbonylContact O-C 3.59Å; L54-G57 WeakPolarHBondContact O-CA 3.35Å; L54-G57 PolarHBondContact O-N 3.24Å; L55-G57 VanDerWaalsContact C-N 3.35Å; L55-G57 PolarHBondContact O-N 3.3Å; G57-A60 PolarHBondContact O-N 3.09Å; G57-Y61 WeakPolarHBondContact O-CB 3.32Å; G57-Y61 PolarHBondContact O-N 3.04Å; G57-L134 WeakPolarHBondContact CA-O 3.47Å
58	I	97.3	Very high	94.8	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.5	-50.7	175.3	-71.7	166.3	0	0	0	110.9	F45 L50 L54 L55 Y61 G62 F63 I99 L134	F45-I58 HydrophobicContact CD1-CD1 4.26Å; F45-I58 HydrophobicContact CD1-CG2 4.21Å; F45-I58 HydrophobicContact CD2-CG2 3.75Å; F45-I58 HydrophobicContact CE1-CG2 4.31Å; F45-I58 HydrophobicContact CE2-CG2 3.86Å; F45-I58 HydrophobicContact CG-CG2 3.93Å; F45-I58 HydrophobicContact CZ-CG2 4.14Å; L50-I58 HydrophobicContact CD1-CD1 3.63Å; L54-I58 HydrophobicContact CD1-CD1 4.44Å; L54-I58 HydrophobicContact CD1-CG1 4.44Å; L54-I58 HydrophobicContact CG-CD1 4.1Å; L54-I58 WeakPolarHBondContact O-CG1 3.12Å; L54-I58 PolarHBondContact O-N 2.96Å; L55-I58 PolarHBondContact O-N 2.97Å; I58-Y61 PolarHBondContact O-N 2.84Å; I58-G62 PolarHBondContact O-N 2.98Å; I58-F63 HydrophobicContact CG2-CB 3.86Å; I58-F63 HydrophobicContact CG2-CD2 4.19Å; I58-F63 PolarHBondContact O-N 2.81Å; I58-I99 HydrophobicContact CD1-CD1 3.85Å; I58-I99 HydrophobicContact CD1-CG1 3.95Å; I58-I99 HydrophobicContact CD1-CG2 3.91Å; I58-I99 HydrophobicContact CG1-CD1 4.02Å; I58-I99 HydrophobicContact CG1-CG1 4.07Å; I58-L134 HydrophobicContact CG1-CD2 4.21Å
59	Y	96.4	Very high	94.5	Very high	89 Å²	89	62.9 Å²	62.9	35%	0.349	33%	0.332	S	S	.	.	H	α-helix	trans	-69.3	-39.2	179.7	-71.1	-52	0	0	0	112.6	D46 L55 R56 Y61 G62 F63	D46-Y59 VanDerWaalsContact CG-OH 3.24Å; D46-Y59 PolarHBondContact OD1-OH 2.87Å; D46-Y59 PolarHBondContact OD2-OH 3.41Å; L55-Y59 HydrophobicContact CD2-CD2 3.79Å; L55-Y59 HydrophobicContact CD2-CE2 3.17Å; L55-Y59 VanDerWaalsContact O-CD2 3.31Å; L55-Y59 WeakPolarHBondContact O-CD2 3.39Å; L55-Y59 PolarHBondContact O-N 3.47Å; L55-Y59 VanDerWaalsContact O-N 3.13Å; R56-Y59 PolarHBondContact O-N 3.49Å; Y59-Y61 VanDerWaalsContact C-N 3.27Å; Y59-Y61 PolarHBondContact O-N 3.44Å; Y59-G62 WeakPolarHBondContact O-CA 3.27Å; Y59-G62 PolarHBondContact O-N 3.11Å; Y59-F63 WeakPolarHBondContact CD1-O 3.29Å
60	A	95.6	Very high	94.4	Very high	64 Å²	64	60.5 Å²	60.5	53%	0.529	31%	0.306	S	S	.	.	H	α-helix	trans	-64.8	-30.7	176.4	0	0	0	0	0	112.9	R56 G57 G62 Y137	R56-A60 VanDerWaalsContact O-CB 3.24Å; R56-A60 WeakPolarHBondContact O-CB 3.32Å; R56-A60 PolarHBondContact O-N 2.9Å; G57-A60 PolarHBondContact O-N 3.09Å; A60-G62 PolarHBondContact O-N 3.37Å; A60-Y137 HydrophobicContact CB-CE2 3.8Å
61	Y	94.5	Very high	94	Very high	100 Å²	100	61.4 Å²	61.4	39%	0.392	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-17.1	172.7	-165.4	-101.5	0	0	0	112.9	G57 I58 Y59 F63 A133 L134	G57-Y61 WeakPolarHBondContact O-CB 3.32Å; G57-Y61 PolarHBondContact O-N 3.04Å; I58-Y61 PolarHBondContact O-N 2.84Å; Y59-Y61 VanDerWaalsContact C-N 3.27Å; Y59-Y61 PolarHBondContact O-N 3.44Å; Y61-F63 HydrophobicContact CD1-CD1 4.3Å; Y61-F63 HydrophobicContact CD1-CD2 4.31Å; Y61-F63 AromaticContact CD1-CE1 3.94Å; Y61-F63 HydrophobicContact CD1-CE1 3.94Å; Y61-F63 AromaticContact CD1-CE2 3.93Å; Y61-F63 HydrophobicContact CD1-CE2 3.93Å; Y61-F63 HydrophobicContact CD1-CG 4.48Å; Y61-F63 AromaticContact CD1-CZ 3.74Å; Y61-F63 HydrophobicContact CD1-CZ 3.74Å; Y61-F63 HydrophobicContact CE1-CE1 4.05Å; Y61-F63 HydrophobicContact CE1-CE2 4.33Å; Y61-F63 AromaticContact CE1-CZ 3.77Å; Y61-F63 HydrophobicContact CE1-CZ 3.77Å; Y61-A133 HydrophobicContact CD2-CB 3.56Å; Y61-A133 HydrophobicContact CE2-CB 3.52Å; Y61-L134 HydrophobicContact CD1-CD2 4.16Å; Y61-L134 HydrophobicContact CG-CD2 3.91Å
62	G	92.9	Very high	93.8	Very high	54 Å²	54	61.5 Å²	61.5	56%	0.557	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.7	14.8	178	0	0	0	0	0	114.8	I58 Y59 A60	I58-G62 PolarHBondContact O-N 2.98Å; Y59-G62 WeakPolarHBondContact O-CA 3.27Å; Y59-G62 PolarHBondContact O-N 3.11Å; A60-G62 PolarHBondContact O-N 3.37Å
63	F	92.5	Very high	93.7	Very high	28 Å²	28	53.4 Å²	53.4	12%	0.123	27%	0.273	C	S	.	.			trans	-81.3	125	171.2	-67.8	-26	0	0	0	110.7	F45 I58 Y59 Y61 A95 L134 Y376	F45-F63 HydrophobicContact CE2-CB 3.91Å; F45-F63 HydrophobicContact CZ-CB 4.31Å; I58-F63 HydrophobicContact CG2-CB 3.86Å; I58-F63 HydrophobicContact CG2-CD2 4.19Å; I58-F63 PolarHBondContact O-N 2.81Å; Y59-F63 WeakPolarHBondContact CD1-O 3.29Å; Y61-F63 HydrophobicContact CD1-CD1 4.3Å; Y61-F63 HydrophobicContact CD1-CD2 4.31Å; Y61-F63 AromaticContact CD1-CE1 3.94Å; Y61-F63 HydrophobicContact CD1-CE1 3.94Å; Y61-F63 AromaticContact CD1-CE2 3.93Å; Y61-F63 HydrophobicContact CD1-CE2 3.93Å; Y61-F63 HydrophobicContact CD1-CG 4.48Å; Y61-F63 AromaticContact CD1-CZ 3.74Å; Y61-F63 HydrophobicContact CD1-CZ 3.74Å; Y61-F63 HydrophobicContact CE1-CE1 4.05Å; Y61-F63 HydrophobicContact CE1-CE2 4.33Å; Y61-F63 AromaticContact CE1-CZ 3.77Å; Y61-F63 HydrophobicContact CE1-CZ 3.77Å; F63-A95 HydrophobicContact CE2-CB 3.67Å; F63-A95 HydrophobicContact CZ-CB 3.83Å; F63-L134 HydrophobicContact CD2-CD2 4.25Å; F63-L134 HydrophobicContact CE2-CD2 4.06Å; F63-Y376 HydrophobicContact CE1-CE1 4.48Å
64	E	88.3	Confident	93.6	Very high	174 Å²	174	50 Å²	50	81%	0.813	25%	0.254	S	S	*	.			trans	-100.3	-50.6	178.5	-63.4	179.1	178.9	0	0	111.9
65	K	89.9	Confident	93.5	Very high	152 Å²	152	52.8 Å²	52.8	66%	0.661	27%	0.266	S	S	*	.	S	Bend	trans	-127.1	137.6	-177	-169.8	178.5	-179.4	178	0	110.7
66	P	92.6	Very high	93.4	Very high	4 Å²	4	51.9 Å²	51.9	3%	0.026	26%	0.262	C	S	.	.			trans	-66.2	141.3	175.6	28.2	-36.2	0	0	0	111.5	P43 F45 M48 Q70 Q71	P43-P66 VanDerWaalsContact O-CG 3.29Å; P43-P66 WeakPolarHBondContact O-CG 3.31Å; F45-P66 HydrophobicContact CD1-CB 4.24Å; F45-P66 HydrophobicContact CE1-CB 3.79Å; F45-P66 HydrophobicContact CE2-CB 4.11Å; F45-P66 HydrophobicContact CZ-CB 3.73Å; M48-P66 HydrophobicContact CE-CB 3.72Å; M48-P66 HydrophobicContact CE-CG 3.83Å; P66-Q70 VanDerWaalsContact CA-OE1 3.24Å; P66-Q70 HydrophobicContact CB-CB 3.79Å; P66-Q71 HydrophobicContact CB-CG 3.88Å; P66-Q71 HydrophobicContact CG-CG 3.68Å; P66-Q71 PolarHBondContact O-NE2 2.98Å
67	S	88.6	Confident	93.4	Very high	31 Å²	31	44.9 Å²	44.9	22%	0.217	24%	0.235	C	C	.	.			trans	-69.8	165.9	170.8	74.6	0	0	0	0	112	I69 Q70 Q71 T91	S67-I69 PolarHBondContact O-N 2.89Å; S67-I69 VanDerWaalsContact O-N 3.17Å; S67-I69 WeakPolarHBondContact OG-CG2 3.32Å; S67-Q70 WeakPolarHBondContact O-CB 3.46Å; S67-Q70 PolarHBondContact O-N 3.07Å; S67-Q70 VanDerWaalsContact OG-CG 3.32Å; S67-Q70 WeakPolarHBondContact OG-CG 3.34Å; S67-Q71 VanDerWaalsContact O-CG 3.28Å; S67-Q71 WeakPolarHBondContact O-CG 3.26Å; S67-Q71 PolarHBondContact O-N 3.18Å; S67-T91 WeakPolarHBondContact CB-O 3.46Å; S67-T91 PolarHBondContact OG-O 2.81Å
68	A	87.4	Confident	93.4	Very high	58 Å²	58	47 Å²	47	48%	0.479	25%	0.246	S	C	.	.	H	α-helix	trans	-55.1	-37.4	-177.6	0	0	0	0	0	113.5	R72	A68-R72 WeakPolarHBondContact O-CG 2.98Å; A68-R72 PolarHBondContact O-NH1 2.98Å
69	I	89.9	Confident	93.3	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-72.7	-39.3	176.4	-171.4	60.7	0	0	0	111.6	S67 Q71 R72 A73 A85 I244	S67-I69 PolarHBondContact O-N 2.89Å; S67-I69 VanDerWaalsContact O-N 3.17Å; S67-I69 WeakPolarHBondContact OG-CG2 3.32Å; I69-Q71 PolarHBondContact O-N 2.75Å; I69-R72 PolarHBondContact O-N 3.33Å; I69-A73 HydrophobicContact CD1-CB 4.18Å; I69-A73 HydrophobicContact CG1-CB 4.39Å; I69-A73 VanDerWaalsContact O-CB 3.27Å; I69-A73 WeakPolarHBondContact O-CB 3.43Å; I69-A73 PolarHBondContact O-N 3.17Å; I69-A85 HydrophobicContact CD1-CB 3.94Å; I69-I244 HydrophobicContact CD1-CB 4.32Å; I69-I244 HydrophobicContact CD1-CG2 3.63Å
70	Q	93.4	Very high	93.3	Very high	7 Å²	7	50.4 Å²	50.4	3%	0.033	28%	0.275	C	S	.	.	H	α-helix	trans	-63.8	-41.4	177.2	-69.4	168.5	-8.9	0	0	111.6	P66 S67 R72 I74 G92 T96	P66-Q70 VanDerWaalsContact CA-OE1 3.24Å; P66-Q70 HydrophobicContact CB-CB 3.79Å; S67-Q70 WeakPolarHBondContact O-CB 3.46Å; S67-Q70 PolarHBondContact O-N 3.07Å; S67-Q70 VanDerWaalsContact OG-CG 3.32Å; S67-Q70 WeakPolarHBondContact OG-CG 3.34Å; Q70-R72 PolarHBondContact O-N 3.23Å; Q70-R72 VanDerWaalsContact O-N 3.17Å; Q70-I74 HydrophobicContact CB-CD1 3.78Å; Q70-I74 HydrophobicContact CB-CG1 4.39Å; Q70-I74 HydrophobicContact CG-CD1 4.17Å; Q70-I74 WeakPolarHBondContact O-CB 3.38Å; Q70-I74 WeakPolarHBondContact O-CG1 3.34Å; Q70-I74 PolarHBondContact O-N 3.29Å; Q70-G92 PolarHBondContact NE2-O 3.13Å; Q70-T96 WeakPolarHBondContact CG-OG1 3.39Å
71	Q	90.6	Very high	93.3	Very high	33 Å²	33	50.3 Å²	50.3	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-59.4	-25.8	177.7	-68.3	170.8	25.9	0	0	113.5	V41 T42 P66 S67 I69	V41-Q71 HydrophobicContact CG1-CB 4.1Å; T42-Q71 PolarHBondContact N-O 3.24Å; T42-Q71 WeakPolarHBondContact O-CA 3.37Å; T42-Q71 WeakPolarHBondContact O-CB 3.48Å; T42-Q71 VanDerWaalsContact O-CG 3.27Å; T42-Q71 WeakPolarHBondContact O-CG 3.47Å; P66-Q71 HydrophobicContact CB-CG 3.88Å; P66-Q71 HydrophobicContact CG-CG 3.68Å; P66-Q71 PolarHBondContact O-NE2 2.98Å; S67-Q71 VanDerWaalsContact O-CG 3.28Å; S67-Q71 WeakPolarHBondContact O-CG 3.26Å; S67-Q71 PolarHBondContact O-N 3.18Å; I69-Q71 PolarHBondContact O-N 2.75Å
72	R	92	Very high	93.5	Very high	80 Å²	80	46.2 Å²	46.2	30%	0.302	25%	0.246	S	C	.	.	H	α-helix	trans	-104.2	-45	-174.3	-71.8	173	179.2	72.3	-1.3	112.6	V39 V41 A68 I69 Q70 Q76 I244	V39-R72 HydrophobicContact CG1-CB 3.56Å; V39-R72 HydrophobicContact CG1-CG 3.79Å; V41-R72 HydrophobicContact CG2-CG 4.29Å; A68-R72 WeakPolarHBondContact O-CG 2.98Å; A68-R72 PolarHBondContact O-NH1 2.98Å; I69-R72 PolarHBondContact O-N 3.33Å; Q70-R72 PolarHBondContact O-N 3.23Å; Q70-R72 VanDerWaalsContact O-N 3.17Å; R72-Q76 WeakPolarHBondContact O-CG 3.42Å; R72-I244 HydrophobicContact CB-CD1 4Å; R72-I244 HydrophobicContact CB-CG2 4.3Å
73	A	95.6	Very high	93.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-87.5	-35.7	-167.9	0	0	0	0	0	113.9	I69 K75 Q76 I77 A85 T96 I244	I69-A73 HydrophobicContact CD1-CB 4.18Å; I69-A73 HydrophobicContact CG1-CB 4.39Å; I69-A73 VanDerWaalsContact O-CB 3.27Å; I69-A73 WeakPolarHBondContact O-CB 3.43Å; I69-A73 PolarHBondContact O-N 3.17Å; A73-K75 VanDerWaalsContact C-N 3.33Å; A73-K75 PolarHBondContact O-N 2.93Å; A73-Q76 PolarHBondContact O-N 2.75Å; A73-Q76 VanDerWaalsContact O-N 3.11Å; A73-I77 WeakPolarHBondContact O-CG1 3.47Å; A73-I77 PolarHBondContact O-N 2.96Å; A73-A85 HydrophobicContact CB-CB 4.36Å; A73-T96 HydrophobicContact CB-CG2 3.56Å; A73-I244 VanDerWaalsContact CA-CD1 3.46Å; A73-I244 HydrophobicContact CB-CD1 3.6Å
74	I	96.9	Very high	93.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-55.6	-50.8	-175.3	-67.3	175.7	0	0	0	110.2	F45 M48 L50 Q70 Q76 I77 I78 T96 I99	F45-I74 HydrophobicContact CE1-CD1 4.15Å; M48-I74 HydrophobicContact CE-CD1 4.33Å; M48-I74 HydrophobicContact SD-CB 4.03Å; M48-I74 HydrophobicContact SD-CD1 3.81Å; M48-I74 HydrophobicContact SD-CG1 4.49Å; M48-I74 HydrophobicContact SD-CG2 3.93Å; L50-I74 HydrophobicContact CD2-CG2 4.19Å; Q70-I74 HydrophobicContact CB-CD1 3.78Å; Q70-I74 HydrophobicContact CB-CG1 4.39Å; Q70-I74 HydrophobicContact CG-CD1 4.17Å; Q70-I74 WeakPolarHBondContact O-CB 3.38Å; Q70-I74 WeakPolarHBondContact O-CG1 3.34Å; Q70-I74 PolarHBondContact O-N 3.29Å; I74-Q76 VanDerWaalsContact C-N 3.27Å; I74-Q76 PolarHBondContact O-N 3.25Å; I74-I77 PolarHBondContact O-N 3.2Å; I74-I78 HydrophobicContact CG2-CG2 4.3Å; I74-I78 WeakPolarHBondContact O-CG1 3.41Å; I74-I78 WeakPolarHBondContact O-CG2 3.43Å; I74-I78 PolarHBondContact O-N 3.29Å; I74-T96 HydrophobicContact CG1-CG2 3.92Å; I74-I99 HydrophobicContact CD1-CB 4.37Å; I74-I99 HydrophobicContact CD1-CD1 4.11Å; I74-I99 HydrophobicContact CD1-CG2 4.14Å; I74-I99 HydrophobicContact CG2-CG2 4.2Å
75	K	95.6	Very high	93.9	Very high	57 Å²	57	34 Å²	34	25%	0.248	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-35.2	-178.8	-166.6	-179.5	-177.9	-170.8	0	113	D40 A73 I78 K79	D40-K75 IonicContact OD2-NZ 2.62Å; D40-K75 PolarHBondContact OD2-NZ 3.26Å; A73-K75 VanDerWaalsContact C-N 3.33Å; A73-K75 PolarHBondContact O-N 2.93Å; K75-I78 VanDerWaalsContact O-CG1 3.26Å; K75-I78 WeakPolarHBondContact O-CG1 3.29Å; K75-K79 WeakPolarHBondContact O-CD 3.38Å; K75-K79 WeakPolarHBondContact O-CG 3.26Å; K75-K79 PolarHBondContact O-N 3.43Å
76	Q	96.6	Very high	93.9	Very high	3 Å²	3	27.6 Å²	27.6	1%	0.014	15%	0.147	C	C	.	.	H	α-helix	trans	-76	-39.1	-178.9	-56.2	-61.8	-12.2	0	0	111.4	E38 R72 A73 I74 K79 R81 V83 I242	E38-Q76 PolarHBondContact O-NE2 2.81Å; R72-Q76 WeakPolarHBondContact O-CG 3.42Å; A73-Q76 PolarHBondContact O-N 2.75Å; A73-Q76 VanDerWaalsContact O-N 3.11Å; I74-Q76 VanDerWaalsContact C-N 3.27Å; I74-Q76 PolarHBondContact O-N 3.25Å; Q76-K79 PolarHBondContact O-N 2.81Å; Q76-R81 PolarHBondContact O-N 3.01Å; Q76-V83 HydrophobicContact CB-CG2 3.89Å; Q76-I242 HydrophobicContact CB-CG2 4.34Å; Q76-I242 HydrophobicContact CG-CG2 4.11Å
77	I	97.8	Very high	93.5	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-66.1	-45.4	176.3	-58.9	164.9	0	0	0	110.5	A73 I74 K79 G80 V83 T96 M188 Q218 V220	A73-I77 WeakPolarHBondContact O-CG1 3.47Å; A73-I77 PolarHBondContact O-N 2.96Å; I74-I77 PolarHBondContact O-N 3.2Å; I77-K79 PolarHBondContact O-N 3.43Å; I77-G80 PolarHBondContact O-N 3.42Å; I77-V83 HydrophobicContact CG1-CB 4.02Å; I77-V83 HydrophobicContact CG1-CG1 4.25Å; I77-V83 HydrophobicContact CG1-CG2 3.76Å; I77-T96 HydrophobicContact CD1-CG2 4.27Å; I77-M188 HydrophobicContact CG2-CE 3.84Å; I77-M188 HydrophobicContact CG2-SD 4.09Å; I77-Q218 PolarHBondContact O-NE2 3.02Å; I77-V220 HydrophobicContact CD1-CG1 3.84Å; I77-V220 HydrophobicContact CG1-CG1 4.14Å; I77-V220 HydrophobicContact CG1-CG2 4.21Å; I77-V220 HydrophobicContact CG2-CG2 3.84Å
78	I	96.8	Very high	93	Very high	43 Å²	43	28.2 Å²	28.2	22%	0.221	15%	0.147	C	C	.	.	H	α-helix	trans	-67.6	-22.1	-179.1	67.3	178.7	0	0	0	113.1	I74 K75 G80 Q103	I74-I78 HydrophobicContact CG2-CG2 4.3Å; I74-I78 WeakPolarHBondContact O-CG1 3.41Å; I74-I78 WeakPolarHBondContact O-CG2 3.43Å; I74-I78 PolarHBondContact O-N 3.29Å; K75-I78 VanDerWaalsContact O-CG1 3.26Å; K75-I78 WeakPolarHBondContact O-CG1 3.29Å; I78-G80 PolarHBondContact O-N 3.37Å; I78-Q103 HydrophobicContact CB-CG 4.21Å; I78-Q103 HydrophobicContact CG2-CB 3.86Å; I78-Q103 HydrophobicContact CG2-CG 3.7Å
79	K	96.1	Very high	92.4	Very high	119 Å²	119	25.6 Å²	25.6	52%	0.517	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-7	171.7	-77.3	172.6	177.3	-178.4	0	113.1	K75 Q76 I77	K75-K79 WeakPolarHBondContact O-CD 3.38Å; K75-K79 WeakPolarHBondContact O-CG 3.26Å; K75-K79 PolarHBondContact O-N 3.43Å; Q76-K79 PolarHBondContact O-N 2.81Å; I77-K79 PolarHBondContact O-N 3.43Å
80	G	96	Very high	91.6	Very high	43 Å²	43	25.9 Å²	25.9	44%	0.443	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	83	12.3	-179.7	0	0	0	0	0	114.7	I77 I78	I77-G80 PolarHBondContact O-N 3.42Å; I78-G80 PolarHBondContact O-N 3.37Å
81	R	96.3	Very high	91	Very high	61 Å²	61	27 Å²	27	23%	0.23	14%	0.137	C	C	.	.			trans	-74.5	144.9	174.8	-64	-65.2	-64.1	-84.9	5.7	110.2	E38 Q76 V83 Q218 D240 I242	E38-R81 IonicContact OE2-CZ 2.75Å; E38-R81 IonicContact OE2-NH1 2.77Å; E38-R81 PolarHBondContact OE2-NH1 2.87Å; E38-R81 IonicContact OE2-NH2 3.75Å; Q76-R81 PolarHBondContact O-N 3.01Å; R81-V83 WeakPolarHBondContact O-CG2 3.5Å; R81-Q218 PolarHBondContact O-NE2 3.09Å; R81-D240 IonicContact CZ-OD2 2.87Å; R81-D240 PolarHBondContact NH2-O 2.9Å; R81-D240 IonicContact NH2-OD2 2.64Å; R81-D240 PolarHBondContact NH2-OD2 3.3Å; R81-I242 HydrophobicContact CB-CG1 4.1Å; R81-I242 HydrophobicContact CG-CG1 4.3Å
82	D	97	Very high	90.7	Very high	15 Å²	15	25.7 Å²	25.7	8%	0.08	13%	0.132	C	C	.	.			trans	-62.6	137.5	163.4	-78	-3.6	0	0	0	109.1	Q218 V219 M238 T239 P241 I242	D82-Q218 WeakPolarHBondContact OD1-CA 3.24Å; D82-V219 VanDerWaalsContact CA-O 3.3Å; D82-V219 WeakPolarHBondContact CA-O 3.47Å; D82-V219 PolarHBondContact OD1-N 3.16Å; D82-M238 HydrophobicContact CB-CB 4.28Å; D82-M238 HydrophobicContact CB-CE 3.99Å; D82-M238 WeakPolarHBondContact OD2-CA 3.44Å; D82-M238 WeakPolarHBondContact OD2-CB 3.27Å; D82-T239 PolarHBondContact OD2-N 3.49Å; D82-P241 HydrophobicContact CB-CB 3.99Å; D82-P241 CarbonylContact O-C 3.59Å; D82-P241 WeakPolarHBondContact O-CA 3.35Å; D82-I242 PolarHBondContact O-N 3.01Å
83	V	96.1	Very high	90.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.4	-174	176.1	0	0	0	0	110.7	Q76 I77 R81 A85 V219 V220 L221 M238 I242	Q76-V83 HydrophobicContact CB-CG2 3.89Å; I77-V83 HydrophobicContact CG1-CB 4.02Å; I77-V83 HydrophobicContact CG1-CG1 4.25Å; I77-V83 HydrophobicContact CG1-CG2 3.76Å; R81-V83 WeakPolarHBondContact O-CG2 3.5Å; V83-A85 HydrophobicContact CG1-CB 3.99Å; V83-V219 PolarHBondContact N-O 2.96Å; V83-V219 VanDerWaalsContact N-O 3.11Å; V83-V220 HydrophobicContact CB-CG1 4.39Å; V83-V220 CarbonylContact O-C 3.55Å; V83-V220 WeakPolarHBondContact O-CA 3.48Å; V83-L221 PolarHBondContact O-N 3.26Å; V83-M238 WeakPolarHBondContact O-CE 3.26Å; V83-I242 CarbonylContact C-O 3.57Å; V83-I242 WeakPolarHBondContact CA-O 3.36Å; V83-I242 HydrophobicContact CG2-CB 4.36Å
84	I	94.9	Very high	90.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	110.9	166.3	-61.1	168.3	0	0	0	106.6	L221 L226 L231 T234 M238 P241 I242 R243 I244 L245	I84-L221 HydrophobicContact CG1-CB 4.42Å; I84-L221 HydrophobicContact CG2-CD2 4.4Å; I84-L226 HydrophobicContact CG2-CD1 3.5Å; I84-L226 VanDerWaalsContact CG2-CD1 3.5Å; I84-L231 HydrophobicContact CG2-CD2 4.03Å; I84-T234 HydrophobicContact CD1-CG2 3.72Å; I84-T234 WeakPolarHBondContact CD1-OG1 3.46Å; I84-T234 HydrophobicContact CG1-CG2 4.21Å; I84-M238 HydrophobicContact CD1-SD 3.97Å; I84-M238 HydrophobicContact CG1-CE 3.96Å; I84-M238 HydrophobicContact CG1-SD 3.65Å; I84-P241 HydrophobicContact CD1-CB 3.98Å; I84-P241 HydrophobicContact CD1-CG 3.84Å; I84-P241 HydrophobicContact CG1-CB 4.12Å; I84-I242 PolarHBondContact N-O 3.29Å; I84-R243 HydrophobicContact CB-CG 4.41Å; I84-R243 HydrophobicContact CD1-CG 4.3Å; I84-R243 CarbonylContact O-C 3.56Å; I84-R243 WeakPolarHBondContact O-CA 3.38Å; I84-I244 PolarHBondContact O-N 3.36Å; I84-L245 HydrophobicContact CG2-CD2 4.29Å
85	A	92.6	Very high	90.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.5	-177.2	0	0	0	0	0	111.4	I69 A73 V83 L221 I222 S223	I69-A85 HydrophobicContact CD1-CB 3.94Å; A73-A85 HydrophobicContact CB-CB 4.36Å; V83-A85 HydrophobicContact CG1-CB 3.99Å; A85-L221 PolarHBondContact N-O 2.92Å; A85-I222 HydrophobicContact CB-CD1 3.47Å; A85-I222 VanDerWaalsContact CB-CD1 3.47Å; A85-I222 WeakPolarHBondContact O-CA 3.46Å; A85-S223 PolarHBondContact O-N 3.36Å
86	Q	89.7	Confident	90.5	Very high	16 Å²	16	21.3 Å²	21.3	8%	0.075	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	137.9	173.3	-162	-179.7	-2.3	0	0	110	S223 A224 L226 I244 L245 V246	Q86-S223 WeakPolarHBondContact CA-O 3.2Å; Q86-A224 WeakPolarHBondContact CG-O 3.21Å; Q86-A224 PolarHBondContact NE2-O 3.38Å; Q86-A224 VanDerWaalsContact NE2-O 3.12Å; Q86-L226 HydrophobicContact CB-CD1 3.77Å; Q86-L226 HydrophobicContact CB-CG 4.35Å; Q86-L226 HydrophobicContact CG-CD1 4.17Å; Q86-L226 HydrophobicContact CG-CG 4.21Å; Q86-I244 PolarHBondContact N-O 3.36Å; Q86-L245 HydrophobicContact CB-CD2 4.17Å; Q86-V246 WeakPolarHBondContact O-CG2 3.48Å
87	S	83.4	Confident	90.6	Very high	5 Å²	5	21.2 Å²	21.2	4%	0.035	12%	0.118	C	C	.	.			trans	-161	160.1	169.7	-176.6	0	0	0	0	110.5	T91 K93 S223 A224	S87-T91 WeakPolarHBondContact CB-OG1 3.2Å; S87-T91 WeakPolarHBondContact OG-CB 3.3Å; S87-T91 PolarHBondContact OG-OG1 3.42Å; S87-K93 WeakPolarHBondContact O-CD 3.37Å; S87-K93 PolarHBondContact O-NZ 3.44Å; S87-S223 PolarHBondContact N-O 3.24Å; S87-A224 VanDerWaalsContact O-CA 3.27Å; S87-A224 WeakPolarHBondContact O-CA 3.41Å
88	Q	78.4	Confident	90.6	Very high	43 Å²	43	21.1 Å²	21.1	20%	0.201	12%	0.118	C	C	.	.			trans	-57.8	160.3	-179.4	-52.6	87.8	-17.2	0	0	112.4	T91 K93 E250 L251 L253	Q88-T91 HydrophobicContact CB-CG2 3.78Å; Q88-T91 WeakPolarHBondContact O-CG2 3.44Å; Q88-T91 PolarHBondContact O-OG1 3.37Å; Q88-K93 VanDerWaalsContact C-NZ 3.3Å; Q88-K93 PolarHBondContact O-NZ 3.29Å; Q88-E250 PolarHBondContact NE2-O 3.26Å; Q88-L251 WeakPolarHBondContact CG-O 3.38Å; Q88-L253 HydrophobicContact CB-CD2 3.67Å; Q88-L253 HydrophobicContact CB-CG 4.39Å; Q88-L253 HydrophobicContact CG-CD2 4.39Å
89	S	75.6	Confident	90.7	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.021	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	140.7	174.2	-75	0	0	0	0	110.9	T91	S89-T91 VanDerWaalsContact C-N 3.34Å; S89-T91 PolarHBondContact O-N 3.4Å
90	G	73.1	Confident	90.8	Very high	14 Å²	14	13.4 Å²	13.4	14%	0.144	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	11.8	175.5	0	0	0	0	0	116.5	Y376	G90-Y376 PolarHBondContact O-N 3.19Å
91	T	79.8	Confident	90.9	Very high	31 Å²	31	11.4 Å²	11.4	19%	0.19	6%	0.062	C	C	.	.	S	Bend	trans	-93.4	9.2	-178.9	59.8	0	0	0	0	114.9	S67 S87 Q88 S89	S67-T91 WeakPolarHBondContact CB-O 3.46Å; S67-T91 PolarHBondContact OG-O 2.81Å; S87-T91 WeakPolarHBondContact CB-OG1 3.2Å; S87-T91 WeakPolarHBondContact OG-CB 3.3Å; S87-T91 PolarHBondContact OG-OG1 3.42Å; Q88-T91 HydrophobicContact CB-CG2 3.78Å; Q88-T91 WeakPolarHBondContact O-CG2 3.44Å; Q88-T91 PolarHBondContact O-OG1 3.37Å; S89-T91 VanDerWaalsContact C-N 3.34Å; S89-T91 PolarHBondContact O-N 3.4Å
92	G	84.9	Confident	91.1	Very high	5 Å²	5	8.5 Å²	8.5	5%	0.052	5%	0.051	C	C	.	.	S	Bend	trans	87.6	23.2	179.6	0	0	0	0	0	115.6	Q70 T94 A95 T96	Q70-G92 PolarHBondContact NE2-O 3.13Å; G92-T94 VanDerWaalsContact C-N 3.34Å; G92-T94 PolarHBondContact O-N 3.24Å; G92-A95 PolarHBondContact O-N 3.1Å; G92-T96 PolarHBondContact O-N 2.72Å; G92-T96 PolarHBondContact O-OG1 3.3Å
93	K	91.1	Very high	91.1	Very high	15 Å²	15	10 Å²	10	7%	0.065	6%	0.057	C	C	.	.	H	α-helix	trans	-51.3	-48.8	170.7	-72.3	-164.9	-64.1	-86.9	0	113	S87 Q88 A95 T96 F97 I222	S87-K93 WeakPolarHBondContact O-CD 3.37Å; S87-K93 PolarHBondContact O-NZ 3.44Å; Q88-K93 VanDerWaalsContact C-NZ 3.3Å; Q88-K93 PolarHBondContact O-NZ 3.29Å; K93-A95 PolarHBondContact O-N 3.28Å; K93-T96 WeakPolarHBondContact O-CB 3.42Å; K93-T96 PolarHBondContact O-N 3.13Å; K93-T96 VanDerWaalsContact O-N 3.15Å; K93-F97 VanDerWaalsContact O-CD1 3.31Å; K93-F97 WeakPolarHBondContact O-CD1 3.32Å; K93-F97 PolarHBondContact O-N 2.99Å; K93-I222 HydrophobicContact CB-CG2 3.7Å; K93-I222 HydrophobicContact CD-CG2 3.8Å; K93-I222 HydrophobicContact CG-CG2 4.13Å
94	T	93.2	Very high	91.2	Very high	26 Å²	26	12.2 Å²	12.2	16%	0.16	7%	0.072	C	C	.	.	H	α-helix	trans	-60.8	-46.2	178.4	-52.9	0	0	0	0	112.1	G92 T96 F97 C98 I127	G92-T94 VanDerWaalsContact C-N 3.34Å; G92-T94 PolarHBondContact O-N 3.24Å; T94-T96 VanDerWaalsContact C-N 3.27Å; T94-T96 PolarHBondContact O-N 3.42Å; T94-F97 VanDerWaalsContact CA-CE1 3.43Å; T94-F97 HydrophobicContact CG2-CE1 4.22Å; T94-F97 HydrophobicContact CG2-CE2 4.37Å; T94-F97 HydrophobicContact CG2-CZ 3.77Å; T94-F97 PolarHBondContact O-N 2.91Å; T94-C98 WeakPolarHBondContact O-CB 3.45Å; T94-C98 PolarHBondContact O-N 3.33Å; T94-C98 PolarHBondContact O-SG 3.25Å; T94-I127 HydrophobicContact CG2-CG1 3.98Å
95	A	95.2	Very high	91.4	Very high	4 Å²	4	12.7 Å²	12.7	3%	0.033	8%	0.075	C	C	.	.	H	α-helix	trans	-61.7	-36.3	176.3	0	0	0	0	0	112.2	F63 G92 K93 F97 C98 I99	F63-A95 HydrophobicContact CE2-CB 3.67Å; F63-A95 HydrophobicContact CZ-CB 3.83Å; G92-A95 PolarHBondContact O-N 3.1Å; K93-A95 PolarHBondContact O-N 3.28Å; A95-F97 PolarHBondContact O-N 2.98Å; A95-C98 PolarHBondContact O-N 3.22Å; A95-I99 WeakPolarHBondContact O-CB 3.41Å; A95-I99 WeakPolarHBondContact O-CG1 3.44Å; A95-I99 PolarHBondContact O-N 3.38Å
96	T	96.9	Very high	91.7	Very high	1 Å²	1	16 Å²	16	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-54.2	-56.6	178.1	-58.2	0	0	0	0	111.3	Q70 A73 I74 I77 G92 K93 T94 S100	Q70-T96 WeakPolarHBondContact CG-OG1 3.39Å; A73-T96 HydrophobicContact CB-CG2 3.56Å; I74-T96 HydrophobicContact CG1-CG2 3.92Å; I77-T96 HydrophobicContact CD1-CG2 4.27Å; G92-T96 PolarHBondContact O-N 2.72Å; G92-T96 PolarHBondContact O-OG1 3.3Å; K93-T96 WeakPolarHBondContact O-CB 3.42Å; K93-T96 PolarHBondContact O-N 3.13Å; K93-T96 VanDerWaalsContact O-N 3.15Å; T94-T96 VanDerWaalsContact C-N 3.27Å; T94-T96 PolarHBondContact O-N 3.42Å; T96-S100 PolarHBondContact O-N 2.89Å; T96-S100 PolarHBondContact O-OG 3.02Å
97	F	97.5	Very high	92	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-75.7	-29.6	-179.8	68.1	-107.5	0	0	0	112.5	K93 T94 A95 S100 V101 I116 I127 V190 D192 I222	K93-F97 VanDerWaalsContact O-CD1 3.31Å; K93-F97 WeakPolarHBondContact O-CD1 3.32Å; K93-F97 PolarHBondContact O-N 2.99Å; T94-F97 VanDerWaalsContact CA-CE1 3.43Å; T94-F97 HydrophobicContact CG2-CE1 4.22Å; T94-F97 HydrophobicContact CG2-CE2 4.37Å; T94-F97 HydrophobicContact CG2-CZ 3.77Å; T94-F97 PolarHBondContact O-N 2.91Å; A95-F97 PolarHBondContact O-N 2.98Å; F97-S100 PolarHBondContact O-N 3.37Å; F97-V101 VanDerWaalsContact O-CB 3.32Å; F97-V101 WeakPolarHBondContact O-CB 3.42Å; F97-V101 WeakPolarHBondContact O-CG2 3.4Å; F97-V101 PolarHBondContact O-N 3.21Å; F97-I116 HydrophobicContact CD2-CD1 4.09Å; F97-I116 HydrophobicContact CE2-CD1 3.89Å; F97-I116 HydrophobicContact CE2-CG2 3.96Å; F97-I116 HydrophobicContact CZ-CG2 4.35Å; F97-I127 HydrophobicContact CE2-CG1 4.46Å; F97-I127 HydrophobicContact CE2-CG2 3.98Å; F97-I127 HydrophobicContact CZ-CD1 4.04Å; F97-I127 HydrophobicContact CZ-CG1 4.09Å; F97-I127 HydrophobicContact CZ-CG2 4.44Å; F97-V190 HydrophobicContact CB-CG1 3.98Å; F97-V190 HydrophobicContact CD1-CG1 4.1Å; F97-V190 HydrophobicContact CD2-CG1 3.85Å; F97-V190 HydrophobicContact CE1-CG1 4.45Å; F97-V190 HydrophobicContact CE2-CG1 4.32Å; F97-V190 HydrophobicContact CG-CG1 3.74Å; F97-D192 HydrophobicContact CE1-CB 3.98Å; F97-D192 HydrophobicContact CZ-CB 4.03Å; F97-I222 HydrophobicContact CD1-CB 4.39Å; F97-I222 HydrophobicContact CD1-CG1 3.91Å; F97-I222 HydrophobicContact CD1-CG2 4.37Å
98	C	98.3	Very high	92.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-45.1	177.3	-70.7	0	0	0	0	111.4	T94 A95 V101 L102 V130 L131 L134	T94-C98 WeakPolarHBondContact O-CB 3.45Å; T94-C98 PolarHBondContact O-N 3.33Å; T94-C98 PolarHBondContact O-SG 3.25Å; A95-C98 PolarHBondContact O-N 3.22Å; C98-V101 PolarHBondContact O-N 3.46Å; C98-L102 VanDerWaalsContact O-CG 3.27Å; C98-L102 WeakPolarHBondContact O-CG 3.47Å; C98-L102 PolarHBondContact O-N 2.81Å; C98-V130 HydrophobicContact CB-CG1 4.06Å; C98-L131 HydrophobicContact CB-CD2 3.93Å; C98-L131 HydrophobicContact CB-CG 4.27Å; C98-L134 HydrophobicContact CB-CD1 4.06Å
99	I	98.6	Very high	93.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-49	175	-69.2	167.7	0	0	0	109.9	F45 L50 L54 I58 I74 A95 V101 L102 Q103 L134	F45-I99 HydrophobicContact CE1-CD1 3.87Å; F45-I99 HydrophobicContact CZ-CD1 4.5Å; L50-I99 HydrophobicContact CD1-CG2 3.83Å; L50-I99 HydrophobicContact CD2-CG2 4.11Å; L54-I99 HydrophobicContact CD2-CG2 4.14Å; L54-I99 WeakPolarHBondContact CD2-O 3.42Å; I58-I99 HydrophobicContact CD1-CD1 3.85Å; I58-I99 HydrophobicContact CD1-CG1 3.95Å; I58-I99 HydrophobicContact CD1-CG2 3.91Å; I58-I99 HydrophobicContact CG1-CD1 4.02Å; I58-I99 HydrophobicContact CG1-CG1 4.07Å; I74-I99 HydrophobicContact CD1-CB 4.37Å; I74-I99 HydrophobicContact CD1-CD1 4.11Å; I74-I99 HydrophobicContact CD1-CG2 4.14Å; I74-I99 HydrophobicContact CG2-CG2 4.2Å; A95-I99 WeakPolarHBondContact O-CB 3.41Å; A95-I99 WeakPolarHBondContact O-CG1 3.44Å; A95-I99 PolarHBondContact O-N 3.38Å; I99-V101 PolarHBondContact O-N 3.46Å; I99-L102 PolarHBondContact O-N 2.82Å; I99-Q103 PolarHBondContact O-N 2.95Å; I99-L134 HydrophobicContact CG1-CD1 3.97Å
100	S	98.4	Very high	94.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-39.3	-179.2	-54.8	0	0	0	0	113.2	T96 F97 Q103 C104	T96-S100 PolarHBondContact O-N 2.89Å; T96-S100 PolarHBondContact O-OG 3.02Å; F97-S100 PolarHBondContact O-N 3.37Å; S100-Q103 PolarHBondContact O-N 2.77Å; S100-C104 PolarHBondContact O-N 3.4Å; S100-C104 PolarHBondContact O-SG 3.01Å; S100-C104 VanDerWaalsContact O-SG 3.36Å
101	V	98.7	Very high	95.8	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-58.8	-53.1	173.9	163.6	0	0	0	0	109.7	F97 C98 I99 Q103 C104 L105 A114 I116 L131 V164 M188 V190	F97-V101 VanDerWaalsContact O-CB 3.32Å; F97-V101 WeakPolarHBondContact O-CB 3.42Å; F97-V101 WeakPolarHBondContact O-CG2 3.4Å; F97-V101 PolarHBondContact O-N 3.21Å; C98-V101 PolarHBondContact O-N 3.46Å; I99-V101 PolarHBondContact O-N 3.46Å; V101-Q103 VanDerWaalsContact C-N 3.28Å; V101-Q103 PolarHBondContact O-N 2.96Å; V101-C104 PolarHBondContact O-N 3.08Å; V101-C104 VanDerWaalsContact O-N 3.11Å; V101-L105 WeakPolarHBondContact O-CG 3.38Å; V101-L105 PolarHBondContact O-N 3.07Å; V101-A114 HydrophobicContact CB-CB 4.47Å; V101-A114 HydrophobicContact CG1-CB 3.53Å; V101-A114 HydrophobicContact CG2-CB 4.18Å; V101-I116 HydrophobicContact CG2-CD1 4.27Å; V101-L131 HydrophobicContact CB-CD2 4.49Å; V101-L131 HydrophobicContact CG1-CD2 4.21Å; V101-V164 HydrophobicContact CG1-CG1 4.21Å; V101-V164 HydrophobicContact CG1-CG2 3.71Å; V101-M188 HydrophobicContact CB-SD 4.49Å; V101-M188 HydrophobicContact CG2-SD 3.5Å; V101-M188 VanDerWaalsContact CG2-SD 3.5Å; V101-V190 HydrophobicContact CG2-CG2 3.93Å
102	L	98.8	Very high	96.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.1	-41.5	-179.4	-70.8	169.2	0	0	0	111.8	L54 C98 I99 C104 L105 L131 L134 M138 V140	L54-L102 HydrophobicContact CD1-CB 3.74Å; L54-L102 HydrophobicContact CD1-CD1 3.58Å; L54-L102 HydrophobicContact CD1-CG 4.3Å; L54-L102 HydrophobicContact CD2-CB 4.02Å; C98-L102 VanDerWaalsContact O-CG 3.27Å; C98-L102 WeakPolarHBondContact O-CG 3.47Å; C98-L102 PolarHBondContact O-N 2.81Å; I99-L102 PolarHBondContact O-N 2.82Å; L102-C104 VanDerWaalsContact C-N 3.26Å; L102-C104 PolarHBondContact O-N 3.3Å; L102-L105 HydrophobicContact CD2-CD1 4.03Å; L102-L105 PolarHBondContact O-N 3.32Å; L102-L131 HydrophobicContact CD1-CD2 4.27Å; L102-L131 HydrophobicContact CD2-CD2 4.11Å; L102-L131 HydrophobicContact CG-CD2 3.87Å; L102-L134 HydrophobicContact CD1-CB 3.64Å; L102-M138 HydrophobicContact CB-CE 4.3Å; L102-M138 HydrophobicContact CB-SD 4.1Å; L102-M138 HydrophobicContact CD2-SD 4.43Å; L102-M138 VanDerWaalsContact O-CE 3.31Å; L102-M138 WeakPolarHBondContact O-CE 3.31Å; L102-V140 HydrophobicContact CD2-CB 4.13Å; L102-V140 HydrophobicContact CD2-CG1 3.99Å; L102-V140 HydrophobicContact CD2-CG2 3.89Å
103	Q	98.6	Very high	97.3	Very high	46 Å²	46	30 Å²	30	22%	0.215	15%	0.151	C	C	.	.	H	α-helix	trans	-58.8	-37.5	178.1	180	61.2	15.4	0	0	112.6	G49 L50 L54 I78 I99 S100 V101 L105	G49-Q103 PolarHBondContact O-NE2 3.49Å; L50-Q103 HydrophobicContact CD2-CB 4.23Å; L50-Q103 HydrophobicContact CD2-CG 4.05Å; L54-Q103 HydrophobicContact CD2-CB 3.9Å; I78-Q103 HydrophobicContact CB-CG 4.21Å; I78-Q103 HydrophobicContact CG2-CB 3.86Å; I78-Q103 HydrophobicContact CG2-CG 3.7Å; I99-Q103 PolarHBondContact O-N 2.95Å; S100-Q103 PolarHBondContact O-N 2.77Å; V101-Q103 VanDerWaalsContact C-N 3.28Å; V101-Q103 PolarHBondContact O-N 2.96Å; Q103-L105 VanDerWaalsContact C-N 3.34Å; Q103-L105 PolarHBondContact O-N 3.03Å
104	C	98.3	Very high	97.7	Very high	47 Å²	47	29.5 Å²	29.5	32%	0.318	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.6	-176.6	-64.3	0	0	0	0	114.5	S100 V101 L102 M188	S100-C104 PolarHBondContact O-N 3.4Å; S100-C104 PolarHBondContact O-SG 3.01Å; S100-C104 VanDerWaalsContact O-SG 3.36Å; V101-C104 PolarHBondContact O-N 3.08Å; V101-C104 VanDerWaalsContact O-N 3.11Å; L102-C104 VanDerWaalsContact C-N 3.26Å; L102-C104 PolarHBondContact O-N 3.3Å; C104-M188 HydrophobicContact CB-CE 4.03Å
105	L	98.4	Very high	98	Very high	10 Å²	10	28.2 Å²	28.2	5%	0.052	14%	0.141	C	C	.	.			trans	-79.3	134.1	-178.7	-64.7	179.8	0	0	0	112.9	R51 V101 L102 Q103 I107 Q113 V140 H163 V164	R51-L105 PolarHBondContact NH1-O 3.34Å; V101-L105 WeakPolarHBondContact O-CG 3.38Å; V101-L105 PolarHBondContact O-N 3.07Å; L102-L105 HydrophobicContact CD2-CD1 4.03Å; L102-L105 PolarHBondContact O-N 3.32Å; Q103-L105 VanDerWaalsContact C-N 3.34Å; Q103-L105 PolarHBondContact O-N 3.03Å; L105-I107 HydrophobicContact CB-CD1 3.96Å; L105-I107 HydrophobicContact CD1-CD1 4.22Å; L105-Q113 HydrophobicContact CD2-CB 3.83Å; L105-V140 HydrophobicContact CD1-CG2 3.48Å; L105-V140 VanDerWaalsContact CD1-CG2 3.48Å; L105-H163 HydrophobicContact CD1-CB 4.07Å; L105-H163 HydrophobicContact CD2-CB 4.34Å; L105-V164 HydrophobicContact CD1-CG2 3.74Å; L105-V164 HydrophobicContact CD2-CG2 4.02Å; L105-V164 HydrophobicContact CG-CG2 4.44Å
106	D	98.1	Very high	98.1	Very high	70 Å²	70	28 Å²	28	37%	0.374	14%	0.14	S	C	.	.			trans	-89.7	105.8	157.8	-175.2	-11.1	0	0	0	109.6	Q108 V109 Q113	D106-Q108 PolarHBondContact O-N 3.12Å; D106-Q108 WeakPolarHBondContact OD1-CB 3.44Å; D106-Q108 PolarHBondContact OD1-N 2.94Å; D106-V109 HydrophobicContact CB-CG2 4.49Å; D106-V109 PolarHBondContact O-N 3.37Å; D106-V109 WeakPolarHBondContact OD2-CG2 3.45Å; D106-Q113 PolarHBondContact O-NE2 3.18Å
107	I	97.7	Very high	98.1	Very high	31 Å²	31	28 Å²	28	16%	0.159	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.4	-176.5	-58.6	-58.5	0	0	0	112.6	L105 V109 M138 V140 H163	L105-I107 HydrophobicContact CB-CD1 3.96Å; L105-I107 HydrophobicContact CD1-CD1 4.22Å; I107-V109 VanDerWaalsContact C-N 3.34Å; I107-M138 HydrophobicContact CD1-CB 4.46Å; I107-M138 HydrophobicContact CD1-CE 4.01Å; I107-M138 HydrophobicContact CG1-CE 4.23Å; I107-M138 WeakPolarHBondContact CG2-O 3.36Å; I107-V140 HydrophobicContact CD1-CB 4.4Å; I107-V140 HydrophobicContact CD1-CG2 4.46Å; I107-H163 PolarHBondContact O-NE2 3.42Å; I107-H163 VanDerWaalsContact O-NE2 3.15Å
108	Q	97.6	Very high	98	Very high	170 Å²	170	28 Å²	28	79%	0.794	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-26.7	178.5	-58.6	-57.3	-42.5	0	0	111.6	D106 R110	D106-Q108 PolarHBondContact O-N 3.12Å; D106-Q108 WeakPolarHBondContact OD1-CB 3.44Å; D106-Q108 PolarHBondContact OD1-N 2.94Å; Q108-R110 PolarHBondContact O-N 2.83Å
109	V	97.6	Very high	97.7	Very high	58 Å²	58	28.3 Å²	28.3	35%	0.352	14%	0.141	S	C	.	.	S	Bend	trans	-93.4	98.3	179.4	-178.1	0	0	0	0	109.6	D106 I107 E111 Q113 H163	D106-V109 HydrophobicContact CB-CG2 4.49Å; D106-V109 PolarHBondContact O-N 3.37Å; D106-V109 WeakPolarHBondContact OD2-CG2 3.45Å; I107-V109 VanDerWaalsContact C-N 3.34Å; V109-E111 HydrophobicContact CG1-CB 4.2Å; V109-E111 HydrophobicContact CG1-CG 4.24Å; V109-E111 PolarHBondContact O-N 2.77Å; V109-Q113 PolarHBondContact O-NE2 3.03Å; V109-H163 PolarHBondContact O-CD2 3.07Å; V109-H163 VanDerWaalsContact O-CD2 3.29Å
110	R	95.8	Very high	97.3	Very high	95 Å²	95	28.8 Å²	28.8	36%	0.358	15%	0.145	S	C	.	.			trans	-78.2	55	-177.9	-153.1	-167	-147.6	-172.5	-137.1	114	Q108 Y160 G161	Q108-R110 PolarHBondContact O-N 2.83Å; R110-Y160 WeakPolarHBondContact CD-O 3.46Å; R110-Y160 PolarHBondContact NH1-OH 3.08Å; R110-Y160 PolarHBondContact NH2-O 2.64Å; R110-G161 WeakPolarHBondContact O-CA 3.15Å
111	E	97.9	Very high	96.9	Very high	46 Å²	46	32.7 Å²	32.7	22%	0.215	16%	0.159	C	C	.	.	S	Bend	trans	-129.3	159.4	174.9	-63.1	-175.2	-164.3	0	0	109.9	V109 Q113 Q162 H163 R184 A185	V109-E111 HydrophobicContact CG1-CB 4.2Å; V109-E111 HydrophobicContact CG1-CG 4.24Å; V109-E111 PolarHBondContact O-N 2.77Å; E111-Q113 PolarHBondContact O-N 3.28Å; E111-Q162 CarbonylContact C-O 3.58Å; E111-H163 WeakPolarHBondContact O-CA 3.48Å; E111-R184 IonicContact OE1-CZ 3.2Å; E111-R184 IonicContact OE1-NE 2.69Å; E111-R184 PolarHBondContact OE1-NE 3.47Å; E111-R184 IonicContact OE1-NH2 3.93Å; E111-R184 PolarHBondContact OE1-NH2 3.42Å; E111-R184 WeakPolarHBondContact OE2-CG 3.49Å; E111-R184 IonicContact OE2-CZ 2.9Å; E111-R184 IonicContact OE2-NE 2.62Å; E111-R184 PolarHBondContact OE2-NE 3.34Å; E111-R184 IonicContact OE2-NH2 3.25Å; E111-A185 HydrophobicContact CB-CB 3.76Å
112	T	98.8	Very high	96.4	Very high	7 Å²	7	33.5 Å²	33.5	4%	0.043	16%	0.163	C	C	.	.			trans	-69.9	117.5	179.8	-53.7	0	0	0	0	110	A114 Q162 V165 L181 A185 I186	T112-A114 WeakPolarHBondContact CG2-O 3.34Å; T112-Q162 WeakPolarHBondContact CA-O 3.44Å; T112-Q162 WeakPolarHBondContact CB-O 3.1Å; T112-Q162 PolarHBondContact N-O 3.14Å; T112-Q162 PolarHBondContact OG1-O 3.33Å; T112-V165 HydrophobicContact CG2-CB 4.08Å; T112-V165 HydrophobicContact CG2-CG2 3.75Å; T112-L181 HydrophobicContact CG2-CD1 4.16Å; T112-A185 CarbonylContact O-C 3.55Å; T112-A185 VanDerWaalsContact O-C 3.23Å; T112-I186 HydrophobicContact CG2-CD1 4.3Å; T112-I186 HydrophobicContact CG2-CG1 4.17Å; T112-I186 VanDerWaalsContact O-CG1 3.24Å; T112-I186 WeakPolarHBondContact O-CG1 3.38Å; T112-I186 PolarHBondContact O-N 2.92Å
113	Q	98.8	Very high	96	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.019	16%	0.163	C	C	.	.			trans	-109	-24.5	-178.2	-70.3	173.8	62.6	0	0	112.4	L105 D106 V109 E111 H163 A185 I186 K187 M188	L105-Q113 HydrophobicContact CD2-CB 3.83Å; D106-Q113 PolarHBondContact O-NE2 3.18Å; V109-Q113 PolarHBondContact O-NE2 3.03Å; E111-Q113 PolarHBondContact O-N 3.28Å; Q113-H163 PolarHBondContact N-O 3.17Å; Q113-A185 WeakPolarHBondContact CA-O 3.24Å; Q113-A185 HydrophobicContact CG-CB 4.34Å; Q113-I186 WeakPolarHBondContact O-CA 3.37Å; Q113-K187 PolarHBondContact O-N 3.19Å; Q113-M188 PolarHBondContact O-N 2.99Å
114	A	98.8	Very high	95.9	Very high	3 Å²	3	31.3 Å²	31.3	3%	0.025	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.8	173.2	0	0	0	0	0	111	V101 T112 H163 V164 V165 M188	V101-A114 HydrophobicContact CB-CB 4.47Å; V101-A114 HydrophobicContact CG1-CB 3.53Å; V101-A114 HydrophobicContact CG2-CB 4.18Å; T112-A114 WeakPolarHBondContact CG2-O 3.34Å; A114-H163 PolarHBondContact N-O 2.65Å; A114-V164 HydrophobicContact CB-CG1 4.28Å; A114-V164 HydrophobicContact CB-CG2 4.36Å; A114-V164 WeakPolarHBondContact O-CA 3.16Å; A114-V165 PolarHBondContact O-N 3.28Å; A114-V165 VanDerWaalsContact O-N 3.07Å; A114-M188 WeakPolarHBondContact CA-O 3.3Å; A114-M188 HydrophobicContact CB-CB 4.31Å
115	L	98.7	Very high	95.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.5	174.7	-179	61.2	0	0	0	109.4	L117 V165 V172 L181 I186 M188 L189 V190 V209 L213	L115-L117 HydrophobicContact CD1-CD2 4.44Å; L115-L117 HydrophobicContact CG-CD2 4.3Å; L115-V165 CarbonylContact C-O 3.13Å; L115-V165 WeakPolarHBondContact CA-O 3.34Å; L115-V165 HydrophobicContact CD1-CB 3.98Å; L115-V165 HydrophobicContact CD1-CG1 3.96Å; L115-V172 HydrophobicContact CD1-CG1 3.83Å; L115-V172 HydrophobicContact CD1-CG2 4.39Å; L115-V172 HydrophobicContact CD2-CG1 3.98Å; L115-V172 HydrophobicContact CG-CG1 4.45Å; L115-L181 HydrophobicContact CD1-CD2 4.3Å; L115-I186 HydrophobicContact CB-CD1 4.21Å; L115-I186 HydrophobicContact CB-CG2 4.47Å; L115-I186 HydrophobicContact CD2-CD1 4.45Å; L115-M188 PolarHBondContact N-O 3.35Å; L115-L189 HydrophobicContact CB-CD1 4.28Å; L115-L189 HydrophobicContact CD2-CD1 4.16Å; L115-L189 HydrophobicContact CG-CD1 4.14Å; L115-L189 CarbonylContact O-C 3.6Å; L115-L189 WeakPolarHBondContact O-CA 3.49Å; L115-V190 PolarHBondContact O-N 3.38Å; L115-V209 HydrophobicContact CD2-CG1 3.54Å; L115-L213 HydrophobicContact CD2-CD2 4.12Å
116	I	98.6	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	121.1	-179.6	-49.3	-178.6	0	0	0	108.8	F97 V101 I127 L131 V164 V165 A166 G167 V190	F97-I116 HydrophobicContact CD2-CD1 4.09Å; F97-I116 HydrophobicContact CE2-CD1 3.89Å; F97-I116 HydrophobicContact CE2-CG2 3.96Å; F97-I116 HydrophobicContact CZ-CG2 4.35Å; V101-I116 HydrophobicContact CG2-CD1 4.27Å; I116-I127 HydrophobicContact CD1-CG2 3.89Å; I116-I127 HydrophobicContact CG2-CD1 4.08Å; I116-I127 HydrophobicContact CG2-CG2 4.18Å; I116-L131 HydrophobicContact CD1-CD1 3.8Å; I116-V164 HydrophobicContact CD1-CG1 4.02Å; I116-V164 HydrophobicContact CG1-CG1 4.26Å; I116-V165 PolarHBondContact N-O 2.9Å; I116-A166 HydrophobicContact CB-CB 4.2Å; I116-A166 CarbonylContact O-C 3.17Å; I116-A166 VanDerWaalsContact O-CA 3.31Å; I116-A166 WeakPolarHBondContact O-CA 3.5Å; I116-G167 PolarHBondContact O-N 3.36Å; I116-V190 CarbonylContact C-O 3.58Å; I116-V190 WeakPolarHBondContact CA-O 3.26Å; I116-V190 HydrophobicContact CB-CB 4.32Å; I116-V190 HydrophobicContact CG1-CB 4.05Å; I116-V190 HydrophobicContact CG1-CG2 4.22Å; I116-V190 HydrophobicContact CG2-CB 4.05Å; I116-V190 HydrophobicContact CG2-CG1 4.23Å
117	L	97.3	Very high	95.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.6	175.8	-57.8	-175.4	0	0	0	110.3	L115 G167 P169 V172 L189 V190 L191 D192 M197 I206 V209	L115-L117 HydrophobicContact CD1-CD2 4.44Å; L115-L117 HydrophobicContact CG-CD2 4.3Å; L117-G167 WeakPolarHBondContact CA-O 3.27Å; L117-P169 HydrophobicContact CD1-CG 4.48Å; L117-V172 HydrophobicContact CD2-CB 4.1Å; L117-V172 HydrophobicContact CD2-CG1 4Å; L117-V172 HydrophobicContact CD2-CG2 3.91Å; L117-L189 HydrophobicContact CD1-CD1 4.21Å; L117-L189 HydrophobicContact CG-CD1 4.12Å; L117-V190 PolarHBondContact N-O 2.83Å; L117-L191 HydrophobicContact CB-CD2 3.93Å; L117-L191 HydrophobicContact CD1-CD2 3.84Å; L117-L191 HydrophobicContact CG-CD2 4.17Å; L117-D192 PolarHBondContact O-N 2.72Å; L117-M197 HydrophobicContact CB-CE 4.4Å; L117-M197 HydrophobicContact CB-SD 3.98Å; L117-I206 HydrophobicContact CD1-CG1 4.21Å; L117-V209 HydrophobicContact CD1-CB 4.43Å; L117-V209 HydrophobicContact CD1-CG1 4.25Å
118	A	94.9	Very high	95.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.13	C	C	.	.			trans	-133.6	149.4	176.2	0	0	0	0	0	111.1	T120 L123 A124 I127 G167 P169	A118-T120 VanDerWaalsContact C-N 3.29Å; A118-T120 PolarHBondContact O-N 2.91Å; A118-L123 HydrophobicContact CB-CB 4.22Å; A118-L123 HydrophobicContact CB-CD2 3.99Å; A118-L123 HydrophobicContact CB-CG 3.91Å; A118-A124 HydrophobicContact CB-CB 4.28Å; A118-I127 HydrophobicContact CB-CD1 3.97Å; A118-G167 PolarHBondContact N-O 2.81Å; A118-P169 WeakPolarHBondContact O-CD 3.41Å
119	P	91.1	Very high	95.2	Very high	6 Å²	6	25.3 Å²	25.3	4%	0.039	12%	0.119	C	C	.	.	S	Bend	trans	-71.6	-16.1	-176.7	27.6	-38.8	0	0	0	114.9	L123 D192 E193 E196 M197	P119-L123 HydrophobicContact CG-CD2 4.31Å; P119-D192 VanDerWaalsContact CD-O 3.25Å; P119-D192 WeakPolarHBondContact CD-O 3.24Å; P119-E193 HydrophobicContact CG-CB 3.76Å; P119-E193 HydrophobicContact CG-CG 4.45Å; P119-E196 HydrophobicContact CB-CB 4.25Å; P119-E196 HydrophobicContact CB-CG 3.74Å; P119-E196 HydrophobicContact CG-CB 4.28Å; P119-E196 HydrophobicContact CG-CG 4.08Å; P119-M197 HydrophobicContact CB-CG 3.82Å; P119-M197 HydrophobicContact CG-CG 4.33Å
120	T	89.7	Confident	95.2	Very high	11 Å²	11	23.2 Å²	23.2	7%	0.067	11%	0.107	C	C	.	.	S	Bend	trans	-133.7	153.6	-178	71.1	0	0	0	0	111.6	A118 E122 L123 A124	A118-T120 VanDerWaalsContact C-N 3.29Å; A118-T120 PolarHBondContact O-N 2.91Å; T120-E122 VanDerWaalsContact C-N 3.31Å; T120-L123 PolarHBondContact O-N 3.4Å; T120-L123 VanDerWaalsContact OG1-CB 3.24Å; T120-L123 WeakPolarHBondContact OG1-CB 3.38Å; T120-L123 PolarHBondContact OG1-N 2.65Å; T120-A124 PolarHBondContact O-N 2.89Å; T120-A124 VanDerWaalsContact O-N 3.16Å
121	R	91	Very high	95.3	Very high	82 Å²	82	18.7 Å²	18.7	31%	0.309	9%	0.09	S	C	.	.	H	α-helix	trans	-66.3	-38.8	-179.5	-59.7	175.1	-178.6	172.8	0.7	111.1	A124 G125 I146 G147 T168	R121-A124 PolarHBondContact O-N 3.48Å; R121-G125 PolarHBondContact O-N 3.17Å; R121-I146 HydrophobicContact CB-CB 3.98Å; R121-I146 HydrophobicContact CB-CD1 4.03Å; R121-I146 HydrophobicContact CB-CG2 4.09Å; R121-I146 HydrophobicContact CG-CB 4Å; R121-I146 HydrophobicContact CG-CG2 4.39Å; R121-G147 WeakPolarHBondContact CD-O 3.32Å; R121-G147 PolarHBondContact NE-O 3.44Å; R121-G147 PolarHBondContact NH1-O 3.39Å; R121-T168 HydrophobicContact CG-CG2 3.94Å
122	E	88.6	Confident	95.3	Very high	18 Å²	18	19.8 Å²	19.8	8%	0.084	10%	0.096	C	C	.	.	H	α-helix	trans	-69.1	-37.6	-177.8	-64	63.3	-136.3	0	0	110.9	T120 G125 Q126 M312 Q318 R321 M325 L346	T120-E122 VanDerWaalsContact C-N 3.31Å; E122-G125 PolarHBondContact O-N 3Å; E122-Q126 WeakPolarHBondContact O-CB 3.32Å; E122-Q126 PolarHBondContact O-N 3Å; E122-M312 HydrophobicContact CG-CE 4.45Å; E122-Q318 PolarHBondContact OE1-NE2 3.01Å; E122-R321 IonicContact OE1-CZ 3.41Å; E122-R321 IonicContact OE1-NE 3.9Å; E122-R321 IonicContact OE1-NH1 3.96Å; E122-R321 PolarHBondContact OE1-NH1 2.69Å; E122-R321 IonicContact OE1-NH2 2.74Å; E122-R321 PolarHBondContact OE1-NH2 3.42Å; E122-R321 VanDerWaalsContact OE1-NH2 3.09Å; E122-R321 IonicContact OE2-CZ 3.28Å; E122-R321 IonicContact OE2-NH1 3.29Å; E122-R321 PolarHBondContact OE2-NH1 2.9Å; E122-R321 IonicContact OE2-NH2 3.3Å; E122-R321 PolarHBondContact OE2-NH2 3.03Å; E122-M325 HydrophobicContact CG-CG 4.36Å; E122-L346 HydrophobicContact CB-CD1 4.25Å; E122-L346 HydrophobicContact CB-CD2 3.48Å; E122-L346 VanDerWaalsContact CB-CD2 3.48Å; E122-L346 HydrophobicContact CB-CG 4.46Å
123	L	90.9	Very high	95.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.6	-45.4	174.5	-179.4	53.7	0	0	0	111.4	A118 P119 T120 G125 Q126 I127 E193	A118-L123 HydrophobicContact CB-CB 4.22Å; A118-L123 HydrophobicContact CB-CD2 3.99Å; A118-L123 HydrophobicContact CB-CG 3.91Å; P119-L123 HydrophobicContact CG-CD2 4.31Å; T120-L123 PolarHBondContact O-N 3.4Å; T120-L123 VanDerWaalsContact OG1-CB 3.24Å; T120-L123 WeakPolarHBondContact OG1-CB 3.38Å; T120-L123 PolarHBondContact OG1-N 2.65Å; L123-G125 VanDerWaalsContact C-N 3.3Å; L123-G125 PolarHBondContact O-N 3.17Å; L123-Q126 WeakPolarHBondContact O-CB 3.15Å; L123-Q126 PolarHBondContact O-N 2.99Å; L123-Q126 VanDerWaalsContact O-N 3.08Å; L123-I127 HydrophobicContact CD1-CD1 4.22Å; L123-I127 HydrophobicContact CD1-CG1 4.22Å; L123-I127 HydrophobicContact CG-CD1 4Å; L123-I127 HydrophobicContact CG-CG1 4.49Å; L123-I127 VanDerWaalsContact O-CG1 3.32Å; L123-I127 WeakPolarHBondContact O-CG1 3.28Å; L123-I127 PolarHBondContact O-N 3.43Å; L123-E193 HydrophobicContact CD2-CG 3.77Å
124	A	94.9	Very high	95.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.2	-41.5	174.8	0	0	0	0	0	112.3	A118 T120 R121 I127 Q128 I146	A118-A124 HydrophobicContact CB-CB 4.28Å; T120-A124 PolarHBondContact O-N 2.89Å; T120-A124 VanDerWaalsContact O-N 3.16Å; R121-A124 PolarHBondContact O-N 3.48Å; A124-I127 PolarHBondContact O-N 2.92Å; A124-Q128 PolarHBondContact O-N 3.38Å; A124-Q128 VanDerWaalsContact O-N 3.08Å; A124-I146 HydrophobicContact CB-CG2 3.58Å
125	G	93.4	Very high	95.2	Very high	17 Å²	17	21 Å²	21	18%	0.175	11%	0.108	C	C	.	.	H	α-helix	trans	-66.6	-34.4	174.2	0	0	0	0	0	113.2	R121 E122 L123 K129 S144	R121-G125 PolarHBondContact O-N 3.17Å; E122-G125 PolarHBondContact O-N 3Å; L123-G125 VanDerWaalsContact C-N 3.3Å; L123-G125 PolarHBondContact O-N 3.17Å; G125-K129 WeakPolarHBondContact O-CG 3.45Å; G125-K129 PolarHBondContact O-N 3.05Å; G125-S144 PolarHBondContact N-OG 3.24Å
126	Q	93.3	Very high	95.1	Very high	13 Å²	13	26.2 Å²	26.2	6%	0.061	14%	0.136	C	C	.	.	H	α-helix	trans	-67.1	-44.9	173.2	-178	178.9	-63.3	0	0	111.9	E122 L123 Q128 K129 V130 R329 G345	E122-Q126 WeakPolarHBondContact O-CB 3.32Å; E122-Q126 PolarHBondContact O-N 3Å; L123-Q126 WeakPolarHBondContact O-CB 3.15Å; L123-Q126 PolarHBondContact O-N 2.99Å; L123-Q126 VanDerWaalsContact O-N 3.08Å; Q126-Q128 VanDerWaalsContact C-N 3.3Å; Q126-Q128 PolarHBondContact O-N 3.26Å; Q126-K129 PolarHBondContact O-N 2.77Å; Q126-K129 VanDerWaalsContact O-N 3.13Å; Q126-V130 WeakPolarHBondContact O-CG2 3.17Å; Q126-V130 PolarHBondContact O-N 3.32Å; Q126-R329 VanDerWaalsContact OE1-NH2 3.11Å; Q126-G345 PolarHBondContact NE2-O 3.27Å
127	I	96.7	Very high	95.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.2	-45.9	176.5	-69.2	163.9	0	0	0	110.3	T94 F97 I116 A118 L123 A124 K129 V130 L131 A166 D192	T94-I127 HydrophobicContact CG2-CG1 3.98Å; F97-I127 HydrophobicContact CE2-CG1 4.46Å; F97-I127 HydrophobicContact CE2-CG2 3.98Å; F97-I127 HydrophobicContact CZ-CD1 4.04Å; F97-I127 HydrophobicContact CZ-CG1 4.09Å; F97-I127 HydrophobicContact CZ-CG2 4.44Å; I116-I127 HydrophobicContact CD1-CG2 3.89Å; I116-I127 HydrophobicContact CG2-CD1 4.08Å; I116-I127 HydrophobicContact CG2-CG2 4.18Å; A118-I127 HydrophobicContact CB-CD1 3.97Å; L123-I127 HydrophobicContact CD1-CD1 4.22Å; L123-I127 HydrophobicContact CD1-CG1 4.22Å; L123-I127 HydrophobicContact CG-CD1 4Å; L123-I127 HydrophobicContact CG-CG1 4.49Å; L123-I127 VanDerWaalsContact O-CG1 3.32Å; L123-I127 WeakPolarHBondContact O-CG1 3.28Å; L123-I127 PolarHBondContact O-N 3.43Å; A124-I127 PolarHBondContact O-N 2.92Å; I127-K129 VanDerWaalsContact C-N 3.33Å; I127-K129 PolarHBondContact O-N 2.84Å; I127-V130 PolarHBondContact O-N 2.85Å; I127-L131 HydrophobicContact CG2-CD1 3.89Å; I127-L131 PolarHBondContact O-N 3.31Å; I127-A166 HydrophobicContact CB-CB 4.31Å; I127-A166 HydrophobicContact CG2-CB 3.89Å; I127-D192 HydrophobicContact CD1-CB 4.29Å
128	Q	97.8	Very high	95.1	Very high	42 Å²	42	30.7 Å²	30.7	20%	0.196	15%	0.154	C	C	.	.	H	α-helix	trans	-55.7	-46.9	175.3	-175.9	-167.3	18.5	0	0	111.7	A124 Q126 V130 L131 L132 C142	A124-Q128 PolarHBondContact O-N 3.38Å; A124-Q128 VanDerWaalsContact O-N 3.08Å; Q126-Q128 VanDerWaalsContact C-N 3.3Å; Q126-Q128 PolarHBondContact O-N 3.26Å; Q128-V130 VanDerWaalsContact C-N 3.35Å; Q128-V130 PolarHBondContact O-N 3.25Å; Q128-L131 PolarHBondContact O-N 3.22Å; Q128-L132 HydrophobicContact CG-CD1 4.04Å; Q128-L132 HydrophobicContact CG-CG 4.48Å; Q128-L132 WeakPolarHBondContact O-CG 3.38Å; Q128-L132 PolarHBondContact O-N 2.99Å; Q128-C142 HydrophobicContact CG-CB 4.24Å; Q128-C142 PolarHBondContact NE2-O 3.36Å
129	K	95.7	Very high	95.1	Very high	129 Å²	129	36.4 Å²	36.4	56%	0.561	18%	0.184	S	C	*	.	H	α-helix	trans	-62.2	-41.4	179.1	-71.2	175.7	-177.6	-178.3	0	112.2	G125 Q126 I127 L132 A133	G125-K129 WeakPolarHBondContact O-CG 3.45Å; G125-K129 PolarHBondContact O-N 3.05Å; Q126-K129 PolarHBondContact O-N 2.77Å; Q126-K129 VanDerWaalsContact O-N 3.13Å; I127-K129 VanDerWaalsContact C-N 3.33Å; I127-K129 PolarHBondContact O-N 2.84Å; K129-L132 PolarHBondContact O-N 3.11Å; K129-A133 WeakPolarHBondContact O-CB 3.43Å; K129-A133 PolarHBondContact O-N 3.32Å
130	V	96.7	Very high	95.5	Very high	15 Å²	15	36.5 Å²	36.5	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-64.3	-44.4	176.9	173.5	0	0	0	0	110.8	C98 Q126 I127 Q128 L132 A133 L134	C98-V130 HydrophobicContact CB-CG1 4.06Å; Q126-V130 WeakPolarHBondContact O-CG2 3.17Å; Q126-V130 PolarHBondContact O-N 3.32Å; I127-V130 PolarHBondContact O-N 2.85Å; Q128-V130 VanDerWaalsContact C-N 3.35Å; Q128-V130 PolarHBondContact O-N 3.25Å; V130-L132 PolarHBondContact O-N 3.05Å; V130-A133 PolarHBondContact O-N 3.15Å; V130-L134 HydrophobicContact CG1-CD1 3.65Å; V130-L134 HydrophobicContact CG1-CG 4.25Å; V130-L134 WeakPolarHBondContact O-CB 3.27Å; V130-L134 WeakPolarHBondContact O-CG 3.43Å; V130-L134 PolarHBondContact O-N 3.41Å
131	L	98.4	Very high	95.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.8	-46	176.2	-80.9	164.7	0	0	0	112.6	C98 V101 L102 I116 I127 Q128 G135 C142 V164	C98-L131 HydrophobicContact CB-CD2 3.93Å; C98-L131 HydrophobicContact CB-CG 4.27Å; V101-L131 HydrophobicContact CB-CD2 4.49Å; V101-L131 HydrophobicContact CG1-CD2 4.21Å; L102-L131 HydrophobicContact CD1-CD2 4.27Å; L102-L131 HydrophobicContact CD2-CD2 4.11Å; L102-L131 HydrophobicContact CG-CD2 3.87Å; I116-L131 HydrophobicContact CD1-CD1 3.8Å; I127-L131 HydrophobicContact CG2-CD1 3.89Å; I127-L131 PolarHBondContact O-N 3.31Å; Q128-L131 PolarHBondContact O-N 3.22Å; L131-G135 WeakPolarHBondContact O-CA 3.4Å; L131-G135 PolarHBondContact O-N 2.74Å; L131-C142 HydrophobicContact CB-CB 4.4Å; L131-C142 VanDerWaalsContact CD1-SG 3.54Å; L131-V164 HydrophobicContact CD1-CB 4.36Å; L131-V164 HydrophobicContact CD1-CG1 3.67Å
132	L	98.1	Very high	96.2	Very high	68 Å²	68	34.6 Å²	34.6	36%	0.356	18%	0.18	S	C	.	.	H	α-helix	trans	-66.4	-39.1	179.2	-69.2	173.9	0	0	0	111.7	Q128 K129 V130 G135 D136 V140 C142	Q128-L132 HydrophobicContact CG-CD1 4.04Å; Q128-L132 HydrophobicContact CG-CG 4.48Å; Q128-L132 WeakPolarHBondContact O-CG 3.38Å; Q128-L132 PolarHBondContact O-N 2.99Å; K129-L132 PolarHBondContact O-N 3.11Å; V130-L132 PolarHBondContact O-N 3.05Å; L132-G135 CarbonylContact O-C 3.59Å; L132-D136 WeakPolarHBondContact O-CA 3.46Å; L132-D136 PolarHBondContact O-N 3.29Å; L132-V140 HydrophobicContact CD2-CG1 4.38Å; L132-C142 HydrophobicContact CD2-CB 3.93Å; L132-C142 HydrophobicContact CG-CB 4.19Å
133	A	97.4	Very high	96.7	Very high	39 Å²	39	34.2 Å²	34.2	32%	0.322	18%	0.177	S	C	.	.	H	α-helix	trans	-71	-44.2	179.8	0	0	0	0	0	112.5	Y61 K129 V130 G135	Y61-A133 HydrophobicContact CD2-CB 3.56Å; Y61-A133 HydrophobicContact CE2-CB 3.52Å; K129-A133 WeakPolarHBondContact O-CB 3.43Å; K129-A133 PolarHBondContact O-N 3.32Å; V130-A133 PolarHBondContact O-N 3.15Å; A133-G135 VanDerWaalsContact C-N 3.32Å
134	L	98.1	Very high	97	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-70.3	-30.5	176.4	-67.4	174.2	0	0	0	112.3	G57 I58 Y61 F63 C98 I99 L102 V130	G57-L134 WeakPolarHBondContact CA-O 3.47Å; I58-L134 HydrophobicContact CG1-CD2 4.21Å; Y61-L134 HydrophobicContact CD1-CD2 4.16Å; Y61-L134 HydrophobicContact CG-CD2 3.91Å; F63-L134 HydrophobicContact CD2-CD2 4.25Å; F63-L134 HydrophobicContact CE2-CD2 4.06Å; C98-L134 HydrophobicContact CB-CD1 4.06Å; I99-L134 HydrophobicContact CG1-CD1 3.97Å; L102-L134 HydrophobicContact CD1-CB 3.64Å; V130-L134 HydrophobicContact CG1-CD1 3.65Å; V130-L134 HydrophobicContact CG1-CG 4.25Å; V130-L134 WeakPolarHBondContact O-CB 3.27Å; V130-L134 WeakPolarHBondContact O-CG 3.43Å; V130-L134 PolarHBondContact O-N 3.41Å
135	G	97.9	Very high	97	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	14.1	-179.8	0	0	0	0	0	114.7	L131 L132 A133 Y137 M138 N139	L131-G135 WeakPolarHBondContact O-CA 3.4Å; L131-G135 PolarHBondContact O-N 2.74Å; L132-G135 CarbonylContact O-C 3.59Å; A133-G135 VanDerWaalsContact C-N 3.32Å; G135-Y137 VanDerWaalsContact C-N 3.27Å; G135-Y137 PolarHBondContact O-N 3.48Å; G135-M138 WeakPolarHBondContact O-CA 3.11Å; G135-M138 WeakPolarHBondContact O-CB 3.21Å; G135-M138 PolarHBondContact O-N 3.39Å; G135-N139 PolarHBondContact O-N 3.15Å
136	D	97.3	Very high	97.1	Very high	110 Å²	110	34.3 Å²	34.3	59%	0.588	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-56.3	-41.7	-173.3	-169.7	43.9	0	0	0	111.8	L132 M138	L132-D136 WeakPolarHBondContact O-CA 3.46Å; L132-D136 PolarHBondContact O-N 3.29Å; D136-M138 VanDerWaalsContact C-N 3.26Å; D136-M138 PolarHBondContact O-N 3.46Å
137	Y	97.6	Very high	96.9	Very high	85 Å²	85	34.3 Å²	34.3	33%	0.333	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-78.5	-4.3	177.1	-57.6	-69.3	0	0	0	114.7	R56 A60 G135	R56-Y137 HydrophobicContact CB-CD2 4.03Å; R56-Y137 HydrophobicContact CB-CE2 4.38Å; R56-Y137 HydrophobicContact CG-CD2 3.71Å; R56-Y137 HydrophobicContact CG-CE2 3.67Å; R56-Y137 HydrophobicContact CG-CG 4.21Å; R56-Y137 VanDerWaalsContact CZ-CD1 3.47Å; R56-Y137 VanDerWaalsContact NE-CE1 3.31Å; R56-Y137 VanDerWaalsContact NH2-CE1 3.29Å; A60-Y137 HydrophobicContact CB-CE2 3.8Å; G135-Y137 VanDerWaalsContact C-N 3.27Å; G135-Y137 PolarHBondContact O-N 3.48Å
138	M	97.5	Very high	96.5	Very high	9 Å²	9	36.9 Å²	36.9	4%	0.044	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-99.5	-6.2	179.3	-60.6	176.5	54.9	0	0	112.9	R51 D53 L54 L102 I107 G135 D136 V140	R51-M138 VanDerWaalsContact NH1-CE 3.3Å; D53-M138 HydrophobicContact CB-CG 3.78Å; L54-M138 HydrophobicContact CB-SD 3.78Å; L54-M138 HydrophobicContact CD1-SD 4.07Å; L54-M138 HydrophobicContact CG-SD 4.41Å; L102-M138 HydrophobicContact CB-CE 4.3Å; L102-M138 HydrophobicContact CB-SD 4.1Å; L102-M138 HydrophobicContact CD2-SD 4.43Å; L102-M138 VanDerWaalsContact O-CE 3.31Å; L102-M138 WeakPolarHBondContact O-CE 3.31Å; I107-M138 HydrophobicContact CD1-CB 4.46Å; I107-M138 HydrophobicContact CD1-CE 4.01Å; I107-M138 HydrophobicContact CG1-CE 4.23Å; I107-M138 WeakPolarHBondContact CG2-O 3.36Å; G135-M138 WeakPolarHBondContact O-CA 3.11Å; G135-M138 WeakPolarHBondContact O-CB 3.21Å; G135-M138 PolarHBondContact O-N 3.39Å; D136-M138 VanDerWaalsContact C-N 3.26Å; D136-M138 PolarHBondContact O-N 3.46Å; M138-V140 PolarHBondContact O-N 3.36Å
139	N	95.7	Very high	96.1	Very high	120 Å²	120	36.9 Å²	36.9	64%	0.642	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	35.2	-172.5	-164.8	25.2	0	0	0	113.1	G135 Q141	G135-N139 PolarHBondContact O-N 3.15Å; N139-Q141 PolarHBondContact O-NE2 2.96Å
140	V	98	Very high	96	Very high	8 Å²	8	35.9 Å²	35.9	5%	0.048	21%	0.208	C	C	.	.			trans	-65	150.2	-179.7	68.9	0	0	0	0	110.9	L102 L105 I107 L132 M138 H163	L102-V140 HydrophobicContact CD2-CB 4.13Å; L102-V140 HydrophobicContact CD2-CG1 3.99Å; L102-V140 HydrophobicContact CD2-CG2 3.89Å; L105-V140 HydrophobicContact CD1-CG2 3.48Å; L105-V140 VanDerWaalsContact CD1-CG2 3.48Å; I107-V140 HydrophobicContact CD1-CB 4.4Å; I107-V140 HydrophobicContact CD1-CG2 4.46Å; L132-V140 HydrophobicContact CD2-CG1 4.38Å; M138-V140 PolarHBondContact O-N 3.36Å; V140-H163 HydrophobicContact CG2-CB 4.09Å
141	Q	98.3	Very high	96	Very high	47 Å²	47	37.3 Å²	37.3	22%	0.22	22%	0.217	C	C	.	.			trans	-115.9	117.3	177	-59.2	-60.7	-57.4	0	0	106.8	N139 H163 V164	N139-Q141 PolarHBondContact O-NE2 2.96Å; Q141-H163 WeakPolarHBondContact CB-ND1 3.45Å; Q141-H163 PolarHBondContact N-ND1 3.08Å; Q141-H163 WeakPolarHBondContact O-CB 3.48Å; Q141-H163 PolarHBondContact O-N 2.72Å; Q141-V164 PolarHBondContact O-N 2.83Å; Q141-V164 VanDerWaalsContact O-N 3.09Å
142	C	98.3	Very high	95.9	Very high	7 Å²	7	39.3 Å²	39.3	5%	0.047	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.4	-180	-175.5	0	0	0	0	110	Q128 L131 L132 V164	Q128-C142 HydrophobicContact CG-CB 4.24Å; Q128-C142 PolarHBondContact NE2-O 3.36Å; L131-C142 HydrophobicContact CB-CB 4.4Å; L131-C142 VanDerWaalsContact CD1-SG 3.54Å; L132-C142 HydrophobicContact CD2-CB 3.93Å; L132-C142 HydrophobicContact CG-CB 4.19Å; C142-V164 VanDerWaalsContact CA-O 3.29Å; C142-V164 WeakPolarHBondContact CA-O 3.34Å; C142-V164 HydrophobicContact CB-CB 4.29Å
143	H	98.2	Very high	95.7	Very high	9 Å²	9	40.9 Å²	40.9	4%	0.042	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.3	177.6	-176.1	47.7	0	0	0	112	D154 K157 Q162 V164 V165 A166	H143-D154 IonicContact CE1-OD1 2.92Å; H143-D154 PolarHBondContact CE1-OD1 3.4Å; H143-D154 VanDerWaalsContact CE1-OD1 3.28Å; H143-D154 IonicContact NE2-OD1 3.34Å; H143-D154 PolarHBondContact NE2-OD1 2.83Å; H143-K157 VanDerWaalsContact CE1-CD 3.42Å; H143-K157 WeakPolarHBondContact CE1-CD 3.42Å; H143-K157 VanDerWaalsContact ND1-CD 3.32Å; H143-K157 WeakPolarHBondContact ND1-CD 3.32Å; H143-Q162 HydrophobicContact CB-CB 4.41Å; H143-Q162 HydrophobicContact CB-CG 3.72Å; H143-V164 PolarHBondContact N-O 3.41Å; H143-V164 VanDerWaalsContact N-O 3.07Å; H143-V165 WeakPolarHBondContact O-CA 3.07Å; H143-A166 PolarHBondContact O-N 2.95Å
144	S	97.4	Very high	95.7	Very high	8 Å²	8	39.2 Å²	39.2	6%	0.056	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	111.6	171.9	-168.7	0	0	0	0	111	G125 I146 A166	G125-S144 PolarHBondContact N-OG 3.24Å; S144-I146 WeakPolarHBondContact OG-CG2 3.43Å; S144-A166 CarbonylContact C-O 3.52Å; S144-A166 WeakPolarHBondContact CA-O 3.26Å
145	C	96.3	Very high	95.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	89.1	-176.9	-160.4	0	0	0	0	110.2	V165 A166 G167 T168 V172 M175	C145-V165 HydrophobicContact CB-CG1 3.72Å; C145-A166 PolarHBondContact N-O 2.72Å; C145-G167 WeakPolarHBondContact O-CA 3.4Å; C145-T168 PolarHBondContact O-N 3.21Å; C145-T168 VanDerWaalsContact O-N 3.17Å; C145-V172 HydrophobicContact CB-CG2 4.14Å; C145-M175 WeakPolarHBondContact SG-CG 3.42Å
146	I	95	Very high	95.6	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.062	28%	0.275	C	S	.	.			trans	-127.3	146.9	-168.8	53.1	164.8	0	0	0	112.7	R121 A124 S144 T149 T168 R171	R121-I146 HydrophobicContact CB-CB 3.98Å; R121-I146 HydrophobicContact CB-CD1 4.03Å; R121-I146 HydrophobicContact CB-CG2 4.09Å; R121-I146 HydrophobicContact CG-CB 4Å; R121-I146 HydrophobicContact CG-CG2 4.39Å; A124-I146 HydrophobicContact CB-CG2 3.58Å; S144-I146 WeakPolarHBondContact OG-CG2 3.43Å; I146-T149 HydrophobicContact CD1-CG2 4Å; I146-T149 HydrophobicContact CG1-CG2 3.8Å; I146-T149 PolarHBondContact O-OG1 2.97Å; I146-T168 HydrophobicContact CG2-CG2 4.32Å; I146-R171 PolarHBondContact O-NH1 2.99Å
147	G	89.5	Confident	95.6	Very high	12 Å²	12	49.1 Å²	49.1	12%	0.124	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	157.2	176	0	0	0	0	0	113.2	R121 T149	R121-G147 WeakPolarHBondContact CD-O 3.32Å; R121-G147 PolarHBondContact NE-O 3.44Å; R121-G147 PolarHBondContact NH1-O 3.39Å; G147-T149 PolarHBondContact O-N 2.82Å
148	G	87.5	Confident	95.6	Very high	54 Å²	54	45.4 Å²	45.4	56%	0.557	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.7	-10.7	177	0	0	0	0	0	115.5
149	T	89.9	Confident	95.6	Very high	42 Å²	42	49.2 Å²	49.2	26%	0.258	27%	0.269	S	S	.	.	S	Bend	trans	-87.2	165.9	168.8	62.7	0	0	0	0	111.6	I146 G147 V151 D154 R171	I146-T149 HydrophobicContact CD1-CG2 4Å; I146-T149 HydrophobicContact CG1-CG2 3.8Å; I146-T149 PolarHBondContact O-OG1 2.97Å; G147-T149 PolarHBondContact O-N 2.82Å; T149-V151 PolarHBondContact O-N 2.97Å; T149-D154 PolarHBondContact OG1-OD2 3.33Å; T149-R171 PolarHBondContact O-NH1 2.87Å; T149-R171 PolarHBondContact O-NH2 3.34Å; T149-R171 PolarHBondContact OG1-NH1 2.92Å
150	N	93.3	Very high	95.7	Very high	108 Å²	108	50.1 Å²	50.1	58%	0.578	27%	0.265	S	S	*	.			trans	-66.9	119.7	177.9	-172.8	-53.2	0	0	0	111	G152 E153 D154	N150-G152 VanDerWaalsContact C-N 3.34Å; N150-G152 PolarHBondContact O-N 3.08Å; N150-G152 WeakPolarHBondContact OD1-CA 3.41Å; N150-G152 PolarHBondContact OD1-N 3.47Å; N150-E153 HydrophobicContact CB-CB 4.19Å; N150-E153 PolarHBondContact O-N 3.35Å; N150-E153 PolarHBondContact OD1-N 3.26Å; N150-D154 PolarHBondContact O-N 2.86Å
151	V	95.6	Very high	95.6	Very high	45 Å²	45	50 Å²	50	27%	0.273	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-37.7	-178.4	175.3	0	0	0	0	112.4	T149 E153 D154 I155 M175	T149-V151 PolarHBondContact O-N 2.97Å; V151-E153 VanDerWaalsContact C-N 3.31Å; V151-E153 PolarHBondContact O-N 3.48Å; V151-D154 WeakPolarHBondContact O-CB 3.38Å; V151-D154 PolarHBondContact O-N 3.16Å; V151-I155 HydrophobicContact CG1-CD1 3.88Å; V151-I155 HydrophobicContact CG1-CG1 4.33Å; V151-I155 VanDerWaalsContact O-CG1 3.27Å; V151-I155 WeakPolarHBondContact O-CG1 3.47Å; V151-I155 PolarHBondContact O-N 2.84Å; V151-M175 HydrophobicContact CG1-CE 3.71Å
152	G	96.2	Very high	95.6	Very high	43 Å²	43	48.3 Å²	48.3	44%	0.443	26%	0.257	S	S	.	.	H	α-helix	trans	-65.6	-34.2	178.5	0	0	0	0	0	112.8	N150 R156	N150-G152 VanDerWaalsContact C-N 3.34Å; N150-G152 PolarHBondContact O-N 3.08Å; N150-G152 WeakPolarHBondContact OD1-CA 3.41Å; N150-G152 PolarHBondContact OD1-N 3.47Å; G152-R156 WeakPolarHBondContact O-CB 3.31Å; G152-R156 PolarHBondContact O-N 3.4Å
153	E	94.7	Very high	95.6	Very high	100 Å²	100	48.2 Å²	48.2	47%	0.467	26%	0.256	S	S	.	.	H	α-helix	trans	-68.9	-42.1	174.1	-167.4	-172.1	155.5	0	0	111.6	N150 V151 R156 K157	N150-E153 HydrophobicContact CB-CB 4.19Å; N150-E153 PolarHBondContact O-N 3.35Å; N150-E153 PolarHBondContact OD1-N 3.26Å; V151-E153 VanDerWaalsContact C-N 3.31Å; V151-E153 PolarHBondContact O-N 3.48Å; E153-R156 PolarHBondContact O-N 3.44Å; E153-K157 PolarHBondContact O-N 2.92Å; E153-K157 VanDerWaalsContact OE1-CE 3.26Å; E153-K157 WeakPolarHBondContact OE1-CE 3.16Å; E153-K157 IonicContact OE1-NZ 3.34Å; E153-K157 PolarHBondContact OE1-NZ 3.31Å
154	D	96.6	Very high	95.7	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-58	-48.7	173.9	-80.6	-15.2	0	0	0	111.2	H143 T149 N150 V151 R156 K157 L158 R171 M175	H143-D154 IonicContact CE1-OD1 2.92Å; H143-D154 PolarHBondContact CE1-OD1 3.4Å; H143-D154 VanDerWaalsContact CE1-OD1 3.28Å; H143-D154 IonicContact NE2-OD1 3.34Å; H143-D154 PolarHBondContact NE2-OD1 2.83Å; T149-D154 PolarHBondContact OG1-OD2 3.33Å; N150-D154 PolarHBondContact O-N 2.86Å; V151-D154 WeakPolarHBondContact O-CB 3.38Å; V151-D154 PolarHBondContact O-N 3.16Å; D154-R156 VanDerWaalsContact C-N 3.34Å; D154-R156 PolarHBondContact O-N 2.82Å; D154-K157 PolarHBondContact O-N 2.81Å; D154-L158 WeakPolarHBondContact O-CB 3.37Å; D154-L158 VanDerWaalsContact O-CG 3.26Å; D154-L158 WeakPolarHBondContact O-CG 3.45Å; D154-L158 PolarHBondContact O-N 3.17Å; D154-R171 IonicContact OD2-CZ 3.55Å; D154-R171 IonicContact OD2-NH1 3.8Å; D154-R171 PolarHBondContact OD2-NH1 2.83Å; D154-M175 HydrophobicContact CB-SD 4.21Å
155	I	97.6	Very high	95.7	Very high	45 Å²	45	47.4 Å²	47.4	23%	0.231	25%	0.251	C	S	.	.	H	α-helix	trans	-57.5	-48.3	177.5	-67.1	171.4	0	0	0	110.1	V151 K157 L158 D159 M175	V151-I155 HydrophobicContact CG1-CD1 3.88Å; V151-I155 HydrophobicContact CG1-CG1 4.33Å; V151-I155 VanDerWaalsContact O-CG1 3.27Å; V151-I155 WeakPolarHBondContact O-CG1 3.47Å; V151-I155 PolarHBondContact O-N 2.84Å; I155-K157 VanDerWaalsContact C-N 3.32Å; I155-K157 PolarHBondContact O-N 2.86Å; I155-L158 PolarHBondContact O-N 3.21Å; I155-D159 WeakPolarHBondContact CG2-OD2 3.38Å; I155-D159 WeakPolarHBondContact O-CB 3.36Å; I155-D159 VanDerWaalsContact O-CG 3.26Å; I155-D159 PolarHBondContact O-N 2.94Å; I155-M175 HydrophobicContact CG1-SD 3.89Å
156	R	97.6	Very high	95.8	Very high	196 Å²	196	47.4 Å²	47.4	74%	0.74	25%	0.251	S	S	*	.	H	α-helix	trans	-58.8	-41.5	179.2	-175.4	178.2	177.3	174.3	0.1	112.6	G152 E153 D154 Y160	G152-R156 WeakPolarHBondContact O-CB 3.31Å; G152-R156 PolarHBondContact O-N 3.4Å; E153-R156 PolarHBondContact O-N 3.44Å; D154-R156 VanDerWaalsContact C-N 3.34Å; D154-R156 PolarHBondContact O-N 2.82Å; R156-Y160 WeakPolarHBondContact O-CB 3.41Å; R156-Y160 PolarHBondContact O-N 3.07Å
157	K	97.4	Very high	95.9	Very high	78 Å²	78	46.8 Å²	46.8	34%	0.339	25%	0.248	S	C	.	.	H	α-helix	trans	-68.8	-39.1	177.5	-75.1	-178.8	-177.8	164.7	0	112	H143 E153 D154 I155 Y160 G161 Q162	H143-K157 VanDerWaalsContact CE1-CD 3.42Å; H143-K157 WeakPolarHBondContact CE1-CD 3.42Å; H143-K157 VanDerWaalsContact ND1-CD 3.32Å; H143-K157 WeakPolarHBondContact ND1-CD 3.32Å; E153-K157 PolarHBondContact O-N 2.92Å; E153-K157 VanDerWaalsContact OE1-CE 3.26Å; E153-K157 WeakPolarHBondContact OE1-CE 3.16Å; E153-K157 IonicContact OE1-NZ 3.34Å; E153-K157 PolarHBondContact OE1-NZ 3.31Å; D154-K157 PolarHBondContact O-N 2.81Å; I155-K157 VanDerWaalsContact C-N 3.32Å; I155-K157 PolarHBondContact O-N 2.86Å; K157-Y160 WeakPolarHBondContact O-CB 3.45Å; K157-G161 PolarHBondContact O-N 3.33Å; K157-Q162 WeakPolarHBondContact O-CG 3.4Å; K157-Q162 PolarHBondContact O-NE2 2.95Å
158	L	97.8	Very high	96.2	Very high	7 Å²	7	47 Å²	47	4%	0.037	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-40	176.7	-68.8	174	0	0	0	112.2	D154 I155 Y160 G161 Q162 V165 M175 L181	D154-L158 WeakPolarHBondContact O-CB 3.37Å; D154-L158 VanDerWaalsContact O-CG 3.26Å; D154-L158 WeakPolarHBondContact O-CG 3.45Å; D154-L158 PolarHBondContact O-N 3.17Å; I155-L158 PolarHBondContact O-N 3.21Å; L158-Y160 VanDerWaalsContact C-N 3.34Å; L158-G161 PolarHBondContact O-N 3.49Å; L158-Q162 HydrophobicContact CD2-CG 4.46Å; L158-V165 HydrophobicContact CD2-CG2 3.71Å; L158-M175 HydrophobicContact CD1-CB 3.77Å; L158-M175 HydrophobicContact CD1-CG 3.72Å; L158-M175 HydrophobicContact CD1-SD 4.13Å; L158-L181 HydrophobicContact CD1-CB 4.1Å; L158-L181 HydrophobicContact CD2-CD1 4.07Å
159	D	96.8	Very high	96.6	Very high	89 Å²	89	44.4 Å²	44.4	48%	0.476	22%	0.221	S	C	.	.	H	α-helix	trans	-66	-36.9	176.2	-73	-19.5	0	0	0	112.1	I155 G161	I155-D159 WeakPolarHBondContact CG2-OD2 3.38Å; I155-D159 WeakPolarHBondContact O-CB 3.36Å; I155-D159 VanDerWaalsContact O-CG 3.26Å; I155-D159 PolarHBondContact O-N 2.94Å; D159-G161 PolarHBondContact O-N 2.96Å
160	Y	96.9	Very high	96.8	Very high	139 Å²	139	44.1 Å²	44.1	55%	0.545	23%	0.225	S	C	.	.	H	α-helix	trans	-58.6	-28.4	171.5	-175.1	-109.8	0	0	0	112.2	R110 R156 K157 L158	R110-Y160 WeakPolarHBondContact CD-O 3.46Å; R110-Y160 PolarHBondContact NH1-OH 3.08Å; R110-Y160 PolarHBondContact NH2-O 2.64Å; R156-Y160 WeakPolarHBondContact O-CB 3.41Å; R156-Y160 PolarHBondContact O-N 3.07Å; K157-Y160 WeakPolarHBondContact O-CB 3.45Å; L158-Y160 VanDerWaalsContact C-N 3.34Å
161	G	96.5	Very high	96.9	Very high	5 Å²	5	40.3 Å²	40.3	5%	0.052	20%	0.203	C	C	.	.			trans	97.8	121.3	-179.5	0	0	0	0	0	112	R110 K157 L158 D159	R110-G161 WeakPolarHBondContact O-CA 3.15Å; K157-G161 PolarHBondContact O-N 3.33Å; L158-G161 PolarHBondContact O-N 3.49Å; D159-G161 PolarHBondContact O-N 2.96Å
162	Q	98.4	Very high	97	Very high	11 Å²	11	38.1 Å²	38.1	5%	0.051	19%	0.19	C	C	.	.			trans	-126.6	128.7	-178.3	-59.1	-61	-41.6	0	0	108.6	E111 T112 H143 K157 L158 V164 V165	E111-Q162 CarbonylContact C-O 3.58Å; T112-Q162 WeakPolarHBondContact CA-O 3.44Å; T112-Q162 WeakPolarHBondContact CB-O 3.1Å; T112-Q162 PolarHBondContact N-O 3.14Å; T112-Q162 PolarHBondContact OG1-O 3.33Å; H143-Q162 HydrophobicContact CB-CB 4.41Å; H143-Q162 HydrophobicContact CB-CG 3.72Å; K157-Q162 WeakPolarHBondContact O-CG 3.4Å; K157-Q162 PolarHBondContact O-NE2 2.95Å; L158-Q162 HydrophobicContact CD2-CG 4.46Å; Q162-V164 VanDerWaalsContact C-N 3.35Å; Q162-V165 HydrophobicContact CB-CG2 4.22Å
163	H	98.8	Very high	97.1	Very high	5 Å²	5	37.6 Å²	37.6	2%	0.023	18%	0.175	C	C	.	.	S	Bend	trans	-68.2	-37.7	177.6	-58.2	109.2	0	0	0	111.6	L105 I107 V109 E111 Q113 A114 V140 Q141	L105-H163 HydrophobicContact CD1-CB 4.07Å; L105-H163 HydrophobicContact CD2-CB 4.34Å; I107-H163 PolarHBondContact O-NE2 3.42Å; I107-H163 VanDerWaalsContact O-NE2 3.15Å; V109-H163 PolarHBondContact O-CD2 3.07Å; V109-H163 VanDerWaalsContact O-CD2 3.29Å; E111-H163 WeakPolarHBondContact O-CA 3.48Å; Q113-H163 PolarHBondContact N-O 3.17Å; A114-H163 PolarHBondContact N-O 2.65Å; V140-H163 HydrophobicContact CG2-CB 4.09Å; Q141-H163 WeakPolarHBondContact CB-ND1 3.45Å; Q141-H163 PolarHBondContact N-ND1 3.08Å; Q141-H163 WeakPolarHBondContact O-CB 3.48Å; Q141-H163 PolarHBondContact O-N 2.72Å
164	V	98.8	Very high	97.2	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.1	179.5	-172.2	0	0	0	0	110.2	V101 L105 A114 I116 L131 Q141 C142 H143 Q162	V101-V164 HydrophobicContact CG1-CG1 4.21Å; V101-V164 HydrophobicContact CG1-CG2 3.71Å; L105-V164 HydrophobicContact CD1-CG2 3.74Å; L105-V164 HydrophobicContact CD2-CG2 4.02Å; L105-V164 HydrophobicContact CG-CG2 4.44Å; A114-V164 HydrophobicContact CB-CG1 4.28Å; A114-V164 HydrophobicContact CB-CG2 4.36Å; A114-V164 WeakPolarHBondContact O-CA 3.16Å; I116-V164 HydrophobicContact CD1-CG1 4.02Å; I116-V164 HydrophobicContact CG1-CG1 4.26Å; L131-V164 HydrophobicContact CD1-CB 4.36Å; L131-V164 HydrophobicContact CD1-CG1 3.67Å; Q141-V164 PolarHBondContact O-N 2.83Å; Q141-V164 VanDerWaalsContact O-N 3.09Å; C142-V164 VanDerWaalsContact CA-O 3.29Å; C142-V164 WeakPolarHBondContact CA-O 3.34Å; C142-V164 HydrophobicContact CB-CB 4.29Å; H143-V164 PolarHBondContact N-O 3.41Å; H143-V164 VanDerWaalsContact N-O 3.07Å; Q162-V164 VanDerWaalsContact C-N 3.35Å
165	V	98.7	Very high	97.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124	168.3	174.8	0	0	0	0	108.4	T112 A114 L115 I116 H143 C145 L158 Q162 L181	T112-V165 HydrophobicContact CG2-CB 4.08Å; T112-V165 HydrophobicContact CG2-CG2 3.75Å; A114-V165 PolarHBondContact O-N 3.28Å; A114-V165 VanDerWaalsContact O-N 3.07Å; L115-V165 CarbonylContact C-O 3.13Å; L115-V165 WeakPolarHBondContact CA-O 3.34Å; L115-V165 HydrophobicContact CD1-CB 3.98Å; L115-V165 HydrophobicContact CD1-CG1 3.96Å; I116-V165 PolarHBondContact N-O 2.9Å; H143-V165 WeakPolarHBondContact O-CA 3.07Å; C145-V165 HydrophobicContact CB-CG1 3.72Å; L158-V165 HydrophobicContact CD2-CG2 3.71Å; Q162-V165 HydrophobicContact CB-CG2 4.22Å; V165-L181 HydrophobicContact CG1-CD2 4.35Å; V165-L181 HydrophobicContact CG2-CD1 4.01Å
166	A	98.5	Very high	97.3	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134	170.7	0	0	0	0	0	108.8	I116 I127 H143 S144 C145	I116-A166 HydrophobicContact CB-CB 4.2Å; I116-A166 CarbonylContact O-C 3.17Å; I116-A166 VanDerWaalsContact O-CA 3.31Å; I116-A166 WeakPolarHBondContact O-CA 3.5Å; I127-A166 HydrophobicContact CB-CB 4.31Å; I127-A166 HydrophobicContact CG2-CB 3.89Å; H143-A166 PolarHBondContact O-N 2.95Å; S144-A166 CarbonylContact C-O 3.52Å; S144-A166 WeakPolarHBondContact CA-O 3.26Å; C145-A166 PolarHBondContact N-O 2.72Å
167	G	97.4	Very high	97.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	173.3	-173.6	0	0	0	0	0	115.7	I116 L117 A118 C145	I116-G167 PolarHBondContact O-N 3.36Å; L117-G167 WeakPolarHBondContact CA-O 3.27Å; A118-G167 PolarHBondContact N-O 2.81Å; C145-G167 WeakPolarHBondContact O-CA 3.4Å
168	T	95.1	Very high	97.2	Very high	16 Å²	16	34.9 Å²	34.9	10%	0.098	16%	0.159	C	C	.	.			trans	-85.9	141.2	171.1	52.1	0	0	0	0	110.1	R121 C145 I146 G170 R171 V172	R121-T168 HydrophobicContact CG-CG2 3.94Å; C145-T168 PolarHBondContact O-N 3.21Å; C145-T168 VanDerWaalsContact O-N 3.17Å; I146-T168 HydrophobicContact CG2-CG2 4.32Å; T168-G170 VanDerWaalsContact C-N 3.32Å; T168-G170 PolarHBondContact O-N 3.33Å; T168-G170 VanDerWaalsContact O-N 3.15Å; T168-R171 PolarHBondContact O-N 3.03Å; T168-R171 VanDerWaalsContact O-N 3.16Å; T168-V172 PolarHBondContact O-N 3.16Å; T168-V172 VanDerWaalsContact O-N 3.11Å
169	P	95.1	Very high	97.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-47.5	-48.6	-174.5	-30.8	34.7	0	0	0	114.3	L117 A118 R171 V172 F173 M197 F202 Q205 I206	L117-P169 HydrophobicContact CD1-CG 4.48Å; A118-P169 WeakPolarHBondContact O-CD 3.41Å; P169-R171 PolarHBondContact O-N 3.31Å; P169-V172 PolarHBondContact O-N 3Å; P169-F173 VanDerWaalsContact O-CB 3.29Å; P169-F173 WeakPolarHBondContact O-CB 3.45Å; P169-F173 PolarHBondContact O-N 3.06Å; P169-M197 HydrophobicContact CG-SD 4.23Å; P169-F202 HydrophobicContact CB-CB 4.45Å; P169-F202 HydrophobicContact CG-CB 4.16Å; P169-F202 HydrophobicContact CG-CD2 4.26Å; P169-F202 HydrophobicContact CG-CG 4.25Å; P169-Q205 HydrophobicContact CB-CB 3.86Å; P169-I206 HydrophobicContact CG-CG1 4.35Å
170	G	94.7	Very high	97.2	Very high	35 Å²	35	41.1 Å²	41.1	36%	0.361	18%	0.178	S	C	.	.	H	α-helix	trans	-59.6	-46.2	-178.4	0	0	0	0	0	115	T168 D174	T168-G170 VanDerWaalsContact C-N 3.32Å; T168-G170 PolarHBondContact O-N 3.33Å; T168-G170 VanDerWaalsContact O-N 3.15Å; G170-D174 PolarHBondContact O-N 2.71Å; G170-D174 VanDerWaalsContact O-N 3.09Å
171	R	95.9	Very high	97.2	Very high	28 Å²	28	34.7 Å²	34.7	11%	0.106	15%	0.153	C	C	.	.	H	α-helix	trans	-73.3	-39	180	176.7	59.5	68.2	82.4	0.8	111.6	I146 T149 D154 T168 P169 F173 D174 M175	I146-R171 PolarHBondContact O-NH1 2.99Å; T149-R171 PolarHBondContact O-NH1 2.87Å; T149-R171 PolarHBondContact O-NH2 3.34Å; T149-R171 PolarHBondContact OG1-NH1 2.92Å; D154-R171 IonicContact OD2-CZ 3.55Å; D154-R171 IonicContact OD2-NH1 3.8Å; D154-R171 PolarHBondContact OD2-NH1 2.83Å; T168-R171 PolarHBondContact O-N 3.03Å; T168-R171 VanDerWaalsContact O-N 3.16Å; P169-R171 PolarHBondContact O-N 3.31Å; R171-F173 VanDerWaalsContact C-N 3.34Å; R171-D174 PolarHBondContact O-N 2.88Å; R171-M175 WeakPolarHBondContact O-CG 3.46Å; R171-M175 PolarHBondContact O-N 3.44Å
172	V	98.1	Very high	97.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.8	-48.8	174.6	168.7	0	0	0	0	110.2	L115 L117 C145 T168 P169 D174 M175 I176 L181 V209	L115-V172 HydrophobicContact CD1-CG1 3.83Å; L115-V172 HydrophobicContact CD1-CG2 4.39Å; L115-V172 HydrophobicContact CD2-CG1 3.98Å; L115-V172 HydrophobicContact CG-CG1 4.45Å; L117-V172 HydrophobicContact CD2-CB 4.1Å; L117-V172 HydrophobicContact CD2-CG1 4Å; L117-V172 HydrophobicContact CD2-CG2 3.91Å; C145-V172 HydrophobicContact CB-CG2 4.14Å; T168-V172 PolarHBondContact O-N 3.16Å; T168-V172 VanDerWaalsContact O-N 3.11Å; P169-V172 PolarHBondContact O-N 3Å; V172-D174 PolarHBondContact O-N 3.41Å; V172-M175 PolarHBondContact O-N 3.11Å; V172-M175 VanDerWaalsContact O-N 3.16Å; V172-I176 HydrophobicContact CG1-CD1 3.94Å; V172-I176 WeakPolarHBondContact O-CG1 3.35Å; V172-I176 PolarHBondContact O-N 3.36Å; V172-L181 HydrophobicContact CG1-CD2 4.09Å; V172-V209 HydrophobicContact CG1-CG1 4.35Å; V172-V209 HydrophobicContact CG1-CG2 4.17Å
173	F	97.2	Very high	97.3	Very high	31 Å²	31	41 Å²	41	14%	0.136	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-41.3	179.5	-176.4	-125	0	0	0	112.6	P169 R171 M175 I176 R177 D208 V209 Y212	P169-F173 VanDerWaalsContact O-CB 3.29Å; P169-F173 WeakPolarHBondContact O-CB 3.45Å; P169-F173 PolarHBondContact O-N 3.06Å; R171-F173 VanDerWaalsContact C-N 3.34Å; F173-M175 VanDerWaalsContact C-N 3.33Å; F173-M175 PolarHBondContact O-N 2.98Å; F173-I176 PolarHBondContact O-N 3.31Å; F173-R177 HydrophobicContact CD1-CG 4.45Å; F173-R177 HydrophobicContact CD2-CG 4.27Å; F173-R177 VanDerWaalsContact CE1-CD 3.45Å; F173-R177 HydrophobicContact CE1-CG 4.11Å; F173-R177 HydrophobicContact CE2-CG 3.85Å; F173-R177 VanDerWaalsContact CZ-CD 3.49Å; F173-R177 HydrophobicContact CZ-CG 3.79Å; F173-R177 WeakPolarHBondContact O-CG 3.28Å; F173-R177 PolarHBondContact O-N 2.89Å; F173-D208 HydrophobicContact CD2-CB 3.99Å; F173-D208 HydrophobicContact CE1-CB 4.17Å; F173-D208 HydrophobicContact CE2-CB 3.61Å; F173-D208 HydrophobicContact CG-CB 4.45Å; F173-D208 HydrophobicContact CZ-CB 3.68Å; F173-V209 HydrophobicContact CB-CG2 3.88Å; F173-V209 HydrophobicContact CD2-CG2 4.27Å; F173-V209 HydrophobicContact CG-CG2 4.48Å; F173-Y212 HydrophobicContact CE2-CD2 4.19Å; F173-Y212 AromaticContact CE2-CE2 3.78Å; F173-Y212 HydrophobicContact CE2-CE2 3.78Å; F173-Y212 HydrophobicContact CZ-CE2 4.49Å
174	D	96.9	Very high	97.2	Very high	45 Å²	45	49 Å²	49	24%	0.241	21%	0.208	C	C	.	.	H	α-helix	trans	-57.4	-44.9	173.5	-177.8	43.6	0	0	0	111.6	G170 R171 V172 I176 R177 R178	G170-D174 PolarHBondContact O-N 2.71Å; G170-D174 VanDerWaalsContact O-N 3.09Å; R171-D174 PolarHBondContact O-N 2.88Å; V172-D174 PolarHBondContact O-N 3.41Å; D174-I176 VanDerWaalsContact C-N 3.34Å; D174-I176 PolarHBondContact O-N 3.06Å; D174-R177 PolarHBondContact O-N 3.31Å; D174-R178 VanDerWaalsContact CG-NE 3.31Å; D174-R178 WeakPolarHBondContact O-CB 3.45Å; D174-R178 VanDerWaalsContact O-CG 3.28Å; D174-R178 WeakPolarHBondContact O-CG 3.46Å; D174-R178 PolarHBondContact O-N 3.43Å; D174-R178 IonicContact OD1-CZ 2.75Å; D174-R178 IonicContact OD1-NE 3.64Å; D174-R178 PolarHBondContact OD1-NE 3.31Å; D174-R178 IonicContact OD1-NH2 3.6Å; D174-R178 PolarHBondContact OD1-NH2 3.24Å; D174-R178 IonicContact OD2-CZ 2.78Å; D174-R178 IonicContact OD2-NE 2.64Å; D174-R178 PolarHBondContact OD2-NE 3.19Å; D174-R178 IonicContact OD2-NH2 2.9Å
175	M	98.2	Very high	97.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.2	-33.6	178.7	-67.3	-55	99.2	0	0	113	C145 V151 D154 I155 L158 R171 V172 F173 R179 S180 L181	C145-M175 WeakPolarHBondContact SG-CG 3.42Å; V151-M175 HydrophobicContact CG1-CE 3.71Å; D154-M175 HydrophobicContact CB-SD 4.21Å; I155-M175 HydrophobicContact CG1-SD 3.89Å; L158-M175 HydrophobicContact CD1-CB 3.77Å; L158-M175 HydrophobicContact CD1-CG 3.72Å; L158-M175 HydrophobicContact CD1-SD 4.13Å; R171-M175 WeakPolarHBondContact O-CG 3.46Å; R171-M175 PolarHBondContact O-N 3.44Å; V172-M175 PolarHBondContact O-N 3.11Å; V172-M175 VanDerWaalsContact O-N 3.16Å; F173-M175 VanDerWaalsContact C-N 3.33Å; F173-M175 PolarHBondContact O-N 2.98Å; M175-R179 PolarHBondContact O-N 3.48Å; M175-S180 PolarHBondContact O-N 3.25Å; M175-L181 HydrophobicContact CB-CB 3.93Å; M175-L181 PolarHBondContact O-N 3.42Å
176	I	97.8	Very high	97.1	Very high	8 Å²	8	50.1 Å²	50.1	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-48.5	173	-67	171.7	0	0	0	110.2	V172 F173 D174 R178 R179 L181 T183 V209 Y212	V172-I176 HydrophobicContact CG1-CD1 3.94Å; V172-I176 WeakPolarHBondContact O-CG1 3.35Å; V172-I176 PolarHBondContact O-N 3.36Å; F173-I176 PolarHBondContact O-N 3.31Å; D174-I176 VanDerWaalsContact C-N 3.34Å; D174-I176 PolarHBondContact O-N 3.06Å; I176-R178 VanDerWaalsContact C-N 3.27Å; I176-R178 PolarHBondContact O-N 3.44Å; I176-R179 WeakPolarHBondContact O-CA 3.29Å; I176-R179 PolarHBondContact O-N 2.81Å; I176-L181 HydrophobicContact CD1-CD2 4.24Å; I176-L181 HydrophobicContact CG1-CB 4Å; I176-L181 HydrophobicContact CG1-CD2 3.79Å; I176-L181 HydrophobicContact CG1-CG 3.95Å; I176-T183 HydrophobicContact CD1-CG2 4.08Å; I176-T183 HydrophobicContact CG1-CG2 4.05Å; I176-T183 HydrophobicContact CG2-CG2 4.32Å; I176-V209 HydrophobicContact CD1-CG1 4Å; I176-V209 HydrophobicContact CD1-CG2 4.42Å; I176-Y212 HydrophobicContact CG2-CD1 3.74Å; I176-Y212 HydrophobicContact CG2-CD2 4.27Å; I176-Y212 HydrophobicContact CG2-CE1 4.45Å; I176-Y212 HydrophobicContact CG2-CG 3.63Å
177	R	97	Very high	97.1	Very high	168 Å²	168	55.1 Å²	55.1	63%	0.634	24%	0.238	S	C	*	.	H	α-helix	trans	-60.5	-36.8	179.6	-76.8	-170.4	69.2	178.8	3.3	112.6	F173 D174 R179	F173-R177 HydrophobicContact CD1-CG 4.45Å; F173-R177 HydrophobicContact CD2-CG 4.27Å; F173-R177 VanDerWaalsContact CE1-CD 3.45Å; F173-R177 HydrophobicContact CE1-CG 4.11Å; F173-R177 HydrophobicContact CE2-CG 3.85Å; F173-R177 VanDerWaalsContact CZ-CD 3.49Å; F173-R177 HydrophobicContact CZ-CG 3.79Å; F173-R177 WeakPolarHBondContact O-CG 3.28Å; F173-R177 PolarHBondContact O-N 2.89Å; D174-R177 PolarHBondContact O-N 3.31Å; R177-R179 PolarHBondContact O-N 3.11Å
178	R	96.6	Very high	97.2	Very high	145 Å²	145	55.3 Å²	55.3	55%	0.547	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-5.7	174.7	-69.5	173	-174.5	-89	-3.6	113.8	D174 I176 S180	D174-R178 VanDerWaalsContact CG-NE 3.31Å; D174-R178 WeakPolarHBondContact O-CB 3.45Å; D174-R178 VanDerWaalsContact O-CG 3.28Å; D174-R178 WeakPolarHBondContact O-CG 3.46Å; D174-R178 PolarHBondContact O-N 3.43Å; D174-R178 IonicContact OD1-CZ 2.75Å; D174-R178 IonicContact OD1-NE 3.64Å; D174-R178 PolarHBondContact OD1-NE 3.31Å; D174-R178 IonicContact OD1-NH2 3.6Å; D174-R178 PolarHBondContact OD1-NH2 3.24Å; D174-R178 IonicContact OD2-CZ 2.78Å; D174-R178 IonicContact OD2-NE 2.64Å; D174-R178 PolarHBondContact OD2-NE 3.19Å; D174-R178 IonicContact OD2-NH2 2.9Å; I176-R178 VanDerWaalsContact C-N 3.27Å; I176-R178 PolarHBondContact O-N 3.44Å; R178-S180 PolarHBondContact O-N 2.86Å
179	R	96.7	Very high	97.3	Very high	215 Å²	215	54.6 Å²	54.6	81%	0.811	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	13	-175.1	-51.6	179.4	176.9	-176.2	-2	114.6	M175 I176 R177	M175-R179 PolarHBondContact O-N 3.48Å; I176-R179 WeakPolarHBondContact O-CA 3.29Å; I176-R179 PolarHBondContact O-N 2.81Å; R177-R179 PolarHBondContact O-N 3.11Å
180	S	97.1	Very high	97.5	Very high	13 Å²	13	54.6 Å²	54.6	9%	0.091	24%	0.235	C	C	.	.	S	Bend	trans	-75.1	-40.8	175	-53.1	0	0	0	0	110.8	M175 R178 R182	M175-S180 PolarHBondContact O-N 3.25Å; R178-S180 PolarHBondContact O-N 2.86Å; S180-R182 PolarHBondContact O-N 3.07Å
181	L	98.3	Very high	97.5	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	22%	0.219	C	C	.	.	S	Bend	trans	-88.8	103	167.7	179.4	53.1	0	0	0	109.7	T112 L115 L158 V165 V172 M175 I176	T112-L181 HydrophobicContact CG2-CD1 4.16Å; L115-L181 HydrophobicContact CD1-CD2 4.3Å; L158-L181 HydrophobicContact CD1-CB 4.1Å; L158-L181 HydrophobicContact CD2-CD1 4.07Å; V165-L181 HydrophobicContact CG1-CD2 4.35Å; V165-L181 HydrophobicContact CG2-CD1 4.01Å; V172-L181 HydrophobicContact CG1-CD2 4.09Å; M175-L181 HydrophobicContact CB-CB 3.93Å; M175-L181 PolarHBondContact O-N 3.42Å; I176-L181 HydrophobicContact CD1-CD2 4.24Å; I176-L181 HydrophobicContact CG1-CB 4Å; I176-L181 HydrophobicContact CG1-CD2 3.79Å; I176-L181 HydrophobicContact CG1-CG 3.95Å
182	R	97.4	Very high	97.4	Very high	122 Å²	122	51.9 Å²	51.9	46%	0.46	21%	0.214	S	C	.	.			trans	-83.6	125	175.5	-67.9	171.4	-76.1	179.2	-2.5	109.7	S180	S180-R182 PolarHBondContact O-N 3.07Å
183	T	98.1	Very high	97	Very high	27 Å²	27	52.2 Å²	52.2	17%	0.166	22%	0.215	C	C	.	.			trans	-98.3	-3.1	-170.1	56.2	0	0	0	0	114.6	I176 A185 I186 Y212 L213 P214	I176-T183 HydrophobicContact CD1-CG2 4.08Å; I176-T183 HydrophobicContact CG1-CG2 4.05Å; I176-T183 HydrophobicContact CG2-CG2 4.32Å; T183-A185 VanDerWaalsContact C-N 3.25Å; T183-A185 PolarHBondContact O-N 3.48Å; T183-A185 VanDerWaalsContact O-N 3.12Å; T183-I186 HydrophobicContact CG2-CD1 3.84Å; T183-I186 WeakPolarHBondContact O-CB 3.49Å; T183-I186 WeakPolarHBondContact O-CG1 3.49Å; T183-I186 PolarHBondContact O-N 2.85Å; T183-Y212 WeakPolarHBondContact CB-O 3.3Å; T183-Y212 PolarHBondContact OG1-O 2.88Å; T183-L213 HydrophobicContact CG2-CD2 3.96Å; T183-P214 VanDerWaalsContact O-CD 3.3Å; T183-P214 WeakPolarHBondContact O-CD 3.32Å; T183-P214 WeakPolarHBondContact O-CG 3.11Å
184	R	97.3	Very high	96.4	Very high	171 Å²	171	50.9 Å²	50.9	65%	0.645	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-31.8	-169.7	68.9	178.2	178.6	-174.2	-1.3	115.3	E111	E111-R184 IonicContact OE1-CZ 3.2Å; E111-R184 IonicContact OE1-NE 2.69Å; E111-R184 PolarHBondContact OE1-NE 3.47Å; E111-R184 IonicContact OE1-NH2 3.93Å; E111-R184 PolarHBondContact OE1-NH2 3.42Å; E111-R184 WeakPolarHBondContact OE2-CG 3.49Å; E111-R184 IonicContact OE2-CZ 2.9Å; E111-R184 IonicContact OE2-NE 2.62Å; E111-R184 PolarHBondContact OE2-NE 3.34Å; E111-R184 IonicContact OE2-NH2 3.25Å
185	A	98	Very high	95.7	Very high	20 Å²	20	48.7 Å²	48.7	17%	0.165	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	0.1	-176.7	0	0	0	0	0	112.6	E111 T112 Q113 T183 K187	E111-A185 HydrophobicContact CB-CB 3.76Å; T112-A185 CarbonylContact O-C 3.55Å; T112-A185 VanDerWaalsContact O-C 3.23Å; Q113-A185 WeakPolarHBondContact CA-O 3.24Å; Q113-A185 HydrophobicContact CG-CB 4.34Å; T183-A185 VanDerWaalsContact C-N 3.25Å; T183-A185 PolarHBondContact O-N 3.48Å; T183-A185 VanDerWaalsContact O-N 3.12Å; A185-K187 PolarHBondContact O-N 3.19Å
186	I	98.6	Very high	94.9	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.021	20%	0.203	C	C	.	.			trans	-67.8	123	-179.4	-63.8	177.2	0	0	0	108.9	T112 Q113 L115 T183 L213 P214 T217	T112-I186 HydrophobicContact CG2-CD1 4.3Å; T112-I186 HydrophobicContact CG2-CG1 4.17Å; T112-I186 VanDerWaalsContact O-CG1 3.24Å; T112-I186 WeakPolarHBondContact O-CG1 3.38Å; T112-I186 PolarHBondContact O-N 2.92Å; Q113-I186 WeakPolarHBondContact O-CA 3.37Å; L115-I186 HydrophobicContact CB-CD1 4.21Å; L115-I186 HydrophobicContact CB-CG2 4.47Å; L115-I186 HydrophobicContact CD2-CD1 4.45Å; T183-I186 HydrophobicContact CG2-CD1 3.84Å; T183-I186 WeakPolarHBondContact O-CB 3.49Å; T183-I186 WeakPolarHBondContact O-CG1 3.49Å; T183-I186 PolarHBondContact O-N 2.85Å; I186-L213 HydrophobicContact CD1-CD2 3.69Å; I186-L213 HydrophobicContact CG2-CD2 4.3Å; I186-P214 WeakPolarHBondContact O-CG 3.31Å; I186-T217 HydrophobicContact CG2-CG2 4.2Å
187	K	98.1	Very high	94.1	Very high	106 Å²	106	49.2 Å²	49.2	46%	0.461	20%	0.201	S	C	.	.			trans	-109.6	-22.1	177.6	-57.2	165.5	-167.7	166	0	111.5	Q113 A185 Q218	Q113-K187 PolarHBondContact O-N 3.19Å; A185-K187 PolarHBondContact O-N 3.19Å; K187-Q218 WeakPolarHBondContact O-CB 3.25Å; K187-Q218 PolarHBondContact O-N 3.29Å
188	M	98.6	Very high	93	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.02	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	131.8	-173.1	-164.6	-173.9	-64.6	0	0	111.7	I77 V101 C104 Q113 A114 L115 V190 Q218 V220	I77-M188 HydrophobicContact CG2-CE 3.84Å; I77-M188 HydrophobicContact CG2-SD 4.09Å; V101-M188 HydrophobicContact CB-SD 4.49Å; V101-M188 HydrophobicContact CG2-SD 3.5Å; V101-M188 VanDerWaalsContact CG2-SD 3.5Å; C104-M188 HydrophobicContact CB-CE 4.03Å; Q113-M188 PolarHBondContact O-N 2.99Å; A114-M188 WeakPolarHBondContact CA-O 3.3Å; A114-M188 HydrophobicContact CB-CB 4.31Å; L115-M188 PolarHBondContact N-O 3.35Å; M188-V190 HydrophobicContact CG-CG2 4.14Å; M188-V190 HydrophobicContact SD-CG2 3.96Å; M188-Q218 CarbonylContact C-O 3.41Å; M188-Q218 WeakPolarHBondContact CA-O 3.4Å; M188-V220 HydrophobicContact CG-CG2 4.29Å; M188-V220 HydrophobicContact SD-CG2 4.35Å
189	L	98.2	Very high	91.8	Very high	1 Å²	1	40 Å²	40	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.3	167.7	174.3	64.4	0	0	0	108.9	L115 L117 L191 Y210 L213 T217 Q218 V219 V220	L115-L189 HydrophobicContact CB-CD1 4.28Å; L115-L189 HydrophobicContact CD2-CD1 4.16Å; L115-L189 HydrophobicContact CG-CD1 4.14Å; L115-L189 CarbonylContact O-C 3.6Å; L115-L189 WeakPolarHBondContact O-CA 3.49Å; L117-L189 HydrophobicContact CD1-CD1 4.21Å; L117-L189 HydrophobicContact CG-CD1 4.12Å; L189-L191 HydrophobicContact CD1-CD2 4.22Å; L189-L191 HydrophobicContact CD2-CD2 4.33Å; L189-L191 HydrophobicContact CG-CD2 4.2Å; L189-Y210 HydrophobicContact CD2-CD2 3.96Å; L189-L213 HydrophobicContact CB-CD1 3.94Å; L189-L213 HydrophobicContact CD1-CD1 4.19Å; L189-L213 HydrophobicContact CD2-CD1 3.87Å; L189-L213 HydrophobicContact CG-CD1 4.21Å; L189-T217 HydrophobicContact CB-CG2 3.92Å; L189-Q218 PolarHBondContact N-O 3.26Å; L189-V219 CarbonylContact O-C 3.59Å; L189-V219 WeakPolarHBondContact O-CA 3.35Å; L189-V220 PolarHBondContact O-N 3Å
190	V	98	Very high	90.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.4	175	-174.6	0	0	0	0	109.7	F97 V101 L115 I116 L117 M188 V220	F97-V190 HydrophobicContact CB-CG1 3.98Å; F97-V190 HydrophobicContact CD1-CG1 4.1Å; F97-V190 HydrophobicContact CD2-CG1 3.85Å; F97-V190 HydrophobicContact CE1-CG1 4.45Å; F97-V190 HydrophobicContact CE2-CG1 4.32Å; F97-V190 HydrophobicContact CG-CG1 3.74Å; V101-V190 HydrophobicContact CG2-CG2 3.93Å; L115-V190 PolarHBondContact O-N 3.38Å; I116-V190 CarbonylContact C-O 3.58Å; I116-V190 WeakPolarHBondContact CA-O 3.26Å; I116-V190 HydrophobicContact CB-CB 4.32Å; I116-V190 HydrophobicContact CG1-CB 4.05Å; I116-V190 HydrophobicContact CG1-CG2 4.22Å; I116-V190 HydrophobicContact CG2-CB 4.05Å; I116-V190 HydrophobicContact CG2-CG1 4.23Å; L117-V190 PolarHBondContact N-O 2.83Å; M188-V190 HydrophobicContact CG-CG2 4.14Å; M188-V190 HydrophobicContact SD-CG2 3.96Å; V190-V220 CarbonylContact C-O 3.55Å; V190-V220 VanDerWaalsContact CA-O 3.32Å; V190-V220 WeakPolarHBondContact CA-O 3.31Å; V190-V220 HydrophobicContact CG1-CB 4.44Å; V190-V220 HydrophobicContact CG1-CG1 4.49Å; V190-V220 HydrophobicContact CG2-CB 4.21Å
191	L	95.4	Very high	89.6	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	103.7	174.4	-59	-176.7	0	0	0	108.9	L117 L189 A194 M197 I206 V220 I222 F237	L117-L191 HydrophobicContact CB-CD2 3.93Å; L117-L191 HydrophobicContact CD1-CD2 3.84Å; L117-L191 HydrophobicContact CG-CD2 4.17Å; L189-L191 HydrophobicContact CD1-CD2 4.22Å; L189-L191 HydrophobicContact CD2-CD2 4.33Å; L189-L191 HydrophobicContact CG-CD2 4.2Å; L191-A194 HydrophobicContact CB-CB 4.13Å; L191-M197 HydrophobicContact CB-CE 3.57Å; L191-M197 HydrophobicContact CD2-CE 3.93Å; L191-M197 HydrophobicContact CG-CE 4.26Å; L191-I206 HydrophobicContact CD1-CG2 4.18Å; L191-I206 HydrophobicContact CD2-CG2 4.06Å; L191-V220 PolarHBondContact N-O 3.41Å; L191-I222 PolarHBondContact O-N 2.9Å; L191-F237 HydrophobicContact CD1-CE2 4.12Å; L191-F237 HydrophobicContact CD1-CZ 4.26Å
192	D	94.1	Very high	88.8	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.011	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	137.6	177.4	-166.4	22.1	0	0	0	110.9	F97 L117 P119 I127 A194 M197	F97-D192 HydrophobicContact CE1-CB 3.98Å; F97-D192 HydrophobicContact CZ-CB 4.03Å; L117-D192 PolarHBondContact O-N 2.72Å; P119-D192 VanDerWaalsContact CD-O 3.25Å; P119-D192 WeakPolarHBondContact CD-O 3.24Å; I127-D192 HydrophobicContact CD1-CB 4.29Å; D192-A194 VanDerWaalsContact C-N 3.32Å; D192-A194 PolarHBondContact O-N 3.21Å; D192-M197 WeakPolarHBondContact O-CE 3.47Å
193	E	89.3	Confident	88.2	Confident	6 Å²	6	36.6 Å²	36.6	3%	0.028	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	50.3	-172.2	-55.8	-81.4	-158	0	0	111	P119 L123 D195 E196 M197 I222 R344 G345 H368	P119-E193 HydrophobicContact CG-CB 3.76Å; P119-E193 HydrophobicContact CG-CG 4.45Å; L123-E193 HydrophobicContact CD2-CG 3.77Å; E193-D195 PolarHBondContact O-N 2.9Å; E193-E196 HydrophobicContact CB-CB 4.44Å; E193-E196 WeakPolarHBondContact O-CB 3.14Å; E193-E196 PolarHBondContact O-N 2.88Å; E193-E196 VanDerWaalsContact O-N 3.08Å; E193-M197 PolarHBondContact O-N 3.11Å; E193-I222 PolarHBondContact N-O 2.87Å; E193-R344 HydrophobicContact CG-CB 4.27Å; E193-G345 PolarHBondContact OE1-N 3.26Å; E193-H368 IonicContact OE2-CE1 3.58Å; E193-H368 PolarHBondContact OE2-CE1 3.37Å; E193-H368 IonicContact OE2-ND1 3.19Å
194	A	84.3	Confident	87.6	Confident	3 Å²	3	42.6 Å²	42.6	3%	0.025	21%	0.208	C	C	.	.	H	α-helix	trans	-63.5	-33.5	-169	0	0	0	0	0	115	L191 D192 E196 M197 L198 L221 I222	L191-A194 HydrophobicContact CB-CB 4.13Å; D192-A194 VanDerWaalsContact C-N 3.32Å; D192-A194 PolarHBondContact O-N 3.21Å; A194-E196 VanDerWaalsContact C-N 3.27Å; A194-E196 PolarHBondContact O-N 2.86Å; A194-M197 HydrophobicContact CB-CE 4.3Å; A194-M197 PolarHBondContact O-N 2.82Å; A194-L198 WeakPolarHBondContact O-CG 3.46Å; A194-L198 PolarHBondContact O-N 2.73Å; A194-L221 HydrophobicContact CB-CD1 3.84Å; A194-L221 HydrophobicContact CB-CD2 3.65Å; A194-L221 HydrophobicContact CB-CG 3.5Å; A194-L221 VanDerWaalsContact CB-CG 3.5Å; A194-I222 PolarHBondContact N-O 2.95Å
195	D	82.8	Confident	87.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-41.7	171.9	63.6	-46.2	0	0	0	111.6	E193 L198 N199 S223 T225 I230 R344 H368	E193-D195 PolarHBondContact O-N 2.9Å; D195-L198 PolarHBondContact O-N 3.15Å; D195-N199 PolarHBondContact O-N 2.99Å; D195-N199 PolarHBondContact O-ND2 2.89Å; D195-S223 VanDerWaalsContact CG-OG 3.28Å; D195-S223 PolarHBondContact OD1-OG 2.77Å; D195-T225 WeakPolarHBondContact CB-O 3.44Å; D195-T225 PolarHBondContact OD2-OG1 3.24Å; D195-I230 HydrophobicContact CB-CD1 4.39Å; D195-I230 HydrophobicContact CB-CG1 4.18Å; D195-R344 IonicContact OD2-CZ 3.41Å; D195-R344 IonicContact OD2-NE 3.4Å; D195-R344 IonicContact OD2-NH2 2.7Å; D195-R344 PolarHBondContact OD2-NH2 3.32Å; D195-H368 IonicContact OD2-NE2 2.89Å
196	E	81.4	Confident	86.8	Confident	18 Å²	18	37.1 Å²	37.1	8%	0.084	19%	0.187	C	C	.	.	H	α-helix	trans	-70.2	-39.5	179.2	180	63.1	159.8	0	0	112.7	P119 E193 A194 L198 N199 K200 R344	P119-E196 HydrophobicContact CB-CB 4.25Å; P119-E196 HydrophobicContact CB-CG 3.74Å; P119-E196 HydrophobicContact CG-CB 4.28Å; P119-E196 HydrophobicContact CG-CG 4.08Å; E193-E196 HydrophobicContact CB-CB 4.44Å; E193-E196 WeakPolarHBondContact O-CB 3.14Å; E193-E196 PolarHBondContact O-N 2.88Å; E193-E196 VanDerWaalsContact O-N 3.08Å; A194-E196 VanDerWaalsContact C-N 3.27Å; A194-E196 PolarHBondContact O-N 2.86Å; E196-L198 PolarHBondContact O-N 2.67Å; E196-N199 PolarHBondContact O-N 2.87Å; E196-K200 HydrophobicContact CG-CD 4.39Å; E196-K200 HydrophobicContact CG-CG 4.37Å; E196-K200 WeakPolarHBondContact O-CG 3.22Å; E196-K200 PolarHBondContact O-N 2.79Å; E196-K200 WeakPolarHBondContact OE1-CE 3.45Å; E196-K200 IonicContact OE1-NZ 3.82Å; E196-R344 IonicContact OE1-NH1 3.94Å; E196-R344 PolarHBondContact OE1-NH1 3.02Å; E196-R344 IonicContact OE2-CZ 2.97Å; E196-R344 IonicContact OE2-NH1 2.9Å; E196-R344 PolarHBondContact OE2-NH1 3.46Å; E196-R344 IonicContact OE2-NH2 3.09Å
197	M	81.4	Confident	86.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.1	-33.5	176.5	-66.6	-166.4	-76.1	0	0	110.9	L117 P119 P169 L191 D192 E193 A194 F202 I206	L117-M197 HydrophobicContact CB-CE 4.4Å; L117-M197 HydrophobicContact CB-SD 3.98Å; P119-M197 HydrophobicContact CB-CG 3.82Å; P119-M197 HydrophobicContact CG-CG 4.33Å; P169-M197 HydrophobicContact CG-SD 4.23Å; L191-M197 HydrophobicContact CB-CE 3.57Å; L191-M197 HydrophobicContact CD2-CE 3.93Å; L191-M197 HydrophobicContact CG-CE 4.26Å; D192-M197 WeakPolarHBondContact O-CE 3.47Å; E193-M197 PolarHBondContact O-N 3.11Å; A194-M197 HydrophobicContact CB-CE 4.3Å; A194-M197 PolarHBondContact O-N 2.82Å; M197-F202 HydrophobicContact CB-CB 4.37Å; M197-F202 HydrophobicContact CB-CD2 4.26Å; M197-F202 HydrophobicContact CG-CD2 4.41Å; M197-F202 WeakPolarHBondContact O-CA 3.39Å; M197-F202 WeakPolarHBondContact O-CB 3.4Å; M197-F202 PolarHBondContact O-N 2.9Å; M197-I206 HydrophobicContact CB-CD1 3.61Å; M197-I206 HydrophobicContact CE-CD1 4.25Å; M197-I206 HydrophobicContact CG-CD1 4.46Å; M197-I206 HydrophobicContact SD-CD1 4.11Å
198	L	74.3	Confident	86	Confident	29 Å²	29	40.3 Å²	40.3	15%	0.152	20%	0.2	C	C	.	.	H	α-helix	trans	-76.2	-42.7	177.5	-63.6	174.4	0	0	0	112.2	A194 D195 E196 K200 G201 K203 I206 I230 M233	A194-L198 WeakPolarHBondContact O-CG 3.46Å; A194-L198 PolarHBondContact O-N 2.73Å; D195-L198 PolarHBondContact O-N 3.15Å; E196-L198 PolarHBondContact O-N 2.67Å; L198-K200 VanDerWaalsContact C-N 3.28Å; L198-K200 PolarHBondContact O-N 2.9Å; L198-G201 PolarHBondContact O-N 2.78Å; L198-K203 HydrophobicContact CD2-CB 3.61Å; L198-K203 HydrophobicContact CD2-CD 4.48Å; L198-K203 HydrophobicContact CD2-CG 3.85Å; L198-I206 HydrophobicContact CD2-CD1 4.32Å; L198-I230 HydrophobicContact CB-CD1 3.83Å; L198-I230 HydrophobicContact CD1-CB 4.42Å; L198-I230 HydrophobicContact CD1-CD1 3.31Å; L198-I230 HydrophobicContact CD1-CG1 4.33Å; L198-I230 HydrophobicContact CD1-CG2 3.95Å; L198-I230 HydrophobicContact CG-CD1 4.15Å; L198-M233 HydrophobicContact CB-CE 4.46Å; L198-M233 HydrophobicContact CD1-CE 3.33Å; L198-M233 HydrophobicContact CD1-SD 3.66Å; L198-M233 HydrophobicContact CD2-CE 3.52Å; L198-M233 HydrophobicContact CD2-SD 3.48Å; L198-M233 WeakPolarHBondContact CD2-SD 3.31Å; L198-M233 HydrophobicContact CG-CE 3.91Å; L198-M233 HydrophobicContact CG-SD 4.21Å
199	N	70.4	Confident	85.8	Confident	91 Å²	91	40.1 Å²	40.1	49%	0.487	20%	0.199	S	C	.	.	H	α-helix	trans	-59.7	-35.3	175.4	-72.4	-22.8	0	0	0	113.4	D195 E196 G201	D195-N199 PolarHBondContact O-N 2.99Å; D195-N199 PolarHBondContact O-ND2 2.89Å; E196-N199 PolarHBondContact O-N 2.87Å; N199-G201 PolarHBondContact O-N 2.89Å
200	K	68.8	Low	85.5	Confident	82 Å²	82	42.9 Å²	42.9	36%	0.357	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	2.9	176.7	-69.7	-166	-173.8	-173.8	0	114.3	E196 L198 F202	E196-K200 HydrophobicContact CG-CD 4.39Å; E196-K200 HydrophobicContact CG-CG 4.37Å; E196-K200 WeakPolarHBondContact O-CG 3.22Å; E196-K200 PolarHBondContact O-N 2.79Å; E196-K200 WeakPolarHBondContact OE1-CE 3.45Å; E196-K200 IonicContact OE1-NZ 3.82Å; L198-K200 VanDerWaalsContact C-N 3.28Å; L198-K200 PolarHBondContact O-N 2.9Å; K200-F202 VanDerWaalsContact C-N 3.28Å; K200-F202 HydrophobicContact CB-CD2 3.9Å; K200-F202 HydrophobicContact CB-CE2 3.79Å; K200-F202 HydrophobicContact CB-CG 4.32Å; K200-F202 HydrophobicContact CB-CZ 4.11Å; K200-F202 HydrophobicContact CD-CE2 3.73Å; K200-F202 HydrophobicContact CD-CZ 4.11Å; K200-F202 HydrophobicContact CG-CE2 4.39Å; K200-F202 PolarHBondContact O-N 2.91Å
201	G	79.3	Confident	85.3	Confident	50 Å²	50	51 Å²	51	52%	0.515	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	18.5	-175.8	0	0	0	0	0	113.5	L198 N199 K203	L198-G201 PolarHBondContact O-N 2.78Å; N199-G201 PolarHBondContact O-N 2.89Å; G201-K203 PolarHBondContact O-N 2.79Å
202	F	81.1	Confident	85.4	Confident	44 Å²	44	56.3 Å²	56.3	19%	0.193	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	3.6	173.5	-55	-42.5	0	0	0	113.2	P169 M197 K200 E204 Q205 I206	P169-F202 HydrophobicContact CB-CB 4.45Å; P169-F202 HydrophobicContact CG-CB 4.16Å; P169-F202 HydrophobicContact CG-CD2 4.26Å; P169-F202 HydrophobicContact CG-CG 4.25Å; M197-F202 HydrophobicContact CB-CB 4.37Å; M197-F202 HydrophobicContact CB-CD2 4.26Å; M197-F202 HydrophobicContact CG-CD2 4.41Å; M197-F202 WeakPolarHBondContact O-CA 3.39Å; M197-F202 WeakPolarHBondContact O-CB 3.4Å; M197-F202 PolarHBondContact O-N 2.9Å; K200-F202 VanDerWaalsContact C-N 3.28Å; K200-F202 HydrophobicContact CB-CD2 3.9Å; K200-F202 HydrophobicContact CB-CE2 3.79Å; K200-F202 HydrophobicContact CB-CG 4.32Å; K200-F202 HydrophobicContact CB-CZ 4.11Å; K200-F202 HydrophobicContact CD-CE2 3.73Å; K200-F202 HydrophobicContact CD-CZ 4.11Å; K200-F202 HydrophobicContact CG-CE2 4.39Å; K200-F202 PolarHBondContact O-N 2.91Å; F202-E204 VanDerWaalsContact C-N 3.33Å; F202-E204 PolarHBondContact O-N 2.98Å; F202-Q205 HydrophobicContact CB-CB 4.49Å; F202-Q205 PolarHBondContact O-N 2.82Å; F202-Q205 VanDerWaalsContact O-N 3.08Å; F202-I206 HydrophobicContact CB-CD1 4.42Å; F202-I206 WeakPolarHBondContact O-CG1 3.39Å; F202-I206 PolarHBondContact O-N 2.84Å
203	K	84.6	Confident	85.5	Confident	106 Å²	106	57 Å²	57	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-49.2	-51.4	176.7	-175.2	175.6	-178.5	173.4	0	112.7	L198 G201 I206 Y207 M233	L198-K203 HydrophobicContact CD2-CB 3.61Å; L198-K203 HydrophobicContact CD2-CD 4.48Å; L198-K203 HydrophobicContact CD2-CG 3.85Å; G201-K203 PolarHBondContact O-N 2.79Å; K203-I206 PolarHBondContact O-N 2.76Å; K203-Y207 WeakPolarHBondContact O-CB 3.33Å; K203-Y207 PolarHBondContact O-N 2.86Å; K203-Y207 VanDerWaalsContact O-N 3.08Å; K203-M233 HydrophobicContact CD-CE 3.63Å; K203-M233 HydrophobicContact CD-SD 4.06Å; K203-M233 VanDerWaalsContact CE-CE 3.43Å; K203-M233 HydrophobicContact CG-CE 4.03Å; K203-M233 HydrophobicContact CG-SD 3.87Å
204	E	85.6	Confident	85.9	Confident	153 Å²	153	58.4 Å²	58.4	72%	0.715	27%	0.274	S	S	*	.	H	α-helix	trans	-65.9	-40.9	178.9	-66.1	-171	164	0	0	111.5	F202 I206 Y207 D208	F202-E204 VanDerWaalsContact C-N 3.33Å; F202-E204 PolarHBondContact O-N 2.98Å; E204-I206 PolarHBondContact O-N 3.2Å; E204-Y207 WeakPolarHBondContact O-CB 3.13Å; E204-Y207 PolarHBondContact O-N 2.96Å; E204-D208 WeakPolarHBondContact O-CB 3.36Å; E204-D208 PolarHBondContact O-N 3.39Å
205	Q	87.9	Confident	86.3	Confident	65 Å²	65	64.7 Å²	64.7	30%	0.304	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-37.6	179.6	-63.2	178.4	14.5	0	0	112.6	P169 F202 D208 V209	P169-Q205 HydrophobicContact CB-CB 3.86Å; F202-Q205 HydrophobicContact CB-CB 4.49Å; F202-Q205 PolarHBondContact O-N 2.82Å; F202-Q205 VanDerWaalsContact O-N 3.08Å; Q205-D208 PolarHBondContact O-N 2.7Å; Q205-V209 WeakPolarHBondContact O-CG2 3.35Å; Q205-V209 PolarHBondContact O-N 3.09Å
206	I	90.2	Very high	86.8	Confident	12 Å²	12	69.1 Å²	69.1	6%	0.062	35%	0.352	C	S	.	.	H	α-helix	trans	-64.6	-45.7	173.8	-69	162.6	0	0	0	109.6	L117 P169 L191 M197 L198 F202 K203 E204 D208 V209 Y210	L117-I206 HydrophobicContact CD1-CG1 4.21Å; P169-I206 HydrophobicContact CG-CG1 4.35Å; L191-I206 HydrophobicContact CD1-CG2 4.18Å; L191-I206 HydrophobicContact CD2-CG2 4.06Å; M197-I206 HydrophobicContact CB-CD1 3.61Å; M197-I206 HydrophobicContact CE-CD1 4.25Å; M197-I206 HydrophobicContact CG-CD1 4.46Å; M197-I206 HydrophobicContact SD-CD1 4.11Å; L198-I206 HydrophobicContact CD2-CD1 4.32Å; F202-I206 HydrophobicContact CB-CD1 4.42Å; F202-I206 WeakPolarHBondContact O-CG1 3.39Å; F202-I206 PolarHBondContact O-N 2.84Å; K203-I206 PolarHBondContact O-N 2.76Å; E204-I206 PolarHBondContact O-N 3.2Å; I206-D208 VanDerWaalsContact C-N 3.31Å; I206-D208 PolarHBondContact O-N 3.14Å; I206-V209 PolarHBondContact O-N 3.45Å; I206-Y210 WeakPolarHBondContact O-CB 3.09Å; I206-Y210 PolarHBondContact O-N 2.68Å
207	Y	88.4	Confident	87.6	Confident	125 Å²	125	68.7 Å²	68.7	49%	0.49	35%	0.35	S	S	.	.	H	α-helix	trans	-62	-42	177.7	-170.6	-107.8	0	0	0	111.6	K203 E204 V209 Y210 R211	K203-Y207 WeakPolarHBondContact O-CB 3.33Å; K203-Y207 PolarHBondContact O-N 2.86Å; K203-Y207 VanDerWaalsContact O-N 3.08Å; E204-Y207 WeakPolarHBondContact O-CB 3.13Å; E204-Y207 PolarHBondContact O-N 2.96Å; Y207-V209 PolarHBondContact O-N 3.4Å; Y207-Y210 PolarHBondContact O-N 3.31Å; Y207-R211 HydrophobicContact CD1-CG 4.29Å; Y207-R211 HydrophobicContact CE1-CG 4.06Å; Y207-R211 VanDerWaalsContact O-CG 3.31Å; Y207-R211 WeakPolarHBondContact O-CG 3.32Å; Y207-R211 PolarHBondContact O-N 2.89Å
208	D	91.3	Very high	88.4	Confident	51 Å²	51	69.5 Å²	69.5	27%	0.273	35%	0.354	S	S	.	.	H	α-helix	trans	-59.6	-44	174.4	-83.4	-18.7	0	0	0	111.7	F173 E204 Q205 I206 Y212	F173-D208 HydrophobicContact CD2-CB 3.99Å; F173-D208 HydrophobicContact CE1-CB 4.17Å; F173-D208 HydrophobicContact CE2-CB 3.61Å; F173-D208 HydrophobicContact CG-CB 4.45Å; F173-D208 HydrophobicContact CZ-CB 3.68Å; E204-D208 WeakPolarHBondContact O-CB 3.36Å; E204-D208 PolarHBondContact O-N 3.39Å; Q205-D208 PolarHBondContact O-N 2.7Å; I206-D208 VanDerWaalsContact C-N 3.31Å; I206-D208 PolarHBondContact O-N 3.14Å; D208-Y212 WeakPolarHBondContact O-CD2 2.99Å
209	V	94.7	Very high	89.5	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-49.5	172.9	170.3	0	0	0	0	111.1	L115 L117 V172 F173 I176 Q205 I206 Y207 R211 Y212	L115-V209 HydrophobicContact CD2-CG1 3.54Å; L117-V209 HydrophobicContact CD1-CB 4.43Å; L117-V209 HydrophobicContact CD1-CG1 4.25Å; V172-V209 HydrophobicContact CG1-CG1 4.35Å; V172-V209 HydrophobicContact CG1-CG2 4.17Å; F173-V209 HydrophobicContact CB-CG2 3.88Å; F173-V209 HydrophobicContact CD2-CG2 4.27Å; F173-V209 HydrophobicContact CG-CG2 4.48Å; I176-V209 HydrophobicContact CD1-CG1 4Å; I176-V209 HydrophobicContact CD1-CG2 4.42Å; Q205-V209 WeakPolarHBondContact O-CG2 3.35Å; Q205-V209 PolarHBondContact O-N 3.09Å; I206-V209 PolarHBondContact O-N 3.45Å; Y207-V209 PolarHBondContact O-N 3.4Å; V209-R211 VanDerWaalsContact C-N 3.28Å; V209-R211 PolarHBondContact O-N 3.44Å; V209-Y212 PolarHBondContact O-N 3.16Å; V209-Y212 VanDerWaalsContact O-N 3.08Å
210	Y	92.9	Very high	90.7	Very high	59 Å²	59	63.8 Å²	63.8	23%	0.231	32%	0.324	C	S	.	.	H	α-helix	trans	-56.1	-39.7	-176.6	179.7	-101.5	0	0	0	112.6	L189 I206 Y207 Y212 L213 V219 F237	L189-Y210 HydrophobicContact CD2-CD2 3.96Å; I206-Y210 WeakPolarHBondContact O-CB 3.09Å; I206-Y210 PolarHBondContact O-N 2.68Å; Y207-Y210 PolarHBondContact O-N 3.31Å; Y210-Y212 PolarHBondContact O-N 3.14Å; Y210-Y212 VanDerWaalsContact O-N 3.14Å; Y210-L213 WeakPolarHBondContact O-CB 3.4Å; Y210-L213 PolarHBondContact O-N 3Å; Y210-V219 HydrophobicContact CE2-CG2 3.93Å; Y210-F237 HydrophobicContact CD1-CB 4.24Å; Y210-F237 HydrophobicContact CD2-CB 4.42Å; Y210-F237 HydrophobicContact CE1-CB 3.84Å; Y210-F237 HydrophobicContact CE2-CB 4.04Å; Y210-F237 PolarHBondContact OH-O 3.23Å
211	R	93.4	Very high	92	Very high	170 Å²	170	60 Å²	60	64%	0.642	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.2	179.4	-72.2	176.4	76.1	179.3	4.6	115	Y207 V209	Y207-R211 HydrophobicContact CD1-CG 4.29Å; Y207-R211 HydrophobicContact CE1-CG 4.06Å; Y207-R211 VanDerWaalsContact O-CG 3.31Å; Y207-R211 WeakPolarHBondContact O-CG 3.32Å; Y207-R211 PolarHBondContact O-N 2.89Å; V209-R211 VanDerWaalsContact C-N 3.28Å; V209-R211 PolarHBondContact O-N 3.44Å
212	Y	96.7	Very high	92.6	Very high	117 Å²	117	57.7 Å²	57.7	46%	0.459	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-2.2	176.8	-74.7	-97.6	0	0	0	112.9	F173 I176 T183 D208 V209 Y210	F173-Y212 HydrophobicContact CE2-CD2 4.19Å; F173-Y212 AromaticContact CE2-CE2 3.78Å; F173-Y212 HydrophobicContact CE2-CE2 3.78Å; F173-Y212 HydrophobicContact CZ-CE2 4.49Å; I176-Y212 HydrophobicContact CG2-CD1 3.74Å; I176-Y212 HydrophobicContact CG2-CD2 4.27Å; I176-Y212 HydrophobicContact CG2-CE1 4.45Å; I176-Y212 HydrophobicContact CG2-CG 3.63Å; T183-Y212 WeakPolarHBondContact CB-O 3.3Å; T183-Y212 PolarHBondContact OG1-O 2.88Å; D208-Y212 WeakPolarHBondContact O-CD2 2.99Å; V209-Y212 PolarHBondContact O-N 3.16Å; V209-Y212 VanDerWaalsContact O-N 3.08Å; Y210-Y212 PolarHBondContact O-N 3.14Å; Y210-Y212 VanDerWaalsContact O-N 3.14Å
213	L	97.1	Very high	93	Very high	17 Å²	17	55.6 Å²	55.6	9%	0.089	27%	0.274	C	S	.	.	S	Bend	trans	-85.7	158	178.9	-54.3	-173.9	0	0	0	111.2	L115 T183 I186 L189 Y210 T217	L115-L213 HydrophobicContact CD2-CD2 4.12Å; T183-L213 HydrophobicContact CG2-CD2 3.96Å; I186-L213 HydrophobicContact CD1-CD2 3.69Å; I186-L213 HydrophobicContact CG2-CD2 4.3Å; L189-L213 HydrophobicContact CB-CD1 3.94Å; L189-L213 HydrophobicContact CD1-CD1 4.19Å; L189-L213 HydrophobicContact CD2-CD1 3.87Å; L189-L213 HydrophobicContact CG-CD1 4.21Å; Y210-L213 WeakPolarHBondContact O-CB 3.4Å; Y210-L213 PolarHBondContact O-N 3Å; L213-T217 HydrophobicContact CD1-CG2 4.12Å
214	P	97.6	Very high	92.9	Very high	35 Å²	35	50.6 Å²	50.6	23%	0.227	25%	0.252	C	S	.	.			trans	-58.1	150.1	173.5	-27.5	38.6	0	0	0	112.8	T183 I186 A216 T217	T183-P214 VanDerWaalsContact O-CD 3.3Å; T183-P214 WeakPolarHBondContact O-CD 3.32Å; T183-P214 WeakPolarHBondContact O-CG 3.11Å; I186-P214 WeakPolarHBondContact O-CG 3.31Å; P214-A216 VanDerWaalsContact C-N 3.27Å; P214-A216 PolarHBondContact O-N 3.15Å; P214-T217 WeakPolarHBondContact CD-OG1 3.49Å; P214-T217 WeakPolarHBondContact O-CB 3.16Å; P214-T217 PolarHBondContact O-N 2.98Å; P214-T217 PolarHBondContact O-OG1 3.47Å
215	P	92.1	Very high	92.8	Very high	134 Å²	134	43.6 Å²	43.6	87%	0.87	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.5	-171.1	25.5	-35.3	0	0	0	114.8
216	A	93.9	Very high	92.6	Very high	94 Å²	94	41.3 Å²	41.3	78%	0.777	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.5	27.3	179.2	0	0	0	0	0	112.1	P214 Q218	P214-A216 VanDerWaalsContact C-N 3.27Å; P214-A216 PolarHBondContact O-N 3.15Å; A216-Q218 PolarHBondContact O-N 3.08Å
217	T	97.6	Very high	92.2	Very high	8 Å²	8	42.5 Å²	42.5	5%	0.049	22%	0.218	C	C	.	.			trans	-68.1	120.8	177.3	-60.3	0	0	0	0	109.3	I186 L189 L213 P214	I186-T217 HydrophobicContact CG2-CG2 4.2Å; L189-T217 HydrophobicContact CB-CG2 3.92Å; L213-T217 HydrophobicContact CD1-CG2 4.12Å; P214-T217 WeakPolarHBondContact CD-OG1 3.49Å; P214-T217 WeakPolarHBondContact O-CB 3.16Å; P214-T217 PolarHBondContact O-N 2.98Å; P214-T217 PolarHBondContact O-OG1 3.47Å
218	Q	98.3	Very high	91.7	Very high	18 Å²	18	38.8 Å²	38.8	8%	0.084	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	135	170.7	-179.5	-171.4	10.1	0	0	109.7	I77 R81 D82 K187 M188 L189 A216 V220	I77-Q218 PolarHBondContact O-NE2 3.02Å; R81-Q218 PolarHBondContact O-NE2 3.09Å; D82-Q218 WeakPolarHBondContact OD1-CA 3.24Å; K187-Q218 WeakPolarHBondContact O-CB 3.25Å; K187-Q218 PolarHBondContact O-N 3.29Å; M188-Q218 CarbonylContact C-O 3.41Å; M188-Q218 WeakPolarHBondContact CA-O 3.4Å; L189-Q218 PolarHBondContact N-O 3.26Å; A216-Q218 PolarHBondContact O-N 3.08Å; Q218-V220 HydrophobicContact CG-CG2 4.4Å
219	V	96.9	Very high	91	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	131.2	176.9	-172.1	0	0	0	0	110.3	D82 V83 L189 Y210 F237 M238	D82-V219 VanDerWaalsContact CA-O 3.3Å; D82-V219 WeakPolarHBondContact CA-O 3.47Å; D82-V219 PolarHBondContact OD1-N 3.16Å; V83-V219 PolarHBondContact N-O 2.96Å; V83-V219 VanDerWaalsContact N-O 3.11Å; L189-V219 CarbonylContact O-C 3.59Å; L189-V219 WeakPolarHBondContact O-CA 3.35Å; Y210-V219 HydrophobicContact CE2-CG2 3.93Å; V219-F237 HydrophobicContact CG1-CD2 3.93Å; V219-F237 HydrophobicContact CG1-CE2 3.94Å; V219-F237 HydrophobicContact CG2-CD2 4.43Å; V219-F237 WeakPolarHBondContact CG2-O 3.47Å; V219-M238 HydrophobicContact CB-CE 3.91Å; V219-M238 HydrophobicContact CB-CG 4.06Å; V219-M238 HydrophobicContact CG1-CE 3.89Å; V219-M238 HydrophobicContact CG1-CG 4.12Å; V219-M238 HydrophobicContact CG1-SD 4.43Å; V219-M238 WeakPolarHBondContact O-CE 3.13Å
220	V	97	Very high	90.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119.2	177	-177.9	0	0	0	0	108.5	I77 V83 M188 L189 V190 L191 Q218 I222	I77-V220 HydrophobicContact CD1-CG1 3.84Å; I77-V220 HydrophobicContact CG1-CG1 4.14Å; I77-V220 HydrophobicContact CG1-CG2 4.21Å; I77-V220 HydrophobicContact CG2-CG2 3.84Å; V83-V220 HydrophobicContact CB-CG1 4.39Å; V83-V220 CarbonylContact O-C 3.55Å; V83-V220 WeakPolarHBondContact O-CA 3.48Å; M188-V220 HydrophobicContact CG-CG2 4.29Å; M188-V220 HydrophobicContact SD-CG2 4.35Å; L189-V220 PolarHBondContact O-N 3Å; V190-V220 CarbonylContact C-O 3.55Å; V190-V220 VanDerWaalsContact CA-O 3.32Å; V190-V220 WeakPolarHBondContact CA-O 3.31Å; V190-V220 HydrophobicContact CG1-CB 4.44Å; V190-V220 HydrophobicContact CG1-CG1 4.49Å; V190-V220 HydrophobicContact CG2-CB 4.21Å; L191-V220 PolarHBondContact N-O 3.41Å; Q218-V220 HydrophobicContact CG-CG2 4.4Å; V220-I222 HydrophobicContact CG1-CD1 3.85Å; V220-I222 HydrophobicContact CG1-CG1 3.96Å
221	L	95	Very high	89.7	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.3	178.8	-169.1	158.1	0	0	0	109.8	V83 I84 A85 A194 L226 I230 T234 M238	V83-L221 PolarHBondContact O-N 3.26Å; I84-L221 HydrophobicContact CG1-CB 4.42Å; I84-L221 HydrophobicContact CG2-CD2 4.4Å; A85-L221 PolarHBondContact N-O 2.92Å; A194-L221 HydrophobicContact CB-CD1 3.84Å; A194-L221 HydrophobicContact CB-CD2 3.65Å; A194-L221 HydrophobicContact CB-CG 3.5Å; A194-L221 VanDerWaalsContact CB-CG 3.5Å; L221-L226 HydrophobicContact CD2-CD2 3.37Å; L221-I230 HydrophobicContact CD1-CG2 4.22Å; L221-T234 HydrophobicContact CD1-CG2 3.59Å; L221-M238 HydrophobicContact CB-CE 4.32Å; L221-M238 HydrophobicContact CB-SD 4.46Å
222	I	92.4	Very high	89	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126	-177.3	-53.8	-66.5	0	0	0	109.3	A85 K93 F97 L191 E193 A194 V220	A85-I222 HydrophobicContact CB-CD1 3.47Å; A85-I222 VanDerWaalsContact CB-CD1 3.47Å; A85-I222 WeakPolarHBondContact O-CA 3.46Å; K93-I222 HydrophobicContact CB-CG2 3.7Å; K93-I222 HydrophobicContact CD-CG2 3.8Å; K93-I222 HydrophobicContact CG-CG2 4.13Å; F97-I222 HydrophobicContact CD1-CB 4.39Å; F97-I222 HydrophobicContact CD1-CG1 3.91Å; F97-I222 HydrophobicContact CD1-CG2 4.37Å; L191-I222 PolarHBondContact O-N 2.9Å; E193-I222 PolarHBondContact N-O 2.87Å; A194-I222 PolarHBondContact N-O 2.95Å; V220-I222 HydrophobicContact CG1-CD1 3.85Å; V220-I222 HydrophobicContact CG1-CG1 3.96Å
223	S	89.3	Confident	88	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	163.1	169.6	-174.3	0	0	0	0	112	A85 Q86 S87 D195 T225	A85-S223 PolarHBondContact O-N 3.36Å; Q86-S223 WeakPolarHBondContact CA-O 3.2Å; S87-S223 PolarHBondContact N-O 3.24Å; D195-S223 VanDerWaalsContact CG-OG 3.28Å; D195-S223 PolarHBondContact OD1-OG 2.77Å; S223-T225 WeakPolarHBondContact CB-O 3.43Å; S223-T225 PolarHBondContact OG-N 3.09Å; S223-T225 PolarHBondContact OG-O 2.96Å
224	A	83.2	Confident	87.2	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.008	18%	0.182	C	C	.	.	S	Bend	trans	-75	-33.8	165.4	0	0	0	0	0	112.3	Q86 S87 L251	Q86-A224 WeakPolarHBondContact CG-O 3.21Å; Q86-A224 PolarHBondContact NE2-O 3.38Å; Q86-A224 VanDerWaalsContact NE2-O 3.12Å; S87-A224 VanDerWaalsContact O-CA 3.27Å; S87-A224 WeakPolarHBondContact O-CA 3.41Å; A224-L251 WeakPolarHBondContact O-CD2 3.36Å
225	T	82.4	Confident	86.5	Confident	6 Å²	6	33.1 Å²	33.1	4%	0.037	19%	0.19	C	C	.	.			trans	-125	127.9	-175.3	37.2	0	0	0	0	109.2	D195 S223 P227 E364 H368	D195-T225 WeakPolarHBondContact CB-O 3.44Å; D195-T225 PolarHBondContact OD2-OG1 3.24Å; S223-T225 WeakPolarHBondContact CB-O 3.43Å; S223-T225 PolarHBondContact OG-N 3.09Å; S223-T225 PolarHBondContact OG-O 2.96Å; T225-P227 WeakPolarHBondContact O-CD 3.29Å; T225-E364 HydrophobicContact CG2-CB 4.12Å; T225-E364 HydrophobicContact CG2-CG 3.98Å; T225-H368 PolarHBondContact OG1-NE2 2.87Å
226	L	84.7	Confident	85.9	Confident	17 Å²	17	34.2 Å²	34.2	9%	0.089	18%	0.182	C	C	.	.			trans	-124.1	81.8	175.6	-65.2	177.4	0	0	0	109.5	I84 Q86 L221 I230 L231 L245	I84-L226 HydrophobicContact CG2-CD1 3.5Å; I84-L226 VanDerWaalsContact CG2-CD1 3.5Å; Q86-L226 HydrophobicContact CB-CD1 3.77Å; Q86-L226 HydrophobicContact CB-CG 4.35Å; Q86-L226 HydrophobicContact CG-CD1 4.17Å; Q86-L226 HydrophobicContact CG-CG 4.21Å; L221-L226 HydrophobicContact CD2-CD2 3.37Å; L226-I230 HydrophobicContact CD2-CG2 4.15Å; L226-L231 HydrophobicContact CB-CD2 4.18Å; L226-L231 HydrophobicContact CB-CG 4.37Å; L226-L231 HydrophobicContact CD1-CD2 4.16Å; L226-L245 HydrophobicContact CD1-CD2 3.77Å
227	P	81	Confident	85.5	Confident	36 Å²	36	31 Å²	31	23%	0.234	15%	0.15	C	C	.	.			trans	-53.9	152.9	168.3	-22.9	30.3	0	0	0	111.6	T225 E229 I230 L231 E364	T225-P227 WeakPolarHBondContact O-CD 3.29Å; P227-E229 PolarHBondContact O-N 2.96Å; P227-I230 HydrophobicContact CB-CG1 4.12Å; P227-I230 HydrophobicContact CG-CG1 4.12Å; P227-I230 VanDerWaalsContact O-CB 3.31Å; P227-I230 WeakPolarHBondContact O-CB 3.2Å; P227-I230 PolarHBondContact O-N 3.01Å; P227-L231 PolarHBondContact O-N 2.84Å; P227-E364 HydrophobicContact CG-CG 4.45Å
228	H	79.2	Confident	85.2	Confident	47 Å²	47	31.2 Å²	31.2	22%	0.218	15%	0.15	C	C	.	.	H	α-helix	trans	-55.1	-40.2	-176.8	-168.8	-76.2	0	0	0	112.8	M28 T29 F33 I230 L231 E232	M28-H228 VanDerWaalsContact C-CE1 3.47Å; M28-H228 PolarHBondContact O-CE1 2.84Å; M28-H228 PolarHBondContact O-NE2 2.84Å; T29-H228 VanDerWaalsContact CA-CE1 3.44Å; T29-H228 WeakPolarHBondContact CA-CE1 3.38Å; F33-H228 AromaticContact CE2-CD2 3.75Å; F33-H228 AromaticContact CE2-CE1 3.98Å; F33-H228 AromaticContact CE2-NE2 3.41Å; F33-H228 WeakPolarHBondContact CE2-NE2 3.46Å; H228-I230 PolarHBondContact O-N 2.76Å; H228-L231 WeakPolarHBondContact O-CB 3.48Å; H228-L231 PolarHBondContact O-N 2.96Å; H228-E232 IonicContact CE1-OE1 3.15Å; H228-E232 PolarHBondContact CE1-OE1 2.82Å; H228-E232 IonicContact ND1-OE1 2.62Å; H228-E232 PolarHBondContact ND1-OE1 3.06Å; H228-E232 PolarHBondContact O-N 3.06Å
229	E	75.9	Confident	84.8	Confident	148 Å²	148	36 Å²	36	69%	0.692	18%	0.181	S	C	*	.	H	α-helix	trans	-59.5	-31	177.1	-59.9	-178.6	-172.7	0	0	113.4	P227 M233	P227-E229 PolarHBondContact O-N 2.96Å; E229-M233 PolarHBondContact O-N 3.47Å
230	I	79.3	Confident	84.5	Confident	8 Å²	8	41.4 Å²	41.4	4%	0.041	21%	0.21	C	C	.	.	H	α-helix	trans	-71.1	-44.8	175.8	-49.5	-53.6	0	0	0	109.6	D195 L198 L221 L226 P227 H228 E232 M233 T234	D195-I230 HydrophobicContact CB-CD1 4.39Å; D195-I230 HydrophobicContact CB-CG1 4.18Å; L198-I230 HydrophobicContact CB-CD1 3.83Å; L198-I230 HydrophobicContact CD1-CB 4.42Å; L198-I230 HydrophobicContact CD1-CD1 3.31Å; L198-I230 HydrophobicContact CD1-CG1 4.33Å; L198-I230 HydrophobicContact CD1-CG2 3.95Å; L198-I230 HydrophobicContact CG-CD1 4.15Å; L221-I230 HydrophobicContact CD1-CG2 4.22Å; L226-I230 HydrophobicContact CD2-CG2 4.15Å; P227-I230 HydrophobicContact CB-CG1 4.12Å; P227-I230 HydrophobicContact CG-CG1 4.12Å; P227-I230 VanDerWaalsContact O-CB 3.31Å; P227-I230 WeakPolarHBondContact O-CB 3.2Å; P227-I230 PolarHBondContact O-N 3.01Å; H228-I230 PolarHBondContact O-N 2.76Å; I230-E232 PolarHBondContact O-N 2.69Å; I230-M233 WeakPolarHBondContact O-CB 3.32Å; I230-M233 PolarHBondContact O-N 3.41Å; I230-M233 VanDerWaalsContact O-N 3.12Å; I230-T234 WeakPolarHBondContact O-CG2 3.29Å; I230-T234 PolarHBondContact O-N 2.79Å
231	L	80.9	Confident	84.3	Confident	10 Å²	10	41.7 Å²	41.7	5%	0.052	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-41.2	179	-63.1	174.3	0	0	0	111.2	F33 I84 L226 P227 H228 M233 T234	F33-L231 HydrophobicContact CB-CD1 3.95Å; F33-L231 HydrophobicContact CD1-CD1 4.35Å; F33-L231 HydrophobicContact CD2-CB 4.13Å; F33-L231 HydrophobicContact CD2-CD1 3.39Å; F33-L231 HydrophobicContact CD2-CG 4.38Å; F33-L231 HydrophobicContact CE1-CB 4.23Å; F33-L231 HydrophobicContact CE2-CB 3.73Å; F33-L231 HydrophobicContact CE2-CD1 3.87Å; F33-L231 HydrophobicContact CE2-CG 4.45Å; F33-L231 HydrophobicContact CG-CD1 3.65Å; F33-L231 HydrophobicContact CZ-CB 3.79Å; I84-L231 HydrophobicContact CG2-CD2 4.03Å; L226-L231 HydrophobicContact CB-CD2 4.18Å; L226-L231 HydrophobicContact CB-CG 4.37Å; L226-L231 HydrophobicContact CD1-CD2 4.16Å; P227-L231 PolarHBondContact O-N 2.84Å; H228-L231 WeakPolarHBondContact O-CB 3.48Å; H228-L231 PolarHBondContact O-N 2.96Å; L231-M233 VanDerWaalsContact C-N 3.25Å; L231-M233 PolarHBondContact O-N 3.04Å; L231-T234 PolarHBondContact O-N 3.13Å; L231-T234 PolarHBondContact O-OG1 3.07Å
232	E	78.7	Confident	84.3	Confident	64 Å²	64	41.8 Å²	41.8	30%	0.299	21%	0.212	S	C	.	.	H	α-helix	trans	-59.5	-37.4	173.3	-73.2	177.7	-169.2	0	0	112.7	M28 H228 I230 T234 N235	M28-E232 HydrophobicContact CB-CG 4.13Å; H228-E232 IonicContact CE1-OE1 3.15Å; H228-E232 PolarHBondContact CE1-OE1 2.82Å; H228-E232 IonicContact ND1-OE1 2.62Å; H228-E232 PolarHBondContact ND1-OE1 3.06Å; H228-E232 PolarHBondContact O-N 3.06Å; I230-E232 PolarHBondContact O-N 2.69Å; E232-T234 VanDerWaalsContact C-N 3.32Å; E232-T234 PolarHBondContact O-N 3.08Å; E232-N235 WeakPolarHBondContact O-CB 3.29Å; E232-N235 PolarHBondContact O-N 3.42Å
233	M	75.3	Confident	84.3	Confident	23 Å²	23	43.9 Å²	43.9	11%	0.113	22%	0.22	C	C	.	.	H	α-helix	trans	-68.4	-32.9	-179.8	-160.2	-173.5	-53.4	0	0	112.5	L198 K203 E229 I230 L231 N235 K236 F237	L198-M233 HydrophobicContact CB-CE 4.46Å; L198-M233 HydrophobicContact CD1-CE 3.33Å; L198-M233 HydrophobicContact CD1-SD 3.66Å; L198-M233 HydrophobicContact CD2-CE 3.52Å; L198-M233 HydrophobicContact CD2-SD 3.48Å; L198-M233 WeakPolarHBondContact CD2-SD 3.31Å; L198-M233 HydrophobicContact CG-CE 3.91Å; L198-M233 HydrophobicContact CG-SD 4.21Å; K203-M233 HydrophobicContact CD-CE 3.63Å; K203-M233 HydrophobicContact CD-SD 4.06Å; K203-M233 VanDerWaalsContact CE-CE 3.43Å; K203-M233 HydrophobicContact CG-CE 4.03Å; K203-M233 HydrophobicContact CG-SD 3.87Å; E229-M233 PolarHBondContact O-N 3.47Å; I230-M233 WeakPolarHBondContact O-CB 3.32Å; I230-M233 PolarHBondContact O-N 3.41Å; I230-M233 VanDerWaalsContact O-N 3.12Å; L231-M233 VanDerWaalsContact C-N 3.25Å; L231-M233 PolarHBondContact O-N 3.04Å; M233-N235 PolarHBondContact O-N 3.35Å; M233-K236 WeakPolarHBondContact O-CB 3.48Å; M233-K236 PolarHBondContact O-N 2.98Å; M233-F237 HydrophobicContact CG-CE1 3.93Å; M233-F237 WeakPolarHBondContact O-CE1 3.22Å; M233-F237 HydrophobicContact SD-CE1 4.31Å
234	T	81.4	Confident	84.4	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-58	-31	178.8	66.6	0	0	0	0	112.7	I84 L221 I230 L231 E232 K236 F237 M238	I84-T234 HydrophobicContact CD1-CG2 3.72Å; I84-T234 WeakPolarHBondContact CD1-OG1 3.46Å; I84-T234 HydrophobicContact CG1-CG2 4.21Å; L221-T234 HydrophobicContact CD1-CG2 3.59Å; I230-T234 WeakPolarHBondContact O-CG2 3.29Å; I230-T234 PolarHBondContact O-N 2.79Å; L231-T234 PolarHBondContact O-N 3.13Å; L231-T234 PolarHBondContact O-OG1 3.07Å; E232-T234 VanDerWaalsContact C-N 3.32Å; E232-T234 PolarHBondContact O-N 3.08Å; T234-K236 PolarHBondContact O-N 2.89Å; T234-F237 PolarHBondContact O-N 3.12Å; T234-M238 VanDerWaalsContact CB-SD 3.58Å; T234-M238 HydrophobicContact CG2-SD 3.82Å; T234-M238 VanDerWaalsContact O-CB 3.31Å; T234-M238 WeakPolarHBondContact O-CB 3.4Å; T234-M238 WeakPolarHBondContact O-CG 3.31Å; T234-M238 PolarHBondContact O-N 3.08Å
235	N	81	Confident	84.5	Confident	76 Å²	76	45.6 Å²	45.6	41%	0.406	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-14.7	177.4	-62.7	-33.1	0	0	0	113.8	E232 M233	E232-N235 WeakPolarHBondContact O-CB 3.29Å; E232-N235 PolarHBondContact O-N 3.42Å; M233-N235 PolarHBondContact O-N 3.35Å
236	K	80.8	Confident	84.3	Confident	158 Å²	158	46.6 Å²	46.6	69%	0.687	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-22.3	-179.5	-62.3	-172.4	179	-173.8	0	114.1	M233 T234	M233-K236 WeakPolarHBondContact O-CB 3.48Å; M233-K236 PolarHBondContact O-N 2.98Å; T234-K236 PolarHBondContact O-N 2.89Å
237	F	84.6	Confident	83.5	Confident	26 Å²	26	52.6 Å²	52.6	11%	0.114	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.3	5	-173.2	58.3	-100.8	0	0	0	113.9	L191 Y210 V219 M233 T234	L191-F237 HydrophobicContact CD1-CE2 4.12Å; L191-F237 HydrophobicContact CD1-CZ 4.26Å; Y210-F237 HydrophobicContact CD1-CB 4.24Å; Y210-F237 HydrophobicContact CD2-CB 4.42Å; Y210-F237 HydrophobicContact CE1-CB 3.84Å; Y210-F237 HydrophobicContact CE2-CB 4.04Å; Y210-F237 PolarHBondContact OH-O 3.23Å; V219-F237 HydrophobicContact CG1-CD2 3.93Å; V219-F237 HydrophobicContact CG1-CE2 3.94Å; V219-F237 HydrophobicContact CG2-CD2 4.43Å; V219-F237 WeakPolarHBondContact CG2-O 3.47Å; M233-F237 HydrophobicContact CG-CE1 3.93Å; M233-F237 WeakPolarHBondContact O-CE1 3.22Å; M233-F237 HydrophobicContact SD-CE1 4.31Å; T234-F237 PolarHBondContact O-N 3.12Å
238	M	91.1	Very high	82.8	Confident	12 Å²	12	57.4 Å²	57.4	6%	0.059	27%	0.274	C	S	.	.			trans	-117.4	146.8	171.4	-51.6	-174.1	90.4	0	0	109.9	D82 V83 I84 V219 L221 T234 P241	D82-M238 HydrophobicContact CB-CB 4.28Å; D82-M238 HydrophobicContact CB-CE 3.99Å; D82-M238 WeakPolarHBondContact OD2-CA 3.44Å; D82-M238 WeakPolarHBondContact OD2-CB 3.27Å; V83-M238 WeakPolarHBondContact O-CE 3.26Å; I84-M238 HydrophobicContact CD1-SD 3.97Å; I84-M238 HydrophobicContact CG1-CE 3.96Å; I84-M238 HydrophobicContact CG1-SD 3.65Å; V219-M238 HydrophobicContact CB-CE 3.91Å; V219-M238 HydrophobicContact CB-CG 4.06Å; V219-M238 HydrophobicContact CG1-CE 3.89Å; V219-M238 HydrophobicContact CG1-CG 4.12Å; V219-M238 HydrophobicContact CG1-SD 4.43Å; V219-M238 WeakPolarHBondContact O-CE 3.13Å; L221-M238 HydrophobicContact CB-CE 4.32Å; L221-M238 HydrophobicContact CB-SD 4.46Å; T234-M238 VanDerWaalsContact CB-SD 3.58Å; T234-M238 HydrophobicContact CG2-SD 3.82Å; T234-M238 VanDerWaalsContact O-CB 3.31Å; T234-M238 WeakPolarHBondContact O-CB 3.4Å; T234-M238 WeakPolarHBondContact O-CG 3.31Å; T234-M238 PolarHBondContact O-N 3.08Å; M238-P241 HydrophobicContact CB-CB 4.27Å; M238-P241 HydrophobicContact CB-CG 4.28Å; M238-P241 HydrophobicContact CE-CB 4.37Å; M238-P241 HydrophobicContact SD-CB 4.4Å
239	T	90.1	Very high	82.1	Confident	119 Å²	119	60 Å²	60	73%	0.73	29%	0.289	S	S	*	.	S	Bend	trans	-117	114.5	179.4	-53.5	0	0	0	0	109.8	D82	D82-T239 PolarHBondContact OD2-N 3.49Å
240	D	90.4	Very high	81.6	Confident	114 Å²	114	58.5 Å²	58.5	61%	0.61	28%	0.282	S	S	*	.	S	Bend	trans	44.8	60.1	-179.7	-173.4	41.2	0	0	0	113.7	R81	R81-D240 IonicContact CZ-OD2 2.87Å; R81-D240 PolarHBondContact NH2-O 2.9Å; R81-D240 IonicContact NH2-OD2 2.64Å; R81-D240 PolarHBondContact NH2-OD2 3.3Å
241	P	94	Very high	80.9	Confident	6 Å²	6	58.4 Å²	58.4	4%	0.039	28%	0.282	C	S	.	.			trans	-73.1	138.6	-172.8	30.1	-34.8	0	0	0	111.6	D82 I84 M238 R243	D82-P241 HydrophobicContact CB-CB 3.99Å; D82-P241 CarbonylContact O-C 3.59Å; D82-P241 WeakPolarHBondContact O-CA 3.35Å; I84-P241 HydrophobicContact CD1-CB 3.98Å; I84-P241 HydrophobicContact CD1-CG 3.84Å; I84-P241 HydrophobicContact CG1-CB 4.12Å; M238-P241 HydrophobicContact CB-CB 4.27Å; M238-P241 HydrophobicContact CB-CG 4.28Å; M238-P241 HydrophobicContact CE-CB 4.37Å; M238-P241 HydrophobicContact SD-CB 4.4Å; P241-R243 PolarHBondContact O-N 3.35Å; P241-R243 PolarHBondContact O-NH1 3Å
242	I	94.4	Very high	80.1	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.015	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	127	164.7	-67.2	-63.6	0	0	0	108.7	E38 V39 Q76 R81 D82 V83 I84 I244	E38-I242 HydrophobicContact CB-CD1 4.25Å; V39-I242 HydrophobicContact CG2-CG2 3.71Å; Q76-I242 HydrophobicContact CB-CG2 4.34Å; Q76-I242 HydrophobicContact CG-CG2 4.11Å; R81-I242 HydrophobicContact CB-CG1 4.1Å; R81-I242 HydrophobicContact CG-CG1 4.3Å; D82-I242 PolarHBondContact O-N 3.01Å; V83-I242 CarbonylContact C-O 3.57Å; V83-I242 WeakPolarHBondContact CA-O 3.36Å; V83-I242 HydrophobicContact CG2-CB 4.36Å; I84-I242 PolarHBondContact N-O 3.29Å; I242-I244 HydrophobicContact CG2-CD1 4.43Å; I242-I244 HydrophobicContact CG2-CG1 4.18Å
243	R	92.2	Very high	79.6	Confident	47 Å²	47	57.3 Å²	57.3	18%	0.177	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.9	178.9	-62.8	178.5	-173.9	80.7	-1.5	109.1	T35 S36 I84 P241 L245	T35-R243 CarbonylContact C-O 3.46Å; T35-R243 VanDerWaalsContact CA-O 3.31Å; T35-R243 WeakPolarHBondContact CA-O 3.46Å; T35-R243 WeakPolarHBondContact CG2-O 3.44Å; S36-R243 PolarHBondContact N-O 2.75Å; S36-R243 PolarHBondContact OG-N 2.82Å; I84-R243 HydrophobicContact CB-CG 4.41Å; I84-R243 HydrophobicContact CD1-CG 4.3Å; I84-R243 CarbonylContact O-C 3.56Å; I84-R243 WeakPolarHBondContact O-CA 3.38Å; P241-R243 PolarHBondContact O-N 3.35Å; P241-R243 PolarHBondContact O-NH1 3Å; R243-L245 HydrophobicContact CB-CD1 4.3Å; R243-L245 HydrophobicContact CB-CG 4.16Å
244	I	90.9	Very high	79.3	Confident	8 Å²	8	65.7 Å²	65.7	4%	0.041	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	95.5	172.2	-58.6	166	0	0	0	105.7	V39 I69 R72 A73 I84 Q86 I242	V39-I244 HydrophobicContact CG1-CD1 4.17Å; V39-I244 HydrophobicContact CG1-CG1 4.13Å; V39-I244 HydrophobicContact CG2-CG1 4.01Å; I69-I244 HydrophobicContact CD1-CB 4.32Å; I69-I244 HydrophobicContact CD1-CG2 3.63Å; R72-I244 HydrophobicContact CB-CD1 4Å; R72-I244 HydrophobicContact CB-CG2 4.3Å; A73-I244 VanDerWaalsContact CA-CD1 3.46Å; A73-I244 HydrophobicContact CB-CD1 3.6Å; I84-I244 PolarHBondContact O-N 3.36Å; Q86-I244 PolarHBondContact N-O 3.36Å; I242-I244 HydrophobicContact CG2-CD1 4.43Å; I242-I244 HydrophobicContact CG2-CG1 4.18Å
245	L	87.1	Confident	79.2	Confident	28 Å²	28	67 Å²	67	15%	0.147	33%	0.331	C	S	.	.			trans	-111.3	147.2	-170.9	-56.2	178.5	0	0	0	110.3	F33 T35 I84 Q86 L226 R243	F33-L245 HydrophobicContact CB-CD1 3.64Å; F33-L245 WeakPolarHBondContact O-CD1 3.27Å; T35-L245 PolarHBondContact OG1-N 3.33Å; T35-L245 PolarHBondContact OG1-O 2.93Å; T35-L245 VanDerWaalsContact OG1-O 3.09Å; I84-L245 HydrophobicContact CG2-CD2 4.29Å; Q86-L245 HydrophobicContact CB-CD2 4.17Å; L226-L245 HydrophobicContact CD1-CD2 3.77Å; R243-L245 HydrophobicContact CB-CD1 4.3Å; R243-L245 HydrophobicContact CB-CG 4.16Å
246	V	76.7	Confident	79.6	Confident	27 Å²	27	63.7 Å²	63.7	16%	0.164	31%	0.314	C	S	.	.			trans	-106.9	132.4	173.7	178.3	0	0	0	0	107.5	Q86 E250 L251	Q86-V246 WeakPolarHBondContact O-CG2 3.48Å; V246-E250 HydrophobicContact CG1-CB 3.91Å; V246-L251 HydrophobicContact CB-CD2 4.2Å; V246-L251 HydrophobicContact CG1-CD2 4.19Å; V246-L251 HydrophobicContact CG1-CG 4.36Å
247	K	68.9	Low	80	Confident	144 Å²	144	61.1 Å²	61.1	63%	0.626	30%	0.303	S	S	*	.			trans	-59.6	146.7	175.7	-70.8	-172.1	176	-176.8	0	109.8	D249 E250 L251	K247-D249 PolarHBondContact O-N 2.81Å; K247-E250 HydrophobicContact CB-CG 4.39Å; K247-E250 PolarHBondContact O-N 2.87Å; K247-L251 PolarHBondContact O-N 3.19Å
248	R	65.5	Low	80.5	Confident	136 Å²	136	60.5 Å²	60.5	51%	0.513	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-58.4	-40.5	-174.7	-66.2	-177.5	-176.4	169.2	3	112.3	E250 L251	R248-E250 PolarHBondContact O-N 3Å; R248-L251 HydrophobicContact CB-CD1 4.4Å; R248-L251 HydrophobicContact CG-CD1 4.41Å; R248-L251 VanDerWaalsContact O-CB 3.32Å; R248-L251 WeakPolarHBondContact O-CB 3.35Å; R248-L251 PolarHBondContact O-N 3.15Å
249	D	64.4	Low	80.6	Confident	101 Å²	101	60.4 Å²	60.4	54%	0.54	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-67	-16	-178.3	-30.5	-23.7	0	0	0	112.1	K247	K247-D249 PolarHBondContact O-N 2.81Å
250	E	66.8	Low	80.9	Confident	117 Å²	117	55.5 Å²	55.5	55%	0.547	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-106.3	4.6	178	-61.9	175.1	-169	0	0	112.2	Q88 V246 K247 R248 T252	Q88-E250 PolarHBondContact NE2-O 3.26Å; V246-E250 HydrophobicContact CG1-CB 3.91Å; K247-E250 HydrophobicContact CB-CG 4.39Å; K247-E250 PolarHBondContact O-N 2.87Å; R248-E250 PolarHBondContact O-N 3Å; E250-T252 VanDerWaalsContact C-N 3.31Å
251	L	63.7	Low	81.1	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.037	25%	0.245	C	C	.	.			trans	-76.6	-18.7	-179.7	-78	166.5	0	0	0	113.5	Q88 A224 V246 K247 R248 Y401	Q88-L251 WeakPolarHBondContact CG-O 3.38Å; A224-L251 WeakPolarHBondContact O-CD2 3.36Å; V246-L251 HydrophobicContact CB-CD2 4.2Å; V246-L251 HydrophobicContact CG1-CD2 4.19Å; V246-L251 HydrophobicContact CG1-CG 4.36Å; K247-L251 PolarHBondContact O-N 3.19Å; R248-L251 HydrophobicContact CB-CD1 4.4Å; R248-L251 HydrophobicContact CG-CD1 4.41Å; R248-L251 VanDerWaalsContact O-CB 3.32Å; R248-L251 WeakPolarHBondContact O-CB 3.35Å; R248-L251 PolarHBondContact O-N 3.15Å; L251-Y401 HydrophobicContact CB-CD1 4.5Å; L251-Y401 HydrophobicContact CD1-CE1 4.42Å
252	T	64.9	Low	81.1	Confident	26 Å²	26	53.2 Å²	53.2	16%	0.16	26%	0.263	C	S	.	.	S	Bend	trans	-70.9	144.3	-178.8	57.6	0	0	0	0	109.9	E250 E254 Y401 T403	E250-T252 VanDerWaalsContact C-N 3.31Å; T252-E254 PolarHBondContact O-N 3.28Å; T252-Y401 VanDerWaalsContact CG2-O 3.31Å; T252-Y401 WeakPolarHBondContact CG2-O 3.45Å; T252-T403 HydrophobicContact CG2-CG2 4.48Å
253	L	68.4	Low	81	Confident	24 Å²	24	53.2 Å²	53.2	13%	0.126	26%	0.263	C	S	.	.			trans	-87.7	101.7	178.8	-70.7	165.4	0	0	0	107.5	Q88 G255 I256	Q88-L253 HydrophobicContact CB-CD2 3.67Å; Q88-L253 HydrophobicContact CB-CG 4.39Å; Q88-L253 HydrophobicContact CG-CD2 4.39Å; L253-G255 PolarHBondContact O-N 2.57Å; L253-I256 HydrophobicContact CB-CB 4.34Å; L253-I256 HydrophobicContact CB-CD1 3.76Å; L253-I256 HydrophobicContact CB-CG1 3.78Å; L253-I256 HydrophobicContact CD1-CD1 3.43Å; L253-I256 VanDerWaalsContact CD1-CD1 3.43Å; L253-I256 HydrophobicContact CD1-CG1 4.35Å; L253-I256 HydrophobicContact CG-CD1 4.22Å; L253-I256 PolarHBondContact O-N 3.41Å
254	E	68.7	Low	80.9	Confident	200 Å²	200	57.2 Å²	57.2	94%	0.935	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-24.5	178.1	-68.3	-177.1	170	0	0	113.2	T252 I256	T252-E254 PolarHBondContact O-N 3.28Å; E254-I256 VanDerWaalsContact C-N 3.34Å
255	G	78.5	Confident	81	Confident	28 Å²	28	64 Å²	64	29%	0.289	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-7	176.7	0	0	0	0	0	115.7	L253 K379 G380	L253-G255 PolarHBondContact O-N 2.57Å; G255-K379 CarbonylContact O-C 3.55Å; G255-K379 VanDerWaalsContact O-CA 3.29Å; G255-K379 WeakPolarHBondContact O-CA 3.47Å; G255-G380 PolarHBondContact O-N 3.37Å
256	I	88.5	Confident	81.2	Confident	7 Å²	7	65.3 Å²	65.3	4%	0.036	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	111.1	-176.1	-55	-176.3	0	0	0	110.5	L253 E254 Q258 I370 G380 A382	L253-I256 HydrophobicContact CB-CB 4.34Å; L253-I256 HydrophobicContact CB-CD1 3.76Å; L253-I256 HydrophobicContact CB-CG1 3.78Å; L253-I256 HydrophobicContact CD1-CD1 3.43Å; L253-I256 VanDerWaalsContact CD1-CD1 3.43Å; L253-I256 HydrophobicContact CD1-CG1 4.35Å; L253-I256 HydrophobicContact CG-CD1 4.22Å; L253-I256 PolarHBondContact O-N 3.41Å; E254-I256 VanDerWaalsContact C-N 3.34Å; I256-Q258 HydrophobicContact CG2-CG 4.26Å; I256-I370 HydrophobicContact CD1-CG1 4.39Å; I256-I370 VanDerWaalsContact CD1-O 3.31Å; I256-I370 WeakPolarHBondContact CD1-O 3.48Å; I256-G380 CarbonylContact C-O 3.55Å; I256-G380 VanDerWaalsContact CA-O 3.32Å; I256-G380 WeakPolarHBondContact CA-O 3.36Å; I256-A382 HydrophobicContact CG2-CB 4.01Å
257	K	90.6	Very high	81.9	Confident	104 Å²	104	70.8 Å²	70.8	45%	0.452	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	129.7	169.9	-66	-171.5	176.4	-178.7	0	109.6	F259 G380 V381 A382 L415	K257-F259 HydrophobicContact CB-CE2 3.67Å; K257-F259 HydrophobicContact CB-CZ 3.89Å; K257-F259 HydrophobicContact CD-CZ 4.22Å; K257-G380 PolarHBondContact N-O 3.48Å; K257-V381 HydrophobicContact CB-CG2 4.43Å; K257-V381 CarbonylContact O-C 3.58Å; K257-V381 WeakPolarHBondContact O-CA 3.45Å; K257-A382 PolarHBondContact O-N 2.92Å; K257-L415 HydrophobicContact CD-CD2 4.08Å
258	Q	93.8	Very high	83.1	Confident	12 Å²	12	68.7 Å²	68.7	6%	0.056	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.1	-174.2	-65.7	161.3	73.1	0	0	108.8	I256 Y366 I370 A382 T403 I405 D406	I256-Q258 HydrophobicContact CG2-CG 4.26Å; Q258-Y366 PolarHBondContact OE1-OH 2.99Å; Q258-I370 HydrophobicContact CG-CD1 4.29Å; Q258-A382 CarbonylContact C-O 3.59Å; Q258-A382 WeakPolarHBondContact CA-O 3.38Å; Q258-A382 HydrophobicContact CG-CB 4.29Å; Q258-T403 PolarHBondContact NE2-OG1 3.49Å; Q258-I405 HydrophobicContact CB-CB 4.45Å; Q258-I405 HydrophobicContact CB-CG1 4.11Å; Q258-I405 HydrophobicContact CB-CG2 4.22Å; Q258-D406 PolarHBondContact O-N 3.33Å; Q258-D406 VanDerWaalsContact O-N 3.08Å
259	F	94.4	Very high	84.5	Confident	11 Å²	11	62.3 Å²	62.3	5%	0.048	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	158.8	179.1	-59.1	-70.2	0	0	0	111.2	K257 V381 A382 N384 D406 M408 P409 L415	K257-F259 HydrophobicContact CB-CE2 3.67Å; K257-F259 HydrophobicContact CB-CZ 3.89Å; K257-F259 HydrophobicContact CD-CZ 4.22Å; F259-V381 HydrophobicContact CD2-CG1 3.77Å; F259-V381 HydrophobicContact CE2-CG1 3.94Å; F259-A382 PolarHBondContact N-O 2.92Å; F259-N384 WeakPolarHBondContact O-CB 3.46Å; F259-N384 PolarHBondContact O-N 3.02Å; F259-N384 PolarHBondContact O-ND2 3.32Å; F259-D406 CarbonylContact C-O 3.59Å; F259-D406 WeakPolarHBondContact CA-O 3.4Å; F259-D406 HydrophobicContact CD1-CB 4.01Å; F259-D406 HydrophobicContact CE1-CB 4.16Å; F259-M408 HydrophobicContact CB-CB 4.11Å; F259-M408 HydrophobicContact CB-CG 4.29Å; F259-P409 HydrophobicContact CE1-CG 4.41Å; F259-L415 HydrophobicContact CE1-CD1 4.36Å; F259-L415 HydrophobicContact CE2-CD1 4.1Å; F259-L415 HydrophobicContact CZ-CD1 3.65Å
260	F	95.9	Very high	86	Confident	16 Å²	16	58.7 Å²	58.7	7%	0.07	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	151	164.8	75	-89.3	0	0	0	111.9	A262 N384 V386 L394 I405 D406 E407 M408	F260-A262 HydrophobicContact CE2-CB 4.31Å; F260-N384 CarbonylContact C-O 3.51Å; F260-N384 WeakPolarHBondContact CA-O 3.19Å; F260-N384 HydrophobicContact CB-CB 4.16Å; F260-V386 HydrophobicContact CB-CG2 4.18Å; F260-V386 HydrophobicContact CD2-CG2 3.65Å; F260-V386 HydrophobicContact CG-CG2 4.27Å; F260-L394 HydrophobicContact CB-CD2 3.48Å; F260-L394 VanDerWaalsContact CB-CD2 3.48Å; F260-L394 HydrophobicContact CD1-CD2 3.87Å; F260-L394 HydrophobicContact CD2-CD2 4.47Å; F260-L394 HydrophobicContact CG-CD2 3.69Å; F260-I405 HydrophobicContact CB-CG2 4.32Å; F260-I405 HydrophobicContact CD1-CG2 4.16Å; F260-D406 VanDerWaalsContact CD1-O 3.27Å; F260-D406 WeakPolarHBondContact CD1-O 3.49Å; F260-D406 PolarHBondContact N-O 3.48Å; F260-E407 HydrophobicContact CE1-CB 3.93Å; F260-E407 VanDerWaalsContact CE1-N 3.34Å; F260-E407 HydrophobicContact CE2-CB 4.29Å; F260-E407 HydrophobicContact CE2-CG 4.19Å; F260-E407 HydrophobicContact CZ-CB 3.69Å; F260-E407 HydrophobicContact CZ-CG 4.07Å; F260-M408 WeakPolarHBondContact O-CB 3.44Å; F260-M408 PolarHBondContact O-N 3.11Å
261	V	94.7	Very high	87.2	Confident	22 Å²	22	57.2 Å²	57.2	13%	0.133	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	116.5	168.9	-174	0	0	0	0	107.5	V263 T272 I383 N384 F385 V386 M408	V261-V263 HydrophobicContact CG1-CG1 4.33Å; V261-T272 HydrophobicContact CB-CG2 4.33Å; V261-T272 HydrophobicContact CG1-CG2 3.87Å; V261-T272 HydrophobicContact CG2-CG2 4.3Å; V261-I383 HydrophobicContact CG2-CG2 3.94Å; V261-N384 PolarHBondContact N-O 2.88Å; V261-F385 HydrophobicContact CB-CD1 4.04Å; V261-F385 HydrophobicContact CB-CE1 4.3Å; V261-F385 HydrophobicContact CG2-CD1 4.31Å; V261-F385 HydrophobicContact CG2-CE1 4.2Å; V261-V386 PolarHBondContact O-N 2.89Å; V261-M408 HydrophobicContact CG2-CB 3.83Å; V261-M408 HydrophobicContact CG2-CE 3.56Å; V261-M408 HydrophobicContact CG2-CG 4.31Å; V261-M408 HydrophobicContact CG2-SD 3.49Å; V261-M408 WeakPolarHBondContact CG2-SD 3.43Å
262	A	93.4	Very high	88.6	Confident	49 Å²	49	58 Å²	58	41%	0.405	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121.6	174.1	0	0	0	0	0	109.4	F260 V386	F260-A262 HydrophobicContact CE2-CB 4.31Å; A262-V386 WeakPolarHBondContact CA-O 3.46Å; A262-V386 HydrophobicContact CB-CG2 4.49Å
263	V	93.3	Very high	89.9	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.024	28%	0.275	C	S	.	.			trans	-118.9	131	176.6	-70	0	0	0	0	109.4	V261 R265 W268 K269 V386 K387	V261-V263 HydrophobicContact CG1-CG1 4.33Å; V263-R265 VanDerWaalsContact C-N 3.34Å; V263-W268 HydrophobicContact CB-CB 4.4Å; V263-W268 HydrophobicContact CG1-CB 4.36Å; V263-K269 HydrophobicContact CB-CG 4.44Å; V263-K269 HydrophobicContact CG1-CG 4.38Å; V263-K269 HydrophobicContact CG2-CD 4.39Å; V263-K269 HydrophobicContact CG2-CG 3.67Å; V263-V386 WeakPolarHBondContact CG2-O 3.28Å; V263-V386 PolarHBondContact N-O 3.21Å; V263-K387 HydrophobicContact CG2-CG 4.03Å; V263-K387 WeakPolarHBondContact O-CA 3.34Å
264	E	90.7	Very high	90.9	Very high	131 Å²	131	56.5 Å²	56.5	61%	0.612	28%	0.275	S	S	*	.	S	Bend	trans	-73.5	-32	178.5	-61.1	-176.6	177.4	0	0	111.8	W268	E264-W268 HydrophobicContact CB-CE3 4.01Å; E264-W268 HydrophobicContact CB-CH2 4.1Å; E264-W268 HydrophobicContact CB-CZ3 3.56Å; E264-W268 HydrophobicContact CG-CE3 4.44Å; E264-W268 HydrophobicContact CG-CH2 4.33Å; E264-W268 HydrophobicContact CG-CZ3 3.69Å; E264-W268 WeakPolarHBondContact OE2-CH2 3.47Å
265	R	91.9	Very high	91.9	Very high	149 Å²	149	51.6 Å²	51.6	56%	0.562	26%	0.255	S	S	*	.	S	Bend	trans	-126	146.5	-175.5	-60	-174.4	-177.6	-168.3	1.4	111.1	V263 E267 W268	V263-R265 VanDerWaalsContact C-N 3.34Å; R265-E267 PolarHBondContact O-N 2.96Å; R265-W268 HydrophobicContact CB-CD2 4.11Å; R265-W268 HydrophobicContact CB-CG 4.09Å; R265-W268 HydrophobicContact CG-CD2 4.45Å; R265-W268 HydrophobicContact CG-CZ2 4.43Å; R265-W268 PolarHBondContact O-N 3.39Å
266	E	91.4	Very high	92.3	Very high	56 Å²	56	50.6 Å²	50.6	26%	0.262	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.2	177.8	-172.4	63.6	-144.8	0	0	112.5	W268 K269 K294 K387	E266-W268 VanDerWaalsContact C-N 3.3Å; E266-W268 PolarHBondContact O-N 3.14Å; E266-K269 WeakPolarHBondContact O-CB 3.42Å; E266-K269 PolarHBondContact O-N 2.89Å; E266-K269 WeakPolarHBondContact OE1-CD 3.36Å; E266-K269 IonicContact OE1-NZ 3.3Å; E266-K269 IonicContact OE2-NZ 3.07Å; E266-K294 IonicContact OE1-NZ 3.79Å; E266-K294 PolarHBondContact OE1-NZ 3.45Å; E266-K387 HydrophobicContact CB-CD 4.45Å; E266-K387 WeakPolarHBondContact OE2-CD 3.42Å; E266-K387 WeakPolarHBondContact OE2-CE 3.01Å; E266-K387 IonicContact OE2-NZ 2.76Å; E266-K387 PolarHBondContact OE2-NZ 3.29Å
267	E	91.3	Very high	92	Very high	143 Å²	143	51.7 Å²	51.7	67%	0.668	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-35	-179.5	-64.3	170	-170.8	0	0	111.9	R265 K269 F270	R265-E267 PolarHBondContact O-N 2.96Å; E267-K269 PolarHBondContact O-N 3.43Å; E267-F270 WeakPolarHBondContact O-CB 3.01Å; E267-F270 PolarHBondContact O-N 3.08Å; E267-F270 VanDerWaalsContact O-N 3.08Å
268	W	93.9	Very high	91.5	Very high	100 Å²	100	52.8 Å²	52.8	38%	0.379	26%	0.258	S	S	.	.	H	α-helix	trans	-69.4	-15.9	-178.2	-62.6	-6.5	0	0	0	113.4	V263 E264 R265 E266 F270 D271 T272	V263-W268 HydrophobicContact CB-CB 4.4Å; V263-W268 HydrophobicContact CG1-CB 4.36Å; E264-W268 HydrophobicContact CB-CE3 4.01Å; E264-W268 HydrophobicContact CB-CH2 4.1Å; E264-W268 HydrophobicContact CB-CZ3 3.56Å; E264-W268 HydrophobicContact CG-CE3 4.44Å; E264-W268 HydrophobicContact CG-CH2 4.33Å; E264-W268 HydrophobicContact CG-CZ3 3.69Å; E264-W268 WeakPolarHBondContact OE2-CH2 3.47Å; R265-W268 HydrophobicContact CB-CD2 4.11Å; R265-W268 HydrophobicContact CB-CG 4.09Å; R265-W268 HydrophobicContact CG-CD2 4.45Å; R265-W268 HydrophobicContact CG-CZ2 4.43Å; R265-W268 PolarHBondContact O-N 3.39Å; E266-W268 VanDerWaalsContact C-N 3.3Å; E266-W268 PolarHBondContact O-N 3.14Å; W268-F270 PolarHBondContact O-N 3.29Å; W268-D271 PolarHBondContact O-N 3.48Å; W268-T272 WeakPolarHBondContact O-CB 3.33Å; W268-T272 PolarHBondContact O-N 3.49Å; W268-T272 PolarHBondContact O-OG1 2.95Å
269	K	95.3	Very high	90.6	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-35.8	170.6	-68.5	-171.1	178.7	-179.4	0	111.7	V263 E266 E267 L273 Y357 D358 F385	V263-K269 HydrophobicContact CB-CG 4.44Å; V263-K269 HydrophobicContact CG1-CG 4.38Å; V263-K269 HydrophobicContact CG2-CD 4.39Å; V263-K269 HydrophobicContact CG2-CG 3.67Å; E266-K269 WeakPolarHBondContact O-CB 3.42Å; E266-K269 PolarHBondContact O-N 2.89Å; E266-K269 WeakPolarHBondContact OE1-CD 3.36Å; E266-K269 IonicContact OE1-NZ 3.3Å; E266-K269 IonicContact OE2-NZ 3.07Å; E267-K269 PolarHBondContact O-N 3.43Å; K269-L273 VanDerWaalsContact O-CB 3.31Å; K269-L273 WeakPolarHBondContact O-CB 3.35Å; K269-L273 PolarHBondContact O-N 3.09Å; K269-Y357 HydrophobicContact CB-CE1 3.84Å; K269-Y357 HydrophobicContact CB-CE2 3.79Å; K269-Y357 WeakPolarHBondContact CB-OH 3.15Å; K269-Y357 HydrophobicContact CD-CD1 3.98Å; K269-Y357 HydrophobicContact CD-CE1 3.68Å; K269-Y357 WeakPolarHBondContact CD-O 3.47Å; K269-Y357 WeakPolarHBondContact CE-O 3.27Å; K269-Y357 HydrophobicContact CG-CE1 4.42Å; K269-Y357 PolarHBondContact NZ-O 3.08Å; K269-D358 IonicContact NZ-OD1 3.53Å; K269-F385 HydrophobicContact CB-CD2 3.71Å; K269-F385 HydrophobicContact CB-CE2 4.16Å; K269-F385 HydrophobicContact CD-CB 3.82Å; K269-F385 HydrophobicContact CD-CD2 4.06Å; K269-F385 HydrophobicContact CD-CG 4.43Å; K269-F385 HydrophobicContact CG-CB 3.99Å; K269-F385 HydrophobicContact CG-CD2 3.86Å; K269-F385 HydrophobicContact CG-CG 4.26Å; K269-F385 WeakPolarHBondContact O-CE2 3.07Å
270	F	95.2	Very high	89.5	Confident	24 Å²	24	56.2 Å²	56.2	11%	0.105	28%	0.281	C	S	.	.	H	α-helix	trans	-69.3	-45.2	179.6	-179.7	-103.6	0	0	0	110.9	E267 W268 T272 L273 C274 L298 K301 M302 A305 Y357	E267-F270 WeakPolarHBondContact O-CB 3.01Å; E267-F270 PolarHBondContact O-N 3.08Å; E267-F270 VanDerWaalsContact O-N 3.08Å; W268-F270 PolarHBondContact O-N 3.29Å; F270-T272 PolarHBondContact O-N 2.88Å; F270-L273 WeakPolarHBondContact O-CB 3.42Å; F270-L273 PolarHBondContact O-N 2.99Å; F270-L273 VanDerWaalsContact O-N 3.15Å; F270-C274 PolarHBondContact O-N 2.89Å; F270-C274 PolarHBondContact O-SG 3.33Å; F270-C274 VanDerWaalsContact O-SG 3.36Å; F270-L298 HydrophobicContact CD2-CD1 3.84Å; F270-L298 HydrophobicContact CE2-CD1 4.34Å; F270-K301 HydrophobicContact CD2-CB 4.26Å; F270-K301 HydrophobicContact CE1-CD 4.29Å; F270-K301 HydrophobicContact CE2-CB 3.68Å; F270-K301 HydrophobicContact CE2-CD 4.29Å; F270-K301 HydrophobicContact CZ-CB 4.08Å; F270-K301 HydrophobicContact CZ-CD 4.14Å; F270-M302 HydrophobicContact CE2-CG 4Å; F270-A305 HydrophobicContact CZ-CB 4.2Å; F270-Y357 PolarHBondContact N-OH 2.83Å
271	D	92.6	Very high	88.2	Confident	86 Å²	86	61.3 Å²	61.3	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-61.3	-47	177.5	-55.5	-35.2	0	0	0	110.5	W268 L273 C274 D275	W268-D271 PolarHBondContact O-N 3.48Å; D271-L273 VanDerWaalsContact C-N 3.27Å; D271-L273 PolarHBondContact O-N 3.02Å; D271-C274 WeakPolarHBondContact O-CB 3.47Å; D271-C274 PolarHBondContact O-N 3.21Å; D271-C274 VanDerWaalsContact O-N 3.13Å; D271-D275 PolarHBondContact O-N 3.08Å
272	T	92.6	Very high	87	Confident	24 Å²	24	61 Å²	61	15%	0.147	31%	0.311	C	S	.	.	H	α-helix	trans	-57.6	-39.7	174.8	-54.4	0	0	0	0	112	V261 W268 F270 D275 L276 F385	V261-T272 HydrophobicContact CB-CG2 4.33Å; V261-T272 HydrophobicContact CG1-CG2 3.87Å; V261-T272 HydrophobicContact CG2-CG2 4.3Å; W268-T272 WeakPolarHBondContact O-CB 3.33Å; W268-T272 PolarHBondContact O-N 3.49Å; W268-T272 PolarHBondContact O-OG1 2.95Å; F270-T272 PolarHBondContact O-N 2.88Å; T272-D275 PolarHBondContact O-N 3.4Å; T272-L276 HydrophobicContact CG2-CD1 4.37Å; T272-L276 VanDerWaalsContact O-CG 3.3Å; T272-L276 WeakPolarHBondContact O-CG 3.31Å; T272-L276 PolarHBondContact O-N 3.33Å; T272-F385 HydrophobicContact CG2-CD1 4.4Å; T272-F385 HydrophobicContact CG2-CE1 3.54Å; T272-F385 HydrophobicContact CG2-CZ 3.61Å
273	L	93.3	Very high	86.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.4	-46.3	178	-175.9	63.1	0	0	0	111	K269 F270 D271 L276 Y277 I287 L298 M302 I355 Y357 F385	K269-L273 VanDerWaalsContact O-CB 3.31Å; K269-L273 WeakPolarHBondContact O-CB 3.35Å; K269-L273 PolarHBondContact O-N 3.09Å; F270-L273 WeakPolarHBondContact O-CB 3.42Å; F270-L273 PolarHBondContact O-N 2.99Å; F270-L273 VanDerWaalsContact O-N 3.15Å; D271-L273 VanDerWaalsContact C-N 3.27Å; D271-L273 PolarHBondContact O-N 3.02Å; L273-L276 WeakPolarHBondContact O-CB 3.42Å; L273-L276 PolarHBondContact O-N 3.07Å; L273-Y277 HydrophobicContact CD1-CD2 4.22Å; L273-Y277 HydrophobicContact CD1-CE2 3.74Å; L273-Y277 HydrophobicContact CG-CD2 4.13Å; L273-Y277 HydrophobicContact CG-CE2 3.93Å; L273-Y277 WeakPolarHBondContact O-CD2 3.34Å; L273-Y277 PolarHBondContact O-N 3.37Å; L273-Y277 VanDerWaalsContact O-N 3.13Å; L273-I287 HydrophobicContact CD1-CD1 3.91Å; L273-I287 HydrophobicContact CD2-CD1 4Å; L273-I287 HydrophobicContact CG-CD1 4.48Å; L273-L298 HydrophobicContact CD2-CD1 4Å; L273-L298 HydrophobicContact CD2-CD2 4.24Å; L273-L298 HydrophobicContact CD2-CG 4.48Å; L273-M302 HydrophobicContact CD2-CE 4.3Å; L273-M302 HydrophobicContact CD2-CG 4.36Å; L273-M302 HydrophobicContact CD2-SD 3.63Å; L273-M302 HydrophobicContact CG-CE 4.47Å; L273-M302 HydrophobicContact CG-SD 4.38Å; L273-I355 HydrophobicContact CD1-CD1 3.42Å; L273-I355 VanDerWaalsContact CD1-CD1 3.42Å; L273-I355 HydrophobicContact CD1-CG2 4.23Å; L273-Y357 HydrophobicContact CD2-CD2 4.14Å; L273-Y357 HydrophobicContact CD2-CE2 4.09Å; L273-F385 HydrophobicContact CB-CE2 4.08Å; L273-F385 HydrophobicContact CB-CZ 4.29Å; L273-F385 HydrophobicContact CD1-CE2 4.48Å; L273-F385 HydrophobicContact CD1-CZ 4.5Å
274	C	90.1	Very high	86.2	Confident	18 Å²	18	62.3 Å²	62.3	12%	0.122	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-45.7	177.2	-65.8	0	0	0	0	111.5	F270 D271 L276 Y277 D278 F307	F270-C274 PolarHBondContact O-N 2.89Å; F270-C274 PolarHBondContact O-SG 3.33Å; F270-C274 VanDerWaalsContact O-SG 3.36Å; D271-C274 WeakPolarHBondContact O-CB 3.47Å; D271-C274 PolarHBondContact O-N 3.21Å; D271-C274 VanDerWaalsContact O-N 3.13Å; C274-L276 VanDerWaalsContact C-N 3.28Å; C274-L276 PolarHBondContact O-N 3.3Å; C274-Y277 WeakPolarHBondContact O-CA 3.44Å; C274-Y277 WeakPolarHBondContact O-CB 3.28Å; C274-Y277 PolarHBondContact O-N 3.32Å; C274-D278 PolarHBondContact O-N 3.32Å; C274-F307 HydrophobicContact CB-CE2 4.28Å; C274-F307 HydrophobicContact CB-CZ 4.36Å
275	D	88.3	Confident	86.2	Confident	97 Å²	97	56.1 Å²	56.1	52%	0.519	28%	0.284	S	S	.	.	H	α-helix	trans	-59.5	-39	178	-67.8	-18.2	0	0	0	112.1	D271 T272 Y277 D278 T279	D271-D275 PolarHBondContact O-N 3.08Å; T272-D275 PolarHBondContact O-N 3.4Å; D275-Y277 VanDerWaalsContact C-N 3.32Å; D275-Y277 PolarHBondContact O-N 2.98Å; D275-D278 PolarHBondContact O-N 2.61Å; D275-T279 WeakPolarHBondContact O-CB 3.1Å; D275-T279 PolarHBondContact O-N 3.08Å; D275-T279 PolarHBondContact O-OG1 2.81Å
276	L	87.6	Confident	86.3	Confident	8 Å²	8	49 Å²	49	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-36.4	174.3	-75.5	172.7	0	0	0	112.2	T272 L273 C274 L280 I355 I383 F385 M408	T272-L276 HydrophobicContact CG2-CD1 4.37Å; T272-L276 VanDerWaalsContact O-CG 3.3Å; T272-L276 WeakPolarHBondContact O-CG 3.31Å; T272-L276 PolarHBondContact O-N 3.33Å; L273-L276 WeakPolarHBondContact O-CB 3.42Å; L273-L276 PolarHBondContact O-N 3.07Å; C274-L276 VanDerWaalsContact C-N 3.28Å; C274-L276 PolarHBondContact O-N 3.3Å; L276-L280 HydrophobicContact CB-CD1 4.32Å; L276-L280 HydrophobicContact CD2-CD1 3.81Å; L276-L280 WeakPolarHBondContact O-CB 3.35Å; L276-L280 VanDerWaalsContact O-CG 3.29Å; L276-L280 WeakPolarHBondContact O-CG 3.44Å; L276-L280 PolarHBondContact O-N 3.08Å; L276-I355 HydrophobicContact CD1-CD1 4.46Å; L276-I383 HydrophobicContact CD1-CD1 3.93Å; L276-I383 HydrophobicContact CD1-CG2 4.3Å; L276-I383 HydrophobicContact CD2-CD1 3.91Å; L276-F385 HydrophobicContact CD1-CE1 3.88Å; L276-F385 HydrophobicContact CD1-CZ 3.86Å; L276-M408 HydrophobicContact CD2-CE 3.87Å; L276-M408 HydrophobicContact CD2-SD 3.82Å
277	Y	82.7	Confident	86.5	Confident	30 Å²	30	46.3 Å²	46.3	12%	0.118	25%	0.245	C	C	.	.	H	α-helix	trans	-68.7	-35.3	175.7	-88.9	-75.3	0	0	0	113.1	L273 C274 D275 I282 I287 M302 F307 V335	L273-Y277 HydrophobicContact CD1-CD2 4.22Å; L273-Y277 HydrophobicContact CD1-CE2 3.74Å; L273-Y277 HydrophobicContact CG-CD2 4.13Å; L273-Y277 HydrophobicContact CG-CE2 3.93Å; L273-Y277 WeakPolarHBondContact O-CD2 3.34Å; L273-Y277 PolarHBondContact O-N 3.37Å; L273-Y277 VanDerWaalsContact O-N 3.13Å; C274-Y277 WeakPolarHBondContact O-CA 3.44Å; C274-Y277 WeakPolarHBondContact O-CB 3.28Å; C274-Y277 PolarHBondContact O-N 3.32Å; D275-Y277 VanDerWaalsContact C-N 3.32Å; D275-Y277 PolarHBondContact O-N 2.98Å; Y277-I282 HydrophobicContact CD1-CD1 3.4Å; Y277-I282 HydrophobicContact CE1-CD1 3.35Å; Y277-I282 HydrophobicContact CG-CD1 4.08Å; Y277-I287 HydrophobicContact CE2-CD1 4.14Å; Y277-I287 WeakPolarHBondContact OH-CD1 3.48Å; Y277-M302 HydrophobicContact CD2-CE 3.61Å; Y277-M302 HydrophobicContact CE2-CE 3.5Å; Y277-M302 VanDerWaalsContact CE2-CE 3.5Å; Y277-M302 HydrophobicContact CE2-SD 4.28Å; Y277-M302 HydrophobicContact CG-CE 4.41Å; Y277-F307 HydrophobicContact CD1-CD1 4.41Å; Y277-F307 HydrophobicContact CD1-CE1 4.48Å; Y277-F307 HydrophobicContact CG-CD1 4.21Å; Y277-F307 AromaticContact CG-CE1 3.97Å; Y277-F307 HydrophobicContact CG-CE1 3.97Å; Y277-V335 HydrophobicContact CE1-CG2 3.35Å; Y277-V335 WeakPolarHBondContact OH-CG1 3.48Å; Y277-V335 WeakPolarHBondContact OH-CG2 3.38Å
278	D	79.6	Confident	86.8	Confident	126 Å²	126	39.5 Å²	39.5	67%	0.674	21%	0.213	S	C	*	.	H	α-helix	trans	-74.8	-31.3	179.3	-71.3	-19.4	0	0	0	112.1	C274 D275	C274-D278 PolarHBondContact O-N 3.32Å; D275-D278 PolarHBondContact O-N 2.61Å
279	T	74.3	Confident	86.9	Confident	86 Å²	86	34.8 Å²	34.8	53%	0.528	20%	0.195	S	C	.	.	H	α-helix	trans	-89.9	-29.9	-175	-50.4	0	0	0	0	113.2	D275 A413	D275-T279 WeakPolarHBondContact O-CB 3.1Å; D275-T279 PolarHBondContact O-N 3.08Å; D275-T279 PolarHBondContact O-OG1 2.81Å; T279-A413 HydrophobicContact CG2-CB 4.46Å
280	L	71.2	Confident	86.9	Confident	10 Å²	10	36.8 Å²	36.8	5%	0.052	21%	0.206	C	C	.	.	S	Bend	trans	-104.8	129.7	-171.2	-59	174.4	0	0	0	112.2	L276 I282 L353 V412 A413 I416	L276-L280 HydrophobicContact CB-CD1 4.32Å; L276-L280 HydrophobicContact CD2-CD1 3.81Å; L276-L280 WeakPolarHBondContact O-CB 3.35Å; L276-L280 VanDerWaalsContact O-CG 3.29Å; L276-L280 WeakPolarHBondContact O-CG 3.44Å; L276-L280 PolarHBondContact O-N 3.08Å; L280-I282 VanDerWaalsContact C-N 3.3Å; L280-I282 HydrophobicContact CB-CD1 4.33Å; L280-I282 HydrophobicContact CB-CG1 3.87Å; L280-I282 PolarHBondContact O-N 3.22Å; L280-L353 HydrophobicContact CD1-CD2 4.19Å; L280-V412 HydrophobicContact CD1-CG1 4.33Å; L280-V412 HydrophobicContact CD2-CB 4.06Å; L280-V412 HydrophobicContact CD2-CG1 3.98Å; L280-A413 HydrophobicContact CD2-CB 4.27Å; L280-I416 HydrophobicContact CB-CD1 4.3Å; L280-I416 HydrophobicContact CD1-CD1 3.53Å; L280-I416 HydrophobicContact CD2-CD1 3.74Å; L280-I416 HydrophobicContact CD2-CG1 4.45Å; L280-I416 HydrophobicContact CG-CD1 4.04Å
281	T	69.4	Low	86.9	Confident	123 Å²	123	39.2 Å²	39.2	76%	0.755	22%	0.223	S	C	*	.			trans	-74.7	84.9	166.8	51.7	0	0	0	0	109.9	T283	T281-T283 PolarHBondContact O-N 3.46Å
282	I	69.3	Low	86.9	Confident	16 Å²	16	38.9 Å²	38.9	8%	0.082	22%	0.217	C	C	.	.			trans	-78.4	121.7	-175.9	-63.3	162.9	0	0	0	110.1	Y277 L280 A285 L353	Y277-I282 HydrophobicContact CD1-CD1 3.4Å; Y277-I282 HydrophobicContact CE1-CD1 3.35Å; Y277-I282 HydrophobicContact CG-CD1 4.08Å; L280-I282 VanDerWaalsContact C-N 3.3Å; L280-I282 HydrophobicContact CB-CD1 4.33Å; L280-I282 HydrophobicContact CB-CG1 3.87Å; L280-I282 PolarHBondContact O-N 3.22Å; I282-A285 HydrophobicContact CG2-CB 3.64Å; I282-L353 HydrophobicContact CD1-CD2 3.98Å; I282-L353 HydrophobicContact CG1-CD2 3.91Å
283	T	80.6	Confident	87.1	Confident	73 Å²	73	48 Å²	48	45%	0.448	25%	0.249	S	C	.	.	S	Bend	trans	-69	-70	169.8	52.8	0	0	0	0	109.5	T281 Q350 S352	T281-T283 PolarHBondContact O-N 3.46Å; T283-Q350 PolarHBondContact OG1-O 3.32Å; T283-S352 PolarHBondContact OG1-OG 3.11Å
284	Q	89.4	Confident	87.2	Confident	7 Å²	7	49.8 Å²	49.8	3%	0.033	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	140.9	167.8	-61.5	-166.3	-86.5	0	0	109.9	F328 S333 R334 Q350 V351 S352	Q284-F328 HydrophobicContact CB-CE2 4.27Å; Q284-F328 HydrophobicContact CB-CZ 4.22Å; Q284-F328 PolarHBondContact NE2-O 3.32Å; Q284-S333 PolarHBondContact NE2-O 2.98Å; Q284-R334 CarbonylContact C-O 3.59Å; Q284-R334 WeakPolarHBondContact CA-O 3.31Å; Q284-Q350 HydrophobicContact CG-CB 4.35Å; Q284-V351 HydrophobicContact CB-CG2 4.21Å; Q284-V351 WeakPolarHBondContact O-CA 3.45Å; Q284-S352 PolarHBondContact O-N 3.47Å
285	A	91.3	Very high	87.5	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149.6	179.7	0	0	0	0	0	112.2	I282 R334 L336 L353	I282-A285 HydrophobicContact CG2-CB 3.64Å; A285-R334 PolarHBondContact N-O 3.45Å; A285-L336 PolarHBondContact O-N 3.01Å; A285-L353 VanDerWaalsContact CA-O 3.22Å; A285-L353 WeakPolarHBondContact CA-O 3.38Å; A285-L353 HydrophobicContact CB-CB 4.06Å; A285-L353 HydrophobicContact CB-CD2 4.28Å; A285-L353 HydrophobicContact CB-CG 4.32Å
286	V	93.8	Very high	87.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.4	169.3	-176.3	0	0	0	0	109.2	F288 F328 L336 W342 V351 L353 I354 I355	V286-F288 HydrophobicContact CB-CE2 4.28Å; V286-F288 HydrophobicContact CG1-CD2 4.1Å; V286-F288 HydrophobicContact CG1-CE1 4.14Å; V286-F288 HydrophobicContact CG1-CE2 3.6Å; V286-F288 HydrophobicContact CG1-CZ 3.62Å; V286-F328 HydrophobicContact CG2-CE1 4.16Å; V286-F328 HydrophobicContact CG2-CZ 3.83Å; V286-L336 CarbonylContact C-O 3.49Å; V286-L336 WeakPolarHBondContact CA-O 3.23Å; V286-W342 HydrophobicContact CG2-CZ3 4.35Å; V286-V351 HydrophobicContact CG2-CG1 3.98Å; V286-V351 HydrophobicContact CG2-CG2 4.11Å; V286-L353 PolarHBondContact N-O 3.15Å; V286-L353 VanDerWaalsContact N-O 3.08Å; V286-I354 HydrophobicContact CB-CD1 3.84Å; V286-I354 HydrophobicContact CG2-CD1 4.29Å; V286-I354 WeakPolarHBondContact O-CA 3.34Å; V286-I355 PolarHBondContact O-N 3.23Å
287	I	95.7	Very high	88.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.1	177.2	-54	173	0	0	0	108.2	L273 Y277 L298 M302 V335 L336 I337 S338 I355 Y357	L273-I287 HydrophobicContact CD1-CD1 3.91Å; L273-I287 HydrophobicContact CD2-CD1 4Å; L273-I287 HydrophobicContact CG-CD1 4.48Å; Y277-I287 HydrophobicContact CE2-CD1 4.14Å; Y277-I287 WeakPolarHBondContact OH-CD1 3.48Å; I287-L298 HydrophobicContact CG2-CD2 3.98Å; I287-M302 HydrophobicContact CD1-SD 4.13Å; I287-V335 HydrophobicContact CD1-CG1 3.84Å; I287-V335 HydrophobicContact CG1-CG1 4.4Å; I287-L336 PolarHBondContact N-O 3.43Å; I287-I337 HydrophobicContact CB-CG1 4.28Å; I287-I337 HydrophobicContact CB-CG2 4.45Å; I287-I337 HydrophobicContact CD1-CG1 4.1Å; I287-I337 CarbonylContact O-C 3.49Å; I287-I337 WeakPolarHBondContact O-CA 3.28Å; I287-S338 PolarHBondContact O-N 3.49Å; I287-I355 CarbonylContact C-O 3.53Å; I287-I355 WeakPolarHBondContact CA-O 3.38Å; I287-I355 HydrophobicContact CG1-CB 4.18Å; I287-I355 HydrophobicContact CG1-CD1 4.4Å; I287-I355 HydrophobicContact CG2-CB 4.38Å; I287-I355 HydrophobicContact CG2-CG2 4.41Å; I287-Y357 HydrophobicContact CG2-CD2 4.43Å
288	F	96.9	Very high	89.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.3	179.2	-73.3	-74.4	0	0	0	112.5	V286 S338 W342 A343 I354 I355 Y357 D358 R369 R372	V286-F288 HydrophobicContact CB-CE2 4.28Å; V286-F288 HydrophobicContact CG1-CD2 4.1Å; V286-F288 HydrophobicContact CG1-CE1 4.14Å; V286-F288 HydrophobicContact CG1-CE2 3.6Å; V286-F288 HydrophobicContact CG1-CZ 3.62Å; F288-S338 WeakPolarHBondContact CA-O 3.42Å; F288-W342 HydrophobicContact CE1-CB 3.74Å; F288-W342 HydrophobicContact CZ-CB 4.18Å; F288-A343 HydrophobicContact CE1-CB 4.21Å; F288-A343 HydrophobicContact CZ-CB 4.44Å; F288-I354 HydrophobicContact CD2-CG2 3.89Å; F288-I354 HydrophobicContact CE2-CG2 4Å; F288-I355 PolarHBondContact N-O 3.06Å; F288-Y357 WeakPolarHBondContact O-CB 3.35Å; F288-Y357 PolarHBondContact O-N 3.46Å; F288-Y357 VanDerWaalsContact O-N 3.11Å; F288-D358 PolarHBondContact O-N 3.21Å; F288-R369 HydrophobicContact CD1-CG 4.14Å; F288-R369 HydrophobicContact CD2-CB 3.81Å; F288-R369 HydrophobicContact CD2-CG 3.7Å; F288-R369 HydrophobicContact CE1-CG 4.24Å; F288-R369 HydrophobicContact CE2-CB 3.75Å; F288-R369 HydrophobicContact CE2-CG 3.81Å; F288-R369 HydrophobicContact CG-CB 4.47Å; F288-R369 HydrophobicContact CG-CG 3.87Å; F288-R369 HydrophobicContact CZ-CB 4.38Å; F288-R369 HydrophobicContact CZ-CG 4.08Å; F288-R372 HydrophobicContact CE2-CG 4.27Å; F288-R372 HydrophobicContact CZ-CG 4.01Å
289	C	96.6	Very high	89.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.			trans	-120.1	151.1	169.3	-53.8	0	0	0	0	110.3	T291 K294 V295 S338 T339	C289-T291 PolarHBondContact O-N 2.62Å; C289-K294 HydrophobicContact CB-CB 4.29Å; C289-K294 HydrophobicContact CB-CG 4.32Å; C289-V295 HydrophobicContact CB-CG2 3.85Å; C289-S338 PolarHBondContact N-O 2.88Å; C289-T339 WeakPolarHBondContact O-CA 3.41Å
290	N	94.1	Very high	90.8	Very high	45 Å²	45	46.8 Å²	46.8	24%	0.241	23%	0.227	C	C	.	.	S	Bend	trans	-79.1	-19.8	-175.7	-70.5	-4.8	0	0	0	113.4	D358 L359 N361 R369	N290-D358 HydrophobicContact CB-CB 4.18Å; N290-D358 PolarHBondContact N-OD2 3.08Å; N290-L359 PolarHBondContact ND2-O 2.83Å; N290-L359 PolarHBondContact OD1-O 3.14Å; N290-N361 PolarHBondContact ND2-OD1 3.47Å; N290-N361 VanDerWaalsContact ND2-OD1 3.11Å; N290-R369 PolarHBondContact OD1-NH2 2.85Å
291	T	94.7	Very high	92	Very high	74 Å²	74	50.1 Å²	50.1	45%	0.454	24%	0.24	S	C	.	.	S	Bend	trans	-128.8	148.4	-176.3	72.7	0	0	0	0	112.3	C289 K294 V295	C289-T291 PolarHBondContact O-N 2.62Å; T291-K294 PolarHBondContact O-N 2.79Å; T291-K294 VanDerWaalsContact OG1-CB 3.24Å; T291-K294 WeakPolarHBondContact OG1-CB 3.03Å; T291-K294 PolarHBondContact OG1-N 3.3Å; T291-V295 PolarHBondContact O-N 3.29Å; T291-V295 VanDerWaalsContact O-N 3.11Å
292	K	94.2	Very high	93.1	Very high	79 Å²	79	44.2 Å²	44.2	34%	0.343	20%	0.204	S	C	.	.	H	α-helix	trans	-62.2	-45.3	179	-49.9	178.4	-164.2	165.2	0	111.4	K294 V295 D296 H313 D315 T339	K292-K294 PolarHBondContact O-N 3.33Å; K292-K294 VanDerWaalsContact O-N 3.16Å; K292-V295 WeakPolarHBondContact O-CA 3.32Å; K292-V295 WeakPolarHBondContact O-CB 3.45Å; K292-V295 PolarHBondContact O-N 3.31Å; K292-D296 PolarHBondContact O-N 3.31Å; K292-H313 HydrophobicContact CB-CB 4.23Å; K292-H313 HydrophobicContact CG-CB 4.07Å; K292-D315 HydrophobicContact CD-CB 4.28Å; K292-D315 WeakPolarHBondContact CD-OD2 3.4Å; K292-D315 IonicContact NZ-OD1 3.64Å; K292-D315 PolarHBondContact NZ-OD1 2.71Å; K292-D315 IonicContact NZ-OD2 3.36Å; K292-D315 PolarHBondContact NZ-OD2 3.17Å; K292-T339 HydrophobicContact CG-CG2 4.19Å
293	R	95.4	Very high	94.2	Very high	217 Å²	217	50.1 Å²	50.1	82%	0.819	23%	0.226	S	C	*	.	H	α-helix	trans	-53.9	-38.2	175.5	-176.9	179.9	176	-174.3	-1	112.5	W297	R293-W297 WeakPolarHBondContact O-CB 3.42Å; R293-W297 PolarHBondContact O-N 3.47Å
294	K	96.4	Very high	94.8	Very high	37 Å²	37	52.9 Å²	52.9	16%	0.161	23%	0.234	C	C	.	.	H	α-helix	trans	-76.4	-33.4	179	-166.4	168.6	-176.8	179.7	0	112.8	E266 C289 T291 K292 D296 W297 L298 Y357 D358	E266-K294 IonicContact OE1-NZ 3.79Å; E266-K294 PolarHBondContact OE1-NZ 3.45Å; C289-K294 HydrophobicContact CB-CB 4.29Å; C289-K294 HydrophobicContact CB-CG 4.32Å; T291-K294 PolarHBondContact O-N 2.79Å; T291-K294 VanDerWaalsContact OG1-CB 3.24Å; T291-K294 WeakPolarHBondContact OG1-CB 3.03Å; T291-K294 PolarHBondContact OG1-N 3.3Å; K292-K294 PolarHBondContact O-N 3.33Å; K292-K294 VanDerWaalsContact O-N 3.16Å; K294-D296 VanDerWaalsContact C-N 3.33Å; K294-W297 HydrophobicContact CG-CE3 4.34Å; K294-L298 VanDerWaalsContact O-CB 3.23Å; K294-L298 WeakPolarHBondContact O-CB 3.35Å; K294-L298 PolarHBondContact O-N 2.85Å; K294-Y357 VanDerWaalsContact CE-CE1 3.43Å; K294-D358 WeakPolarHBondContact CD-OD2 3.44Å; K294-D358 IonicContact NZ-OD1 2.94Å; K294-D358 PolarHBondContact NZ-OD1 3.21Å; K294-D358 IonicContact NZ-OD2 3.71Å; K294-D358 PolarHBondContact NZ-OD2 3.43Å
295	V	96.9	Very high	94.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.5	-49.2	168.5	171	0	0	0	0	109.8	C289 T291 K292 L298 T299 I337 T339	C289-V295 HydrophobicContact CB-CG2 3.85Å; T291-V295 PolarHBondContact O-N 3.29Å; T291-V295 VanDerWaalsContact O-N 3.11Å; K292-V295 WeakPolarHBondContact O-CA 3.32Å; K292-V295 WeakPolarHBondContact O-CB 3.45Å; K292-V295 PolarHBondContact O-N 3.31Å; V295-L298 PolarHBondContact O-N 2.9Å; V295-T299 VanDerWaalsContact O-CB 3.32Å; V295-T299 WeakPolarHBondContact O-CB 3.14Å; V295-T299 PolarHBondContact O-N 3.37Å; V295-T299 PolarHBondContact O-OG1 2.81Å; V295-I337 HydrophobicContact CB-CG2 4.37Å; V295-I337 HydrophobicContact CG1-CB 4.39Å; V295-I337 HydrophobicContact CG1-CG2 4Å; V295-I337 HydrophobicContact CG2-CG2 4.32Å; V295-T339 HydrophobicContact CG2-CG2 3.65Å
296	D	96.3	Very high	94.6	Very high	70 Å²	70	61.8 Å²	61.8	37%	0.374	29%	0.287	S	S	.	.	H	α-helix	trans	-62.2	-49.5	-180	-60.2	-32.5	0	0	0	111.7	K292 K294 L298 T299 E300 H313	K292-D296 PolarHBondContact O-N 3.31Å; K294-D296 VanDerWaalsContact C-N 3.33Å; D296-L298 PolarHBondContact O-N 3.05Å; D296-T299 WeakPolarHBondContact O-CB 3.5Å; D296-T299 PolarHBondContact O-N 3.18Å; D296-E300 PolarHBondContact O-N 3.49Å; D296-H313 IonicContact OD1-CD2 3.43Å; D296-H313 PolarHBondContact OD1-CD2 2.96Å; D296-H313 VanDerWaalsContact OD1-CD2 3.3Å; D296-H313 IonicContact OD1-NE2 2.62Å; D296-H313 PolarHBondContact OD1-NE2 3.42Å; D296-H313 VanDerWaalsContact OD1-NE2 3.07Å; D296-H313 IonicContact OD2-NE2 3.48Å
297	W	97	Very high	94.1	Very high	106 Å²	106	63.9 Å²	63.9	40%	0.402	30%	0.297	S	S	.	.	H	α-helix	trans	-57.5	-47.4	177.6	172.6	81.9	0	0	0	112.7	R293 K294 T299 E300 K301	R293-W297 WeakPolarHBondContact O-CB 3.42Å; R293-W297 PolarHBondContact O-N 3.47Å; K294-W297 HydrophobicContact CG-CE3 4.34Å; W297-T299 VanDerWaalsContact C-N 3.31Å; W297-T299 PolarHBondContact O-N 3.01Å; W297-E300 PolarHBondContact O-N 2.82Å; W297-K301 HydrophobicContact CD2-CG 4.38Å; W297-K301 HydrophobicContact CH2-CG 4.44Å; W297-K301 HydrophobicContact CZ2-CD 4.21Å; W297-K301 HydrophobicContact CZ2-CG 3.93Å; W297-K301 WeakPolarHBondContact O-CB 3.48Å; W297-K301 PolarHBondContact O-N 2.8Å
298	L	97	Very high	93.6	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-36.2	-179	-175.2	62	0	0	0	111	F270 L273 I287 K294 V295 D296 M302 I337 Y357	F270-L298 HydrophobicContact CD2-CD1 3.84Å; F270-L298 HydrophobicContact CE2-CD1 4.34Å; L273-L298 HydrophobicContact CD2-CD1 4Å; L273-L298 HydrophobicContact CD2-CD2 4.24Å; L273-L298 HydrophobicContact CD2-CG 4.48Å; I287-L298 HydrophobicContact CG2-CD2 3.98Å; K294-L298 VanDerWaalsContact O-CB 3.23Å; K294-L298 WeakPolarHBondContact O-CB 3.35Å; K294-L298 PolarHBondContact O-N 2.85Å; V295-L298 PolarHBondContact O-N 2.9Å; D296-L298 PolarHBondContact O-N 3.05Å; L298-M302 HydrophobicContact CD1-CG 4.28Å; L298-M302 HydrophobicContact CG-CG 4.42Å; L298-M302 WeakPolarHBondContact O-CB 3.44Å; L298-M302 WeakPolarHBondContact O-CG 3.42Å; L298-M302 PolarHBondContact O-N 3.12Å; L298-I337 HydrophobicContact CB-CD1 4.47Å; L298-I337 HydrophobicContact CD2-CD1 4.26Å; L298-I337 HydrophobicContact CD2-CG2 4.05Å; L298-I337 HydrophobicContact CG-CD1 4.02Å; L298-Y357 HydrophobicContact CD1-CD2 4.38Å; L298-Y357 HydrophobicContact CD1-CE2 3.76Å; L298-Y357 HydrophobicContact CD2-CD2 3.68Å; L298-Y357 HydrophobicContact CD2-CE2 3.91Å; L298-Y357 HydrophobicContact CD2-CG 4.08Å
299	T	95.5	Very high	93.2	Very high	4 Å²	4	69.7 Å²	69.7	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-62.5	-46.4	176.2	-55.8	0	0	0	0	111.3	V295 D296 W297 M302 R303 V309 S311	V295-T299 VanDerWaalsContact O-CB 3.32Å; V295-T299 WeakPolarHBondContact O-CB 3.14Å; V295-T299 PolarHBondContact O-N 3.37Å; V295-T299 PolarHBondContact O-OG1 2.81Å; D296-T299 WeakPolarHBondContact O-CB 3.5Å; D296-T299 PolarHBondContact O-N 3.18Å; W297-T299 VanDerWaalsContact C-N 3.31Å; W297-T299 PolarHBondContact O-N 3.01Å; T299-M302 PolarHBondContact O-N 3.26Å; T299-R303 WeakPolarHBondContact O-CB 3.49Å; T299-R303 VanDerWaalsContact O-CG 3.28Å; T299-R303 WeakPolarHBondContact O-CG 3.01Å; T299-R303 PolarHBondContact O-N 3.34Å; T299-V309 HydrophobicContact CG2-CG2 3.97Å; T299-S311 WeakPolarHBondContact OG1-CB 3.37Å; T299-S311 PolarHBondContact OG1-OG 3.35Å
300	E	95.8	Very high	93	Very high	122 Å²	122	70.2 Å²	70.2	57%	0.57	34%	0.336	S	S	*	.	H	α-helix	trans	-62.4	-51.3	177.5	-173.5	170.4	-154	0	0	110.9	D296 W297 M302 R303 E304	D296-E300 PolarHBondContact O-N 3.49Å; W297-E300 PolarHBondContact O-N 2.82Å; E300-M302 VanDerWaalsContact C-N 3.34Å; E300-M302 PolarHBondContact O-N 3.31Å; E300-R303 PolarHBondContact O-N 3.07Å; E300-R303 VanDerWaalsContact O-N 3.08Å; E300-E304 WeakPolarHBondContact O-CG 3.31Å; E300-E304 PolarHBondContact O-N 2.96Å
301	K	95.3	Very high	93.1	Very high	79 Å²	79	68.6 Å²	68.6	34%	0.343	33%	0.328	S	S	.	.	H	α-helix	trans	-53.5	-45.5	175.3	-90.5	-91.9	-177.3	170.9	0	113.5	F270 W297 E304 A305	F270-K301 HydrophobicContact CD2-CB 4.26Å; F270-K301 HydrophobicContact CE1-CD 4.29Å; F270-K301 HydrophobicContact CE2-CB 3.68Å; F270-K301 HydrophobicContact CE2-CD 4.29Å; F270-K301 HydrophobicContact CZ-CB 4.08Å; F270-K301 HydrophobicContact CZ-CD 4.14Å; W297-K301 HydrophobicContact CD2-CG 4.38Å; W297-K301 HydrophobicContact CH2-CG 4.44Å; W297-K301 HydrophobicContact CZ2-CD 4.21Å; W297-K301 HydrophobicContact CZ2-CG 3.93Å; W297-K301 WeakPolarHBondContact O-CB 3.48Å; W297-K301 PolarHBondContact O-N 2.8Å; K301-E304 PolarHBondContact O-N 3.49Å; K301-A305 PolarHBondContact O-N 3.13Å; K301-A305 VanDerWaalsContact O-N 3.14Å
302	M	92.7	Very high	92.9	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.1	-36.8	178.3	-76.9	-151.1	78.6	0	0	112.1	F270 L273 Y277 I287 L298 T299 E300 A305 N306 F307 V309 I337	F270-M302 HydrophobicContact CE2-CG 4Å; L273-M302 HydrophobicContact CD2-CE 4.3Å; L273-M302 HydrophobicContact CD2-CG 4.36Å; L273-M302 HydrophobicContact CD2-SD 3.63Å; L273-M302 HydrophobicContact CG-CE 4.47Å; L273-M302 HydrophobicContact CG-SD 4.38Å; Y277-M302 HydrophobicContact CD2-CE 3.61Å; Y277-M302 HydrophobicContact CE2-CE 3.5Å; Y277-M302 VanDerWaalsContact CE2-CE 3.5Å; Y277-M302 HydrophobicContact CE2-SD 4.28Å; Y277-M302 HydrophobicContact CG-CE 4.41Å; I287-M302 HydrophobicContact CD1-SD 4.13Å; L298-M302 HydrophobicContact CD1-CG 4.28Å; L298-M302 HydrophobicContact CG-CG 4.42Å; L298-M302 WeakPolarHBondContact O-CB 3.44Å; L298-M302 WeakPolarHBondContact O-CG 3.42Å; L298-M302 PolarHBondContact O-N 3.12Å; T299-M302 PolarHBondContact O-N 3.26Å; E300-M302 VanDerWaalsContact C-N 3.34Å; E300-M302 PolarHBondContact O-N 3.31Å; M302-A305 CarbonylContact O-C 3.56Å; M302-A305 PolarHBondContact O-N 3.03Å; M302-N306 PolarHBondContact O-N 2.78Å; M302-F307 HydrophobicContact CB-CB 4.29Å; M302-F307 HydrophobicContact CE-CB 3.71Å; M302-F307 HydrophobicContact CE-CD1 4.21Å; M302-F307 HydrophobicContact CE-CD2 3.58Å; M302-F307 HydrophobicContact CE-CE2 4.24Å; M302-F307 HydrophobicContact CE-CG 3.56Å; M302-F307 WeakPolarHBondContact O-CB 3.33Å; M302-F307 PolarHBondContact O-N 2.87Å; M302-V309 HydrophobicContact CB-CG1 4.03Å; M302-V309 HydrophobicContact CB-CG2 3.92Å; M302-V309 HydrophobicContact CE-CG1 4.09Å; M302-V309 HydrophobicContact SD-CG1 3.86Å; M302-I337 HydrophobicContact CG-CD1 4.46Å; M302-I337 HydrophobicContact SD-CD1 4.03Å
303	R	92.2	Very high	92.8	Very high	139 Å²	139	62 Å²	62	53%	0.525	29%	0.293	S	S	.	.	H	α-helix	trans	-68.1	-39	175.5	-74.1	174.4	179.5	170.1	1.8	112.3	T299 E300 A305 N306 V309	T299-R303 WeakPolarHBondContact O-CB 3.49Å; T299-R303 VanDerWaalsContact O-CG 3.28Å; T299-R303 WeakPolarHBondContact O-CG 3.01Å; T299-R303 PolarHBondContact O-N 3.34Å; E300-R303 PolarHBondContact O-N 3.07Å; E300-R303 VanDerWaalsContact O-N 3.08Å; R303-A305 PolarHBondContact O-N 2.84Å; R303-N306 WeakPolarHBondContact O-CA 3.43Å; R303-N306 PolarHBondContact O-N 2.99Å; R303-V309 HydrophobicContact CG-CG2 3.9Å; R303-V309 PolarHBondContact NE-O 3.29Å; R303-V309 PolarHBondContact NH2-O 3.29Å; R303-V309 VanDerWaalsContact NH2-O 3.14Å
304	E	94.3	Very high	92.3	Very high	132 Å²	132	53.4 Å²	53.4	62%	0.617	27%	0.272	S	S	*	.	H	α-helix	trans	-60.7	-34.2	172.8	-72	176.7	168.9	0	0	111.9	E300 K301 N306	E300-E304 WeakPolarHBondContact O-CG 3.31Å; E300-E304 PolarHBondContact O-N 2.96Å; K301-E304 PolarHBondContact O-N 3.49Å; E304-N306 PolarHBondContact O-N 3.27Å
305	A	88.2	Confident	91.9	Very high	43 Å²	43	57 Å²	57	36%	0.355	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	13.4	172.3	0	0	0	0	0	113.9	F270 K301 M302 R303 F307	F270-A305 HydrophobicContact CZ-CB 4.2Å; K301-A305 PolarHBondContact O-N 3.13Å; K301-A305 VanDerWaalsContact O-N 3.14Å; M302-A305 CarbonylContact O-C 3.56Å; M302-A305 PolarHBondContact O-N 3.03Å; R303-A305 PolarHBondContact O-N 2.84Å; A305-F307 VanDerWaalsContact C-N 3.29Å; A305-F307 HydrophobicContact CB-CD2 3.74Å; A305-F307 HydrophobicContact CB-CE2 3.83Å; A305-F307 PolarHBondContact O-N 3.46Å
306	N	86.9	Confident	91.6	Very high	151 Å²	151	58 Å²	58	81%	0.807	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	20.4	179.9	-58.8	-60.3	0	0	0	115.8	M302 R303 E304	M302-N306 PolarHBondContact O-N 2.78Å; R303-N306 WeakPolarHBondContact O-CA 3.43Å; R303-N306 PolarHBondContact O-N 2.99Å; E304-N306 PolarHBondContact O-N 3.27Å
307	F	84.3	Confident	91.3	Very high	44 Å²	44	58.7 Å²	58.7	19%	0.193	31%	0.306	C	S	.	.			trans	-83	134.1	171.3	-64.4	-76.2	0	0	0	111.6	C274 Y277 M302 A305 V309	C274-F307 HydrophobicContact CB-CE2 4.28Å; C274-F307 HydrophobicContact CB-CZ 4.36Å; Y277-F307 HydrophobicContact CD1-CD1 4.41Å; Y277-F307 HydrophobicContact CD1-CE1 4.48Å; Y277-F307 HydrophobicContact CG-CD1 4.21Å; Y277-F307 AromaticContact CG-CE1 3.97Å; Y277-F307 HydrophobicContact CG-CE1 3.97Å; M302-F307 HydrophobicContact CB-CB 4.29Å; M302-F307 HydrophobicContact CE-CB 3.71Å; M302-F307 HydrophobicContact CE-CD1 4.21Å; M302-F307 HydrophobicContact CE-CD2 3.58Å; M302-F307 HydrophobicContact CE-CE2 4.24Å; M302-F307 HydrophobicContact CE-CG 3.56Å; M302-F307 WeakPolarHBondContact O-CB 3.33Å; M302-F307 PolarHBondContact O-N 2.87Å; A305-F307 VanDerWaalsContact C-N 3.29Å; A305-F307 HydrophobicContact CB-CD2 3.74Å; A305-F307 HydrophobicContact CB-CE2 3.83Å; A305-F307 PolarHBondContact O-N 3.46Å; F307-V309 HydrophobicContact CB-CG1 4.03Å; F307-V309 PolarHBondContact O-N 3.32Å
308	T	84.4	Confident	90.6	Very high	115 Å²	115	54.4 Å²	54.4	71%	0.706	29%	0.291	S	S	*	.			trans	-81.9	98.5	173.7	-58.1	0	0	0	0	109.7
309	V	89.8	Confident	90.3	Very high	6 Å²	6	63.1 Å²	63.1	4%	0.036	33%	0.329	C	S	.	.			trans	-123.2	139.1	-178.7	-57.4	0	0	0	0	112.2	T299 M302 R303 F307 V335 I337	T299-V309 HydrophobicContact CG2-CG2 3.97Å; M302-V309 HydrophobicContact CB-CG1 4.03Å; M302-V309 HydrophobicContact CB-CG2 3.92Å; M302-V309 HydrophobicContact CE-CG1 4.09Å; M302-V309 HydrophobicContact SD-CG1 3.86Å; R303-V309 HydrophobicContact CG-CG2 3.9Å; R303-V309 PolarHBondContact NE-O 3.29Å; R303-V309 PolarHBondContact NH2-O 3.29Å; R303-V309 VanDerWaalsContact NH2-O 3.14Å; F307-V309 HydrophobicContact CB-CG1 4.03Å; F307-V309 PolarHBondContact O-N 3.32Å; V309-V335 HydrophobicContact CB-CB 4.33Å; V309-V335 HydrophobicContact CB-CG1 4.21Å; V309-V335 HydrophobicContact CG1-CB 3.88Å; V309-V335 HydrophobicContact CG1-CG1 3.7Å; V309-V335 HydrophobicContact CG1-CG2 4.48Å; V309-I337 HydrophobicContact CB-CD1 4.25Å; V309-I337 HydrophobicContact CG2-CD1 4.19Å
310	S	92.7	Very high	90.1	Very high	12 Å²	12	67.4 Å²	67.4	8%	0.084	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	154.1	164.8	-61.7	0	0	0	0	109.4	S333 V335 L336 I337	S310-S333 WeakPolarHBondContact CB-OG 3.41Å; S310-S333 WeakPolarHBondContact OG-CB 3.03Å; S310-S333 PolarHBondContact OG-OG 3.26Å; S310-V335 PolarHBondContact N-O 3.02Å; S310-L336 CarbonylContact O-C 3.59Å; S310-L336 WeakPolarHBondContact O-CA 3.32Å; S310-I337 PolarHBondContact O-N 3.24Å
311	S	94.4	Very high	89.7	Confident	11 Å²	11	62.1 Å²	62.1	8%	0.077	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.4	175.2	66.4	0	0	0	0	111.7	T299 I324 I337	T299-S311 WeakPolarHBondContact OG1-CB 3.37Å; T299-S311 PolarHBondContact OG1-OG 3.35Å; S311-I324 WeakPolarHBondContact O-CD1 3.44Å; S311-I337 CarbonylContact C-O 3.55Å; S311-I337 WeakPolarHBondContact CA-O 3.39Å; S311-I337 WeakPolarHBondContact CB-O 2.85Å
312	M	91.1	Very high	89.3	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	138	177.1	-162.7	173	79.3	0	0	112.9	E122 M316 R321 I324 M325 L336 I337 S338 W342	E122-M312 HydrophobicContact CG-CE 4.45Å; M312-M316 VanDerWaalsContact CA-SD 3.57Å; M312-M316 HydrophobicContact CB-SD 4.39Å; M312-M316 HydrophobicContact CG-SD 4.11Å; M312-R321 HydrophobicContact CG-CB 4.27Å; M312-R321 HydrophobicContact CG-CG 3.88Å; M312-R321 HydrophobicContact SD-CB 3.53Å; M312-R321 VanDerWaalsContact SD-CB 3.53Å; M312-R321 HydrophobicContact SD-CG 3.81Å; M312-I324 HydrophobicContact CB-CG2 4.29Å; M312-I324 HydrophobicContact CG-CD1 4.47Å; M312-M325 HydrophobicContact CE-CG 4.39Å; M312-M325 HydrophobicContact CE-SD 3.99Å; M312-M325 HydrophobicContact SD-CG 4.14Å; M312-M325 HydrophobicContact SD-SD 4.34Å; M312-L336 HydrophobicContact CB-CD1 4.24Å; M312-I337 PolarHBondContact N-O 3.44Å; M312-S338 VanDerWaalsContact O-CA 3.28Å; M312-S338 WeakPolarHBondContact O-CA 3.5Å; M312-S338 WeakPolarHBondContact O-CB 3.35Å; M312-S338 PolarHBondContact O-OG 3Å; M312-W342 HydrophobicContact CE-CG 4.46Å
313	H	92.1	Very high	89.2	Confident	14 Å²	14	65.6 Å²	65.6	7%	0.065	35%	0.347	C	S	.	.			trans	-150.1	176.7	172.4	62.3	55.4	0	0	0	112.2	K292 D296 D315 M316 T339	K292-H313 HydrophobicContact CB-CB 4.23Å; K292-H313 HydrophobicContact CG-CB 4.07Å; D296-H313 IonicContact OD1-CD2 3.43Å; D296-H313 PolarHBondContact OD1-CD2 2.96Å; D296-H313 VanDerWaalsContact OD1-CD2 3.3Å; D296-H313 IonicContact OD1-NE2 2.62Å; D296-H313 PolarHBondContact OD1-NE2 3.42Å; D296-H313 VanDerWaalsContact OD1-NE2 3.07Å; D296-H313 IonicContact OD2-NE2 3.48Å; H313-D315 PolarHBondContact ND1-N 3.05Å; H313-D315 PolarHBondContact O-N 3.19Å; H313-M316 PolarHBondContact O-N 3.01Å; H313-T339 HydrophobicContact CB-CG2 4.24Å
314	G	85.6	Confident	89.1	Confident	37 Å²	37	59.7 Å²	59.7	38%	0.381	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-24.4	-172	0	0	0	0	0	116.5	M316	G314-M316 VanDerWaalsContact C-N 3.34Å
315	D	88.1	Confident	88.7	Confident	112 Å²	112	54 Å²	54	60%	0.599	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.8	-179.4	-67.5	-15	0	0	0	114.1	K292 H313	K292-D315 HydrophobicContact CD-CB 4.28Å; K292-D315 WeakPolarHBondContact CD-OD2 3.4Å; K292-D315 IonicContact NZ-OD1 3.64Å; K292-D315 PolarHBondContact NZ-OD1 2.71Å; K292-D315 IonicContact NZ-OD2 3.36Å; K292-D315 PolarHBondContact NZ-OD2 3.17Å; H313-D315 PolarHBondContact ND1-N 3.05Å; H313-D315 PolarHBondContact O-N 3.19Å
316	M	89.4	Confident	88.6	Confident	21 Å²	21	59.7 Å²	59.7	10%	0.103	32%	0.316	C	S	.	.	S	Bend	trans	-72.3	142.6	177.9	-73.5	169.9	177.3	0	0	111.1	M312 H313 G314 R321 I324	M312-M316 VanDerWaalsContact CA-SD 3.57Å; M312-M316 HydrophobicContact CB-SD 4.39Å; M312-M316 HydrophobicContact CG-SD 4.11Å; H313-M316 PolarHBondContact O-N 3.01Å; G314-M316 VanDerWaalsContact C-N 3.34Å; M316-R321 HydrophobicContact CB-CG 3.68Å; M316-R321 VanDerWaalsContact O-CD 3.31Å; M316-R321 WeakPolarHBondContact O-CD 3.49Å; M316-I324 HydrophobicContact SD-CD1 4.05Å
317	P	89.6	Confident	88.8	Confident	84 Å²	84	56.2 Å²	56.2	55%	0.545	30%	0.295	S	S	.	.			trans	-53.5	144	170.2	-25.3	33.9	0	0	0	112.4	K319 E320 R321	P317-K319 VanDerWaalsContact C-N 3.28Å; P317-K319 PolarHBondContact O-N 3.36Å; P317-E320 WeakPolarHBondContact CD-OE2 3.48Å; P317-E320 WeakPolarHBondContact O-CB 3.3Å; P317-E320 PolarHBondContact O-N 2.84Å; P317-E320 VanDerWaalsContact O-N 3.07Å; P317-R321 WeakPolarHBondContact O-CG 3.39Å; P317-R321 PolarHBondContact O-N 3.24Å; P317-R321 VanDerWaalsContact O-N 3.14Å
318	Q	84.1	Confident	89	Confident	17 Å²	17	54.1 Å²	54.1	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-58.6	-37.9	-175.5	-170.3	60.2	33.2	0	0	113.2	E122 E320 R321 E322	E122-Q318 PolarHBondContact OE1-NE2 3.01Å; Q318-E320 VanDerWaalsContact C-N 3.31Å; Q318-E320 PolarHBondContact O-N 3.15Å; Q318-R321 PolarHBondContact O-N 3.11Å; Q318-R321 VanDerWaalsContact OE1-NH1 3.13Å; Q318-E322 WeakPolarHBondContact O-CG 3.42Å; Q318-E322 PolarHBondContact O-N 3.25Å
319	K	89.7	Confident	89.1	Confident	182 Å²	182	52.9 Å²	52.9	79%	0.791	27%	0.268	S	S	*	.	H	α-helix	trans	-61	-39.9	177.8	-69.7	-175.2	176.6	-177.9	0	112.6	P317 E322 S323	P317-K319 VanDerWaalsContact C-N 3.28Å; P317-K319 PolarHBondContact O-N 3.36Å; K319-E322 PolarHBondContact O-N 2.62Å; K319-S323 PolarHBondContact O-N 2.91Å; K319-S323 VanDerWaalsContact O-N 3.08Å
320	E	90.9	Very high	88.9	Confident	95 Å²	95	56.6 Å²	56.6	44%	0.444	29%	0.294	S	S	.	.	H	α-helix	trans	-68.3	-45.7	178.9	-169.6	178.8	170.9	0	0	110.3	P317 Q318 E322 S323 I324	P317-E320 WeakPolarHBondContact CD-OE2 3.48Å; P317-E320 WeakPolarHBondContact O-CB 3.3Å; P317-E320 PolarHBondContact O-N 2.84Å; P317-E320 VanDerWaalsContact O-N 3.07Å; Q318-E320 VanDerWaalsContact C-N 3.31Å; Q318-E320 PolarHBondContact O-N 3.15Å; E320-E322 VanDerWaalsContact C-N 3.3Å; E320-E322 PolarHBondContact O-N 3.37Å; E320-S323 WeakPolarHBondContact O-CB 3.06Å; E320-S323 PolarHBondContact O-N 2.92Å; E320-I324 HydrophobicContact CG-CD1 3.95Å; E320-I324 WeakPolarHBondContact O-CD1 3.32Å; E320-I324 WeakPolarHBondContact O-CG1 3.48Å; E320-I324 PolarHBondContact O-N 3.06Å
321	R	88.1	Confident	88.6	Confident	10 Å²	10	57.6 Å²	57.6	4%	0.038	31%	0.306	C	S	.	.	H	α-helix	trans	-55.6	-44.5	174.9	-63.3	178.5	73.6	-134.8	-3.9	111.6	E122 M312 M316 P317 Q318 M325	E122-R321 IonicContact OE1-CZ 3.41Å; E122-R321 IonicContact OE1-NE 3.9Å; E122-R321 IonicContact OE1-NH1 3.96Å; E122-R321 PolarHBondContact OE1-NH1 2.69Å; E122-R321 IonicContact OE1-NH2 2.74Å; E122-R321 PolarHBondContact OE1-NH2 3.42Å; E122-R321 VanDerWaalsContact OE1-NH2 3.09Å; E122-R321 IonicContact OE2-CZ 3.28Å; E122-R321 IonicContact OE2-NH1 3.29Å; E122-R321 PolarHBondContact OE2-NH1 2.9Å; E122-R321 IonicContact OE2-NH2 3.3Å; E122-R321 PolarHBondContact OE2-NH2 3.03Å; M312-R321 HydrophobicContact CG-CB 4.27Å; M312-R321 HydrophobicContact CG-CG 3.88Å; M312-R321 HydrophobicContact SD-CB 3.53Å; M312-R321 VanDerWaalsContact SD-CB 3.53Å; M312-R321 HydrophobicContact SD-CG 3.81Å; M316-R321 HydrophobicContact CB-CG 3.68Å; M316-R321 VanDerWaalsContact O-CD 3.31Å; M316-R321 WeakPolarHBondContact O-CD 3.49Å; P317-R321 WeakPolarHBondContact O-CG 3.39Å; P317-R321 PolarHBondContact O-N 3.24Å; P317-R321 VanDerWaalsContact O-N 3.14Å; Q318-R321 PolarHBondContact O-N 3.11Å; Q318-R321 VanDerWaalsContact OE1-NH1 3.13Å; R321-M325 WeakPolarHBondContact O-CB 3.49Å; R321-M325 WeakPolarHBondContact O-CG 3.36Å; R321-M325 PolarHBondContact O-N 3.35Å
322	E	85.9	Confident	88.1	Confident	99 Å²	99	60.5 Å²	60.5	46%	0.463	33%	0.331	S	S	.	.	H	α-helix	trans	-64.8	-38	176	-74.6	171.6	-166.9	0	0	113.4	Q318 K319 E320 K326	Q318-E322 WeakPolarHBondContact O-CG 3.42Å; Q318-E322 PolarHBondContact O-N 3.25Å; K319-E322 PolarHBondContact O-N 2.62Å; E320-E322 VanDerWaalsContact C-N 3.3Å; E320-E322 PolarHBondContact O-N 3.37Å; E322-K326 WeakPolarHBondContact O-CB 3.38Å; E322-K326 PolarHBondContact O-N 3.19Å
323	S	90.8	Very high	87.8	Confident	54 Å²	54	60.7 Å²	60.7	38%	0.378	33%	0.332	S	S	.	.	H	α-helix	trans	-63.7	-50.7	175.3	-161.5	0	0	0	0	111.2	K319 E320 M325 K326 E327	K319-S323 PolarHBondContact O-N 2.91Å; K319-S323 VanDerWaalsContact O-N 3.08Å; E320-S323 WeakPolarHBondContact O-CB 3.06Å; E320-S323 PolarHBondContact O-N 2.92Å; S323-M325 VanDerWaalsContact C-N 3.29Å; S323-M325 PolarHBondContact O-N 3.36Å; S323-K326 WeakPolarHBondContact O-CB 3.46Å; S323-K326 PolarHBondContact O-N 3.12Å; S323-E327 WeakPolarHBondContact O-CG 3.31Å; S323-E327 PolarHBondContact O-N 3.19Å; S323-E327 PolarHBondContact OG-OE1 3.21Å
324	I	90.9	Very high	87.6	Confident	15 Å²	15	67.6 Å²	67.6	8%	0.077	36%	0.358	C	S	.	.	H	α-helix	trans	-57.8	-44.3	178	-67.6	154.4	0	0	0	110.6	S311 M312 M316 E320 K326 E327 F328 L336	S311-I324 WeakPolarHBondContact O-CD1 3.44Å; M312-I324 HydrophobicContact CB-CG2 4.29Å; M312-I324 HydrophobicContact CG-CD1 4.47Å; M316-I324 HydrophobicContact SD-CD1 4.05Å; E320-I324 HydrophobicContact CG-CD1 3.95Å; E320-I324 WeakPolarHBondContact O-CD1 3.32Å; E320-I324 WeakPolarHBondContact O-CG1 3.48Å; E320-I324 PolarHBondContact O-N 3.06Å; I324-K326 VanDerWaalsContact C-N 3.3Å; I324-K326 PolarHBondContact O-N 3.41Å; I324-E327 PolarHBondContact O-N 2.61Å; I324-F328 VanDerWaalsContact O-CB 3.32Å; I324-F328 WeakPolarHBondContact O-CB 3.36Å; I324-F328 PolarHBondContact O-N 3.47Å; I324-L336 HydrophobicContact CG2-CD1 3.79Å
325	M	84.9	Confident	87.8	Confident	13 Å²	13	66.2 Å²	66.2	6%	0.064	34%	0.342	C	S	.	.	H	α-helix	trans	-60.4	-39.8	176.2	-76.1	-59.2	-44.2	0	0	112.5	E122 M312 R321 S323 R329 W342 L346	E122-M325 HydrophobicContact CG-CG 4.36Å; M312-M325 HydrophobicContact CE-CG 4.39Å; M312-M325 HydrophobicContact CE-SD 3.99Å; M312-M325 HydrophobicContact SD-CG 4.14Å; M312-M325 HydrophobicContact SD-SD 4.34Å; R321-M325 WeakPolarHBondContact O-CB 3.49Å; R321-M325 WeakPolarHBondContact O-CG 3.36Å; R321-M325 PolarHBondContact O-N 3.35Å; S323-M325 VanDerWaalsContact C-N 3.29Å; S323-M325 PolarHBondContact O-N 3.36Å; M325-R329 VanDerWaalsContact O-CB 3.3Å; M325-R329 WeakPolarHBondContact O-CB 3.38Å; M325-R329 VanDerWaalsContact O-CG 3.26Å; M325-R329 WeakPolarHBondContact O-CG 3.34Å; M325-R329 PolarHBondContact O-N 3.28Å; M325-W342 HydrophobicContact CE-CH2 3.83Å; M325-W342 HydrophobicContact CE-CZ2 3.29Å; M325-W342 HydrophobicContact SD-CH2 4.19Å; M325-W342 HydrophobicContact SD-CZ2 3.09Å; M325-W342 WeakPolarHBondContact SD-CZ2 3.46Å; M325-W342 PolarHBondContact SD-NE1 3.49Å; M325-L346 HydrophobicContact CE-CD1 4.34Å; M325-L346 HydrophobicContact SD-CD1 4.19Å
326	K	87.9	Confident	88.1	Confident	161 Å²	161	60.9 Å²	60.9	70%	0.7	31%	0.313	S	S	*	.	H	α-helix	trans	-68.3	-46.3	178.5	-175	-176	177	-172.7	0	110.9	E322 S323 I324 R329 S330	E322-K326 WeakPolarHBondContact O-CB 3.38Å; E322-K326 PolarHBondContact O-N 3.19Å; S323-K326 WeakPolarHBondContact O-CB 3.46Å; S323-K326 PolarHBondContact O-N 3.12Å; I324-K326 VanDerWaalsContact C-N 3.3Å; I324-K326 PolarHBondContact O-N 3.41Å; K326-R329 PolarHBondContact O-N 3.32Å; K326-S330 WeakPolarHBondContact O-CB 3.32Å; K326-S330 PolarHBondContact O-N 2.89Å; K326-S330 PolarHBondContact O-OG 2.94Å
327	E	89.4	Confident	88.4	Confident	79 Å²	79	59.9 Å²	59.9	37%	0.369	31%	0.308	S	S	.	.	H	α-helix	trans	-60.6	-48.5	177.6	-73.3	163.2	-147.6	0	0	111.1	S323 I324 S330 G331 A332	S323-E327 WeakPolarHBondContact O-CG 3.31Å; S323-E327 PolarHBondContact O-N 3.19Å; S323-E327 PolarHBondContact OG-OE1 3.21Å; I324-E327 PolarHBondContact O-N 2.61Å; E327-S330 PolarHBondContact O-N 3.47Å; E327-S330 PolarHBondContact O-OG 3.03Å; E327-G331 PolarHBondContact O-N 3.48Å; E327-A332 HydrophobicContact CB-CB 4.44Å; E327-A332 PolarHBondContact O-N 3.25Å; E327-A332 VanDerWaalsContact O-N 3.13Å
328	F	89.1	Confident	88.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.3	-45	178.5	-171	-111.2	0	0	0	111.5	Q284 V286 I324 S330 G331 S333 L336 W342 V348 V351	Q284-F328 HydrophobicContact CB-CE2 4.27Å; Q284-F328 HydrophobicContact CB-CZ 4.22Å; Q284-F328 PolarHBondContact NE2-O 3.32Å; V286-F328 HydrophobicContact CG2-CE1 4.16Å; V286-F328 HydrophobicContact CG2-CZ 3.83Å; I324-F328 VanDerWaalsContact O-CB 3.32Å; I324-F328 WeakPolarHBondContact O-CB 3.36Å; I324-F328 PolarHBondContact O-N 3.47Å; F328-S330 VanDerWaalsContact C-N 3.26Å; F328-S330 PolarHBondContact O-N 3.23Å; F328-G331 PolarHBondContact O-N 2.99Å; F328-G331 VanDerWaalsContact O-N 3.1Å; F328-S333 WeakPolarHBondContact CD2-O 3.37Å; F328-L336 HydrophobicContact CD1-CB 4.48Å; F328-L336 HydrophobicContact CD1-CD2 4.15Å; F328-L336 HydrophobicContact CD2-CB 3.78Å; F328-L336 HydrophobicContact CE1-CB 4.3Å; F328-L336 HydrophobicContact CE1-CD2 4.23Å; F328-L336 HydrophobicContact CE2-CB 3.57Å; F328-L336 HydrophobicContact CG-CB 4.23Å; F328-L336 HydrophobicContact CG-CD2 4.41Å; F328-L336 HydrophobicContact CZ-CB 3.84Å; F328-W342 AromaticContact CD1-CH2 3.5Å; F328-W342 HydrophobicContact CD1-CH2 3.5Å; F328-W342 AromaticContact CD1-CZ2 3.93Å; F328-W342 HydrophobicContact CD1-CZ2 3.93Å; F328-W342 HydrophobicContact CD1-CZ3 4.45Å; F328-W342 AromaticContact CE1-CH2 3.53Å; F328-W342 HydrophobicContact CE1-CH2 3.53Å; F328-W342 HydrophobicContact CE1-CZ2 4.28Å; F328-W342 HydrophobicContact CE1-CZ3 4.04Å; F328-V348 HydrophobicContact CD1-CG1 4.3Å; F328-V348 HydrophobicContact CD1-CG2 4.01Å; F328-V348 HydrophobicContact CE1-CB 4.21Å; F328-V348 HydrophobicContact CE1-CG1 4.04Å; F328-V348 HydrophobicContact CE1-CG2 4.04Å; F328-V351 HydrophobicContact CE1-CG2 3.8Å; F328-V351 HydrophobicContact CZ-CG2 3.74Å
329	R	86.1	Confident	89	Confident	88 Å²	88	55.7 Å²	55.7	33%	0.332	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-31.3	176.1	-77.6	177.3	-177.4	-169.9	3.7	113.9	Q126 M325 K326 G331 V348	Q126-R329 VanDerWaalsContact OE1-NH2 3.11Å; M325-R329 VanDerWaalsContact O-CB 3.3Å; M325-R329 WeakPolarHBondContact O-CB 3.38Å; M325-R329 VanDerWaalsContact O-CG 3.26Å; M325-R329 WeakPolarHBondContact O-CG 3.34Å; M325-R329 PolarHBondContact O-N 3.28Å; K326-R329 PolarHBondContact O-N 3.32Å; R329-G331 VanDerWaalsContact C-N 3.26Å; R329-V348 HydrophobicContact CG-CG2 3.86Å
330	S	86.8	Confident	88.9	Confident	85 Å²	85	48.3 Å²	48.3	59%	0.594	25%	0.252	S	S	*	.	H	α-helix	trans	-76.8	-13.2	177.7	71.2	0	0	0	0	113.7	K326 E327 F328 A332	K326-S330 WeakPolarHBondContact O-CB 3.32Å; K326-S330 PolarHBondContact O-N 2.89Å; K326-S330 PolarHBondContact O-OG 2.94Å; E327-S330 PolarHBondContact O-N 3.47Å; E327-S330 PolarHBondContact O-OG 3.03Å; F328-S330 VanDerWaalsContact C-N 3.26Å; F328-S330 PolarHBondContact O-N 3.23Å; S330-A332 VanDerWaalsContact C-N 3.28Å; S330-A332 WeakPolarHBondContact OG-CB 3.47Å; S330-A332 PolarHBondContact OG-N 3.22Å
331	G	84.7	Confident	88.2	Confident	32 Å²	32	45.1 Å²	45.1	33%	0.33	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	3.2	-172.9	0	0	0	0	0	114.4	E327 F328 R329 S333	E327-G331 PolarHBondContact O-N 3.48Å; F328-G331 PolarHBondContact O-N 2.99Å; F328-G331 VanDerWaalsContact O-N 3.1Å; R329-G331 VanDerWaalsContact C-N 3.26Å; G331-S333 PolarHBondContact O-N 3.42Å
332	A	85.8	Confident	87.6	Confident	73 Å²	73	44.7 Å²	44.7	60%	0.603	24%	0.237	S	C	*	.	S	Bend	trans	-61.2	-36.2	173.8	0	0	0	0	0	111.6	E327 S330	E327-A332 HydrophobicContact CB-CB 4.44Å; E327-A332 PolarHBondContact O-N 3.25Å; E327-A332 VanDerWaalsContact O-N 3.13Å; S330-A332 VanDerWaalsContact C-N 3.28Å; S330-A332 WeakPolarHBondContact OG-CB 3.47Å; S330-A332 PolarHBondContact OG-N 3.22Å
333	S	84.9	Confident	86.5	Confident	3 Å²	3	40 Å²	40	2%	0.021	22%	0.215	C	C	.	.			trans	-108.9	128.4	166.4	-178.2	0	0	0	0	110	Q284 S310 F328 G331 V335	Q284-S333 PolarHBondContact NE2-O 2.98Å; S310-S333 WeakPolarHBondContact CB-OG 3.41Å; S310-S333 WeakPolarHBondContact OG-CB 3.03Å; S310-S333 PolarHBondContact OG-OG 3.26Å; F328-S333 WeakPolarHBondContact CD2-O 3.37Å; G331-S333 PolarHBondContact O-N 3.42Å; S333-V335 PolarHBondContact OG-O 3.23Å
334	R	87.4	Confident	85.7	Confident	160 Å²	160	37.7 Å²	37.7	60%	0.604	20%	0.198	S	C	*	.			trans	-91	-20.3	179	-64.7	-170	-179	-176	1.4	112.9	Q284 A285	Q284-R334 CarbonylContact C-O 3.59Å; Q284-R334 WeakPolarHBondContact CA-O 3.31Å; A285-R334 PolarHBondContact N-O 3.45Å
335	V	90.4	Very high	84.4	Confident	7 Å²	7	37.3 Å²	37.3	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127	-173.3	179.4	0	0	0	0	109.6	Y277 I287 V309 S310 S333 I337	Y277-V335 HydrophobicContact CE1-CG2 3.35Å; Y277-V335 WeakPolarHBondContact OH-CG1 3.48Å; Y277-V335 WeakPolarHBondContact OH-CG2 3.38Å; I287-V335 HydrophobicContact CD1-CG1 3.84Å; I287-V335 HydrophobicContact CG1-CG1 4.4Å; V309-V335 HydrophobicContact CB-CB 4.33Å; V309-V335 HydrophobicContact CB-CG1 4.21Å; V309-V335 HydrophobicContact CG1-CB 3.88Å; V309-V335 HydrophobicContact CG1-CG1 3.7Å; V309-V335 HydrophobicContact CG1-CG2 4.48Å; S310-V335 PolarHBondContact N-O 3.02Å; S333-V335 PolarHBondContact OG-O 3.23Å; V335-I337 HydrophobicContact CG1-CG1 4.4Å
336	L	93.3	Very high	83.8	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.1	173.3	-179.3	67.6	0	0	0	111.2	A285 V286 I287 S310 M312 I324 F328 W342	A285-L336 PolarHBondContact O-N 3.01Å; V286-L336 CarbonylContact C-O 3.49Å; V286-L336 WeakPolarHBondContact CA-O 3.23Å; I287-L336 PolarHBondContact N-O 3.43Å; S310-L336 CarbonylContact O-C 3.59Å; S310-L336 WeakPolarHBondContact O-CA 3.32Å; M312-L336 HydrophobicContact CB-CD1 4.24Å; I324-L336 HydrophobicContact CG2-CD1 3.79Å; F328-L336 HydrophobicContact CD1-CB 4.48Å; F328-L336 HydrophobicContact CD1-CD2 4.15Å; F328-L336 HydrophobicContact CD2-CB 3.78Å; F328-L336 HydrophobicContact CE1-CB 4.3Å; F328-L336 HydrophobicContact CE1-CD2 4.23Å; F328-L336 HydrophobicContact CE2-CB 3.57Å; F328-L336 HydrophobicContact CG-CB 4.23Å; F328-L336 HydrophobicContact CG-CD2 4.41Å; F328-L336 HydrophobicContact CZ-CB 3.84Å; L336-W342 HydrophobicContact CD2-CD2 3.59Å; L336-W342 HydrophobicContact CD2-CE3 4.09Å; L336-W342 HydrophobicContact CD2-CG 4.1Å; L336-W342 HydrophobicContact CD2-CH2 3.74Å; L336-W342 HydrophobicContact CD2-CZ2 3.16Å; L336-W342 HydrophobicContact CD2-CZ3 4.17Å
337	I	95.3	Very high	83.1	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.4	172.1	-49.2	179.1	0	0	0	108.6	I287 V295 L298 M302 V309 S310 S311 M312 V335	I287-I337 HydrophobicContact CB-CG1 4.28Å; I287-I337 HydrophobicContact CB-CG2 4.45Å; I287-I337 HydrophobicContact CD1-CG1 4.1Å; I287-I337 CarbonylContact O-C 3.49Å; I287-I337 WeakPolarHBondContact O-CA 3.28Å; V295-I337 HydrophobicContact CB-CG2 4.37Å; V295-I337 HydrophobicContact CG1-CB 4.39Å; V295-I337 HydrophobicContact CG1-CG2 4Å; V295-I337 HydrophobicContact CG2-CG2 4.32Å; L298-I337 HydrophobicContact CB-CD1 4.47Å; L298-I337 HydrophobicContact CD2-CD1 4.26Å; L298-I337 HydrophobicContact CD2-CG2 4.05Å; L298-I337 HydrophobicContact CG-CD1 4.02Å; M302-I337 HydrophobicContact CG-CD1 4.46Å; M302-I337 HydrophobicContact SD-CD1 4.03Å; V309-I337 HydrophobicContact CB-CD1 4.25Å; V309-I337 HydrophobicContact CG2-CD1 4.19Å; S310-I337 PolarHBondContact O-N 3.24Å; S311-I337 CarbonylContact C-O 3.55Å; S311-I337 WeakPolarHBondContact CA-O 3.39Å; S311-I337 WeakPolarHBondContact CB-O 2.85Å; M312-I337 PolarHBondContact N-O 3.44Å; V335-I337 HydrophobicContact CG1-CG1 4.4Å
338	S	95	Very high	82.8	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162.4	-175.7	-177	0	0	0	0	113.1	I287 F288 C289 M312 W342	I287-S338 PolarHBondContact O-N 3.49Å; F288-S338 WeakPolarHBondContact CA-O 3.42Å; C289-S338 PolarHBondContact N-O 2.88Å; M312-S338 VanDerWaalsContact O-CA 3.28Å; M312-S338 WeakPolarHBondContact O-CA 3.5Å; M312-S338 WeakPolarHBondContact O-CB 3.35Å; M312-S338 PolarHBondContact O-OG 3Å; S338-W342 WeakPolarHBondContact OG-CB 3.48Å
339	T	92.9	Very high	82.4	Confident	13 Å²	13	29.4 Å²	29.4	8%	0.08	17%	0.169	C	C	.	.			trans	-83.6	-180	162.8	62.6	0	0	0	0	111.4	C289 K292 V295 H313 V341 W342	C289-T339 WeakPolarHBondContact O-CA 3.41Å; K292-T339 HydrophobicContact CG-CG2 4.19Å; V295-T339 HydrophobicContact CG2-CG2 3.65Å; H313-T339 HydrophobicContact CB-CG2 4.24Å; T339-V341 PolarHBondContact O-N 3Å; T339-V341 WeakPolarHBondContact OG1-CG2 3.32Å; T339-W342 PolarHBondContact O-N 3.11Å
340	D	86.3	Confident	82.3	Confident	27 Å²	27	30.5 Å²	30.5	14%	0.144	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-57.7	-7.1	176.8	-68.6	-55.5	0	0	0	115.4	W342 A343 L365 R369	D340-W342 PolarHBondContact O-N 3.16Å; D340-W342 VanDerWaalsContact O-N 3.09Å; D340-A343 HydrophobicContact CB-CB 4.26Å; D340-A343 WeakPolarHBondContact O-CB 3.36Å; D340-A343 PolarHBondContact O-N 3.25Å; D340-L365 HydrophobicContact CB-CD2 4.15Å; D340-R369 VanDerWaalsContact CG-NH2 3.25Å; D340-R369 IonicContact OD1-CZ 2.81Å; D340-R369 IonicContact OD1-NE 3.98Å; D340-R369 PolarHBondContact OD1-NE 3.3Å; D340-R369 IonicContact OD1-NH2 2.7Å; D340-R369 PolarHBondContact OD1-NH2 2.99Å; D340-R369 IonicContact OD2-CZ 3.88Å; D340-R369 IonicContact OD2-NH2 2.68Å; D340-R369 PolarHBondContact OD2-NH2 3.3Å
341	V	76.5	Confident	82.5	Confident	28 Å²	28	26.7 Å²	26.7	17%	0.17	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-52.4	-27.9	164.7	177.1	0	0	0	0	111.6	T339	T339-V341 PolarHBondContact O-N 3Å; T339-V341 WeakPolarHBondContact OG1-CG2 3.32Å
342	W	76.2	Confident	82.7	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.008	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-97.9	-6.1	175.9	-110.3	82.6	0	0	0	116.1	V286 F288 M312 M325 F328 L336 S338 T339 D340 R344 L346 V348 R372	V286-W342 HydrophobicContact CG2-CZ3 4.35Å; F288-W342 HydrophobicContact CE1-CB 3.74Å; F288-W342 HydrophobicContact CZ-CB 4.18Å; M312-W342 HydrophobicContact CE-CG 4.46Å; M325-W342 HydrophobicContact CE-CH2 3.83Å; M325-W342 HydrophobicContact CE-CZ2 3.29Å; M325-W342 HydrophobicContact SD-CH2 4.19Å; M325-W342 HydrophobicContact SD-CZ2 3.09Å; M325-W342 WeakPolarHBondContact SD-CZ2 3.46Å; M325-W342 PolarHBondContact SD-NE1 3.49Å; F328-W342 AromaticContact CD1-CH2 3.5Å; F328-W342 HydrophobicContact CD1-CH2 3.5Å; F328-W342 AromaticContact CD1-CZ2 3.93Å; F328-W342 HydrophobicContact CD1-CZ2 3.93Å; F328-W342 HydrophobicContact CD1-CZ3 4.45Å; F328-W342 AromaticContact CE1-CH2 3.53Å; F328-W342 HydrophobicContact CE1-CH2 3.53Å; F328-W342 HydrophobicContact CE1-CZ2 4.28Å; F328-W342 HydrophobicContact CE1-CZ3 4.04Å; L336-W342 HydrophobicContact CD2-CD2 3.59Å; L336-W342 HydrophobicContact CD2-CE3 4.09Å; L336-W342 HydrophobicContact CD2-CG 4.1Å; L336-W342 HydrophobicContact CD2-CH2 3.74Å; L336-W342 HydrophobicContact CD2-CZ2 3.16Å; L336-W342 HydrophobicContact CD2-CZ3 4.17Å; S338-W342 WeakPolarHBondContact OG-CB 3.48Å; T339-W342 PolarHBondContact O-N 3.11Å; D340-W342 PolarHBondContact O-N 3.16Å; D340-W342 VanDerWaalsContact O-N 3.09Å; W342-R344 PolarHBondContact O-N 3.21Å; W342-L346 HydrophobicContact CD2-CB 4.43Å; W342-L346 HydrophobicContact CD2-CD1 3.44Å; W342-L346 VanDerWaalsContact CD2-CD1 3.44Å; W342-L346 VanDerWaalsContact CE2-CD1 3.47Å; W342-L346 HydrophobicContact CE3-CB 4.09Å; W342-L346 HydrophobicContact CE3-CD1 3.96Å; W342-L346 HydrophobicContact CG-CD1 3.73Å; W342-L346 HydrophobicContact CH2-CB 4.47Å; W342-L346 HydrophobicContact CZ2-CD1 4.11Å; W342-L346 HydrophobicContact CZ3-CB 4.09Å; W342-L346 HydrophobicContact CZ3-CD1 4.45Å; W342-V348 HydrophobicContact CH2-CG2 3.68Å; W342-V348 HydrophobicContact CZ3-CG2 4.19Å; W342-R372 WeakPolarHBondContact O-CD 3.17Å
343	A	62.8	Low	82.9	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-24.8	-173.3	0	0	0	0	0	111.9	F288 D340 L365 H368 R369 R372	F288-A343 HydrophobicContact CE1-CB 4.21Å; F288-A343 HydrophobicContact CZ-CB 4.44Å; D340-A343 HydrophobicContact CB-CB 4.26Å; D340-A343 WeakPolarHBondContact O-CB 3.36Å; D340-A343 PolarHBondContact O-N 3.25Å; A343-L365 HydrophobicContact CB-CD2 4.09Å; A343-H368 HydrophobicContact CB-CB 4.33Å; A343-H368 CarbonylContact O-C 3.54Å; A343-H368 WeakPolarHBondContact O-CB 3.35Å; A343-R369 HydrophobicContact CB-CG 3.76Å; A343-R372 PolarHBondContact O-NE 2.62Å; A343-R372 VanDerWaalsContact O-NE 3.08Å
344	R	73.9	Confident	83.4	Confident	5 Å²	5	22.6 Å²	22.6	2%	0.019	11%	0.113	C	C	.	.	S	Bend	trans	-121.2	147.9	-168.6	-68.5	-164.7	169.2	103.5	-20.8	114.7	E193 D195 E196 W342 L346 L365 H368	E193-R344 HydrophobicContact CG-CB 4.27Å; D195-R344 IonicContact OD2-CZ 3.41Å; D195-R344 IonicContact OD2-NE 3.4Å; D195-R344 IonicContact OD2-NH2 2.7Å; D195-R344 PolarHBondContact OD2-NH2 3.32Å; E196-R344 IonicContact OE1-NH1 3.94Å; E196-R344 PolarHBondContact OE1-NH1 3.02Å; E196-R344 IonicContact OE2-CZ 2.97Å; E196-R344 IonicContact OE2-NH1 2.9Å; E196-R344 PolarHBondContact OE2-NH1 3.46Å; E196-R344 IonicContact OE2-NH2 3.09Å; W342-R344 PolarHBondContact O-N 3.21Å; R344-L346 PolarHBondContact O-N 2.9Å; R344-L365 VanDerWaalsContact NH1-CD2 3.25Å; R344-H368 HydrophobicContact CG-CB 3.84Å; R344-H368 VanDerWaalsContact CZ-CD2 3.41Å; R344-H368 PolarHBondContact NE-CD2 3.41Å; R344-H368 PolarHBondContact NE-CE1 3.08Å; R344-H368 VanDerWaalsContact NE-CE1 3.28Å; R344-H368 PolarHBondContact NE-NE2 2.81Å; R344-H368 PolarHBondContact NH2-CD2 3.12Å; R344-H368 PolarHBondContact NH2-NE2 2.75Å
345	G	62.6	Low	83.7	Confident	7 Å²	7	15 Å²	15	7%	0.072	8%	0.084	C	C	.	.	S	Bend	trans	64.9	-34.5	171.4	0	0	0	0	0	119.6	Q126 E193 D347	Q126-G345 PolarHBondContact NE2-O 3.27Å; E193-G345 PolarHBondContact OE1-N 3.26Å; G345-D347 PolarHBondContact O-N 3.25Å
346	L	73.7	Confident	84.1	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.005	8%	0.082	C	C	.	.			trans	-67.6	123.8	-173.1	-60.5	179.7	0	0	0	114.9	E122 M325 W342 R344 R372 R375	E122-L346 HydrophobicContact CB-CD1 4.25Å; E122-L346 HydrophobicContact CB-CD2 3.48Å; E122-L346 VanDerWaalsContact CB-CD2 3.48Å; E122-L346 HydrophobicContact CB-CG 4.46Å; M325-L346 HydrophobicContact CE-CD1 4.34Å; M325-L346 HydrophobicContact SD-CD1 4.19Å; W342-L346 HydrophobicContact CD2-CB 4.43Å; W342-L346 HydrophobicContact CD2-CD1 3.44Å; W342-L346 VanDerWaalsContact CD2-CD1 3.44Å; W342-L346 VanDerWaalsContact CE2-CD1 3.47Å; W342-L346 HydrophobicContact CE3-CB 4.09Å; W342-L346 HydrophobicContact CE3-CD1 3.96Å; W342-L346 HydrophobicContact CG-CD1 3.73Å; W342-L346 HydrophobicContact CH2-CB 4.47Å; W342-L346 HydrophobicContact CZ2-CD1 4.11Å; W342-L346 HydrophobicContact CZ3-CB 4.09Å; W342-L346 HydrophobicContact CZ3-CD1 4.45Å; R344-L346 PolarHBondContact O-N 2.9Å; L346-R372 PolarHBondContact O-NH1 3.43Å; L346-R375 PolarHBondContact O-NH2 3.43Å
347	D	73.3	Confident	84.2	Confident	33 Å²	33	14.7 Å²	14.7	18%	0.176	8%	0.082	C	C	.	.			trans	-100.3	110.7	-175.7	-163.8	2.7	0	0	0	113	G345 P349 R375	G345-D347 PolarHBondContact O-N 3.25Å; D347-P349 WeakPolarHBondContact OD1-CD 3.05Å; D347-R375 WeakPolarHBondContact OD1-CD 3.2Å; D347-R375 IonicContact OD1-CZ 3.94Å; D347-R375 VanDerWaalsContact OD1-CZ 3.3Å; D347-R375 IonicContact OD1-NE 3.64Å; D347-R375 PolarHBondContact OD1-NE 3.26Å; D347-R375 IonicContact OD1-NH1 3.75Å; D347-R375 PolarHBondContact OD1-NH1 3.11Å; D347-R375 IonicContact OD2-NH1 3.32Å; D347-R375 PolarHBondContact OD2-NH1 3.3Å
348	V	82.6	Confident	84.2	Confident	6 Å²	6	15.4 Å²	15.4	4%	0.036	9%	0.086	C	C	.	.			trans	-135.3	93.1	167.6	-173.6	0	0	0	0	107.6	F328 R329 W342 Q350 V351	F328-V348 HydrophobicContact CD1-CG1 4.3Å; F328-V348 HydrophobicContact CD1-CG2 4.01Å; F328-V348 HydrophobicContact CE1-CB 4.21Å; F328-V348 HydrophobicContact CE1-CG1 4.04Å; F328-V348 HydrophobicContact CE1-CG2 4.04Å; R329-V348 HydrophobicContact CG-CG2 3.86Å; W342-V348 HydrophobicContact CH2-CG2 3.68Å; W342-V348 HydrophobicContact CZ3-CG2 4.19Å; V348-Q350 PolarHBondContact O-N 2.99Å; V348-V351 HydrophobicContact CB-CG2 3.85Å; V348-V351 HydrophobicContact CG1-CG2 3.86Å; V348-V351 PolarHBondContact O-N 2.78Å; V348-V351 VanDerWaalsContact O-N 3.15Å
349	P	79.6	Confident	84.2	Confident	47 Å²	47	16 Å²	16	31%	0.305	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-20	-172.1	-27.2	35.4	0	0	0	115.1	D347 V351 R378	D347-P349 WeakPolarHBondContact OD1-CD 3.05Å; P349-V351 VanDerWaalsContact C-N 3.29Å; P349-R378 VanDerWaalsContact C-NH1 3.26Å; P349-R378 VanDerWaalsContact CB-NH1 3.27Å; P349-R378 PolarHBondContact O-NH1 3.06Å
350	Q	85.3	Confident	84.2	Confident	111 Å²	111	15.5 Å²	15.5	52%	0.519	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-7.2	-178.2	-59.8	-61.8	10	0	0	113.9	T283 Q284 V348 S352	T283-Q350 PolarHBondContact OG1-O 3.32Å; Q284-Q350 HydrophobicContact CG-CB 4.35Å; V348-Q350 PolarHBondContact O-N 2.99Å; Q350-S352 PolarHBondContact O-N 2.99Å
351	V	89.3	Confident	84.2	Confident	6 Å²	6	20.2 Å²	20.2	4%	0.036	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	113.7	174.2	177.7	0	0	0	0	109.1	Q284 V286 F328 V348 P349 I354 S373	Q284-V351 HydrophobicContact CB-CG2 4.21Å; Q284-V351 WeakPolarHBondContact O-CA 3.45Å; V286-V351 HydrophobicContact CG2-CG1 3.98Å; V286-V351 HydrophobicContact CG2-CG2 4.11Å; F328-V351 HydrophobicContact CE1-CG2 3.8Å; F328-V351 HydrophobicContact CZ-CG2 3.74Å; V348-V351 HydrophobicContact CB-CG2 3.85Å; V348-V351 HydrophobicContact CG1-CG2 3.86Å; V348-V351 PolarHBondContact O-N 2.78Å; V348-V351 VanDerWaalsContact O-N 3.15Å; P349-V351 VanDerWaalsContact C-N 3.29Å; V351-I354 HydrophobicContact CG1-CD1 3.61Å; V351-S373 WeakPolarHBondContact O-CA 3.45Å
352	S	89.2	Confident	84.6	Confident	22 Å²	22	21.3 Å²	21.3	15%	0.154	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-23.9	178	59.1	0	0	0	0	112.3	T283 Q284 Q350 G380 V381	T283-S352 PolarHBondContact OG1-OG 3.11Å; Q284-S352 PolarHBondContact O-N 3.47Å; Q350-S352 PolarHBondContact O-N 2.99Å; S352-G380 CarbonylContact O-C 3.51Å; S352-G380 VanDerWaalsContact O-CA 3.29Å; S352-G380 WeakPolarHBondContact O-CA 3.48Å; S352-V381 PolarHBondContact O-N 2.85Å
353	L	91.3	Very high	85.2	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.3	-174.6	-178.5	63	0	0	0	111.7	L280 I282 A285 V286 I355 V381 I383 I416	L280-L353 HydrophobicContact CD1-CD2 4.19Å; I282-L353 HydrophobicContact CD1-CD2 3.98Å; I282-L353 HydrophobicContact CG1-CD2 3.91Å; A285-L353 VanDerWaalsContact CA-O 3.22Å; A285-L353 WeakPolarHBondContact CA-O 3.38Å; A285-L353 HydrophobicContact CB-CB 4.06Å; A285-L353 HydrophobicContact CB-CD2 4.28Å; A285-L353 HydrophobicContact CB-CG 4.32Å; V286-L353 PolarHBondContact N-O 3.15Å; V286-L353 VanDerWaalsContact N-O 3.08Å; L353-I355 HydrophobicContact CD2-CD1 4.21Å; L353-I355 HydrophobicContact CD2-CG1 4.34Å; L353-I355 HydrophobicContact CG-CG1 4.17Å; L353-V381 CarbonylContact C-O 3.51Å; L353-V381 WeakPolarHBondContact CA-O 3.31Å; L353-V381 HydrophobicContact CD1-CB 3.98Å; L353-V381 HydrophobicContact CD1-CG1 3.95Å; L353-I383 HydrophobicContact CD1-CD1 3.86Å; L353-I383 HydrophobicContact CD1-CG1 4.03Å; L353-I416 HydrophobicContact CD1-CD1 4.24Å
354	I	93.8	Very high	86.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.7	170.5	-56.1	-59.4	0	0	0	108.7	V286 F288 V351 R372 V381 A382 I383	V286-I354 HydrophobicContact CB-CD1 3.84Å; V286-I354 HydrophobicContact CG2-CD1 4.29Å; V286-I354 WeakPolarHBondContact O-CA 3.34Å; F288-I354 HydrophobicContact CD2-CG2 3.89Å; F288-I354 HydrophobicContact CE2-CG2 4Å; V351-I354 HydrophobicContact CG1-CD1 3.61Å; I354-R372 HydrophobicContact CD1-CB 3.6Å; I354-R372 HydrophobicContact CG1-CB 4.42Å; I354-V381 PolarHBondContact N-O 3.48Å; I354-A382 HydrophobicContact CB-CB 4.46Å; I354-A382 CarbonylContact O-C 3.43Å; I354-A382 WeakPolarHBondContact O-CA 3.37Å; I354-I383 PolarHBondContact O-N 3.18Å
355	I	95.6	Very high	86.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	112.5	173.1	-57.5	-179.9	0	0	0	108	L273 L276 V286 I287 F288 L353 Y357 I383 F385	L273-I355 HydrophobicContact CD1-CD1 3.42Å; L273-I355 VanDerWaalsContact CD1-CD1 3.42Å; L273-I355 HydrophobicContact CD1-CG2 4.23Å; L276-I355 HydrophobicContact CD1-CD1 4.46Å; V286-I355 PolarHBondContact O-N 3.23Å; I287-I355 CarbonylContact C-O 3.53Å; I287-I355 WeakPolarHBondContact CA-O 3.38Å; I287-I355 HydrophobicContact CG1-CB 4.18Å; I287-I355 HydrophobicContact CG1-CD1 4.4Å; I287-I355 HydrophobicContact CG2-CB 4.38Å; I287-I355 HydrophobicContact CG2-CG2 4.41Å; F288-I355 PolarHBondContact N-O 3.06Å; L353-I355 HydrophobicContact CD2-CD1 4.21Å; L353-I355 HydrophobicContact CD2-CG1 4.34Å; L353-I355 HydrophobicContact CG-CG1 4.17Å; I355-Y357 VanDerWaalsContact C-N 3.33Å; I355-Y357 PolarHBondContact O-N 3.2Å; I355-Y357 VanDerWaalsContact O-N 3.15Å; I355-I383 CarbonylContact C-O 3.55Å; I355-I383 WeakPolarHBondContact CA-O 3.46Å; I355-F385 HydrophobicContact CG2-CE1 4.48Å; I355-F385 HydrophobicContact CG2-CE2 4.18Å; I355-F385 HydrophobicContact CG2-CZ 4.17Å
356	N	97	Very high	88.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	86.4	165.9	-72.4	-40.6	0	0	0	107.7	D358 R369 I383 N384 F385	N356-D358 PolarHBondContact O-N 3.47Å; N356-R369 WeakPolarHBondContact OD1-CD 3.4Å; N356-R369 PolarHBondContact OD1-NH1 2.86Å; N356-I383 PolarHBondContact N-O 3.09Å; N356-N384 WeakPolarHBondContact CB-OD1 3.38Å; N356-N384 PolarHBondContact ND2-OD1 2.95Å; N356-F385 PolarHBondContact O-N 3.5Å
357	Y	96.9	Very high	88.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-61	-39.3	174.9	-166.7	-76.8	0	0	0	110	K269 F270 L273 I287 F288 K294 L298 I355 F385	K269-Y357 HydrophobicContact CB-CE1 3.84Å; K269-Y357 HydrophobicContact CB-CE2 3.79Å; K269-Y357 WeakPolarHBondContact CB-OH 3.15Å; K269-Y357 HydrophobicContact CD-CD1 3.98Å; K269-Y357 HydrophobicContact CD-CE1 3.68Å; K269-Y357 WeakPolarHBondContact CD-O 3.47Å; K269-Y357 WeakPolarHBondContact CE-O 3.27Å; K269-Y357 HydrophobicContact CG-CE1 4.42Å; K269-Y357 PolarHBondContact NZ-O 3.08Å; F270-Y357 PolarHBondContact N-OH 2.83Å; L273-Y357 HydrophobicContact CD2-CD2 4.14Å; L273-Y357 HydrophobicContact CD2-CE2 4.09Å; I287-Y357 HydrophobicContact CG2-CD2 4.43Å; F288-Y357 WeakPolarHBondContact O-CB 3.35Å; F288-Y357 PolarHBondContact O-N 3.46Å; F288-Y357 VanDerWaalsContact O-N 3.11Å; K294-Y357 VanDerWaalsContact CE-CE1 3.43Å; L298-Y357 HydrophobicContact CD1-CD2 4.38Å; L298-Y357 HydrophobicContact CD1-CE2 3.76Å; L298-Y357 HydrophobicContact CD2-CD2 3.68Å; L298-Y357 HydrophobicContact CD2-CE2 3.91Å; L298-Y357 HydrophobicContact CD2-CG 4.08Å; I355-Y357 VanDerWaalsContact C-N 3.33Å; I355-Y357 PolarHBondContact O-N 3.2Å; I355-Y357 VanDerWaalsContact O-N 3.15Å; Y357-F385 AromaticContact CD2-CD2 3.95Å; Y357-F385 HydrophobicContact CD2-CD2 3.95Å; Y357-F385 AromaticContact CD2-CE2 3.98Å; Y357-F385 HydrophobicContact CD2-CE2 3.98Å; Y357-F385 HydrophobicContact CE2-CD2 4.34Å; Y357-F385 HydrophobicContact CE2-CE2 4.26Å; Y357-F385 HydrophobicContact CG-CD2 4.28Å
358	D	95.5	Very high	89.4	Confident	16 Å²	16	25.8 Å²	25.8	9%	0.086	13%	0.131	C	C	.	.	S	Bend	trans	-113.4	137.7	164.2	-62.1	-38.4	0	0	0	109.7	K269 F288 N290 K294 N356 R369	K269-D358 IonicContact NZ-OD1 3.53Å; F288-D358 PolarHBondContact O-N 3.21Å; N290-D358 HydrophobicContact CB-CB 4.18Å; N290-D358 PolarHBondContact N-OD2 3.08Å; K294-D358 WeakPolarHBondContact CD-OD2 3.44Å; K294-D358 IonicContact NZ-OD1 2.94Å; K294-D358 PolarHBondContact NZ-OD1 3.21Å; K294-D358 IonicContact NZ-OD2 3.71Å; K294-D358 PolarHBondContact NZ-OD2 3.43Å; N356-D358 PolarHBondContact O-N 3.47Å; D358-R369 PolarHBondContact O-NH1 2.81Å
359	L	94.4	Very high	89.8	Confident	11 Å²	11	25.5 Å²	25.5	6%	0.058	13%	0.13	C	C	.	.			trans	-60.4	142.3	168.6	-76	-170.1	0	0	0	110.5	N290 N384 V386 D390 I393 L394	N290-L359 PolarHBondContact ND2-O 2.83Å; N290-L359 PolarHBondContact OD1-O 3.14Å; L359-N384 HydrophobicContact CD2-CB 3.98Å; L359-V386 HydrophobicContact CD1-CG1 3.8Å; L359-V386 HydrophobicContact CD2-CG1 4Å; L359-V386 HydrophobicContact CG-CG1 3.95Å; L359-D390 HydrophobicContact CD1-CB 3.85Å; L359-D390 WeakPolarHBondContact CD1-O 3.31Å; L359-I393 HydrophobicContact CD1-CB 4.19Å; L359-I393 HydrophobicContact CD1-CG2 4.24Å; L359-L394 HydrophobicContact CD1-CB 4.13Å; L359-L394 HydrophobicContact CD2-CD1 4.07Å
360	P	92.2	Very high	90.3	Very high	4 Å²	4	23.3 Å²	23.3	3%	0.026	12%	0.115	C	C	.	.			trans	-63.4	149.3	176.2	27.9	-34.2	0	0	0	111.2	N362 L365 Y366	P360-N362 PolarHBondContact O-N 2.85Å; P360-L365 HydrophobicContact CB-CB 3.7Å; P360-Y366 HydrophobicContact CG-CD2 3.94Å; P360-Y366 HydrophobicContact CG-CG 4.37Å
361	N	87.1	Confident	90.4	Very high	125 Å²	125	18 Å²	18	67%	0.668	9%	0.091	S	C	*	.	S	Bend	trans	-72.5	-14.3	-178.2	-62.2	-35.8	0	0	0	113.7	N290	N290-N361 PolarHBondContact ND2-OD1 3.47Å; N290-N361 VanDerWaalsContact ND2-OD1 3.11Å
362	N	85.1	Confident	90.2	Very high	51 Å²	51	18 Å²	18	27%	0.273	9%	0.09	S	C	.	.	S	Bend	trans	-142.4	166	175.5	68.9	25.6	0	0	0	111	P360 L365	P360-N362 PolarHBondContact O-N 2.85Å; N362-L365 WeakPolarHBondContact OD1-CB 3.49Å; N362-L365 WeakPolarHBondContact OD1-CD1 3.48Å; N362-L365 WeakPolarHBondContact OD1-CG 3.2Å; N362-L365 PolarHBondContact OD1-N 2.95Å
363	R	87.1	Confident	89.9	Confident	89 Å²	89	17 Å²	17	34%	0.336	8%	0.083	S	C	.	.	H	α-helix	trans	-71.2	-39.2	-173.4	-60.6	178.1	-178.7	169.3	-1.9	111	L365 Y366 D396 I397 Y400 Y401	R363-L365 PolarHBondContact O-N 3.2Å; R363-Y366 WeakPolarHBondContact O-CB 3.37Å; R363-Y366 PolarHBondContact O-N 3.15Å; R363-Y366 VanDerWaalsContact O-N 3.1Å; R363-D396 IonicContact NH2-OD2 3.03Å; R363-D396 PolarHBondContact NH2-OD2 3.43Å; R363-I397 HydrophobicContact CG-CG1 4.08Å; R363-Y400 VanDerWaalsContact NH1-CD2 3.34Å; R363-Y401 VanDerWaalsContact C-OH 3.25Å; R363-Y401 HydrophobicContact CB-CE2 4.04Å; R363-Y401 WeakPolarHBondContact O-CE2 3.5Å; R363-Y401 PolarHBondContact O-OH 3.37Å; R363-Y401 VanDerWaalsContact O-OH 3.12Å
364	E	83.8	Confident	89.2	Confident	37 Å²	37	17.4 Å²	17.4	17%	0.173	9%	0.086	C	C	.	.	H	α-helix	trans	-61.1	-44.5	-179	-65	71.3	-157.8	0	0	111.4	T225 P227 Y366 I367 H368 Y401	T225-E364 HydrophobicContact CG2-CB 4.12Å; T225-E364 HydrophobicContact CG2-CG 3.98Å; P227-E364 HydrophobicContact CG-CG 4.45Å; E364-Y366 PolarHBondContact O-N 3.49Å; E364-I367 PolarHBondContact O-N 3.43Å; E364-H368 PolarHBondContact O-CD2 3.28Å; E364-H368 PolarHBondContact O-N 3.1Å; E364-Y401 WeakPolarHBondContact CA-OH 3.32Å; E364-Y401 PolarHBondContact N-OH 2.97Å
365	L	87.7	Confident	88.3	Confident	13 Å²	13	18.1 Å²	18.1	7%	0.068	9%	0.089	C	C	.	.	H	α-helix	trans	-59.2	-30.2	177.7	-78.5	170.1	0	0	0	112.4	D340 A343 R344 P360 N362 R363 H368 R369	D340-L365 HydrophobicContact CB-CD2 4.15Å; A343-L365 HydrophobicContact CB-CD2 4.09Å; R344-L365 VanDerWaalsContact NH1-CD2 3.25Å; P360-L365 HydrophobicContact CB-CB 3.7Å; N362-L365 WeakPolarHBondContact OD1-CB 3.49Å; N362-L365 WeakPolarHBondContact OD1-CD1 3.48Å; N362-L365 WeakPolarHBondContact OD1-CG 3.2Å; N362-L365 PolarHBondContact OD1-N 2.95Å; R363-L365 PolarHBondContact O-N 3.2Å; L365-H368 PolarHBondContact O-N 3.43Å; L365-R369 WeakPolarHBondContact O-CB 3.45Å; L365-R369 WeakPolarHBondContact O-CG 3.42Å; L365-R369 PolarHBondContact O-N 2.9Å
366	Y	90.9	Very high	87.1	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-57.6	-53.5	176.7	-173.9	-96.2	0	0	0	111.7	Q258 P360 R363 E364 H368 R369 I370 N384 L394 I397 I405	Q258-Y366 PolarHBondContact OE1-OH 2.99Å; P360-Y366 HydrophobicContact CG-CD2 3.94Å; P360-Y366 HydrophobicContact CG-CG 4.37Å; R363-Y366 WeakPolarHBondContact O-CB 3.37Å; R363-Y366 PolarHBondContact O-N 3.15Å; R363-Y366 VanDerWaalsContact O-N 3.1Å; E364-Y366 PolarHBondContact O-N 3.49Å; Y366-H368 VanDerWaalsContact C-N 3.26Å; Y366-H368 PolarHBondContact O-N 2.77Å; Y366-R369 PolarHBondContact O-N 2.79Å; Y366-I370 HydrophobicContact CD1-CD1 4.03Å; Y366-I370 HydrophobicContact CD1-CG2 4.45Å; Y366-I370 HydrophobicContact CE1-CD1 3.62Å; Y366-I370 HydrophobicContact CE1-CG2 4.12Å; Y366-I370 HydrophobicContact CE2-CG2 4.31Å; Y366-I370 WeakPolarHBondContact O-CG2 3.21Å; Y366-I370 PolarHBondContact O-N 3.22Å; Y366-N384 VanDerWaalsContact CE2-OD1 3.28Å; Y366-N384 WeakPolarHBondContact CE2-OD1 3.35Å; Y366-N384 PolarHBondContact OH-ND2 2.98Å; Y366-N384 VanDerWaalsContact OH-ND2 3.14Å; Y366-L394 HydrophobicContact CE2-CD1 4.42Å; Y366-I397 HydrophobicContact CD1-CG2 3.5Å; Y366-I397 VanDerWaalsContact CD1-CG2 3.5Å; Y366-I397 HydrophobicContact CD2-CD1 3.98Å; Y366-I397 HydrophobicContact CD2-CG2 4.11Å; Y366-I397 HydrophobicContact CE1-CG2 3.82Å; Y366-I397 HydrophobicContact CE2-CG2 4.37Å; Y366-I397 HydrophobicContact CG-CD1 4.19Å; Y366-I397 HydrophobicContact CG-CG2 3.67Å; Y366-I405 HydrophobicContact CE1-CD1 4.4Å; Y366-I405 WeakPolarHBondContact OH-CD1 3.37Å
367	I	86.7	Confident	85.8	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-62.1	-35.6	179	-68.2	-64.8	0	0	0	111.6	E364 I370 G371 Y401	E364-I367 PolarHBondContact O-N 3.43Å; I367-I370 HydrophobicContact CD1-CD1 4.23Å; I367-G371 WeakPolarHBondContact O-CA 3.4Å; I367-G371 PolarHBondContact O-N 2.95Å; I367-Y401 HydrophobicContact CD1-CD1 4.26Å; I367-Y401 HydrophobicContact CD1-CD2 4.24Å; I367-Y401 HydrophobicContact CD1-CE1 4.38Å; I367-Y401 HydrophobicContact CD1-CE2 4.34Å; I367-Y401 HydrophobicContact CD1-CG 4.2Å; I367-Y401 HydrophobicContact CG1-CD1 4.09Å; I367-Y401 HydrophobicContact CG1-CD2 4.1Å; I367-Y401 HydrophobicContact CG1-CE1 3.71Å; I367-Y401 HydrophobicContact CG1-CE2 3.7Å; I367-Y401 HydrophobicContact CG1-CG 4.29Å
368	H	85.8	Confident	84.9	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.3	-47.3	177.1	-72.5	-68.8	0	0	0	112.5	E193 D195 T225 A343 R344 E364 L365 Y366 R372	E193-H368 IonicContact OE2-CE1 3.58Å; E193-H368 PolarHBondContact OE2-CE1 3.37Å; E193-H368 IonicContact OE2-ND1 3.19Å; D195-H368 IonicContact OD2-NE2 2.89Å; T225-H368 PolarHBondContact OG1-NE2 2.87Å; A343-H368 HydrophobicContact CB-CB 4.33Å; A343-H368 CarbonylContact O-C 3.54Å; A343-H368 WeakPolarHBondContact O-CB 3.35Å; R344-H368 HydrophobicContact CG-CB 3.84Å; R344-H368 VanDerWaalsContact CZ-CD2 3.41Å; R344-H368 PolarHBondContact NE-CD2 3.41Å; R344-H368 PolarHBondContact NE-CE1 3.08Å; R344-H368 VanDerWaalsContact NE-CE1 3.28Å; R344-H368 PolarHBondContact NE-NE2 2.81Å; R344-H368 PolarHBondContact NH2-CD2 3.12Å; R344-H368 PolarHBondContact NH2-NE2 2.75Å; E364-H368 PolarHBondContact O-CD2 3.28Å; E364-H368 PolarHBondContact O-N 3.1Å; L365-H368 PolarHBondContact O-N 3.43Å; Y366-H368 VanDerWaalsContact C-N 3.26Å; Y366-H368 PolarHBondContact O-N 2.77Å; H368-R372 PolarHBondContact O-N 2.91Å; H368-R372 PolarHBondContact O-NE 3.43Å; H368-R372 VanDerWaalsContact O-NE 3.12Å
369	R	91.4	Very high	84.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-56.1	177.5	-73.9	-173.9	-176.4	-175.2	2.3	111.2	F288 N290 D340 A343 N356 D358 L365 Y366 G371 R372	F288-R369 HydrophobicContact CD1-CG 4.14Å; F288-R369 HydrophobicContact CD2-CB 3.81Å; F288-R369 HydrophobicContact CD2-CG 3.7Å; F288-R369 HydrophobicContact CE1-CG 4.24Å; F288-R369 HydrophobicContact CE2-CB 3.75Å; F288-R369 HydrophobicContact CE2-CG 3.81Å; F288-R369 HydrophobicContact CG-CB 4.47Å; F288-R369 HydrophobicContact CG-CG 3.87Å; F288-R369 HydrophobicContact CZ-CB 4.38Å; F288-R369 HydrophobicContact CZ-CG 4.08Å; N290-R369 PolarHBondContact OD1-NH2 2.85Å; D340-R369 VanDerWaalsContact CG-NH2 3.25Å; D340-R369 IonicContact OD1-CZ 2.81Å; D340-R369 IonicContact OD1-NE 3.98Å; D340-R369 PolarHBondContact OD1-NE 3.3Å; D340-R369 IonicContact OD1-NH2 2.7Å; D340-R369 PolarHBondContact OD1-NH2 2.99Å; D340-R369 IonicContact OD2-CZ 3.88Å; D340-R369 IonicContact OD2-NH2 2.68Å; D340-R369 PolarHBondContact OD2-NH2 3.3Å; A343-R369 HydrophobicContact CB-CG 3.76Å; N356-R369 WeakPolarHBondContact OD1-CD 3.4Å; N356-R369 PolarHBondContact OD1-NH1 2.86Å; D358-R369 PolarHBondContact O-NH1 2.81Å; L365-R369 WeakPolarHBondContact O-CB 3.45Å; L365-R369 WeakPolarHBondContact O-CG 3.42Å; L365-R369 PolarHBondContact O-N 2.9Å; Y366-R369 PolarHBondContact O-N 2.79Å; R369-G371 VanDerWaalsContact C-N 3.27Å; R369-G371 PolarHBondContact O-N 2.8Å; R369-R372 VanDerWaalsContact O-CB 3.28Å; R369-R372 WeakPolarHBondContact O-CB 3.44Å; R369-R372 WeakPolarHBondContact O-CG 3.28Å; R369-R372 PolarHBondContact O-N 2.64Å
370	I	90.8	Very high	84.1	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-35.8	-176.7	74.4	177.7	0	0	0	111.2	I256 Q258 Y366 I367 R372 S373 A382	I256-I370 HydrophobicContact CD1-CG1 4.39Å; I256-I370 VanDerWaalsContact CD1-O 3.31Å; I256-I370 WeakPolarHBondContact CD1-O 3.48Å; Q258-I370 HydrophobicContact CG-CD1 4.29Å; Y366-I370 HydrophobicContact CD1-CD1 4.03Å; Y366-I370 HydrophobicContact CD1-CG2 4.45Å; Y366-I370 HydrophobicContact CE1-CD1 3.62Å; Y366-I370 HydrophobicContact CE1-CG2 4.12Å; Y366-I370 HydrophobicContact CE2-CG2 4.31Å; Y366-I370 WeakPolarHBondContact O-CG2 3.21Å; Y366-I370 PolarHBondContact O-N 3.22Å; I367-I370 HydrophobicContact CD1-CD1 4.23Å; I370-R372 PolarHBondContact O-N 2.94Å; I370-S373 PolarHBondContact O-N 3.21Å; I370-S373 PolarHBondContact O-OG 3.01Å; I370-A382 HydrophobicContact CB-CB 3.85Å; I370-A382 HydrophobicContact CG2-CB 3.52Å
371	G	86.3	Confident	84.1	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	6.5	175.4	0	0	0	0	0	115.1	I367 R369 S373	I367-G371 WeakPolarHBondContact O-CA 3.4Å; I367-G371 PolarHBondContact O-N 2.95Å; R369-G371 VanDerWaalsContact C-N 3.27Å; R369-G371 PolarHBondContact O-N 2.8Å; G371-S373 VanDerWaalsContact C-N 3.3Å; G371-S373 CarbonylContact C-O 3.47Å
372	R	85	Confident	84.4	Confident	6 Å²	6	34.1 Å²	34.1	2%	0.023	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-27.9	161.5	-67.1	-47.8	87.4	-179.7	5.8	111.8	F288 W342 A343 L346 I354 H368 R369 I370	F288-R372 HydrophobicContact CE2-CG 4.27Å; F288-R372 HydrophobicContact CZ-CG 4.01Å; W342-R372 WeakPolarHBondContact O-CD 3.17Å; A343-R372 PolarHBondContact O-NE 2.62Å; A343-R372 VanDerWaalsContact O-NE 3.08Å; L346-R372 PolarHBondContact O-NH1 3.43Å; I354-R372 HydrophobicContact CD1-CB 3.6Å; I354-R372 HydrophobicContact CG1-CB 4.42Å; H368-R372 PolarHBondContact O-N 2.91Å; H368-R372 PolarHBondContact O-NE 3.43Å; H368-R372 VanDerWaalsContact O-NE 3.12Å; R369-R372 VanDerWaalsContact O-CB 3.28Å; R369-R372 WeakPolarHBondContact O-CB 3.44Å; R369-R372 WeakPolarHBondContact O-CG 3.28Å; R369-R372 PolarHBondContact O-N 2.64Å; I370-R372 PolarHBondContact O-N 2.94Å
373	S	83.1	Confident	84.8	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.007	15%	0.154	C	C	.	.	S	Bend	trans	-91.9	176.6	167.9	71.6	0	0	0	0	111.6	V351 I370 G371 R375	V351-S373 WeakPolarHBondContact O-CA 3.45Å; I370-S373 PolarHBondContact O-N 3.21Å; I370-S373 PolarHBondContact O-OG 3.01Å; G371-S373 VanDerWaalsContact C-N 3.3Å; G371-S373 CarbonylContact C-O 3.47Å; S373-R375 VanDerWaalsContact C-N 3.25Å; S373-R375 PolarHBondContact O-N 3.11Å
374	G	76.1	Confident	85.3	Confident	7 Å²	7	27.4 Å²	27.4	7%	0.072	14%	0.138	C	C	.	.	S	Bend	trans	64.2	25.9	171.6	0	0	0	0	0	115.1	R378	G374-R378 CarbonylContact C-O 3.23Å; G374-R378 WeakPolarHBondContact CA-O 3.41Å
375	R	76.1	Confident	85.9	Confident	15 Å²	15	25.7 Å²	25.7	6%	0.057	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-67.8	142.7	-176.2	-69.8	-178	158.1	-103	-6.3	111.9	L346 D347 S373 G377 R378	L346-R375 PolarHBondContact O-NH2 3.43Å; D347-R375 WeakPolarHBondContact OD1-CD 3.2Å; D347-R375 IonicContact OD1-CZ 3.94Å; D347-R375 VanDerWaalsContact OD1-CZ 3.3Å; D347-R375 IonicContact OD1-NE 3.64Å; D347-R375 PolarHBondContact OD1-NE 3.26Å; D347-R375 IonicContact OD1-NH1 3.75Å; D347-R375 PolarHBondContact OD1-NH1 3.11Å; D347-R375 IonicContact OD2-NH1 3.32Å; D347-R375 PolarHBondContact OD2-NH1 3.3Å; S373-R375 VanDerWaalsContact C-N 3.25Å; S373-R375 PolarHBondContact O-N 3.11Å; R375-G377 PolarHBondContact O-N 2.7Å; R375-R378 VanDerWaalsContact O-CB 3.32Å; R375-R378 WeakPolarHBondContact O-CB 3.43Å; R375-R378 VanDerWaalsContact O-CG 3.24Å; R375-R378 WeakPolarHBondContact O-CG 3.38Å; R375-R378 PolarHBondContact O-N 3.36Å; R375-R378 VanDerWaalsContact O-N 3.11Å
376	Y	69.9	Low	86.3	Confident	111 Å²	111	25 Å²	25	44%	0.435	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	52.4	37.5	-179	-58.7	-79.4	0	0	0	113.7	F63 G90 R378	F63-Y376 HydrophobicContact CE1-CE1 4.48Å; G90-Y376 PolarHBondContact O-N 3.19Å; Y376-R378 VanDerWaalsContact C-N 3.28Å; Y376-R378 PolarHBondContact O-N 2.73Å
377	G	69.1	Low	86.4	Confident	71 Å²	71	28.1 Å²	28.1	73%	0.732	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	77.6	9.2	178.2	0	0	0	0	0	114.6	R375	R375-G377 PolarHBondContact O-N 2.7Å
378	R	79.7	Confident	86.4	Confident	119 Å²	119	32.8 Å²	32.8	45%	0.449	17%	0.165	S	C	.	.			trans	-62.5	154.5	168.4	-69.2	176.1	-176	-165.3	-3.8	110	P349 G374 R375 Y376	P349-R378 VanDerWaalsContact C-NH1 3.26Å; P349-R378 VanDerWaalsContact CB-NH1 3.27Å; P349-R378 PolarHBondContact O-NH1 3.06Å; G374-R378 CarbonylContact C-O 3.23Å; G374-R378 WeakPolarHBondContact CA-O 3.41Å; R375-R378 VanDerWaalsContact O-CB 3.32Å; R375-R378 WeakPolarHBondContact O-CB 3.43Å; R375-R378 VanDerWaalsContact O-CG 3.24Å; R375-R378 WeakPolarHBondContact O-CG 3.38Å; R375-R378 PolarHBondContact O-N 3.36Å; R375-R378 VanDerWaalsContact O-N 3.11Å; Y376-R378 VanDerWaalsContact C-N 3.28Å; Y376-R378 PolarHBondContact O-N 2.73Å
379	K	84.3	Confident	86.4	Confident	184 Å²	184	39.4 Å²	39.4	80%	0.8	20%	0.201	S	C	*	.			trans	-73.3	144.3	170	-64.5	-177.5	-179.1	177.6	0	109.7	G255	G255-K379 CarbonylContact O-C 3.55Å; G255-K379 VanDerWaalsContact O-CA 3.29Å; G255-K379 WeakPolarHBondContact O-CA 3.47Å
380	G	88.4	Confident	86.2	Confident	4 Å²	4	41 Å²	41	4%	0.041	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	163.3	174.3	0	0	0	0	0	111	G255 I256 K257 S352	G255-G380 PolarHBondContact O-N 3.37Å; I256-G380 CarbonylContact C-O 3.55Å; I256-G380 VanDerWaalsContact CA-O 3.32Å; I256-G380 WeakPolarHBondContact CA-O 3.36Å; K257-G380 PolarHBondContact N-O 3.48Å; S352-G380 CarbonylContact O-C 3.51Å; S352-G380 VanDerWaalsContact O-CA 3.29Å; S352-G380 WeakPolarHBondContact O-CA 3.48Å
381	V	90.9	Very high	86.1	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.9	174.6	179.2	0	0	0	0	109.2	K257 F259 S352 L353 I354 I383 I416	K257-V381 HydrophobicContact CB-CG2 4.43Å; K257-V381 CarbonylContact O-C 3.58Å; K257-V381 WeakPolarHBondContact O-CA 3.45Å; F259-V381 HydrophobicContact CD2-CG1 3.77Å; F259-V381 HydrophobicContact CE2-CG1 3.94Å; S352-V381 PolarHBondContact O-N 2.85Å; L353-V381 CarbonylContact C-O 3.51Å; L353-V381 WeakPolarHBondContact CA-O 3.31Å; L353-V381 HydrophobicContact CD1-CB 3.98Å; L353-V381 HydrophobicContact CD1-CG1 3.95Å; I354-V381 PolarHBondContact N-O 3.48Å; V381-I383 HydrophobicContact CG1-CD1 4.45Å; V381-I383 HydrophobicContact CG1-CG1 3.97Å; V381-I416 HydrophobicContact CB-CG1 4.28Å; V381-I416 HydrophobicContact CG2-CD1 4.49Å; V381-I416 HydrophobicContact CG2-CG1 3.75Å
382	A	93.5	Very high	86.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.2	173.3	0	0	0	0	0	109.6	I256 K257 Q258 F259 I354 I370	I256-A382 HydrophobicContact CG2-CB 4.01Å; K257-A382 PolarHBondContact O-N 2.92Å; Q258-A382 CarbonylContact C-O 3.59Å; Q258-A382 WeakPolarHBondContact CA-O 3.38Å; Q258-A382 HydrophobicContact CG-CB 4.29Å; F259-A382 PolarHBondContact N-O 2.92Å; I354-A382 HydrophobicContact CB-CB 4.46Å; I354-A382 CarbonylContact O-C 3.43Å; I354-A382 WeakPolarHBondContact O-CA 3.37Å; I370-A382 HydrophobicContact CB-CB 3.85Å; I370-A382 HydrophobicContact CG2-CB 3.52Å
383	I	95.2	Very high	86.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.2	179.2	-54.1	178.3	0	0	0	108.9	V261 L276 L353 I354 I355 N356 V381 F385 M408	V261-I383 HydrophobicContact CG2-CG2 3.94Å; L276-I383 HydrophobicContact CD1-CD1 3.93Å; L276-I383 HydrophobicContact CD1-CG2 4.3Å; L276-I383 HydrophobicContact CD2-CD1 3.91Å; L353-I383 HydrophobicContact CD1-CD1 3.86Å; L353-I383 HydrophobicContact CD1-CG1 4.03Å; I354-I383 PolarHBondContact O-N 3.18Å; I355-I383 CarbonylContact C-O 3.55Å; I355-I383 WeakPolarHBondContact CA-O 3.46Å; N356-I383 PolarHBondContact N-O 3.09Å; V381-I383 HydrophobicContact CG1-CD1 4.45Å; V381-I383 HydrophobicContact CG1-CG1 3.97Å; I383-F385 HydrophobicContact CG2-CD1 4.25Å; I383-F385 HydrophobicContact CG2-CE1 3.98Å; I383-M408 HydrophobicContact CD1-SD 4.02Å; I383-M408 HydrophobicContact CG2-SD 4.05Å
384	N	96.8	Very high	86.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	118.3	-176.2	-58.3	-73.8	0	0	0	110.3	F259 F260 V261 N356 L359 Y366 V386 L394	F259-N384 WeakPolarHBondContact O-CB 3.46Å; F259-N384 PolarHBondContact O-N 3.02Å; F259-N384 PolarHBondContact O-ND2 3.32Å; F260-N384 CarbonylContact C-O 3.51Å; F260-N384 WeakPolarHBondContact CA-O 3.19Å; F260-N384 HydrophobicContact CB-CB 4.16Å; V261-N384 PolarHBondContact N-O 2.88Å; N356-N384 WeakPolarHBondContact CB-OD1 3.38Å; N356-N384 PolarHBondContact ND2-OD1 2.95Å; L359-N384 HydrophobicContact CD2-CB 3.98Å; Y366-N384 VanDerWaalsContact CE2-OD1 3.28Å; Y366-N384 WeakPolarHBondContact CE2-OD1 3.35Å; Y366-N384 PolarHBondContact OH-ND2 2.98Å; Y366-N384 VanDerWaalsContact OH-ND2 3.14Å; N384-V386 HydrophobicContact CB-CG1 4.37Å; N384-L394 HydrophobicContact CB-CD1 4.24Å
385	F	96.7	Very high	87.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	117.2	172.3	-67	-11.2	0	0	0	109.7	V261 K269 T272 L273 L276 I355 N356 Y357 I383	V261-F385 HydrophobicContact CB-CD1 4.04Å; V261-F385 HydrophobicContact CB-CE1 4.3Å; V261-F385 HydrophobicContact CG2-CD1 4.31Å; V261-F385 HydrophobicContact CG2-CE1 4.2Å; K269-F385 HydrophobicContact CB-CD2 3.71Å; K269-F385 HydrophobicContact CB-CE2 4.16Å; K269-F385 HydrophobicContact CD-CB 3.82Å; K269-F385 HydrophobicContact CD-CD2 4.06Å; K269-F385 HydrophobicContact CD-CG 4.43Å; K269-F385 HydrophobicContact CG-CB 3.99Å; K269-F385 HydrophobicContact CG-CD2 3.86Å; K269-F385 HydrophobicContact CG-CG 4.26Å; K269-F385 WeakPolarHBondContact O-CE2 3.07Å; T272-F385 HydrophobicContact CG2-CD1 4.4Å; T272-F385 HydrophobicContact CG2-CE1 3.54Å; T272-F385 HydrophobicContact CG2-CZ 3.61Å; L273-F385 HydrophobicContact CB-CE2 4.08Å; L273-F385 HydrophobicContact CB-CZ 4.29Å; L273-F385 HydrophobicContact CD1-CE2 4.48Å; L273-F385 HydrophobicContact CD1-CZ 4.5Å; L276-F385 HydrophobicContact CD1-CE1 3.88Å; L276-F385 HydrophobicContact CD1-CZ 3.86Å; I355-F385 HydrophobicContact CG2-CE1 4.48Å; I355-F385 HydrophobicContact CG2-CE2 4.18Å; I355-F385 HydrophobicContact CG2-CZ 4.17Å; N356-F385 PolarHBondContact O-N 3.5Å; Y357-F385 AromaticContact CD2-CD2 3.95Å; Y357-F385 HydrophobicContact CD2-CD2 3.95Å; Y357-F385 AromaticContact CD2-CE2 3.98Å; Y357-F385 HydrophobicContact CD2-CE2 3.98Å; Y357-F385 HydrophobicContact CE2-CD2 4.34Å; Y357-F385 HydrophobicContact CE2-CE2 4.26Å; Y357-F385 HydrophobicContact CG-CD2 4.28Å; I383-F385 HydrophobicContact CG2-CD1 4.25Å; I383-F385 HydrophobicContact CG2-CE1 3.98Å
386	V	95.1	Very high	88.4	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.2	-175.1	-61.9	0	0	0	0	110.6	F260 V261 A262 V263 L359 N384 D390 I391 L394	F260-V386 HydrophobicContact CB-CG2 4.18Å; F260-V386 HydrophobicContact CD2-CG2 3.65Å; F260-V386 HydrophobicContact CG-CG2 4.27Å; V261-V386 PolarHBondContact O-N 2.89Å; A262-V386 WeakPolarHBondContact CA-O 3.46Å; A262-V386 HydrophobicContact CB-CG2 4.49Å; V263-V386 WeakPolarHBondContact CG2-O 3.28Å; V263-V386 PolarHBondContact N-O 3.21Å; L359-V386 HydrophobicContact CD1-CG1 3.8Å; L359-V386 HydrophobicContact CD2-CG1 4Å; L359-V386 HydrophobicContact CG-CG1 3.95Å; N384-V386 HydrophobicContact CB-CG1 4.37Å; V386-D390 HydrophobicContact CB-CB 4.06Å; V386-D390 HydrophobicContact CG1-CB 4.41Å; V386-I391 HydrophobicContact CB-CG1 4.46Å; V386-I391 HydrophobicContact CG2-CG1 4.06Å; V386-L394 HydrophobicContact CG1-CB 4.33Å; V386-L394 HydrophobicContact CG1-CD2 3.93Å
387	K	93.3	Very high	89.4	Confident	64 Å²	64	59.1 Å²	59.1	28%	0.278	29%	0.289	S	S	.	.			trans	-83.7	169.8	164.1	-66	-177.9	-59.3	-159.5	0	110.4	V263 E266 D389 D390 I391	V263-K387 HydrophobicContact CG2-CG 4.03Å; V263-K387 WeakPolarHBondContact O-CA 3.34Å; E266-K387 HydrophobicContact CB-CD 4.45Å; E266-K387 WeakPolarHBondContact OE2-CD 3.42Å; E266-K387 WeakPolarHBondContact OE2-CE 3.01Å; E266-K387 IonicContact OE2-NZ 2.76Å; E266-K387 PolarHBondContact OE2-NZ 3.29Å; K387-D389 PolarHBondContact O-N 3.49Å; K387-D389 VanDerWaalsContact O-N 3.11Å; K387-D390 WeakPolarHBondContact CB-OD2 3.48Å; K387-D390 PolarHBondContact N-OD2 3.32Å; K387-D390 VanDerWaalsContact N-OD2 3.08Å; K387-D390 WeakPolarHBondContact O-CA 3.37Å; K387-D390 WeakPolarHBondContact O-CB 3.24Å; K387-D390 PolarHBondContact O-N 3.08Å; K387-I391 PolarHBondContact O-N 3.34Å
388	N	86.6	Confident	90.4	Very high	102 Å²	102	57.3 Å²	57.3	55%	0.545	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-40.7	179.2	-65.7	-17.8	0	0	0	113.4
389	D	85.3	Confident	90.9	Very high	140 Å²	140	59 Å²	59	75%	0.749	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-26.8	179.4	-60.8	-31	0	0	0	113.1	K387	K387-D389 PolarHBondContact O-N 3.49Å; K387-D389 VanDerWaalsContact O-N 3.11Å
390	D	88.6	Confident	91	Very high	32 Å²	32	53.3 Å²	53.3	17%	0.171	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-19.7	-176.4	-62.4	-34.9	0	0	0	112.4	L359 V386 K387 R392 I393 L394	L359-D390 HydrophobicContact CD1-CB 3.85Å; L359-D390 WeakPolarHBondContact CD1-O 3.31Å; V386-D390 HydrophobicContact CB-CB 4.06Å; V386-D390 HydrophobicContact CG1-CB 4.41Å; K387-D390 WeakPolarHBondContact CB-OD2 3.48Å; K387-D390 PolarHBondContact N-OD2 3.32Å; K387-D390 VanDerWaalsContact N-OD2 3.08Å; K387-D390 WeakPolarHBondContact O-CA 3.37Å; K387-D390 WeakPolarHBondContact O-CB 3.24Å; K387-D390 PolarHBondContact O-N 3.08Å; D390-R392 PolarHBondContact O-N 3.42Å; D390-I393 WeakPolarHBondContact O-CB 3.15Å; D390-I393 PolarHBondContact O-N 3.41Å; D390-L394 PolarHBondContact O-N 3.45Å
391	I	87.4	Confident	90.9	Very high	57 Å²	57	53.2 Å²	53.2	29%	0.292	25%	0.246	S	C	.	.	H	α-helix	trans	-57	-38.1	-178.6	-67.3	172.2	0	0	0	111.1	V386 K387 I393 L394 R395	V386-I391 HydrophobicContact CB-CG1 4.46Å; V386-I391 HydrophobicContact CG2-CG1 4.06Å; K387-I391 PolarHBondContact O-N 3.34Å; I391-I393 PolarHBondContact O-N 2.88Å; I391-L394 PolarHBondContact O-N 3.02Å; I391-R395 HydrophobicContact CG2-CG 4.28Å; I391-R395 WeakPolarHBondContact O-CG 3.38Å; I391-R395 PolarHBondContact O-N 3Å
392	R	89.1	Confident	90.7	Very high	204 Å²	204	56.7 Å²	56.7	77%	0.77	27%	0.271	S	S	*	.	H	α-helix	trans	-62.6	-43.3	177.7	-67.2	-177.3	-178.2	176.2	1.7	111.6	D390 L394 R395 D396	D390-R392 PolarHBondContact O-N 3.42Å; R392-L394 VanDerWaalsContact C-N 3.3Å; R392-L394 PolarHBondContact O-N 3.04Å; R392-R395 PolarHBondContact O-N 2.97Å; R392-D396 WeakPolarHBondContact O-CB 3.42Å; R392-D396 PolarHBondContact O-N 3.34Å
393	I	91.4	Very high	90.5	Very high	79 Å²	79	57.9 Å²	57.9	41%	0.405	28%	0.278	S	S	.	.	H	α-helix	trans	-63.3	-41	178.2	-58.4	173.7	0	0	0	110.1	L359 D390 I391 D396 I397	L359-I393 HydrophobicContact CD1-CB 4.19Å; L359-I393 HydrophobicContact CD1-CG2 4.24Å; D390-I393 WeakPolarHBondContact O-CB 3.15Å; D390-I393 PolarHBondContact O-N 3.41Å; I391-I393 PolarHBondContact O-N 2.88Å; I393-D396 WeakPolarHBondContact O-CB 3.49Å; I393-D396 PolarHBondContact O-N 3.09Å; I393-I397 HydrophobicContact CG2-CD1 4.27Å; I393-I397 WeakPolarHBondContact O-CG1 3.43Å; I393-I397 PolarHBondContact O-N 3.19Å; I393-I397 VanDerWaalsContact O-N 3.08Å
394	L	92.4	Very high	90.2	Very high	2 Å²	2	63.9 Å²	63.9	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-64.4	-45.3	177.1	-171.9	70	0	0	0	112.2	F260 L359 Y366 N384 V386 D390 I391 R392 D396 I397 E398 I405	F260-L394 HydrophobicContact CB-CD2 3.48Å; F260-L394 VanDerWaalsContact CB-CD2 3.48Å; F260-L394 HydrophobicContact CD1-CD2 3.87Å; F260-L394 HydrophobicContact CD2-CD2 4.47Å; F260-L394 HydrophobicContact CG-CD2 3.69Å; L359-L394 HydrophobicContact CD1-CB 4.13Å; L359-L394 HydrophobicContact CD2-CD1 4.07Å; Y366-L394 HydrophobicContact CE2-CD1 4.42Å; N384-L394 HydrophobicContact CB-CD1 4.24Å; V386-L394 HydrophobicContact CG1-CB 4.33Å; V386-L394 HydrophobicContact CG1-CD2 3.93Å; D390-L394 PolarHBondContact O-N 3.45Å; I391-L394 PolarHBondContact O-N 3.02Å; R392-L394 VanDerWaalsContact C-N 3.3Å; R392-L394 PolarHBondContact O-N 3.04Å; L394-D396 VanDerWaalsContact C-N 3.32Å; L394-D396 PolarHBondContact O-N 2.95Å; L394-I397 WeakPolarHBondContact O-CB 3.17Å; L394-I397 PolarHBondContact O-N 2.86Å; L394-E398 PolarHBondContact O-N 2.94Å; L394-I405 HydrophobicContact CD1-CD1 3.56Å; L394-I405 HydrophobicContact CD1-CG2 4.26Å; L394-I405 HydrophobicContact CD2-CG2 4.08Å; L394-I405 HydrophobicContact CG-CD1 4.01Å; L394-I405 HydrophobicContact CG-CG2 4.43Å
395	R	90.9	Very high	90.1	Very high	107 Å²	107	63.9 Å²	63.9	40%	0.404	31%	0.306	S	S	.	.	H	α-helix	trans	-65.2	-35.9	177.6	-67.1	-61	-177.6	-167	-4.5	112.2	I391 R392 I397 E398 Q399	I391-R395 HydrophobicContact CG2-CG 4.28Å; I391-R395 WeakPolarHBondContact O-CG 3.38Å; I391-R395 PolarHBondContact O-N 3Å; R392-R395 PolarHBondContact O-N 2.97Å; R395-I397 VanDerWaalsContact C-N 3.34Å; R395-I397 PolarHBondContact O-N 3.2Å; R395-E398 WeakPolarHBondContact CD-OE2 3.34Å; R395-E398 IonicContact CZ-OE2 3.66Å; R395-E398 IonicContact NE-OE2 3.66Å; R395-E398 IonicContact NH1-OE1 2.84Å; R395-E398 PolarHBondContact NH1-OE1 3.27Å; R395-E398 IonicContact NH1-OE2 3.55Å; R395-E398 PolarHBondContact NH1-OE2 2.84Å; R395-E398 WeakPolarHBondContact O-CB 3.43Å; R395-E398 PolarHBondContact O-N 3.33Å; R395-Q399 WeakPolarHBondContact O-CB 3.44Å; R395-Q399 PolarHBondContact O-N 3.47Å
396	D	91.2	Very high	89.9	Confident	72 Å²	72	67 Å²	67	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-42.3	171.5	-90.5	23.9	0	0	0	112.2	R363 R392 I393 L394 Y400	R363-D396 IonicContact NH2-OD2 3.03Å; R363-D396 PolarHBondContact NH2-OD2 3.43Å; R392-D396 WeakPolarHBondContact O-CB 3.42Å; R392-D396 PolarHBondContact O-N 3.34Å; I393-D396 WeakPolarHBondContact O-CB 3.49Å; I393-D396 PolarHBondContact O-N 3.09Å; L394-D396 VanDerWaalsContact C-N 3.32Å; L394-D396 PolarHBondContact O-N 2.95Å; D396-Y400 WeakPolarHBondContact O-CB 3.5Å; D396-Y400 PolarHBondContact O-N 2.76Å
397	I	91.1	Very high	89.8	Confident	2 Å²	2	73.6 Å²	73.6	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-64.7	-46.9	175.5	-70.1	165.7	0	0	0	110.1	R363 Y366 I393 L394 R395 Q399 Y400 Y401	R363-I397 HydrophobicContact CG-CG1 4.08Å; Y366-I397 HydrophobicContact CD1-CG2 3.5Å; Y366-I397 VanDerWaalsContact CD1-CG2 3.5Å; Y366-I397 HydrophobicContact CD2-CD1 3.98Å; Y366-I397 HydrophobicContact CD2-CG2 4.11Å; Y366-I397 HydrophobicContact CE1-CG2 3.82Å; Y366-I397 HydrophobicContact CE2-CG2 4.37Å; Y366-I397 HydrophobicContact CG-CD1 4.19Å; Y366-I397 HydrophobicContact CG-CG2 3.67Å; I393-I397 HydrophobicContact CG2-CD1 4.27Å; I393-I397 WeakPolarHBondContact O-CG1 3.43Å; I393-I397 PolarHBondContact O-N 3.19Å; I393-I397 VanDerWaalsContact O-N 3.08Å; L394-I397 WeakPolarHBondContact O-CB 3.17Å; L394-I397 PolarHBondContact O-N 2.86Å; R395-I397 VanDerWaalsContact C-N 3.34Å; R395-I397 PolarHBondContact O-N 3.2Å; I397-Q399 PolarHBondContact O-N 2.76Å; I397-Y400 PolarHBondContact O-N 3.22Å; I397-Y401 HydrophobicContact CG2-CD2 3.92Å; I397-Y401 HydrophobicContact CG2-CE2 4.28Å; I397-Y401 WeakPolarHBondContact O-CD2 3.48Å; I397-Y401 PolarHBondContact O-N 3.21Å; I397-Y401 VanDerWaalsContact O-N 3.09Å
398	E	90.8	Very high	89.6	Confident	32 Å²	32	72.9 Å²	72.9	15%	0.15	35%	0.352	C	S	.	.	H	α-helix	trans	-56.4	-50.9	179.2	-171.9	-179.8	-140.8	0	0	111.5	L394 R395 S402 T403 I405	L394-E398 PolarHBondContact O-N 2.94Å; R395-E398 WeakPolarHBondContact CD-OE2 3.34Å; R395-E398 IonicContact CZ-OE2 3.66Å; R395-E398 IonicContact NE-OE2 3.66Å; R395-E398 IonicContact NH1-OE1 2.84Å; R395-E398 PolarHBondContact NH1-OE1 3.27Å; R395-E398 IonicContact NH1-OE2 3.55Å; R395-E398 PolarHBondContact NH1-OE2 2.84Å; R395-E398 WeakPolarHBondContact O-CB 3.43Å; R395-E398 PolarHBondContact O-N 3.33Å; E398-S402 WeakPolarHBondContact O-CA 3.35Å; E398-S402 PolarHBondContact O-N 3.37Å; E398-T403 HydrophobicContact CG-CG2 4.35Å; E398-T403 WeakPolarHBondContact CG-O 3.38Å; E398-T403 PolarHBondContact O-N 2.92Å; E398-T403 VanDerWaalsContact O-N 3.08Å; E398-I405 HydrophobicContact CB-CD1 4.13Å; E398-I405 HydrophobicContact CB-CG1 4.33Å; E398-I405 HydrophobicContact CG-CG1 4.27Å; E398-I405 PolarHBondContact OE1-N 2.95Å
399	Q	90.3	Very high	89.5	Confident	156 Å²	156	70.6 Å²	70.6	73%	0.729	34%	0.343	S	S	*	.	H	α-helix	trans	-65	-42.2	178.4	-174.5	-179.8	4.7	0	0	112.1	R395 I397 Y401 S402	R395-Q399 WeakPolarHBondContact O-CB 3.44Å; R395-Q399 PolarHBondContact O-N 3.47Å; I397-Q399 PolarHBondContact O-N 2.76Å; Q399-Y401 PolarHBondContact O-N 3.38Å; Q399-S402 PolarHBondContact O-N 2.76Å
400	Y	86.5	Confident	89	Confident	63 Å²	63	72.9 Å²	72.9	25%	0.247	35%	0.351	C	S	.	.	H	α-helix	trans	-65.3	-39.5	-176.4	-178.5	-92.1	0	0	0	112.7	R363 D396 I397	R363-Y400 VanDerWaalsContact NH1-CD2 3.34Å; D396-Y400 WeakPolarHBondContact O-CB 3.5Å; D396-Y400 PolarHBondContact O-N 2.76Å; I397-Y400 PolarHBondContact O-N 3.22Å
401	Y	85.7	Confident	88	Confident	2 Å²	2	76.7 Å²	76.7	1%	0.008	37%	0.371	C	S	.	.	H	α-helix	trans	-93.5	1.1	179.9	-70.5	-63.7	0	0	0	113.6	L251 T252 R363 E364 I367 I397 Q399 T403	L251-Y401 HydrophobicContact CB-CD1 4.5Å; L251-Y401 HydrophobicContact CD1-CE1 4.42Å; T252-Y401 VanDerWaalsContact CG2-O 3.31Å; T252-Y401 WeakPolarHBondContact CG2-O 3.45Å; R363-Y401 VanDerWaalsContact C-OH 3.25Å; R363-Y401 HydrophobicContact CB-CE2 4.04Å; R363-Y401 WeakPolarHBondContact O-CE2 3.5Å; R363-Y401 PolarHBondContact O-OH 3.37Å; R363-Y401 VanDerWaalsContact O-OH 3.12Å; E364-Y401 WeakPolarHBondContact CA-OH 3.32Å; E364-Y401 PolarHBondContact N-OH 2.97Å; I367-Y401 HydrophobicContact CD1-CD1 4.26Å; I367-Y401 HydrophobicContact CD1-CD2 4.24Å; I367-Y401 HydrophobicContact CD1-CE1 4.38Å; I367-Y401 HydrophobicContact CD1-CE2 4.34Å; I367-Y401 HydrophobicContact CD1-CG 4.2Å; I367-Y401 HydrophobicContact CG1-CD1 4.09Å; I367-Y401 HydrophobicContact CG1-CD2 4.1Å; I367-Y401 HydrophobicContact CG1-CE1 3.71Å; I367-Y401 HydrophobicContact CG1-CE2 3.7Å; I367-Y401 HydrophobicContact CG1-CG 4.29Å; I397-Y401 HydrophobicContact CG2-CD2 3.92Å; I397-Y401 HydrophobicContact CG2-CE2 4.28Å; I397-Y401 WeakPolarHBondContact O-CD2 3.48Å; I397-Y401 PolarHBondContact O-N 3.21Å; I397-Y401 VanDerWaalsContact O-N 3.09Å; Q399-Y401 PolarHBondContact O-N 3.38Å; Y401-T403 PolarHBondContact O-N 3.44Å
402	S	86.8	Confident	87.1	Confident	77 Å²	77	74.3 Å²	74.3	54%	0.538	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	41	-173.6	-57.7	0	0	0	0	112.4	E398 Q399	E398-S402 WeakPolarHBondContact O-CA 3.35Å; E398-S402 PolarHBondContact O-N 3.37Å; Q399-S402 PolarHBondContact O-N 2.76Å
403	T	88.9	Confident	86	Confident	25 Å²	25	66.8 Å²	66.8	15%	0.153	34%	0.341	C	S	.	.			trans	-101	172.6	177.4	-169	0	0	0	0	110.4	T252 Q258 E398 Y401 I405	T252-T403 HydrophobicContact CG2-CG2 4.48Å; Q258-T403 PolarHBondContact NE2-OG1 3.49Å; E398-T403 HydrophobicContact CG-CG2 4.35Å; E398-T403 WeakPolarHBondContact CG-O 3.38Å; E398-T403 PolarHBondContact O-N 2.92Å; E398-T403 VanDerWaalsContact O-N 3.08Å; Y401-T403 PolarHBondContact O-N 3.44Å; T403-I405 HydrophobicContact CG2-CD1 4.33Å; T403-I405 HydrophobicContact CG2-CG1 4.05Å
404	Q	90.3	Very high	84.7	Confident	125 Å²	125	69.5 Å²	69.5	58%	0.584	36%	0.357	S	S	*	.			trans	-113.8	130.3	168.6	-172.4	171.9	-4.3	0	0	109.3	D406	Q404-D406 WeakPolarHBondContact CG-OD1 3.49Å; Q404-D406 PolarHBondContact NE2-OD1 3.28Å
405	I	93.6	Very high	83.2	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.005	37%	0.368	C	S	.	.			trans	-123.2	99.5	174.3	-49.7	176.6	0	0	0	107.5	Q258 F260 Y366 L394 E398 T403	Q258-I405 HydrophobicContact CB-CB 4.45Å; Q258-I405 HydrophobicContact CB-CG1 4.11Å; Q258-I405 HydrophobicContact CB-CG2 4.22Å; F260-I405 HydrophobicContact CB-CG2 4.32Å; F260-I405 HydrophobicContact CD1-CG2 4.16Å; Y366-I405 HydrophobicContact CE1-CD1 4.4Å; Y366-I405 WeakPolarHBondContact OH-CD1 3.37Å; L394-I405 HydrophobicContact CD1-CD1 3.56Å; L394-I405 HydrophobicContact CD1-CG2 4.26Å; L394-I405 HydrophobicContact CD2-CG2 4.08Å; L394-I405 HydrophobicContact CG-CD1 4.01Å; L394-I405 HydrophobicContact CG-CG2 4.43Å; E398-I405 HydrophobicContact CB-CD1 4.13Å; E398-I405 HydrophobicContact CB-CG1 4.33Å; E398-I405 HydrophobicContact CG-CG1 4.27Å; E398-I405 PolarHBondContact OE1-N 2.95Å; T403-I405 HydrophobicContact CG2-CD1 4.33Å; T403-I405 HydrophobicContact CG2-CG1 4.05Å
406	D	92.5	Very high	81.6	Confident	66 Å²	66	70.6 Å²	70.6	35%	0.353	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	154.5	-173.2	-67.9	-45.8	0	0	0	112	Q258 F259 F260 Q404 M408	Q258-D406 PolarHBondContact O-N 3.33Å; Q258-D406 VanDerWaalsContact O-N 3.08Å; F259-D406 CarbonylContact C-O 3.59Å; F259-D406 WeakPolarHBondContact CA-O 3.4Å; F259-D406 HydrophobicContact CD1-CB 4.01Å; F259-D406 HydrophobicContact CE1-CB 4.16Å; F260-D406 VanDerWaalsContact CD1-O 3.27Å; F260-D406 WeakPolarHBondContact CD1-O 3.49Å; F260-D406 PolarHBondContact N-O 3.48Å; Q404-D406 WeakPolarHBondContact CG-OD1 3.49Å; Q404-D406 PolarHBondContact NE2-OD1 3.28Å; D406-M408 PolarHBondContact O-N 3.29Å
407	E	92.8	Very high	81.2	Confident	138 Å²	138	70.5 Å²	70.5	65%	0.645	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	136.3	166.1	-170.9	168.4	-166.3	0	0	108.9	F260 P409	F260-E407 HydrophobicContact CE1-CB 3.93Å; F260-E407 VanDerWaalsContact CE1-N 3.34Å; F260-E407 HydrophobicContact CE2-CB 4.29Å; F260-E407 HydrophobicContact CE2-CG 4.19Å; F260-E407 HydrophobicContact CZ-CB 3.69Å; F260-E407 HydrophobicContact CZ-CG 4.07Å; E407-P409 WeakPolarHBondContact O-CD 3.34Å
408	M	90.2	Very high	80.6	Confident	49 Å²	49	74.1 Å²	74.1	24%	0.241	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-62.7	120.4	-174.1	-168.5	175.2	80.9	0	0	110.7	F259 F260 V261 L276 I383 D406 V412	F259-M408 HydrophobicContact CB-CB 4.11Å; F259-M408 HydrophobicContact CB-CG 4.29Å; F260-M408 WeakPolarHBondContact O-CB 3.44Å; F260-M408 PolarHBondContact O-N 3.11Å; V261-M408 HydrophobicContact CG2-CB 3.83Å; V261-M408 HydrophobicContact CG2-CE 3.56Å; V261-M408 HydrophobicContact CG2-CG 4.31Å; V261-M408 HydrophobicContact CG2-SD 3.49Å; V261-M408 WeakPolarHBondContact CG2-SD 3.43Å; L276-M408 HydrophobicContact CD2-CE 3.87Å; L276-M408 HydrophobicContact CD2-SD 3.82Å; I383-M408 HydrophobicContact CD1-SD 4.02Å; I383-M408 HydrophobicContact CG2-SD 4.05Å; D406-M408 PolarHBondContact O-N 3.29Å; M408-V412 HydrophobicContact CE-CG2 4.08Å; M408-V412 HydrophobicContact CG-CG2 3.33Å; M408-V412 HydrophobicContact SD-CG2 3.73Å
409	P	84.1	Confident	80.1	Confident	53 Å²	53	76.4 Å²	76.4	34%	0.344	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-70.9	157.1	179.3	29.4	-34	0	0	0	110.5	F259 E407 N411 V412 L415	F259-P409 HydrophobicContact CE1-CG 4.41Å; E407-P409 WeakPolarHBondContact O-CD 3.34Å; P409-N411 PolarHBondContact O-N 2.88Å; P409-V412 WeakPolarHBondContact O-CG2 3.4Å; P409-L415 HydrophobicContact CG-CD1 3.62Å
410	M	73.5	Confident	79.5	Confident	188 Å²	188	71.8 Å²	71.8	93%	0.926	38%	0.381	S	S	*	.	S	Bend	trans	-61.4	-27.1	176.3	-70.6	175.9	54.3	0	0	113.5	V412	M410-V412 PolarHBondContact O-N 3.04Å
411	N	68.9	Low	79	Confident	112 Å²	112	72.3 Å²	72.3	60%	0.599	39%	0.389	S	S	*	.			trans	-101.1	59.3	-178	-64	-12.5	0	0	0	111.9	P409 A413	P409-N411 PolarHBondContact O-N 2.88Å; N411-A413 VanDerWaalsContact C-N 3.27Å; N411-A413 PolarHBondContact O-N 3.08Å
412	V	67.9	Low	78.6	Confident	7 Å²	7	77 Å²	77	4%	0.042	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-68.5	-27.3	-179.8	-169.3	0	0	0	0	112.6	L280 M408 P409 M410 D414 L415	L280-V412 HydrophobicContact CD1-CG1 4.33Å; L280-V412 HydrophobicContact CD2-CB 4.06Å; L280-V412 HydrophobicContact CD2-CG1 3.98Å; M408-V412 HydrophobicContact CE-CG2 4.08Å; M408-V412 HydrophobicContact CG-CG2 3.33Å; M408-V412 HydrophobicContact SD-CG2 3.73Å; P409-V412 WeakPolarHBondContact O-CG2 3.4Å; M410-V412 PolarHBondContact O-N 3.04Å; V412-D414 PolarHBondContact O-N 3.22Å; V412-D414 VanDerWaalsContact O-N 3.16Å; V412-L415 WeakPolarHBondContact O-CB 3.45Å; V412-L415 PolarHBondContact O-N 3.03Å
413	A	65.8	Low	78	Confident	46 Å²	46	77 Å²	77	38%	0.38	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-58.3	-29.5	-177.4	0	0	0	0	0	113.5	T279 L280 N411 L415	T279-A413 HydrophobicContact CG2-CB 4.46Å; L280-A413 HydrophobicContact CD2-CB 4.27Å; N411-A413 VanDerWaalsContact C-N 3.27Å; N411-A413 PolarHBondContact O-N 3.08Å; A413-L415 VanDerWaalsContact C-N 3.27Å; A413-L415 PolarHBondContact O-N 2.6Å
414	D	63.8	Low	77.1	Confident	137 Å²	137	81 Å²	81	73%	0.733	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-80.3	-6.8	179.9	-62.5	-30.9	0	0	0	113.4	V412	V412-D414 PolarHBondContact O-N 3.22Å; V412-D414 VanDerWaalsContact O-N 3.16Å
415	L	61.6	Low	76.1	Confident	49 Å²	49	77.3 Å²	77.3	26%	0.257	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-101.9	-14.5	-173	-63.2	167.7	0	0	0	113.6	K257 F259 P409 V412 A413	K257-L415 HydrophobicContact CD-CD2 4.08Å; F259-L415 HydrophobicContact CE1-CD1 4.36Å; F259-L415 HydrophobicContact CE2-CD1 4.1Å; F259-L415 HydrophobicContact CZ-CD1 3.65Å; P409-L415 HydrophobicContact CG-CD1 3.62Å; V412-L415 WeakPolarHBondContact O-CB 3.45Å; V412-L415 PolarHBondContact O-N 3.03Å; A413-L415 VanDerWaalsContact C-N 3.27Å; A413-L415 PolarHBondContact O-N 2.6Å
416	I	58	Low	74.5	Confident	82 Å²	82	84.3 Å²	84.3	42%	0.421	45%	0.449	S	S	.	.			trans	-102.5	0	178.1	-57.1	-172.2	0	0	0	108.8	L280 L353 V381	L280-I416 HydrophobicContact CB-CD1 4.3Å; L280-I416 HydrophobicContact CD1-CD1 3.53Å; L280-I416 HydrophobicContact CD2-CD1 3.74Å; L280-I416 HydrophobicContact CD2-CG1 4.45Å; L280-I416 HydrophobicContact CG-CD1 4.04Å; L353-I416 HydrophobicContact CD1-CD1 4.24Å; V381-I416 HydrophobicContact CB-CG1 4.28Å; V381-I416 HydrophobicContact CG2-CD1 4.49Å; V381-I416 HydrophobicContact CG2-CG1 3.75Å

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