A0A087Y412_POEFO Loading...

Phospholipid-transporting ATPase

AlphaFold DB , UniProt , Accession A0A087Y412, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,149 aa.

						>A0A087Y412_POEFO|A0A087Y412
MLRRRLNRLFGGDEGRVHSRTIYVGHKSCPPNEAYIPPKFCDNRIVSSKYTVWNFLPKNLFEQFRRIANFYFLIIFLVQVIVDTPTSPVTSGLPLFFVITVTAVKQGYEDWLRHKADREVNEYRVSVLEDGRRIRKMSAKIKVGDILEVEEDETFPCDLILLQSSRDDGTCFVTTASLDGESNHKTHYTVADLESDLQYLSATIECEQPQPDLYKFVGRMHIYRNSQEPDVRSLGPENLLLKGANLKNTQKICGVAVYTGMETKMALNYQGKSQKRSAVEKSINAFLLVYLFILVSKALVCTTLKYVWQSKHDETWYNEKTQKEKETNQYLKMFTDFLSFMVLFNFIIPVSMYVTVEMQKFLGSFFITWDKDFFDPEIQEGALVNTSDLNEELGQVEYIFTDKTGTLTQNNMEFIECCIDGFQYKHGDGSSELDGFCVTDGPVNKIQQKAGREREELFLRALCLCHTVQVKESTKQRQDQNDQFDQIDQIDQVDGLGLDHGFLDPPQKEMGFIASSPDEIALVKGAMRYGFTFLGLESKNMKILNRNKDVETYELLHVLNFDPVRRRMSVMVRSKTGDILLFCKGADSSIFPQVRQEEVERIRMHVERNATEGYRTLCVAYKHLSAQEYARADADLREARLALQDREEKLMAVYNRVETDMILIGATAVEDQLQDEAAQTMEALQGAGMKVWVLTGDKMETAKSTCYACGLFKKNTELLELTLRTLEDGGRSREERLHDLLLEYHKKAVQDAPPVKLGITRSWSVAGHDYGFIIDGASLSMVLSSSSEPNSRRYKNLFLQICQNCTSVLCCRMAPLQKAQIVKLVKNSKGNPITLSIGDGANDVSMILEAHVGIGIKGKEGRQAVKNSDYAIPKLKHLKKLLLAHGHLYYVRIAHLVQYFFYKNLCFILPQFLYQFFCGYSQQPLYDAAYLTMYNICFTSMPILAYSLLEQHICIEVLLEHSTLYRDIAKNAMLRWKLFLYWTALGIFHGLVFFFGVRFLFSNPALQDNGQVFGNWSYGTIVFTVLVFTVTLKLALDTRHWTWINHFVIWGSLAFYVFFSFFWGGIIWPFLKHQRLYFVFANMLSSVSAWLVIILLILLSLLPEILLVVLRKPRGPHARQMKHRLPSSGTSTIFMLSQTASTHSFSWSD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	33	Very low	223 Å²	223	164.9 Å²	164.9	100%	1.099	76%	0.758	S	S	*	*				0	-45.8	0	-75.8	-177.6	177.9	0	0	114.2	R3 R4	M1-R3 VanDerWaalsContact C-N 3.31Å; M1-R3 PolarHBondContact O-N 3.14Å; M1-R3 VanDerWaalsContact O-N 3.08Å; M1-R4 PolarHBondContact O-N 2.83Å
2	L	25.9	Very low	32.5	Very low	138 Å²	138	156.8 Å²	156.8	72%	0.723	75%	0.754	S	S	*	*	H	α-helix	trans	-45.4	-44.1	-171.7	-130.3	74.1	0	0	0	115.9	R4 R5 L6	L2-R4 PolarHBondContact O-N 2.65Å; L2-R5 PolarHBondContact O-N 2.66Å; L2-L6 PolarHBondContact O-N 2.93Å; L2-L6 VanDerWaalsContact O-N 3.15Å
3	R	25.1	Very low	32.6	Very low	213 Å²	213	158.5 Å²	158.5	80%	0.804	77%	0.769	S	S	*	*	H	α-helix	trans	-56	-32.2	-180	-150.6	172.9	-172.7	176	1.8	113.6	M1 N7	M1-R3 VanDerWaalsContact C-N 3.31Å; M1-R3 PolarHBondContact O-N 3.14Å; M1-R3 VanDerWaalsContact O-N 3.08Å; R3-N7 PolarHBondContact O-N 3.2Å; R3-N7 PolarHBondContact O-OD1 3.3Å; R3-N7 VanDerWaalsContact O-OD1 3.11Å
4	R	34	Very low	32.3	Very low	228 Å²	228	160.1 Å²	160.1	86%	0.86	78%	0.775	S	S	*	*	H	α-helix	trans	-74.7	-18.9	174.1	-87.3	-171.7	174.7	-179.1	-3.1	114.3	M1 L2	M1-R4 PolarHBondContact O-N 2.83Å; L2-R4 PolarHBondContact O-N 2.65Å
5	R	39.3	Very low	32.3	Very low	202 Å²	202	154.9 Å²	154.9	76%	0.762	78%	0.779	S	S	*	*	H	α-helix	trans	-84.4	-39	170.5	-83.2	-172	173.2	-178.9	-2	111.6	L2 R8 L9	L2-R5 PolarHBondContact O-N 2.66Å; R5-R8 WeakPolarHBondContact O-CA 3.42Å; R5-R8 WeakPolarHBondContact O-CB 2.98Å; R5-R8 PolarHBondContact O-N 2.84Å; R5-L9 PolarHBondContact O-N 2.98Å
6	L	31.8	Very low	32.2	Very low	90 Å²	90	158.5 Å²	158.5	47%	0.471	78%	0.781	S	S	.	*	H	α-helix	trans	-62	-45.8	178.7	-84.2	156.6	0	0	0	112.6	L2 R8 L9 F10	L2-L6 PolarHBondContact O-N 2.93Å; L2-L6 VanDerWaalsContact O-N 3.15Å; L6-R8 PolarHBondContact O-N 3.13Å; L6-L9 PolarHBondContact O-N 2.9Å; L6-F10 HydrophobicContact CD2-CE2 4.39Å; L6-F10 PolarHBondContact O-N 2.72Å
7	N	32.2	Very low	32.7	Very low	121 Å²	121	157.2 Å²	157.2	65%	0.647	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-13.2	173	-73.4	50.5	0	0	0	113.9	R3	R3-N7 PolarHBondContact O-N 3.2Å; R3-N7 PolarHBondContact O-OD1 3.3Å; R3-N7 VanDerWaalsContact O-OD1 3.11Å
8	R	40.5	Very low	34	Very low	228 Å²	228	156 Å²	156	86%	0.86	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-3.1	175.4	-126.6	-175.1	-168.6	-167.2	4.2	113.9	R5 L6	R5-R8 WeakPolarHBondContact O-CA 3.42Å; R5-R8 WeakPolarHBondContact O-CB 2.98Å; R5-R8 PolarHBondContact O-N 2.84Å; L6-R8 PolarHBondContact O-N 3.13Å
9	L	32.4	Very low	36	Very low	137 Å²	137	151.3 Å²	151.3	72%	0.717	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-19.3	170.9	-93.2	81.8	0	0	0	113.1	R5 L6	R5-L9 PolarHBondContact O-N 2.98Å; L6-L9 PolarHBondContact O-N 2.9Å
10	F	31.6	Very low	38.4	Very low	171 Å²	171	144.5 Å²	144.5	75%	0.75	72%	0.723	S	S	*	*	S	Bend	trans	-127.4	25.7	-174.8	-66.6	-78.6	0	0	0	113	L6 G12	L6-F10 HydrophobicContact CD2-CE2 4.39Å; L6-F10 PolarHBondContact O-N 2.72Å; F10-G12 PolarHBondContact O-N 2.92Å
11	G	29	Very low	40.7	Very low	63 Å²	63	139.8 Å²	139.8	65%	0.649	70%	0.702	S	S	*	*			trans	-80.7	111.9	168.7	0	0	0	0	0	109.7
12	G	27.3	Very low	42.9	Very low	68 Å²	68	129.2 Å²	129.2	70%	0.701	65%	0.65	S	S	*	*			trans	-79.5	157.6	164.4	0	0	0	0	0	111.1	F10 E14	F10-G12 PolarHBondContact O-N 2.92Å; G12-E14 PolarHBondContact O-N 3.27Å
13	D	33.3	Very low	45.8	Very low	178 Å²	178	124.6 Å²	124.6	95%	0.952	62%	0.624	S	S	*	*			trans	-73.1	83.8	176.1	-74.4	-53.9	0	0	0	111.6
14	E	28.7	Very low	48.7	Very low	182 Å²	182	114.5 Å²	114.5	85%	0.85	59%	0.586	S	S	*	*			trans	-94.4	104	159	-73.9	-164.3	165	0	0	109.7	G12 R16	G12-E14 PolarHBondContact O-N 3.27Å; E14-R16 VanDerWaalsContact C-N 3.32Å; E14-R16 PolarHBondContact O-N 2.81Å
15	G	31.6	Very low	50.9	Low	82 Å²	82	105.2 Å²	105.2	85%	0.845	56%	0.56	S	S	*	*			trans	-70.1	72.6	-172.4	0	0	0	0	0	115.2
16	R	30.9	Very low	52.6	Low	212 Å²	212	100.6 Å²	100.6	80%	0.8	55%	0.548	S	S	*	.			trans	-93	103.5	160.1	-74.8	-172.6	174.7	-171.3	-1.7	110	E14 H18	E14-R16 VanDerWaalsContact C-N 3.32Å; E14-R16 PolarHBondContact O-N 2.81Å; R16-H18 VanDerWaalsContact C-N 3.33Å; R16-H18 PolarHBondContact O-CD2 2.94Å; R16-H18 PolarHBondContact O-N 2.96Å
17	V	41.4	Very low	54.4	Low	136 Å²	136	99.9 Å²	99.9	82%	0.824	54%	0.541	S	S	*	.			trans	-67.8	91	172.7	-176.4	0	0	0	0	108.9	S19	V17-S19 PolarHBondContact O-N 2.82Å; V17-S19 VanDerWaalsContact O-N 3.08Å
18	H	56.2	Low	55.7	Low	136 Å²	136	98.9 Å²	98.9	63%	0.63	54%	0.543	S	S	*	.			trans	-71.8	95.8	175	-80.8	-78.6	0	0	0	110	R16 Q208	R16-H18 VanDerWaalsContact C-N 3.33Å; R16-H18 PolarHBondContact O-CD2 2.94Å; R16-H18 PolarHBondContact O-N 2.96Å; H18-Q208 VanDerWaalsContact O-CG 3.24Å; H18-Q208 WeakPolarHBondContact O-CG 3.45Å; H18-Q208 PolarHBondContact O-NE2 3.07Å
19	S	71.7	Confident	56.5	Low	67 Å²	67	89.6 Å²	89.6	47%	0.469	51%	0.513	S	S	.	.			trans	-59.5	161.4	166.8	51.5	0	0	0	0	111.7	V17 C206	V17-S19 PolarHBondContact O-N 2.82Å; V17-S19 VanDerWaalsContact O-N 3.08Å; S19-C206 WeakPolarHBondContact CA-O 3.36Å
20	R	84.9	Confident	57.5	Low	14 Å²	14	87 Å²	87	5%	0.053	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.2	170.9	92.3	-160.3	-34.3	-124.8	8.5	109.5	I22 E205 C206 V257 E262	R20-I22 HydrophobicContact CG-CD1 4.09Å; R20-I22 HydrophobicContact CG-CG1 4.3Å; R20-E205 WeakPolarHBondContact O-CA 3.46Å; R20-C206 VanDerWaalsContact CG-SG 3.57Å; R20-C206 PolarHBondContact N-O 2.9Å; R20-C206 PolarHBondContact O-N 3.4Å; R20-V257 PolarHBondContact NH1-O 2.92Å; R20-E262 IonicContact CZ-OE2 3.93Å; R20-E262 IonicContact NH1-OE2 2.74Å; R20-E262 PolarHBondContact NH1-OE2 2.69Å; R20-E262 IonicContact NH2-OE1 2.62Å; R20-E262 IonicContact NH2-OE2 3.29Å; R20-E262 PolarHBondContact NH2-OE2 3.36Å
21	T	85.8	Confident	58.6	Low	46 Å²	46	85 Å²	85	28%	0.282	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.5	-175.8	-49.7	0	0	0	0	109.6	T203 I204 E205	T21-T203 HydrophobicContact CG2-CG2 3.3Å; T21-I204 CarbonylContact C-O 3.54Å; T21-I204 WeakPolarHBondContact CA-O 3.24Å; T21-E205 HydrophobicContact CG2-CG 4.22Å
22	I	88	Confident	59.6	Low	1 Å²	1	89.5 Å²	89.5	1%	0.005	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.5	-168.4	-61.1	168.3	0	0	0	108.7	R20 F40 V143 T203 I204 V257	R20-I22 HydrophobicContact CG-CD1 4.09Å; R20-I22 HydrophobicContact CG-CG1 4.3Å; I22-F40 HydrophobicContact CG1-CZ 3.93Å; I22-V143 HydrophobicContact CB-CG1 4.29Å; I22-V143 HydrophobicContact CD1-CG1 3.66Å; I22-V143 HydrophobicContact CG1-CG1 3.64Å; I22-V143 HydrophobicContact CG2-CG1 3.73Å; I22-T203 CarbonylContact O-C 3.58Å; I22-T203 WeakPolarHBondContact O-CA 3.49Å; I22-I204 HydrophobicContact CB-CB 4.38Å; I22-I204 PolarHBondContact N-O 3.41Å; I22-I204 PolarHBondContact O-N 3.23Å; I22-V257 HydrophobicContact CD1-CB 4.14Å; I22-V257 HydrophobicContact CD1-CG1 3.8Å; I22-V257 HydrophobicContact CD1-CG2 4.12Å
23	Y	86.8	Confident	60.8	Low	42 Å²	42	93.6 Å²	93.6	17%	0.165	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.6	-179.6	-59.5	-83.7	0	0	0	109.9	G25 H26 K27 C29 Y35 T203	Y23-G25 PolarHBondContact O-N 3.11Å; Y23-H26 PolarHBondContact O-N 2.79Å; Y23-K27 WeakPolarHBondContact CB-O 3.28Å; Y23-C29 HydrophobicContact CE1-CB 4.07Å; Y23-Y35 HydrophobicContact CD2-CE2 4.12Å; Y23-Y35 HydrophobicContact CE2-CD2 4.16Å; Y23-Y35 AromaticContact CE2-CE2 3.69Å; Y23-Y35 HydrophobicContact CE2-CE2 3.69Å; Y23-T203 HydrophobicContact CD1-CG2 4.41Å; Y23-T203 WeakPolarHBondContact CD1-OG1 3.39Å; Y23-T203 HydrophobicContact CE1-CG2 4.22Å
24	V	85.9	Confident	61.4	Low	1 Å²	1	89.8 Å²	89.8	1%	0.006	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-69.5	124.5	-177.4	178.1	0	0	0	0	109.7	H26 I146 L162 L200 A202 I204 M220 V255	V24-H26 PolarHBondContact O-N 3.33Å; V24-I146 HydrophobicContact CG1-CD1 3.95Å; V24-I146 HydrophobicContact CG1-CG1 4.13Å; V24-L162 HydrophobicContact CG1-CD1 4.45Å; V24-L200 HydrophobicContact CG1-CD2 4.24Å; V24-A202 HydrophobicContact CB-CB 4.39Å; V24-A202 HydrophobicContact CG2-CB 4.06Å; V24-A202 WeakPolarHBondContact CG2-O 3.12Å; V24-A202 PolarHBondContact N-O 2.97Å; V24-I204 HydrophobicContact CG2-CD1 4.06Å; V24-I204 HydrophobicContact CG2-CG1 4.31Å; V24-M220 HydrophobicContact CG2-CE 4.48Å; V24-V255 HydrophobicContact CG1-CG2 4.26Å; V24-V255 HydrophobicContact CG2-CG1 4.34Å; V24-V255 HydrophobicContact CG2-CG2 4.2Å
25	G	78.8	Confident	62.6	Low	32 Å²	32	87.9 Å²	87.9	33%	0.33	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	66.3	21.8	-178	0	0	0	0	0	114.4	Y23 K27 G144	Y23-G25 PolarHBondContact O-N 3.11Å; G25-K27 PolarHBondContact O-N 2.94Å; G25-K27 VanDerWaalsContact O-N 3.11Å; G25-G144 PolarHBondContact N-O 3.21Å
26	H	75.8	Confident	63.8	Low	106 Å²	106	91 Å²	91	49%	0.491	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	59.3	15.2	-178.2	-52.5	-78.5	0	0	0	115.8	Y23 V24 V143 D145	Y23-H26 PolarHBondContact O-N 2.79Å; V24-H26 PolarHBondContact O-N 3.33Å; H26-V143 PolarHBondContact CE1-O 3.2Å; H26-V143 VanDerWaalsContact CE1-O 3.26Å; H26-D145 IonicContact CD2-OD1 2.64Å; H26-D145 IonicContact CE1-OD1 2.67Å; H26-D145 IonicContact NE2-OD1 3.31Å; H26-D145 PolarHBondContact NE2-OD1 2.91Å
27	K	69.3	Low	65	Low	75 Å²	75	84.3 Å²	84.3	33%	0.326	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-68.2	143.4	177.1	-65.4	173.2	179	177.2	0	111.5	Y23 G25 Q198 Y199 L200	Y23-K27 WeakPolarHBondContact CB-O 3.28Å; G25-K27 PolarHBondContact O-N 2.94Å; G25-K27 VanDerWaalsContact O-N 3.11Å; K27-Q198 PolarHBondContact NZ-O 3.26Å; K27-Y199 PolarHBondContact NZ-O 2.83Å; K27-L200 PolarHBondContact NZ-O 3.27Å
28	S	59.9	Low	66.1	Low	100 Å²	100	80.6 Å²	80.6	70%	0.699	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-83.2	142.3	-179.2	53.7	0	0	0	0	113.4
29	C	57.1	Low	67.1	Low	33 Å²	33	84 Å²	84	22%	0.223	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-64.9	166.2	168.4	-109.6	0	0	0	0	113.2	Y23	Y23-C29 HydrophobicContact CE1-CB 4.07Å
30	P	54.5	Low	67.8	Low	81 Å²	81	83.6 Å²	83.6	53%	0.526	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-57.6	158.6	172	-23.9	35.3	0	0	0	113.7	N32	P30-N32 PolarHBondContact O-N 3.13Å
31	P	52.9	Low	68	Low	129 Å²	129	84.8 Å²	84.8	84%	0.838	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	11.1	-158.5	30.3	-38.1	0	0	0	117.3
32	N	50.3	Low	68.2	Low	159 Å²	159	87.3 Å²	87.3	85%	0.85	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-5.1	-171.8	-77.3	-0.9	0	0	0	115.3	P30	P30-N32 PolarHBondContact O-N 3.13Å
33	E	52.2	Low	68.4	Low	154 Å²	154	87.2 Å²	87.2	72%	0.72	48%	0.48	S	S	*	.	S	Bend	trans	-117.9	142.4	178.8	-67.5	-164.6	142.4	0	0	113.3	Y35	E33-Y35 PolarHBondContact O-N 2.9Å
34	A	47.1	Very low	68.6	Low	98 Å²	98	92.2 Å²	92.2	81%	0.81	50%	0.499	S	S	*	.			trans	-76.5	93	-178.5	0	0	0	0	0	111.5	I36	A34-I36 PolarHBondContact O-N 2.66Å
35	Y	53.7	Low	68.6	Low	142 Å²	142	93.5 Å²	93.5	56%	0.557	51%	0.505	S	S	*	.			trans	-61	103.7	179.4	-178.9	-96.6	0	0	0	112.7	Y23 E33 P37	Y23-Y35 HydrophobicContact CD2-CE2 4.12Å; Y23-Y35 HydrophobicContact CE2-CD2 4.16Å; Y23-Y35 AromaticContact CE2-CE2 3.69Å; Y23-Y35 HydrophobicContact CE2-CE2 3.69Å; E33-Y35 PolarHBondContact O-N 2.9Å; Y35-P37 HydrophobicContact CE1-CB 3.66Å; Y35-P37 HydrophobicContact CE1-CG 4.05Å
36	I	55.8	Low	68.8	Low	146 Å²	146	95.1 Å²	95.1	75%	0.749	51%	0.509	S	S	*	.			trans	-100.1	108.6	166.1	-58.9	175.3	0	0	0	107.3	A34 P38	A34-I36 PolarHBondContact O-N 2.66Å; I36-P38 WeakPolarHBondContact O-CD 3.45Å; I36-P38 VanDerWaalsContact O-N 3.17Å
37	P	57.8	Low	68.9	Low	73 Å²	73	91.5 Å²	91.5	47%	0.474	50%	0.496	S	S	.	.			trans	-64.4	115.8	-177.3	21.4	-30.9	0	0	0	111.4	Y35 K39	Y35-P37 HydrophobicContact CE1-CB 3.66Å; Y35-P37 HydrophobicContact CE1-CG 4.05Å; P37-K39 PolarHBondContact O-N 3.12Å
38	P	64.3	Low	69.4	Low	58 Å²	58	88.8 Å²	88.8	38%	0.377	49%	0.486	S	S	.	.			trans	-67	126.8	176.7	27	-33.5	0	0	0	110.4	I36 F40	I36-P38 WeakPolarHBondContact O-CD 3.45Å; I36-P38 VanDerWaalsContact O-N 3.17Å; P38-F40 HydrophobicContact CB-CE1 4.08Å; P38-F40 HydrophobicContact CB-CE2 4.19Å; P38-F40 HydrophobicContact CB-CZ 3.86Å; P38-F40 HydrophobicContact CG-CD2 4.38Å; P38-F40 HydrophobicContact CG-CE1 4.2Å; P38-F40 HydrophobicContact CG-CE2 3.57Å; P38-F40 HydrophobicContact CG-CZ 3.46Å; P38-F40 VanDerWaalsContact CG-CZ 3.46Å; P38-F40 PolarHBondContact O-N 2.8Å; P38-F40 VanDerWaalsContact O-N 3.1Å
39	K	76.9	Confident	70.2	Confident	206 Å²	206	88.5 Å²	88.5	90%	0.896	47%	0.472	S	S	*	.			trans	-84.7	83	177.3	-70.6	-171.3	176.4	-177.2	0	110.7	P37	P37-K39 PolarHBondContact O-N 3.12Å
40	F	86.6	Confident	71.6	Confident	59 Å²	59	87.7 Å²	87.7	26%	0.259	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-63.2	165	169.7	-56.9	-60	0	0	0	112.5	I22 P38 V143	I22-F40 HydrophobicContact CG1-CZ 3.93Å; P38-F40 HydrophobicContact CB-CE1 4.08Å; P38-F40 HydrophobicContact CB-CE2 4.19Å; P38-F40 HydrophobicContact CB-CZ 3.86Å; P38-F40 HydrophobicContact CG-CD2 4.38Å; P38-F40 HydrophobicContact CG-CE1 4.2Å; P38-F40 HydrophobicContact CG-CE2 3.57Å; P38-F40 HydrophobicContact CG-CZ 3.46Å; P38-F40 VanDerWaalsContact CG-CZ 3.46Å; P38-F40 PolarHBondContact O-N 2.8Å; P38-F40 VanDerWaalsContact O-N 3.1Å; F40-V143 HydrophobicContact CB-CB 4.27Å; F40-V143 HydrophobicContact CB-CG2 3.85Å; F40-V143 HydrophobicContact CD1-CB 4.48Å; F40-V143 HydrophobicContact CD1-CG1 4.39Å; F40-V143 HydrophobicContact CD1-CG2 4.26Å; F40-V143 HydrophobicContact CD2-CB 3.58Å; F40-V143 HydrophobicContact CD2-CG1 3.84Å; F40-V143 HydrophobicContact CD2-CG2 4.08Å; F40-V143 HydrophobicContact CE1-CG1 4.26Å; F40-V143 HydrophobicContact CE2-CB 3.94Å; F40-V143 HydrophobicContact CE2-CG1 3.66Å; F40-V143 HydrophobicContact CG-CB 3.87Å; F40-V143 HydrophobicContact CG-CG1 4.19Å; F40-V143 HydrophobicContact CG-CG2 3.82Å; F40-V143 HydrophobicContact CZ-CG1 3.9Å
41	C	88.4	Confident	73.2	Confident	39 Å²	39	87 Å²	87	26%	0.264	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-82.3	157.2	172.9	81.9	0	0	0	0	112.9	T259 E262	C41-T259 PolarHBondContact O-OG1 2.85Å; C41-T259 PolarHBondContact SG-O 3.05Å; C41-E262 HydrophobicContact CB-CG 4.36Å; C41-E262 VanDerWaalsContact SG-CG 3.54Å
42	D	90.8	Very high	74.8	Confident	99 Å²	99	87.4 Å²	87.4	53%	0.529	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-77.4	149.2	178.5	-166.5	24	0	0	0	110.9	R44	D42-R44 PolarHBondContact O-N 2.72Å
43	N	92.6	Very high	76.7	Confident	0 Å²	0	91.2 Å²	91.2	0%	0	46%	0.461	C	S	.	.	S	Bend	trans	-73.3	16.5	-174.3	-165	34.9	0	0	0	114.9	S138 I141 P156 K242 T259 G260	N43-S138 PolarHBondContact ND2-O 2.87Å; N43-I141 HydrophobicContact CB-CB 4.2Å; N43-I141 VanDerWaalsContact CB-O 3.29Å; N43-I141 WeakPolarHBondContact CB-O 3.5Å; N43-P156 PolarHBondContact ND2-O 2.81Å; N43-P156 PolarHBondContact OD1-O 2.84Å; N43-K242 PolarHBondContact OD1-NZ 2.79Å; N43-T259 HydrophobicContact CB-CG2 4.08Å; N43-G260 PolarHBondContact OD1-N 2.82Å
44	R	90.4	Very high	78.6	Confident	146 Å²	146	86.9 Å²	86.9	55%	0.551	44%	0.443	S	S	*	.			trans	-79.8	122.7	-178.8	-171.9	178.7	177.1	166.8	1.1	112	D42 V46 N121 A139	D42-R44 PolarHBondContact O-N 2.72Å; R44-V46 HydrophobicContact CG-CG2 4.23Å; R44-N121 VanDerWaalsContact CA-OD1 3.29Å; R44-N121 WeakPolarHBondContact CA-OD1 3.48Å; R44-A139 HydrophobicContact CB-CB 4.33Å
45	I	85.3	Confident	80.7	Confident	28 Å²	28	84.6 Å²	84.6	14%	0.144	42%	0.415	C	S	.	.			trans	-84.7	140	169.8	-59.1	-58.8	0	0	0	110.1	V120 N121 K242 G260 M261 A266	I45-V120 HydrophobicContact CG1-CG1 4.37Å; I45-N121 PolarHBondContact N-OD1 3.13Å; I45-N121 PolarHBondContact O-ND2 3.13Å; I45-K242 HydrophobicContact CD1-CD 4.39Å; I45-G260 WeakPolarHBondContact CD1-O 3.21Å; I45-M261 HydrophobicContact CD1-SD 4.33Å; I45-A266 HydrophobicContact CD1-CB 4.3Å
46	V	84.1	Confident	82.4	Confident	67 Å²	67	83 Å²	83	41%	0.406	42%	0.415	S	S	.	.			trans	-141.2	101	176.8	-176.7	0	0	0	0	109.4	R44 S48	R44-V46 HydrophobicContact CG-CG2 4.23Å; V46-S48 VanDerWaalsContact CG1-OG 3.31Å; V46-S48 WeakPolarHBondContact CG1-OG 3.39Å
47	S	76.8	Confident	84.2	Confident	30 Å²	30	80.4 Å²	80.4	21%	0.21	41%	0.408	C	S	.	.			trans	-94.4	-16.6	173.7	70.6	0	0	0	0	113.3	D117	S47-D117 VanDerWaalsContact CB-OD1 3.26Å; S47-D117 WeakPolarHBondContact CB-OD1 3.33Å; S47-D117 VanDerWaalsContact N-CG 3.31Å; S47-D117 PolarHBondContact N-OD1 2.95Å; S47-D117 VanDerWaalsContact N-OD1 3.08Å; S47-D117 PolarHBondContact N-OD2 3.09Å; S47-D117 VanDerWaalsContact OG-CG 3.26Å; S47-D117 PolarHBondContact OG-OD1 3.21Å; S47-D117 PolarHBondContact OG-OD2 2.86Å
48	S	80.7	Confident	85.7	Confident	17 Å²	17	80.5 Å²	80.5	12%	0.119	40%	0.401	C	S	.	.			trans	-55.1	139.9	176.7	67.9	0	0	0	0	113.8	V46 H114 D117	V46-S48 VanDerWaalsContact CG1-OG 3.31Å; V46-S48 WeakPolarHBondContact CG1-OG 3.39Å; S48-H114 WeakPolarHBondContact CB-CE1 3.27Å; S48-H114 WeakPolarHBondContact CB-NE2 3.46Å; S48-H114 PolarHBondContact OG-CE1 3.15Å; S48-H114 PolarHBondContact OG-NE2 2.95Å; S48-D117 PolarHBondContact N-OD2 2.87Å; S48-D117 VanDerWaalsContact N-OD2 3.16Å
49	K	77.1	Confident	86.9	Confident	95 Å²	95	77.8 Å²	77.8	41%	0.413	38%	0.383	S	S	.	.	S	Bend	trans	-82.2	-26.4	175.6	-68.5	-174.8	178.9	-179.2	0	112.9	K58 D110	K49-K58 PolarHBondContact O-NZ 2.81Å; K49-D110 VanDerWaalsContact N-CG 3.35Å; K49-D110 PolarHBondContact N-OD1 3.03Å; K49-D110 PolarHBondContact N-OD2 2.74Å; K49-D110 VanDerWaalsContact N-OD2 3.07Å
50	Y	84.5	Confident	87.5	Confident	15 Å²	15	70.7 Å²	70.7	6%	0.059	36%	0.355	C	S	.	.			trans	-124.9	151.1	-175.6	-48.7	-75.3	0	0	0	111.1	N54 F55 K58 E62 D110 H114	Y50-N54 WeakPolarHBondContact CA-OD1 3.31Å; Y50-F55 HydrophobicContact CD1-CD2 4.29Å; Y50-F55 AromaticContact CD2-CD2 3.85Å; Y50-F55 HydrophobicContact CD2-CD2 3.85Å; Y50-F55 HydrophobicContact CD2-CE2 4.14Å; Y50-F55 HydrophobicContact CE2-CE2 4.45Å; Y50-F55 AromaticContact CG-CD2 3.74Å; Y50-F55 HydrophobicContact CG-CD2 3.74Å; Y50-F55 HydrophobicContact CG-CE2 4.44Å; Y50-K58 HydrophobicContact CD1-CB 4.2Å; Y50-K58 HydrophobicContact CD1-CD 3.8Å; Y50-K58 HydrophobicContact CD1-CG 4.12Å; Y50-K58 HydrophobicContact CE1-CB 4.32Å; Y50-K58 HydrophobicContact CE1-CD 3.92Å; Y50-K58 HydrophobicContact CE1-CG 3.94Å; Y50-E62 PolarHBondContact OH-OE2 2.92Å; Y50-D110 HydrophobicContact CD2-CB 3.8Å; Y50-D110 WeakPolarHBondContact CD2-OD2 3.4Å; Y50-D110 HydrophobicContact CE2-CB 4.37Å; Y50-D110 PolarHBondContact N-OD2 3.1Å; Y50-H114 PolarHBondContact O-CE1 3.39Å; Y50-H114 PolarHBondContact O-NE2 3.48Å
51	T	88.3	Confident	87.6	Confident	66 Å²	66	75 Å²	75	41%	0.405	37%	0.374	S	S	.	.			trans	-105.8	157.1	163.3	70	0	0	0	0	108.9	W53 N54 F55	T51-W53 PolarHBondContact O-N 3.42Å; T51-N54 PolarHBondContact N-OD1 3.39Å; T51-N54 PolarHBondContact O-N 3.44Å; T51-N54 VanDerWaalsContact OG1-CG 3.27Å; T51-N54 PolarHBondContact OG1-N 2.96Å; T51-N54 PolarHBondContact OG1-ND2 3.06Å; T51-F55 WeakPolarHBondContact O-CB 3.32Å; T51-F55 PolarHBondContact O-N 2.89Å
52	V	87.2	Confident	87.4	Confident	138 Å²	138	76.1 Å²	76.1	84%	0.836	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-38.9	179.4	-176.7	0	0	0	0	112.3
53	W	89.8	Confident	87.1	Confident	239 Å²	239	71.5 Å²	71.5	91%	0.905	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-39.4	177.5	-70.1	102.1	0	0	0	114.8	T51	T51-W53 PolarHBondContact O-N 3.42Å
54	N	92.2	Very high	86.9	Confident	63 Å²	63	74 Å²	74	34%	0.337	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.9	-176.6	82.9	23.4	0	0	0	113.9	Y50 T51 P57 K58	Y50-N54 WeakPolarHBondContact CA-OD1 3.31Å; T51-N54 PolarHBondContact N-OD1 3.39Å; T51-N54 PolarHBondContact O-N 3.44Å; T51-N54 VanDerWaalsContact OG1-CG 3.27Å; T51-N54 PolarHBondContact OG1-N 2.96Å; T51-N54 PolarHBondContact OG1-ND2 3.06Å; N54-P57 WeakPolarHBondContact O-CD 3.47Å; N54-K58 WeakPolarHBondContact O-CB 3.34Å; N54-K58 PolarHBondContact O-N 3.05Å
55	F	91.3	Very high	86.6	Confident	51 Å²	51	73.9 Å²	73.9	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-52.4	-63.3	-178.6	177	-101.7	0	0	0	111.5	Y50 T51 K58 N59 A103	Y50-F55 HydrophobicContact CD1-CD2 4.29Å; Y50-F55 AromaticContact CD2-CD2 3.85Å; Y50-F55 HydrophobicContact CD2-CD2 3.85Å; Y50-F55 HydrophobicContact CD2-CE2 4.14Å; Y50-F55 HydrophobicContact CE2-CE2 4.45Å; Y50-F55 AromaticContact CG-CD2 3.74Å; Y50-F55 HydrophobicContact CG-CD2 3.74Å; Y50-F55 HydrophobicContact CG-CE2 4.44Å; T51-F55 WeakPolarHBondContact O-CB 3.32Å; T51-F55 PolarHBondContact O-N 2.89Å; F55-K58 PolarHBondContact O-N 3.3Å; F55-N59 HydrophobicContact CE2-CB 4.35Å; F55-N59 HydrophobicContact CZ-CB 4.42Å; F55-N59 WeakPolarHBondContact O-CA 3.25Å; F55-N59 WeakPolarHBondContact O-CB 3.46Å; F55-N59 PolarHBondContact O-N 3.19Å; F55-A103 HydrophobicContact CZ-CB 4.45Å; F55-A103 WeakPolarHBondContact CZ-O 3.07Å
56	L	90.6	Very high	86.5	Confident	108 Å²	108	75 Å²	75	57%	0.565	36%	0.363	S	S	*	.	H	α-helix	trans	-60.3	-49.8	-174.2	-175.8	69.7	0	0	0	112.9	K58 L60	L56-K58 PolarHBondContact O-N 3.03Å; L56-L60 HydrophobicContact CD1-CD1 3.75Å; L56-L60 HydrophobicContact CD1-CD2 4.46Å; L56-L60 HydrophobicContact CD1-CG 3.94Å; L56-L60 HydrophobicContact CG-CD1 3.88Å; L56-L60 HydrophobicContact CG-CG 4.39Å; L56-L60 WeakPolarHBondContact O-CB 3.42Å; L56-L60 VanDerWaalsContact O-CG 3.23Å; L56-L60 WeakPolarHBondContact O-CG 3.17Å; L56-L60 PolarHBondContact O-N 3.09Å
57	P	92.6	Very high	86.4	Confident	92 Å²	92	75.7 Å²	75.7	60%	0.597	36%	0.364	S	S	*	.	H	α-helix	trans	-63.2	-40.6	178.9	-23.8	35	0	0	0	113.9	N54 F61	N54-P57 WeakPolarHBondContact O-CD 3.47Å; P57-F61 WeakPolarHBondContact O-CB 3.39Å; P57-F61 PolarHBondContact O-N 2.85Å
58	K	88.9	Confident	86.6	Confident	75 Å²	75	74.3 Å²	74.3	33%	0.326	35%	0.354	S	S	.	.	H	α-helix	trans	-75.1	-42	-178	-175	178.4	160.8	-174.5	0	111.7	K49 Y50 N54 F55 L56 F61 E62	K49-K58 PolarHBondContact O-NZ 2.81Å; Y50-K58 HydrophobicContact CD1-CB 4.2Å; Y50-K58 HydrophobicContact CD1-CD 3.8Å; Y50-K58 HydrophobicContact CD1-CG 4.12Å; Y50-K58 HydrophobicContact CE1-CB 4.32Å; Y50-K58 HydrophobicContact CE1-CD 3.92Å; Y50-K58 HydrophobicContact CE1-CG 3.94Å; N54-K58 WeakPolarHBondContact O-CB 3.34Å; N54-K58 PolarHBondContact O-N 3.05Å; F55-K58 PolarHBondContact O-N 3.3Å; L56-K58 PolarHBondContact O-N 3.03Å; K58-F61 PolarHBondContact O-N 3.26Å; K58-E62 WeakPolarHBondContact CE-OE1 3.05Å; K58-E62 WeakPolarHBondContact CG-OE1 3.38Å; K58-E62 IonicContact NZ-OE1 3.05Å; K58-E62 WeakPolarHBondContact O-CB 2.9Å; K58-E62 WeakPolarHBondContact O-CG 3.39Å; K58-E62 PolarHBondContact O-N 2.84Å
59	N	89.1	Confident	86.9	Confident	1 Å²	1	73.7 Å²	73.7	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-62.7	-49.3	177.8	-169.9	-79.7	0	0	0	110.9	F55 F61 E62 Q63 Q106	F55-N59 HydrophobicContact CE2-CB 4.35Å; F55-N59 HydrophobicContact CZ-CB 4.42Å; F55-N59 WeakPolarHBondContact O-CA 3.25Å; F55-N59 WeakPolarHBondContact O-CB 3.46Å; F55-N59 PolarHBondContact O-N 3.19Å; N59-F61 VanDerWaalsContact C-N 3.33Å; N59-F61 PolarHBondContact O-N 3.19Å; N59-E62 PolarHBondContact O-N 3.4Å; N59-Q63 WeakPolarHBondContact O-CB 3.4Å; N59-Q63 WeakPolarHBondContact O-CG 3.47Å; N59-Q63 PolarHBondContact O-N 2.8Å; N59-Q63 PolarHBondContact OD1-NE2 3.1Å; N59-Q106 PolarHBondContact ND2-OE1 2.88Å
60	L	89.4	Confident	87.5	Confident	56 Å²	56	74.7 Å²	74.7	29%	0.293	35%	0.354	S	S	.	.	H	α-helix	trans	-59.4	-41.7	176	-69.4	176.5	0	0	0	112	L56 Q63 F64 I99	L56-L60 HydrophobicContact CD1-CD1 3.75Å; L56-L60 HydrophobicContact CD1-CD2 4.46Å; L56-L60 HydrophobicContact CD1-CG 3.94Å; L56-L60 HydrophobicContact CG-CD1 3.88Å; L56-L60 HydrophobicContact CG-CG 4.39Å; L56-L60 WeakPolarHBondContact O-CB 3.42Å; L56-L60 VanDerWaalsContact O-CG 3.23Å; L56-L60 WeakPolarHBondContact O-CG 3.17Å; L56-L60 PolarHBondContact O-N 3.09Å; L60-Q63 PolarHBondContact O-N 2.75Å; L60-F64 HydrophobicContact CB-CD2 4.38Å; L60-F64 HydrophobicContact CD2-CE2 4.2Å; L60-F64 WeakPolarHBondContact O-CB 3.37Å; L60-F64 VanDerWaalsContact O-CD2 3.24Å; L60-F64 WeakPolarHBondContact O-CD2 3.22Å; L60-F64 PolarHBondContact O-N 3.44Å; L60-I99 HydrophobicContact CD2-CG2 3.52Å
61	F	89.3	Confident	87.7	Confident	150 Å²	150	74.9 Å²	74.9	66%	0.658	36%	0.355	S	S	*	.	H	α-helix	trans	-63.1	-43.5	175.4	-179.6	-97.3	0	0	0	112.4	P57 K58 N59 Q63 R65	P57-F61 WeakPolarHBondContact O-CB 3.39Å; P57-F61 PolarHBondContact O-N 2.85Å; K58-F61 PolarHBondContact O-N 3.26Å; N59-F61 VanDerWaalsContact C-N 3.33Å; N59-F61 PolarHBondContact O-N 3.19Å; F61-Q63 VanDerWaalsContact C-N 3.34Å; F61-Q63 PolarHBondContact O-N 2.71Å; F61-R65 WeakPolarHBondContact O-CB 3.44Å; F61-R65 PolarHBondContact O-N 3.02Å
62	E	84.1	Confident	87.7	Confident	63 Å²	63	72.1 Å²	72.1	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-65.6	-35.8	177.1	-75	173.1	-171.1	0	0	112.3	Y50 K58 N59	Y50-E62 PolarHBondContact OH-OE2 2.92Å; K58-E62 WeakPolarHBondContact CE-OE1 3.05Å; K58-E62 WeakPolarHBondContact CG-OE1 3.38Å; K58-E62 IonicContact NZ-OE1 3.05Å; K58-E62 WeakPolarHBondContact O-CB 2.9Å; K58-E62 WeakPolarHBondContact O-CG 3.39Å; K58-E62 PolarHBondContact O-N 2.84Å; N59-E62 PolarHBondContact O-N 3.4Å
63	Q	85.4	Confident	87.9	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.009	31%	0.31	C	S	.	.	H	α-helix	trans	-71.7	-46	174.4	-72	-158	51.9	0	0	113.3	N59 L60 F61 R65 R66 N69 I99 T102	N59-Q63 WeakPolarHBondContact O-CB 3.4Å; N59-Q63 WeakPolarHBondContact O-CG 3.47Å; N59-Q63 PolarHBondContact O-N 2.8Å; N59-Q63 PolarHBondContact OD1-NE2 3.1Å; L60-Q63 PolarHBondContact O-N 2.75Å; F61-Q63 VanDerWaalsContact C-N 3.34Å; F61-Q63 PolarHBondContact O-N 2.71Å; Q63-R65 VanDerWaalsContact C-N 3.25Å; Q63-R65 PolarHBondContact O-N 2.75Å; Q63-R66 WeakPolarHBondContact O-CB 3.43Å; Q63-R66 PolarHBondContact O-N 3.3Å; Q63-R66 VanDerWaalsContact O-N 3.17Å; Q63-N69 PolarHBondContact O-ND2 3.17Å; Q63-I99 HydrophobicContact CB-CD1 4.21Å; Q63-I99 PolarHBondContact NE2-O 3.48Å; Q63-T102 HydrophobicContact CG-CG2 4.04Å
64	F	88.1	Confident	87.9	Confident	53 Å²	53	60.1 Å²	60.1	23%	0.232	29%	0.285	C	S	.	.	H	α-helix	trans	-75.7	-9.9	179.8	-75.6	-61.4	0	0	0	113.7	L60 R66 N69 L73 I99	L60-F64 HydrophobicContact CB-CD2 4.38Å; L60-F64 HydrophobicContact CD2-CE2 4.2Å; L60-F64 WeakPolarHBondContact O-CB 3.37Å; L60-F64 VanDerWaalsContact O-CD2 3.24Å; L60-F64 WeakPolarHBondContact O-CD2 3.22Å; L60-F64 PolarHBondContact O-N 3.44Å; F64-R66 PolarHBondContact O-N 3.44Å; F64-N69 HydrophobicContact CD1-CB 3.9Å; F64-N69 HydrophobicContact CE1-CB 4.28Å; F64-L73 HydrophobicContact CD1-CB 4.24Å; F64-L73 HydrophobicContact CD1-CD2 3.99Å; F64-L73 HydrophobicContact CE1-CB 3.89Å; F64-L73 HydrophobicContact CE1-CD1 4.48Å; F64-L73 HydrophobicContact CE1-CD2 4.01Å; F64-L73 HydrophobicContact CE1-CG 4.35Å; F64-L73 HydrophobicContact CG-CD2 4.36Å; F64-L73 HydrophobicContact CZ-CD1 4.49Å; F64-L73 HydrophobicContact CZ-CD2 4.37Å; F64-I99 HydrophobicContact CE1-CD1 4.12Å; F64-I99 HydrophobicContact CZ-CD1 4.05Å; F64-I99 HydrophobicContact CZ-CG1 4.19Å
65	R	84.8	Confident	87.8	Confident	142 Å²	142	57.4 Å²	57.4	54%	0.536	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-11.6	164.9	-168.1	176	62.2	148	-3.3	113.1	F61 Q63	F61-R65 WeakPolarHBondContact O-CB 3.44Å; F61-R65 PolarHBondContact O-N 3.02Å; Q63-R65 VanDerWaalsContact C-N 3.25Å; Q63-R65 PolarHBondContact O-N 2.75Å
66	R	81.8	Confident	87.8	Confident	53 Å²	53	58.2 Å²	58.2	20%	0.2	27%	0.274	C	S	.	.	S	Bend	trans	-81.8	131.2	172.8	-64.5	176.2	169.2	168.5	-4.8	110.8	Q63 F64 A68 N69 F70 E357	Q63-R66 WeakPolarHBondContact O-CB 3.43Å; Q63-R66 PolarHBondContact O-N 3.3Å; Q63-R66 VanDerWaalsContact O-N 3.17Å; F64-R66 PolarHBondContact O-N 3.44Å; R66-A68 VanDerWaalsContact C-N 3.3Å; R66-A68 PolarHBondContact O-N 2.99Å; R66-N69 HydrophobicContact CB-CB 4.37Å; R66-N69 PolarHBondContact O-N 3.07Å; R66-N69 VanDerWaalsContact O-N 3.17Å; R66-F70 PolarHBondContact O-N 3.49Å; R66-E357 IonicContact CZ-OE1 3.17Å; R66-E357 IonicContact NH1-OE1 3.53Å; R66-E357 PolarHBondContact NH1-OE1 3.11Å; R66-E357 IonicContact NH1-OE2 2.84Å; R66-E357 IonicContact NH2-OE1 2.7Å; R66-E357 PolarHBondContact NH2-OE1 2.98Å
67	I	83	Confident	87.8	Confident	81 Å²	81	57.1 Å²	57.1	42%	0.415	27%	0.268	S	S	.	.	H	α-helix	trans	-52.6	-45.3	-175.5	-58.8	172.9	0	0	0	112	F70 Y71 L287	I67-F70 PolarHBondContact O-N 2.95Å; I67-Y71 WeakPolarHBondContact O-CB 3.31Å; I67-Y71 PolarHBondContact O-N 2.93Å; I67-L287 HydrophobicContact CG2-CD2 3.96Å
68	A	81.7	Confident	87.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-49	-180	0	0	0	0	0	112.9	R66 F70 Y71 F72 L287 Y353	R66-A68 VanDerWaalsContact C-N 3.3Å; R66-A68 PolarHBondContact O-N 2.99Å; A68-F70 VanDerWaalsContact C-N 3.29Å; A68-F70 PolarHBondContact O-N 2.76Å; A68-Y71 WeakPolarHBondContact O-CB 3.17Å; A68-Y71 PolarHBondContact O-N 3.14Å; A68-F72 HydrophobicContact CB-CE2 4.26Å; A68-F72 WeakPolarHBondContact O-CD2 3.39Å; A68-F72 PolarHBondContact O-N 3.23Å; A68-L287 HydrophobicContact CB-CD1 3.68Å; A68-Y353 HydrophobicContact CB-CD2 3.87Å; A68-Y353 HydrophobicContact CB-CE2 3.25Å
69	N	86.6	Confident	87.8	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-39.1	-179.9	-69.3	-1.9	0	0	0	111.2	Q63 F64 R66 L73 I99	Q63-N69 PolarHBondContact O-ND2 3.17Å; F64-N69 HydrophobicContact CD1-CB 3.9Å; F64-N69 HydrophobicContact CE1-CB 4.28Å; R66-N69 HydrophobicContact CB-CB 4.37Å; R66-N69 PolarHBondContact O-N 3.07Å; R66-N69 VanDerWaalsContact O-N 3.17Å; N69-L73 WeakPolarHBondContact O-CB 3.34Å; N69-L73 PolarHBondContact O-N 2.87Å; N69-I99 HydrophobicContact CB-CD1 4.39Å
70	F	88.6	Confident	87.9	Confident	116 Å²	116	54.8 Å²	54.8	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-66.3	-42.6	174.5	-172.5	-115.4	0	0	0	112.6	R66 I67 A68 L73 I74	R66-F70 PolarHBondContact O-N 3.49Å; I67-F70 PolarHBondContact O-N 2.95Å; A68-F70 VanDerWaalsContact C-N 3.29Å; A68-F70 PolarHBondContact O-N 2.76Å; F70-L73 WeakPolarHBondContact O-CB 3.43Å; F70-L73 PolarHBondContact O-N 3.48Å; F70-I74 HydrophobicContact CD1-CD1 3.93Å; F70-I74 HydrophobicContact CE1-CD1 3.6Å; F70-I74 HydrophobicContact CZ-CD1 3.99Å; F70-I74 WeakPolarHBondContact O-CG1 3.42Å; F70-I74 PolarHBondContact O-N 3.22Å
71	Y	89	Confident	87.9	Confident	20 Å²	20	58.7 Å²	58.7	8%	0.078	28%	0.277	C	S	.	.	H	α-helix	trans	-59.1	-47.1	173.8	163.2	-97.4	0	0	0	112	I67 A68 L73 I74 I75 L291 L294 I348	I67-Y71 WeakPolarHBondContact O-CB 3.31Å; I67-Y71 PolarHBondContact O-N 2.93Å; A68-Y71 WeakPolarHBondContact O-CB 3.17Å; A68-Y71 PolarHBondContact O-N 3.14Å; Y71-L73 VanDerWaalsContact C-N 3.32Å; Y71-L73 PolarHBondContact O-N 2.8Å; Y71-I74 WeakPolarHBondContact O-CB 3.46Å; Y71-I74 PolarHBondContact O-N 2.76Å; Y71-I75 HydrophobicContact CD2-CG1 4.2Å; Y71-I75 HydrophobicContact CE1-CG1 4.04Å; Y71-I75 HydrophobicContact CE2-CD1 3.9Å; Y71-I75 HydrophobicContact CE2-CG1 3.62Å; Y71-I75 WeakPolarHBondContact O-CG1 3.24Å; Y71-I75 PolarHBondContact O-N 2.71Å; Y71-L291 HydrophobicContact CD2-CD1 4.02Å; Y71-L291 HydrophobicContact CE2-CD1 3.94Å; Y71-L294 HydrophobicContact CE2-CD2 3.95Å; Y71-L294 WeakPolarHBondContact OH-CD2 3.16Å; Y71-I348 HydrophobicContact CD1-CD1 4.09Å; Y71-I348 HydrophobicContact CE1-CB 4.12Å; Y71-I348 HydrophobicContact CE1-CD1 3.76Å; Y71-I348 HydrophobicContact CE1-CG1 4.23Å; Y71-I348 HydrophobicContact CE2-CD1 4.36Å
72	F	88.6	Confident	87.9	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-67.5	-31.8	178.4	-65.9	-56.9	0	0	0	112.9	A68 I75 F76 L95 I348 V350	A68-F72 HydrophobicContact CB-CE2 4.26Å; A68-F72 WeakPolarHBondContact O-CD2 3.39Å; A68-F72 PolarHBondContact O-N 3.23Å; F72-I75 PolarHBondContact O-N 3.07Å; F72-F76 WeakPolarHBondContact O-CB 3.28Å; F72-F76 PolarHBondContact O-N 2.82Å; F72-L95 HydrophobicContact CB-CD1 3.95Å; F72-L95 HydrophobicContact CB-CD2 4.08Å; F72-L95 HydrophobicContact CB-CG 4.47Å; F72-I348 HydrophobicContact CE1-CB 4.29Å; F72-I348 HydrophobicContact CE1-CG2 4.46Å; F72-I348 HydrophobicContact CE2-CG2 4.35Å; F72-I348 HydrophobicContact CZ-CB 3.94Å; F72-I348 HydrophobicContact CZ-CG2 3.69Å; F72-I348 WeakPolarHBondContact CZ-O 3.3Å; F72-V350 HydrophobicContact CD1-CG2 3.76Å; F72-V350 HydrophobicContact CD2-CG1 4.41Å; F72-V350 HydrophobicContact CD2-CG2 4.27Å; F72-V350 HydrophobicContact CE1-CB 4.42Å; F72-V350 HydrophobicContact CE1-CG2 3.35Å; F72-V350 HydrophobicContact CE2-CB 4.17Å; F72-V350 HydrophobicContact CE2-CG1 4.4Å; F72-V350 HydrophobicContact CE2-CG2 3.93Å; F72-V350 HydrophobicContact CG-CG2 4.22Å; F72-V350 HydrophobicContact CZ-CB 4.07Å; F72-V350 HydrophobicContact CZ-CG2 3.45Å; F72-V350 VanDerWaalsContact CZ-CG2 3.45Å
73	L	90.2	Very high	87.8	Confident	50 Å²	50	57.2 Å²	57.2	26%	0.262	28%	0.279	S	S	.	.	H	α-helix	trans	-62.6	-43.9	170.9	-179.3	62.2	0	0	0	111.6	F64 N69 F70 Y71 F76 L77	F64-L73 HydrophobicContact CD1-CB 4.24Å; F64-L73 HydrophobicContact CD1-CD2 3.99Å; F64-L73 HydrophobicContact CE1-CB 3.89Å; F64-L73 HydrophobicContact CE1-CD1 4.48Å; F64-L73 HydrophobicContact CE1-CD2 4.01Å; F64-L73 HydrophobicContact CE1-CG 4.35Å; F64-L73 HydrophobicContact CG-CD2 4.36Å; F64-L73 HydrophobicContact CZ-CD1 4.49Å; F64-L73 HydrophobicContact CZ-CD2 4.37Å; N69-L73 WeakPolarHBondContact O-CB 3.34Å; N69-L73 PolarHBondContact O-N 2.87Å; F70-L73 WeakPolarHBondContact O-CB 3.43Å; F70-L73 PolarHBondContact O-N 3.48Å; Y71-L73 VanDerWaalsContact C-N 3.32Å; Y71-L73 PolarHBondContact O-N 2.8Å; L73-F76 PolarHBondContact O-N 2.79Å; L73-L77 HydrophobicContact CD1-CD1 4.49Å; L73-L77 HydrophobicContact CG-CD1 4.28Å; L73-L77 VanDerWaalsContact O-CG 3.31Å; L73-L77 WeakPolarHBondContact O-CG 3.24Å; L73-L77 PolarHBondContact O-N 2.91Å
74	I	91	Very high	87.8	Confident	76 Å²	76	58.2 Å²	58.2	39%	0.39	29%	0.286	S	S	.	.	H	α-helix	trans	-60.3	-47.8	174.4	-69.1	167	0	0	0	110.7	F70 Y71 F76 L77 V78	F70-I74 HydrophobicContact CD1-CD1 3.93Å; F70-I74 HydrophobicContact CE1-CD1 3.6Å; F70-I74 HydrophobicContact CZ-CD1 3.99Å; F70-I74 WeakPolarHBondContact O-CG1 3.42Å; F70-I74 PolarHBondContact O-N 3.22Å; Y71-I74 WeakPolarHBondContact O-CB 3.46Å; Y71-I74 PolarHBondContact O-N 2.76Å; I74-F76 VanDerWaalsContact C-N 3.33Å; I74-F76 PolarHBondContact O-N 2.91Å; I74-L77 PolarHBondContact O-N 2.72Å; I74-V78 HydrophobicContact CG2-CG2 4.4Å; I74-V78 WeakPolarHBondContact O-CG2 3.37Å; I74-V78 PolarHBondContact O-N 2.55Å
75	I	90.5	Very high	87.5	Confident	6 Å²	6	57.9 Å²	57.9	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-38.2	-179.8	-68.1	-67.7	0	0	0	112.1	Y71 F72 V78 Q79 N345	Y71-I75 HydrophobicContact CD2-CG1 4.2Å; Y71-I75 HydrophobicContact CE1-CG1 4.04Å; Y71-I75 HydrophobicContact CE2-CD1 3.9Å; Y71-I75 HydrophobicContact CE2-CG1 3.62Å; Y71-I75 WeakPolarHBondContact O-CG1 3.24Å; Y71-I75 PolarHBondContact O-N 2.71Å; F72-I75 PolarHBondContact O-N 3.07Å; I75-V78 PolarHBondContact O-N 2.72Å; I75-Q79 PolarHBondContact O-N 2.95Å; I75-N345 HydrophobicContact CG2-CB 3.94Å; I75-N345 VanDerWaalsContact CG2-ND2 3.29Å; I75-N345 WeakPolarHBondContact CG2-ND2 3.42Å
76	F	90.9	Very high	87.4	Confident	68 Å²	68	51.6 Å²	51.6	30%	0.298	27%	0.266	S	S	.	.	H	α-helix	trans	-64.8	-44.1	173.5	175.2	-112.6	0	0	0	112	F72 L73 I74 V78 Q79 V80 P88	F72-F76 WeakPolarHBondContact O-CB 3.28Å; F72-F76 PolarHBondContact O-N 2.82Å; L73-F76 PolarHBondContact O-N 2.79Å; I74-F76 VanDerWaalsContact C-N 3.33Å; I74-F76 PolarHBondContact O-N 2.91Å; F76-V78 VanDerWaalsContact C-N 3.34Å; F76-V78 PolarHBondContact O-N 3.26Å; F76-Q79 PolarHBondContact O-N 2.8Å; F76-V80 HydrophobicContact CD2-CG2 4.36Å; F76-V80 HydrophobicContact CE1-CG2 4.36Å; F76-V80 HydrophobicContact CE2-CG2 3.93Å; F76-V80 HydrophobicContact CZ-CG2 3.93Å; F76-V80 WeakPolarHBondContact O-CG2 3.36Å; F76-V80 PolarHBondContact O-N 2.85Å; F76-P88 HydrophobicContact CE2-CB 4.28Å
77	L	91.2	Very high	87.5	Confident	84 Å²	84	52 Å²	52	44%	0.44	28%	0.277	S	S	.	.	H	α-helix	trans	-62.3	-39.9	175	-70.1	169.5	0	0	0	111.9	L73 I74 V80 I81	L73-L77 HydrophobicContact CD1-CD1 4.49Å; L73-L77 HydrophobicContact CG-CD1 4.28Å; L73-L77 VanDerWaalsContact O-CG 3.31Å; L73-L77 WeakPolarHBondContact O-CG 3.24Å; L73-L77 PolarHBondContact O-N 2.91Å; I74-L77 PolarHBondContact O-N 2.72Å; L77-V80 PolarHBondContact O-N 2.89Å; L77-I81 WeakPolarHBondContact O-CB 3.5Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.26Å; L77-I81 PolarHBondContact O-N 3.08Å
78	V	91.3	Very high	87.7	Confident	24 Å²	24	50.2 Å²	50.2	15%	0.145	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-45	173.7	171.6	0	0	0	0	111	I74 I75 F76 V80 I81 V82 L338 V342	I74-V78 HydrophobicContact CG2-CG2 4.4Å; I74-V78 WeakPolarHBondContact O-CG2 3.37Å; I74-V78 PolarHBondContact O-N 2.55Å; I75-V78 PolarHBondContact O-N 2.72Å; F76-V78 VanDerWaalsContact C-N 3.34Å; F76-V78 PolarHBondContact O-N 3.26Å; V78-V80 VanDerWaalsContact C-N 3.27Å; V78-V80 PolarHBondContact O-N 3.43Å; V78-I81 PolarHBondContact O-N 3.48Å; V78-V82 HydrophobicContact CG1-CB 4.38Å; V78-V82 HydrophobicContact CG1-CG2 4.16Å; V78-V82 WeakPolarHBondContact O-CA 3.48Å; V78-V82 VanDerWaalsContact O-CB 3.28Å; V78-V82 WeakPolarHBondContact O-CB 3.23Å; V78-V82 PolarHBondContact O-N 2.79Å; V78-L338 HydrophobicContact CG1-CB 4.11Å; V78-L338 HydrophobicContact CG1-CD1 4.43Å; V78-V342 HydrophobicContact CB-CG2 4.44Å; V78-V342 HydrophobicContact CG1-CG2 3.75Å
79	Q	90.3	Very high	87.8	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.028	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-30.7	175.5	-81.4	-175.4	-37	0	0	113.8	I75 F76 T86 P88 T90 S91 V342	I75-Q79 PolarHBondContact O-N 2.95Å; F76-Q79 PolarHBondContact O-N 2.8Å; Q79-T86 PolarHBondContact NE2-OG1 2.83Å; Q79-P88 HydrophobicContact CB-CB 4.18Å; Q79-P88 HydrophobicContact CB-CG 4.2Å; Q79-P88 WeakPolarHBondContact O-CG 3.34Å; Q79-T90 PolarHBondContact NE2-OG1 3.24Å; Q79-S91 PolarHBondContact NE2-OG 3.5Å; Q79-S91 VanDerWaalsContact NE2-OG 3.16Å; Q79-S91 PolarHBondContact OE1-OG 2.95Å; Q79-V342 HydrophobicContact CG-CB 4.5Å; Q79-V342 HydrophobicContact CG-CG1 3.57Å; Q79-V342 HydrophobicContact CG-CG2 4.04Å
80	V	91.3	Very high	87.6	Confident	89 Å²	89	54.2 Å²	54.2	54%	0.539	30%	0.295	S	S	.	.	H	α-helix	trans	-81.3	-30.3	179.2	171.8	0	0	0	0	112.4	F76 L77 V78 P88	F76-V80 HydrophobicContact CD2-CG2 4.36Å; F76-V80 HydrophobicContact CE1-CG2 4.36Å; F76-V80 HydrophobicContact CE2-CG2 3.93Å; F76-V80 HydrophobicContact CZ-CG2 3.93Å; F76-V80 WeakPolarHBondContact O-CG2 3.36Å; F76-V80 PolarHBondContact O-N 2.85Å; L77-V80 PolarHBondContact O-N 2.89Å; V78-V80 VanDerWaalsContact C-N 3.27Å; V78-V80 PolarHBondContact O-N 3.43Å; V80-P88 HydrophobicContact CG2-CB 4.07Å; V80-P88 HydrophobicContact CG2-CG 4.39Å
81	I	89.3	Confident	87.3	Confident	138 Å²	138	49 Å²	49	71%	0.708	27%	0.273	S	S	*	.	H	α-helix	trans	-92.5	-31.9	-177.2	-65.4	167	0	0	0	112.2	L77 V78	L77-I81 WeakPolarHBondContact O-CB 3.5Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.26Å; L77-I81 PolarHBondContact O-N 3.08Å; V78-I81 PolarHBondContact O-N 3.48Å
82	V	87.4	Confident	87.1	Confident	25 Å²	25	48.7 Å²	48.7	15%	0.152	28%	0.276	C	S	.	.	S	Bend	trans	-113	132.4	-172.1	-172.7	0	0	0	0	110.5	V78 T84 T335 L338	V78-V82 HydrophobicContact CG1-CB 4.38Å; V78-V82 HydrophobicContact CG1-CG2 4.16Å; V78-V82 WeakPolarHBondContact O-CA 3.48Å; V78-V82 VanDerWaalsContact O-CB 3.28Å; V78-V82 WeakPolarHBondContact O-CB 3.23Å; V78-V82 PolarHBondContact O-N 2.79Å; V82-T84 HydrophobicContact CB-CG2 4.06Å; V82-T84 HydrophobicContact CG1-CG2 4.07Å; V82-T84 VanDerWaalsContact O-CG2 3.3Å; V82-T84 WeakPolarHBondContact O-CG2 3.26Å; V82-T84 PolarHBondContact O-N 3.02Å; V82-T84 VanDerWaalsContact O-N 3.08Å; V82-T84 PolarHBondContact O-OG1 3.24Å; V82-T335 HydrophobicContact CG1-CG2 3.8Å; V82-L338 HydrophobicContact CG2-CD1 4.36Å
83	D	83.1	Confident	86.9	Confident	157 Å²	157	52.7 Å²	52.7	84%	0.84	30%	0.298	S	S	*	.			trans	-63.4	109.4	173.1	-135.7	-24	0	0	0	109
84	T	86.2	Confident	86.5	Confident	24 Å²	24	50.9 Å²	50.9	15%	0.147	29%	0.288	C	S	.	.			trans	-130.9	151.1	-163.2	40.8	0	0	0	0	111.3	V82 T86 V342	V82-T84 HydrophobicContact CB-CG2 4.06Å; V82-T84 HydrophobicContact CG1-CG2 4.07Å; V82-T84 VanDerWaalsContact O-CG2 3.3Å; V82-T84 WeakPolarHBondContact O-CG2 3.26Å; V82-T84 PolarHBondContact O-N 3.02Å; V82-T84 VanDerWaalsContact O-N 3.08Å; V82-T84 PolarHBondContact O-OG1 3.24Å; T84-T86 PolarHBondContact O-N 2.77Å; T84-V342 HydrophobicContact CG2-CB 4.32Å; T84-V342 HydrophobicContact CG2-CG1 4.31Å; T84-V342 HydrophobicContact CG2-CG2 4.11Å
85	P	80	Confident	86.2	Confident	45 Å²	45	47.8 Å²	47.8	29%	0.292	27%	0.273	S	S	.	.	S	Bend	trans	-68.2	-2.1	-170.2	29.4	-39.8	0	0	0	115.4	L343 Q922	P85-L343 HydrophobicContact CB-CD1 4.38Å; P85-L343 HydrophobicContact CG-CB 4.26Å; P85-L343 HydrophobicContact CG-CD1 3.97Å; P85-Q922 HydrophobicContact CB-CB 4.15Å; P85-Q922 WeakPolarHBondContact CB-O 3.31Å; P85-Q922 HydrophobicContact CG-CB 4.1Å
86	T	83.4	Confident	86.1	Confident	10 Å²	10	54.6 Å²	54.6	6%	0.061	30%	0.302	C	S	.	.	S	Bend	trans	-137.6	134.4	-174.8	54.5	0	0	0	0	109.3	Q79 T84 V342 L931	Q79-T86 PolarHBondContact NE2-OG1 2.83Å; T84-T86 PolarHBondContact O-N 2.77Å; T86-V342 WeakPolarHBondContact OG1-CG1 3.5Å; T86-L931 HydrophobicContact CG2-CD1 3.99Å
87	S	85.1	Confident	85.8	Confident	61 Å²	61	56 Å²	56	43%	0.427	31%	0.309	S	S	.	.			trans	-57.9	141.8	179.4	-179.3	0	0	0	0	112.4	V89 T90	S87-V89 PolarHBondContact O-N 3.23Å; S87-T90 PolarHBondContact O-N 2.97Å; S87-T90 PolarHBondContact O-OG1 3Å
88	P	86.1	Confident	85.5	Confident	44 Å²	44	52.2 Å²	52.2	29%	0.286	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-24.3	175.8	-27.1	34.2	0	0	0	114.8	F76 Q79 V80 T90 S91 G92	F76-P88 HydrophobicContact CE2-CB 4.28Å; Q79-P88 HydrophobicContact CB-CB 4.18Å; Q79-P88 HydrophobicContact CB-CG 4.2Å; Q79-P88 WeakPolarHBondContact O-CG 3.34Å; V80-P88 HydrophobicContact CG2-CB 4.07Å; V80-P88 HydrophobicContact CG2-CG 4.39Å; P88-T90 PolarHBondContact O-N 3.47Å; P88-S91 PolarHBondContact O-N 2.72Å; P88-G92 PolarHBondContact O-N 2.96Å
89	V	84.1	Confident	85.3	Confident	85 Å²	85	51.8 Å²	51.8	52%	0.515	29%	0.286	S	S	.	.	H	α-helix	trans	-57.8	-33	174.2	-177.7	0	0	0	0	111.6	S87 S91 L93	S87-V89 PolarHBondContact O-N 3.23Å; V89-S91 VanDerWaalsContact C-N 3.31Å; V89-S91 PolarHBondContact O-N 3.34Å; V89-L93 HydrophobicContact CG1-CB 4.31Å; V89-L93 HydrophobicContact CG1-CD1 4.35Å; V89-L93 WeakPolarHBondContact O-CB 3.28Å; V89-L93 PolarHBondContact O-N 2.61Å; V89-L93 VanDerWaalsContact O-N 3.12Å
90	T	82.4	Confident	85.3	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-70.3	-23.1	-173.4	68	0	0	0	0	114.2	Q79 S87 P88 P94 A928 T932	Q79-T90 PolarHBondContact NE2-OG1 3.24Å; S87-T90 PolarHBondContact O-N 2.97Å; S87-T90 PolarHBondContact O-OG1 3Å; P88-T90 PolarHBondContact O-N 3.47Å; T90-P94 WeakPolarHBondContact O-CD 3.38Å; T90-P94 VanDerWaalsContact O-CG 3.27Å; T90-P94 WeakPolarHBondContact O-CG 3.3Å; T90-A928 HydrophobicContact CG2-CB 3.97Å; T90-T932 HydrophobicContact CG2-CG2 4.12Å
91	S	81.8	Confident	85	Confident	7 Å²	7	51.5 Å²	51.5	5%	0.049	29%	0.285	C	S	.	.	H	α-helix	trans	-107.2	-35.5	172.8	-40.4	0	0	0	0	112.3	Q79 P88 V89 P94 L95 N345	Q79-S91 PolarHBondContact NE2-OG 3.5Å; Q79-S91 VanDerWaalsContact NE2-OG 3.16Å; Q79-S91 PolarHBondContact OE1-OG 2.95Å; P88-S91 PolarHBondContact O-N 2.72Å; V89-S91 VanDerWaalsContact C-N 3.31Å; V89-S91 PolarHBondContact O-N 3.34Å; S91-P94 WeakPolarHBondContact O-CD 3.4Å; S91-L95 WeakPolarHBondContact O-CB 3.39Å; S91-L95 PolarHBondContact O-N 2.92Å; S91-N345 PolarHBondContact OG-ND2 2.89Å
92	G	85.2	Confident	84.7	Confident	14 Å²	14	45 Å²	45	14%	0.144	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-43.2	-178	0	0	0	0	0	113.6	P88 L95 F96	P88-G92 PolarHBondContact O-N 2.96Å; G92-L95 PolarHBondContact O-N 3.34Å; G92-F96 WeakPolarHBondContact O-CB 3.48Å; G92-F96 PolarHBondContact O-N 3.09Å
93	L	84.5	Confident	84.8	Confident	91 Å²	91	44.6 Å²	44.6	48%	0.476	25%	0.251	S	S	.	.	H	α-helix	trans	-66.3	-47.9	-180	-176.5	159.7	0	0	0	112.4	V89 L95 F96 F97 I936	V89-L93 HydrophobicContact CG1-CB 4.31Å; V89-L93 HydrophobicContact CG1-CD1 4.35Å; V89-L93 WeakPolarHBondContact O-CB 3.28Å; V89-L93 PolarHBondContact O-N 2.61Å; V89-L93 VanDerWaalsContact O-N 3.12Å; L93-L95 VanDerWaalsContact C-N 3.33Å; L93-L95 PolarHBondContact O-N 2.61Å; L93-F96 PolarHBondContact O-N 3.01Å; L93-F97 WeakPolarHBondContact O-CB 3.35Å; L93-F97 PolarHBondContact O-N 2.89Å; L93-I936 HydrophobicContact CD2-CD1 3.91Å
94	P	81.7	Confident	85.1	Confident	11 Å²	11	41.9 Å²	41.9	7%	0.071	24%	0.239	C	C	.	.	H	α-helix	trans	-55.6	-44	172	-23.9	29.2	0	0	0	113.6	T90 S91 F97 V98 V350 I936	T90-P94 WeakPolarHBondContact O-CD 3.38Å; T90-P94 VanDerWaalsContact O-CG 3.27Å; T90-P94 WeakPolarHBondContact O-CG 3.3Å; S91-P94 WeakPolarHBondContact O-CD 3.4Å; P94-F97 PolarHBondContact O-N 3.03Å; P94-V98 WeakPolarHBondContact O-CG2 3.45Å; P94-V98 PolarHBondContact O-N 2.92Å; P94-V98 VanDerWaalsContact O-N 3.07Å; P94-V350 HydrophobicContact CB-CB 4.36Å; P94-V350 HydrophobicContact CB-CG1 3.85Å; P94-I936 HydrophobicContact CB-CD1 4.03Å; P94-I936 HydrophobicContact CG-CD1 3.94Å
95	L	85.5	Confident	85	Confident	11 Å²	11	41.8 Å²	41.8	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-65.3	-47.9	179.7	179.7	60.2	0	0	0	111.4	F72 S91 G92 L93 F97 V98 I99	F72-L95 HydrophobicContact CB-CD1 3.95Å; F72-L95 HydrophobicContact CB-CD2 4.08Å; F72-L95 HydrophobicContact CB-CG 4.47Å; S91-L95 WeakPolarHBondContact O-CB 3.39Å; S91-L95 PolarHBondContact O-N 2.92Å; G92-L95 PolarHBondContact O-N 3.34Å; L93-L95 VanDerWaalsContact C-N 3.33Å; L93-L95 PolarHBondContact O-N 2.61Å; L95-F97 VanDerWaalsContact C-N 3.32Å; L95-F97 PolarHBondContact O-N 2.93Å; L95-V98 PolarHBondContact O-N 3.04Å; L95-I99 HydrophobicContact CD1-CD1 4.3Å; L95-I99 HydrophobicContact CD1-CG1 3.95Å; L95-I99 HydrophobicContact CG-CG1 4.33Å; L95-I99 VanDerWaalsContact O-CG1 3.29Å; L95-I99 WeakPolarHBondContact O-CG1 3.31Å; L95-I99 PolarHBondContact O-N 2.93Å
96	F	88.1	Confident	85.1	Confident	149 Å²	149	40.8 Å²	40.8	65%	0.654	23%	0.228	S	C	*	.	H	α-helix	trans	-58.6	-43.2	177.7	177.5	-99.8	0	0	0	112	G92 L93 T100	G92-F96 WeakPolarHBondContact O-CB 3.48Å; G92-F96 PolarHBondContact O-N 3.09Å; L93-F96 PolarHBondContact O-N 3.01Å; F96-T100 VanDerWaalsContact O-CB 3.3Å; F96-T100 WeakPolarHBondContact O-CB 3.44Å; F96-T100 PolarHBondContact O-N 3.27Å; F96-T100 PolarHBondContact O-OG1 3.41Å
97	F	84.9	Confident	85.3	Confident	98 Å²	98	41.4 Å²	41.4	43%	0.43	24%	0.236	S	C	.	.	H	α-helix	trans	-59.8	-49.6	175.5	177.2	-100.1	0	0	0	112.1	L93 P94 L95 T100 V101	L93-F97 WeakPolarHBondContact O-CB 3.35Å; L93-F97 PolarHBondContact O-N 2.89Å; P94-F97 PolarHBondContact O-N 3.03Å; L95-F97 VanDerWaalsContact C-N 3.32Å; L95-F97 PolarHBondContact O-N 2.93Å; F97-T100 PolarHBondContact O-N 2.87Å; F97-V101 HydrophobicContact CD2-CG2 4.36Å; F97-V101 HydrophobicContact CE1-CG2 4.2Å; F97-V101 HydrophobicContact CE2-CG2 3.97Å; F97-V101 HydrophobicContact CZ-CG2 3.89Å; F97-V101 WeakPolarHBondContact O-CG2 3.47Å; F97-V101 PolarHBondContact O-N 3.4Å
98	V	83.3	Confident	85.4	Confident	4 Å²	4	44 Å²	44	2%	0.024	24%	0.238	C	C	.	.	H	α-helix	trans	-56.9	-53.6	177.3	167.7	0	0	0	0	111.3	P94 L95 T100 V101 T102 V350 V354	P94-V98 WeakPolarHBondContact O-CG2 3.45Å; P94-V98 PolarHBondContact O-N 2.92Å; P94-V98 VanDerWaalsContact O-N 3.07Å; L95-V98 PolarHBondContact O-N 3.04Å; V98-T100 VanDerWaalsContact C-N 3.27Å; V98-T100 PolarHBondContact O-N 2.81Å; V98-V101 PolarHBondContact O-N 2.68Å; V98-T102 PolarHBondContact O-N 2.83Å; V98-T102 PolarHBondContact O-OG1 2.86Å; V98-V350 HydrophobicContact CG2-CG1 4.02Å; V98-V354 HydrophobicContact CB-CB 4.48Å; V98-V354 HydrophobicContact CG1-CB 4.27Å; V98-V354 HydrophobicContact CG2-CB 4.02Å; V98-V354 HydrophobicContact CG2-CG1 3.78Å
99	I	88.2	Confident	85	Confident	15 Å²	15	44.2 Å²	44.2	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-38.8	-177.6	-63.4	-64.7	0	0	0	111.3	L60 Q63 F64 N69 L95 A103	L60-I99 HydrophobicContact CD2-CG2 3.52Å; Q63-I99 HydrophobicContact CB-CD1 4.21Å; Q63-I99 PolarHBondContact NE2-O 3.48Å; F64-I99 HydrophobicContact CE1-CD1 4.12Å; F64-I99 HydrophobicContact CZ-CD1 4.05Å; F64-I99 HydrophobicContact CZ-CG1 4.19Å; N69-I99 HydrophobicContact CB-CD1 4.39Å; L95-I99 HydrophobicContact CD1-CD1 4.3Å; L95-I99 HydrophobicContact CD1-CG1 3.95Å; L95-I99 HydrophobicContact CG-CG1 4.33Å; L95-I99 VanDerWaalsContact O-CG1 3.29Å; L95-I99 WeakPolarHBondContact O-CG1 3.31Å; L95-I99 PolarHBondContact O-N 2.93Å; I99-A103 VanDerWaalsContact O-CB 3.25Å; I99-A103 WeakPolarHBondContact O-CB 3.35Å; I99-A103 PolarHBondContact O-N 2.68Å
100	T	89.4	Confident	85	Confident	56 Å²	56	40.3 Å²	40.3	34%	0.344	21%	0.211	S	C	.	.	H	α-helix	trans	-66.4	-47	178.2	-56.2	0	0	0	0	111.4	F96 F97 V98 A103 V104	F96-T100 VanDerWaalsContact O-CB 3.3Å; F96-T100 WeakPolarHBondContact O-CB 3.44Å; F96-T100 PolarHBondContact O-N 3.27Å; F96-T100 PolarHBondContact O-OG1 3.41Å; F97-T100 PolarHBondContact O-N 2.87Å; V98-T100 VanDerWaalsContact C-N 3.27Å; V98-T100 PolarHBondContact O-N 2.81Å; T100-A103 PolarHBondContact O-N 3Å; T100-V104 WeakPolarHBondContact O-CG2 3.13Å; T100-V104 PolarHBondContact O-N 2.75Å
101	V	85.6	Confident	85.2	Confident	34 Å²	34	47 Å²	47	21%	0.206	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-44.4	-179.7	173.5	0	0	0	0	111.3	F97 V98 A103 V104 K105 V354 M358	F97-V101 HydrophobicContact CD2-CG2 4.36Å; F97-V101 HydrophobicContact CE1-CG2 4.2Å; F97-V101 HydrophobicContact CE2-CG2 3.97Å; F97-V101 HydrophobicContact CZ-CG2 3.89Å; F97-V101 WeakPolarHBondContact O-CG2 3.47Å; F97-V101 PolarHBondContact O-N 3.4Å; V98-V101 PolarHBondContact O-N 2.68Å; V101-A103 VanDerWaalsContact C-N 3.32Å; V101-A103 PolarHBondContact O-N 2.93Å; V101-V104 PolarHBondContact O-N 2.73Å; V101-K105 PolarHBondContact O-N 3.32Å; V101-V354 HydrophobicContact CB-CG2 3.78Å; V101-V354 HydrophobicContact CG1-CG2 3.52Å; V101-V354 HydrophobicContact CG2-CG2 4.45Å; V101-M358 HydrophobicContact CG1-CE 3.73Å
102	T	83.4	Confident	85.1	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-39.5	174.8	-59.9	0	0	0	0	111.7	Q63 V98 K105 Q106 E357	Q63-T102 HydrophobicContact CG-CG2 4.04Å; V98-T102 PolarHBondContact O-N 2.83Å; V98-T102 PolarHBondContact O-OG1 2.86Å; T102-K105 PolarHBondContact O-N 3.11Å; T102-Q106 WeakPolarHBondContact O-CG 3.36Å; T102-Q106 PolarHBondContact O-N 3.01Å; T102-Q106 VanDerWaalsContact O-N 3.09Å; T102-E357 WeakPolarHBondContact CB-OE2 3.35Å; T102-E357 VanDerWaalsContact CG2-OE2 3.24Å; T102-E357 WeakPolarHBondContact CG2-OE2 3.48Å; T102-E357 PolarHBondContact OG1-OE2 2.7Å
103	A	88.8	Confident	84.8	Confident	16 Å²	16	53.2 Å²	53.2	13%	0.132	26%	0.259	C	S	.	.	H	α-helix	trans	-65.1	-42.5	175.3	0	0	0	0	0	111.9	F55 I99 T100 V101 Q106 G107	F55-A103 HydrophobicContact CZ-CB 4.45Å; F55-A103 WeakPolarHBondContact CZ-O 3.07Å; I99-A103 VanDerWaalsContact O-CB 3.25Å; I99-A103 WeakPolarHBondContact O-CB 3.35Å; I99-A103 PolarHBondContact O-N 2.68Å; T100-A103 PolarHBondContact O-N 3Å; V101-A103 VanDerWaalsContact C-N 3.32Å; V101-A103 PolarHBondContact O-N 2.93Å; A103-Q106 PolarHBondContact O-N 2.95Å; A103-G107 PolarHBondContact O-N 2.86Å
104	V	89.8	Confident	84.9	Confident	99 Å²	99	51.7 Å²	51.7	60%	0.6	25%	0.25	S	C	*	.	H	α-helix	trans	-62.4	-43.8	176.9	170.2	0	0	0	0	111.4	T100 V101 Q106 G107 Y108	T100-V104 WeakPolarHBondContact O-CG2 3.13Å; T100-V104 PolarHBondContact O-N 2.75Å; V101-V104 PolarHBondContact O-N 2.73Å; V104-Q106 PolarHBondContact O-N 3.08Å; V104-G107 PolarHBondContact O-N 3.31Å; V104-Y108 WeakPolarHBondContact O-CB 3.48Å; V104-Y108 PolarHBondContact O-N 3.12Å
105	K	83.9	Confident	85.2	Confident	22 Å²	22	57.1 Å²	57.1	10%	0.096	27%	0.272	C	S	.	.	H	α-helix	trans	-54.4	-55.3	172.5	178.7	-168.6	169.3	178.5	0	110.7	V101 T102 G107 Y108 E109 F361 S387 D388	V101-K105 PolarHBondContact O-N 3.32Å; T102-K105 PolarHBondContact O-N 3.11Å; K105-G107 VanDerWaalsContact C-N 3.33Å; K105-G107 PolarHBondContact O-N 3.38Å; K105-Y108 PolarHBondContact O-N 2.93Å; K105-E109 WeakPolarHBondContact CE-OE1 3.4Å; K105-E109 IonicContact NZ-OE1 2.66Å; K105-E109 PolarHBondContact O-N 3.32Å; K105-F361 HydrophobicContact CD-CB 4.42Å; K105-F361 HydrophobicContact CD-CD2 4.48Å; K105-F361 HydrophobicContact CG-CD2 4.33Å; K105-S387 VanDerWaalsContact CE-OG 3.29Å; K105-S387 WeakPolarHBondContact CE-OG 3.3Å; K105-S387 PolarHBondContact NZ-OG 3.17Å; K105-D388 IonicContact NZ-OD1 3.88Å; K105-D388 PolarHBondContact NZ-OD1 3.33Å
106	Q	82.1	Confident	84.9	Confident	25 Å²	25	58.9 Å²	58.9	12%	0.117	29%	0.288	C	S	.	.	H	α-helix	trans	-69.6	-31.1	-173.1	-69	173.1	-1.4	0	0	112.8	N59 T102 A103 V104 D110	N59-Q106 PolarHBondContact ND2-OE1 2.88Å; T102-Q106 WeakPolarHBondContact O-CG 3.36Å; T102-Q106 PolarHBondContact O-N 3.01Å; T102-Q106 VanDerWaalsContact O-N 3.09Å; A103-Q106 PolarHBondContact O-N 2.95Å; V104-Q106 PolarHBondContact O-N 3.08Å; Q106-D110 PolarHBondContact O-N 2.83Å; Q106-D110 VanDerWaalsContact O-N 3.12Å
107	G	87.9	Confident	84.7	Confident	22 Å²	22	52.4 Å²	52.4	23%	0.227	26%	0.26	C	S	.	.	H	α-helix	trans	-67.4	-40.9	171.7	0	0	0	0	0	112.5	A103 V104 K105 W111	A103-G107 PolarHBondContact O-N 2.86Å; V104-G107 PolarHBondContact O-N 3.31Å; K105-G107 VanDerWaalsContact C-N 3.33Å; K105-G107 PolarHBondContact O-N 3.38Å; G107-W111 VanDerWaalsContact O-CB 3.25Å; G107-W111 WeakPolarHBondContact O-CB 3.44Å; G107-W111 PolarHBondContact O-N 2.9Å
108	Y	85.9	Confident	84.9	Confident	117 Å²	117	54.9 Å²	54.9	46%	0.459	27%	0.267	S	S	.	.	H	α-helix	trans	-66.3	-46.8	174.5	-179.6	-105.1	0	0	0	112.1	V104 K105 D110 W111 L112	V104-Y108 WeakPolarHBondContact O-CB 3.48Å; V104-Y108 PolarHBondContact O-N 3.12Å; K105-Y108 PolarHBondContact O-N 2.93Å; Y108-D110 VanDerWaalsContact C-N 3.28Å; Y108-D110 PolarHBondContact O-N 3Å; Y108-W111 HydrophobicContact CD2-CE3 4.29Å; Y108-W111 HydrophobicContact CE2-CE3 4.16Å; Y108-W111 HydrophobicContact CE2-CZ3 4.22Å; Y108-W111 PolarHBondContact O-N 3.12Å; Y108-L112 HydrophobicContact CD1-CD1 4.25Å; Y108-L112 HydrophobicContact CE1-CD1 3.75Å; Y108-L112 HydrophobicContact CE1-CG 4.38Å; Y108-L112 PolarHBondContact O-N 3.48Å
109	E	77.9	Confident	85	Confident	48 Å²	48	61.3 Å²	61.3	22%	0.224	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-33.8	176.9	-74.7	-175.2	170.1	0	0	113	K105 S387	K105-E109 WeakPolarHBondContact CE-OE1 3.4Å; K105-E109 IonicContact NZ-OE1 2.66Å; K105-E109 PolarHBondContact O-N 3.32Å; E109-S387 PolarHBondContact OE1-OG 3.17Å
110	D	84.1	Confident	84.8	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-84.8	-28.1	175.5	-147.4	58.2	0	0	0	113	K49 Y50 Q106 Y108 L112 R113 H114	K49-D110 VanDerWaalsContact N-CG 3.35Å; K49-D110 PolarHBondContact N-OD1 3.03Å; K49-D110 PolarHBondContact N-OD2 2.74Å; K49-D110 VanDerWaalsContact N-OD2 3.07Å; Y50-D110 HydrophobicContact CD2-CB 3.8Å; Y50-D110 WeakPolarHBondContact CD2-OD2 3.4Å; Y50-D110 HydrophobicContact CE2-CB 4.37Å; Y50-D110 PolarHBondContact N-OD2 3.1Å; Q106-D110 PolarHBondContact O-N 2.83Å; Q106-D110 VanDerWaalsContact O-N 3.12Å; Y108-D110 VanDerWaalsContact C-N 3.28Å; Y108-D110 PolarHBondContact O-N 3Å; D110-L112 VanDerWaalsContact C-N 3.3Å; D110-L112 PolarHBondContact O-N 2.94Å; D110-R113 WeakPolarHBondContact O-CA 3.49Å; D110-R113 WeakPolarHBondContact O-CB 3.17Å; D110-R113 PolarHBondContact O-N 3.44Å; D110-R113 WeakPolarHBondContact OD1-CD 3.48Å; D110-R113 IonicContact OD1-CZ 2.71Å; D110-R113 IonicContact OD1-NE 3.17Å; D110-R113 IonicContact OD1-NH1 3.42Å; D110-R113 PolarHBondContact OD1-NH1 2.73Å; D110-H114 PolarHBondContact O-CD2 3.16Å; D110-H114 VanDerWaalsContact O-CD2 3.23Å; D110-H114 PolarHBondContact O-N 3.27Å; D110-H114 IonicContact OD2-NE2 3.46Å
111	W	86.1	Confident	84.8	Confident	144 Å²	144	61.6 Å²	61.6	55%	0.545	30%	0.298	S	S	.	.	H	α-helix	trans	-62.2	-37.2	170.6	175.7	83.6	0	0	0	112	G107 Y108 R113 H114 K115	G107-W111 VanDerWaalsContact O-CB 3.25Å; G107-W111 WeakPolarHBondContact O-CB 3.44Å; G107-W111 PolarHBondContact O-N 2.9Å; Y108-W111 HydrophobicContact CD2-CE3 4.29Å; Y108-W111 HydrophobicContact CE2-CE3 4.16Å; Y108-W111 HydrophobicContact CE2-CZ3 4.22Å; Y108-W111 PolarHBondContact O-N 3.12Å; W111-R113 VanDerWaalsContact C-N 3.27Å; W111-R113 PolarHBondContact O-N 2.91Å; W111-H114 CarbonylContact O-C 3.33Å; W111-H114 WeakPolarHBondContact O-CB 3.39Å; W111-H114 PolarHBondContact O-N 3.45Å; W111-H114 VanDerWaalsContact O-N 3.14Å; W111-K115 HydrophobicContact CH2-CD 4.46Å; W111-K115 PolarHBondContact O-N 2.8Å
112	L	81.2	Confident	85	Confident	75 Å²	75	64.8 Å²	64.8	39%	0.393	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-36	171.3	-69.5	173.6	0	0	0	112	Y108 D110 K115 A116	Y108-L112 HydrophobicContact CD1-CD1 4.25Å; Y108-L112 HydrophobicContact CE1-CD1 3.75Å; Y108-L112 HydrophobicContact CE1-CG 4.38Å; Y108-L112 PolarHBondContact O-N 3.48Å; D110-L112 VanDerWaalsContact C-N 3.3Å; D110-L112 PolarHBondContact O-N 2.94Å; L112-K115 PolarHBondContact O-N 3.47Å; L112-A116 PolarHBondContact O-N 2.91Å; L112-A116 VanDerWaalsContact O-N 3.13Å
113	R	79.4	Confident	85.1	Confident	76 Å²	76	68.1 Å²	68.1	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-66.5	-45.1	171	-58.4	-173.7	-170.4	93.9	19	111.5	D110 W111 K115 A116 D117	D110-R113 WeakPolarHBondContact O-CA 3.49Å; D110-R113 WeakPolarHBondContact O-CB 3.17Å; D110-R113 PolarHBondContact O-N 3.44Å; D110-R113 WeakPolarHBondContact OD1-CD 3.48Å; D110-R113 IonicContact OD1-CZ 2.71Å; D110-R113 IonicContact OD1-NE 3.17Å; D110-R113 IonicContact OD1-NH1 3.42Å; D110-R113 PolarHBondContact OD1-NH1 2.73Å; W111-R113 VanDerWaalsContact C-N 3.27Å; W111-R113 PolarHBondContact O-N 2.91Å; R113-K115 PolarHBondContact O-N 2.9Å; R113-A116 PolarHBondContact O-N 3.31Å; R113-D117 VanDerWaalsContact O-CB 3.3Å; R113-D117 WeakPolarHBondContact O-CB 3.3Å; R113-D117 VanDerWaalsContact O-CG 3.3Å; R113-D117 PolarHBondContact O-N 2.91Å
114	H	86	Confident	85.2	Confident	59 Å²	59	76.1 Å²	76.1	27%	0.273	35%	0.351	S	S	.	.	H	α-helix	trans	-59.7	-31.4	174.4	-78.4	-73.9	0	0	0	113.3	S48 Y50 D110 W111 R118	S48-H114 WeakPolarHBondContact CB-CE1 3.27Å; S48-H114 WeakPolarHBondContact CB-NE2 3.46Å; S48-H114 PolarHBondContact OG-CE1 3.15Å; S48-H114 PolarHBondContact OG-NE2 2.95Å; Y50-H114 PolarHBondContact O-CE1 3.39Å; Y50-H114 PolarHBondContact O-NE2 3.48Å; D110-H114 PolarHBondContact O-CD2 3.16Å; D110-H114 VanDerWaalsContact O-CD2 3.23Å; D110-H114 PolarHBondContact O-N 3.27Å; D110-H114 IonicContact OD2-NE2 3.46Å; W111-H114 CarbonylContact O-C 3.33Å; W111-H114 WeakPolarHBondContact O-CB 3.39Å; W111-H114 PolarHBondContact O-N 3.45Å; W111-H114 VanDerWaalsContact O-N 3.14Å; H114-R118 VanDerWaalsContact O-CB 3.31Å; H114-R118 WeakPolarHBondContact O-CB 3.33Å; H114-R118 PolarHBondContact O-N 2.91Å; H114-R118 VanDerWaalsContact O-N 3.09Å
115	K	87	Confident	85.2	Confident	124 Å²	124	71.8 Å²	71.8	54%	0.539	32%	0.324	S	S	.	.	H	α-helix	trans	-68.5	-51.5	173.9	-171.6	-172.6	174.2	-167.7	0	111.1	W111 L112 R113 R118 E119	W111-K115 HydrophobicContact CH2-CD 4.46Å; W111-K115 PolarHBondContact O-N 2.8Å; L112-K115 PolarHBondContact O-N 3.47Å; R113-K115 PolarHBondContact O-N 2.9Å; K115-R118 WeakPolarHBondContact O-CB 3.3Å; K115-R118 PolarHBondContact O-N 3.4Å; K115-E119 PolarHBondContact O-N 3.22Å; K115-E119 VanDerWaalsContact O-N 3.09Å
116	A	79.8	Confident	85.7	Confident	48 Å²	48	70.7 Å²	70.7	40%	0.397	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-41.5	178.5	0	0	0	0	0	112.6	L112 R113 R118 E119 V120	L112-A116 PolarHBondContact O-N 2.91Å; L112-A116 VanDerWaalsContact O-N 3.13Å; R113-A116 PolarHBondContact O-N 3.31Å; A116-R118 VanDerWaalsContact C-N 3.26Å; A116-R118 PolarHBondContact O-N 3.48Å; A116-E119 PolarHBondContact O-N 2.62Å; A116-V120 WeakPolarHBondContact O-CG2 3.46Å; A116-V120 PolarHBondContact O-N 3.06Å; A116-V120 VanDerWaalsContact O-N 3.1Å
117	D	84.4	Confident	86.1	Confident	13 Å²	13	69.6 Å²	69.6	7%	0.07	31%	0.314	C	S	.	.	H	α-helix	trans	-57.3	-41.3	172	-77.1	-14.1	0	0	0	110.5	S47 S48 R113 N121	S47-D117 VanDerWaalsContact CB-OD1 3.26Å; S47-D117 WeakPolarHBondContact CB-OD1 3.33Å; S47-D117 VanDerWaalsContact N-CG 3.31Å; S47-D117 PolarHBondContact N-OD1 2.95Å; S47-D117 VanDerWaalsContact N-OD1 3.08Å; S47-D117 PolarHBondContact N-OD2 3.09Å; S47-D117 VanDerWaalsContact OG-CG 3.26Å; S47-D117 PolarHBondContact OG-OD1 3.21Å; S47-D117 PolarHBondContact OG-OD2 2.86Å; S48-D117 PolarHBondContact N-OD2 2.87Å; S48-D117 VanDerWaalsContact N-OD2 3.16Å; R113-D117 VanDerWaalsContact O-CB 3.3Å; R113-D117 WeakPolarHBondContact O-CB 3.3Å; R113-D117 VanDerWaalsContact O-CG 3.3Å; R113-D117 PolarHBondContact O-N 2.91Å; D117-N121 VanDerWaalsContact O-CB 3.29Å; D117-N121 WeakPolarHBondContact O-CB 3.27Å; D117-N121 PolarHBondContact O-N 2.59Å; D117-N121 PolarHBondContact O-ND2 2.88Å
118	R	89	Confident	86.1	Confident	150 Å²	150	70.7 Å²	70.7	57%	0.566	32%	0.315	S	S	*	.	H	α-helix	trans	-64.4	-48.1	179.2	-172.9	-178.4	-55.7	-162.1	1.1	111.8	H114 K115 A116 V120 N121 E122	H114-R118 VanDerWaalsContact O-CB 3.31Å; H114-R118 WeakPolarHBondContact O-CB 3.33Å; H114-R118 PolarHBondContact O-N 2.91Å; H114-R118 VanDerWaalsContact O-N 3.09Å; K115-R118 WeakPolarHBondContact O-CB 3.3Å; K115-R118 PolarHBondContact O-N 3.4Å; A116-R118 VanDerWaalsContact C-N 3.26Å; A116-R118 PolarHBondContact O-N 3.48Å; R118-V120 VanDerWaalsContact C-N 3.3Å; R118-V120 PolarHBondContact O-N 3.41Å; R118-N121 PolarHBondContact O-N 2.88Å; R118-E122 WeakPolarHBondContact CD-OE1 3.49Å; R118-E122 WeakPolarHBondContact CD-OE2 3.36Å; R118-E122 HydrophobicContact CG-CG 3.94Å; R118-E122 WeakPolarHBondContact CG-OE1 3.39Å; R118-E122 WeakPolarHBondContact CG-OE2 3.43Å; R118-E122 WeakPolarHBondContact O-CB 3.24Å; R118-E122 PolarHBondContact O-N 3.03Å
119	E	85.5	Confident	86	Confident	140 Å²	140	68.4 Å²	68.4	65%	0.654	31%	0.308	S	S	*	.	H	α-helix	trans	-55	-45.4	177.9	-168.9	170.1	178.9	0	0	111.5	K115 A116 N121 Y123	K115-E119 PolarHBondContact O-N 3.22Å; K115-E119 VanDerWaalsContact O-N 3.09Å; A116-E119 PolarHBondContact O-N 2.62Å; E119-N121 VanDerWaalsContact C-N 3.31Å; E119-N121 PolarHBondContact O-N 3.24Å; E119-Y123 PolarHBondContact O-N 2.94Å
120	V	83.3	Confident	85.7	Confident	64 Å²	64	73.6 Å²	73.6	39%	0.388	34%	0.338	S	S	.	.	H	α-helix	trans	-71.3	-19.3	176.1	175.8	0	0	0	0	113.6	I45 A116 R118 Y123	I45-V120 HydrophobicContact CG1-CG1 4.37Å; A116-V120 WeakPolarHBondContact O-CG2 3.46Å; A116-V120 PolarHBondContact O-N 3.06Å; A116-V120 VanDerWaalsContact O-N 3.1Å; R118-V120 VanDerWaalsContact C-N 3.3Å; R118-V120 PolarHBondContact O-N 3.41Å; V120-Y123 HydrophobicContact CG1-CE1 4.46Å; V120-Y123 VanDerWaalsContact O-CD1 3.3Å; V120-Y123 WeakPolarHBondContact O-CD1 3.42Å; V120-Y123 WeakPolarHBondContact O-CE1 3.38Å
121	N	88.6	Confident	85.1	Confident	12 Å²	12	75.2 Å²	75.2	6%	0.064	36%	0.355	C	S	.	.	H	α-helix	trans	-94.5	-28.3	178.6	-77.9	-49.2	0	0	0	113.4	R44 I45 D117 R118 E119 A139	R44-N121 VanDerWaalsContact CA-OD1 3.29Å; R44-N121 WeakPolarHBondContact CA-OD1 3.48Å; I45-N121 PolarHBondContact N-OD1 3.13Å; I45-N121 PolarHBondContact O-ND2 3.13Å; D117-N121 VanDerWaalsContact O-CB 3.29Å; D117-N121 WeakPolarHBondContact O-CB 3.27Å; D117-N121 PolarHBondContact O-N 2.59Å; D117-N121 PolarHBondContact O-ND2 2.88Å; R118-N121 PolarHBondContact O-N 2.88Å; E119-N121 VanDerWaalsContact C-N 3.31Å; E119-N121 PolarHBondContact O-N 3.24Å; N121-A139 HydrophobicContact CB-CB 3.79Å; N121-A139 VanDerWaalsContact O-CB 3.31Å; N121-A139 WeakPolarHBondContact O-CB 3.23Å; N121-A139 PolarHBondContact O-N 2.93Å
122	E	89.9	Confident	84.9	Confident	101 Å²	101	77.2 Å²	77.2	47%	0.472	36%	0.363	S	S	.	.	H	α-helix	trans	-98.6	-13.3	-171	-71.3	-179.6	179.6	0	0	114.8	R118	R118-E122 WeakPolarHBondContact CD-OE1 3.49Å; R118-E122 WeakPolarHBondContact CD-OE2 3.36Å; R118-E122 HydrophobicContact CG-CG 3.94Å; R118-E122 WeakPolarHBondContact CG-OE1 3.39Å; R118-E122 WeakPolarHBondContact CG-OE2 3.43Å; R118-E122 WeakPolarHBondContact O-CB 3.24Å; R118-E122 PolarHBondContact O-N 3.03Å
123	Y	87.1	Confident	85	Confident	72 Å²	72	78.3 Å²	78.3	28%	0.282	36%	0.362	S	S	.	.	S	Bend	trans	-59.7	153.7	174.6	76.1	-98.3	0	0	0	112.1	E119 V120 V125 M137 S138 P156	E119-Y123 PolarHBondContact O-N 2.94Å; V120-Y123 HydrophobicContact CG1-CE1 4.46Å; V120-Y123 VanDerWaalsContact O-CD1 3.3Å; V120-Y123 WeakPolarHBondContact O-CD1 3.42Å; V120-Y123 WeakPolarHBondContact O-CE1 3.38Å; Y123-V125 HydrophobicContact CD2-CG2 4.02Å; Y123-V125 HydrophobicContact CE2-CG2 3.58Å; Y123-M137 CarbonylContact O-C 3.57Å; Y123-M137 WeakPolarHBondContact O-CA 3.45Å; Y123-S138 PolarHBondContact O-N 2.91Å; Y123-S138 PolarHBondContact OH-OG 2.98Å; Y123-P156 HydrophobicContact CE2-CB 4.23Å; Y123-P156 VanDerWaalsContact OH-CA 3.22Å; Y123-P156 WeakPolarHBondContact OH-CA 3.41Å; Y123-P156 VanDerWaalsContact OH-CB 3.32Å; Y123-P156 WeakPolarHBondContact OH-CB 3.3Å
124	R	90.3	Very high	85.6	Confident	185 Å²	185	78 Å²	78	70%	0.698	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	143.4	-171.4	-62.8	-176.1	-177.6	-171.1	1.1	111.5	K136	R124-K136 CarbonylContact C-O 3.59Å; R124-K136 VanDerWaalsContact CA-O 3.25Å; R124-K136 WeakPolarHBondContact CA-O 3.48Å
125	V	90.8	Very high	85.8	Confident	7 Å²	7	82.2 Å²	82.2	4%	0.042	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.9	178.5	175.6	0	0	0	0	108.2	Y123 R135 K136 I141 L147 P156	Y123-V125 HydrophobicContact CD2-CG2 4.02Å; Y123-V125 HydrophobicContact CE2-CG2 3.58Å; V125-R135 CarbonylContact O-C 3.54Å; V125-R135 VanDerWaalsContact O-CA 3.3Å; V125-R135 WeakPolarHBondContact O-CA 3.36Å; V125-K136 PolarHBondContact N-O 3.39Å; V125-K136 PolarHBondContact O-N 2.86Å; V125-I141 HydrophobicContact CB-CD1 3.94Å; V125-I141 HydrophobicContact CG1-CD1 3.8Å; V125-I141 HydrophobicContact CG2-CD1 3.92Å; V125-L147 HydrophobicContact CG1-CD1 4.19Å; V125-L147 HydrophobicContact CG1-CD2 4.09Å; V125-P156 HydrophobicContact CG1-CG 3.88Å; V125-P156 HydrophobicContact CG2-CB 3.69Å; V125-P156 HydrophobicContact CG2-CG 3.92Å
126	S	93.1	Very high	86	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	121.3	176.2	-49.5	0	0	0	0	110.3	R133 L147 E148	S126-R133 PolarHBondContact OG-NE 3.39Å; S126-R133 PolarHBondContact OG-NH2 2.86Å; S126-L147 WeakPolarHBondContact O-CA 3.19Å; S126-E148 WeakPolarHBondContact CB-O 3.36Å; S126-E148 PolarHBondContact O-N 3.19Å
127	V	91.6	Very high	86.7	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.006	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	138.9	177.8	-169.7	0	0	0	0	108.8	E129 I134 K136 D145 I146 L147	V127-E129 HydrophobicContact CG1-CG 4.18Å; V127-I134 PolarHBondContact N-O 2.95Å; V127-I134 PolarHBondContact O-N 2.86Å; V127-K136 HydrophobicContact CB-CD 4.28Å; V127-K136 HydrophobicContact CB-CG 4.38Å; V127-K136 HydrophobicContact CG2-CB 3.96Å; V127-K136 HydrophobicContact CG2-CD 3.8Å; V127-K136 HydrophobicContact CG2-CG 3.82Å; V127-D145 HydrophobicContact CG1-CB 4.26Å; V127-I146 WeakPolarHBondContact CA-O 3.34Å; V127-I146 WeakPolarHBondContact CG1-O 3.47Å; V127-L147 HydrophobicContact CB-CD2 4.3Å; V127-L147 HydrophobicContact CG1-CD2 4.17Å; V127-L147 HydrophobicContact CG2-CD2 3.75Å
128	L	87.1	Confident	87	Confident	45 Å²	45	79.2 Å²	79.2	24%	0.236	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	109.1	174	-76.9	162	0	0	0	109.2	I146 E148	L128-I146 HydrophobicContact CB-CB 4.24Å; L128-I146 HydrophobicContact CB-CG2 4.12Å; L128-I146 HydrophobicContact CD1-CG2 4.02Å; L128-I146 PolarHBondContact N-O 3.47Å; L128-E148 HydrophobicContact CD1-CB 4.31Å
129	E	82.9	Confident	87.1	Confident	69 Å²	69	72.9 Å²	72.9	32%	0.322	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129	172.8	-70.5	-179.9	134.3	0	0	108.6	V127 G131 R132 I134 K136	V127-E129 HydrophobicContact CG1-CG 4.18Å; E129-G131 PolarHBondContact O-N 3.11Å; E129-G131 VanDerWaalsContact O-N 3.13Å; E129-R132 PolarHBondContact N-O 3.33Å; E129-R132 VanDerWaalsContact N-O 3.09Å; E129-R132 WeakPolarHBondContact O-CA 3.28Å; E129-R132 WeakPolarHBondContact O-CB 3.36Å; E129-R132 PolarHBondContact O-N 2.87Å; E129-I134 HydrophobicContact CB-CD1 4.14Å; E129-K136 IonicContact OE1-NZ 3.65Å; E129-K136 PolarHBondContact OE1-NZ 3.48Å; E129-K136 WeakPolarHBondContact OE2-CE 3.34Å; E129-K136 IonicContact OE2-NZ 2.69Å; E129-K136 PolarHBondContact OE2-NZ 2.83Å
130	D	73.7	Confident	87.5	Confident	158 Å²	158	72.4 Å²	72.4	85%	0.845	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	43	178.6	-54.5	-29.6	0	0	0	114.2	R132	D130-R132 PolarHBondContact O-N 3.48Å
131	G	70.1	Confident	87.9	Confident	37 Å²	37	69.4 Å²	69.4	38%	0.381	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	4.7	-178.8	0	0	0	0	0	115.3	E129 Q198	E129-G131 PolarHBondContact O-N 3.11Å; E129-G131 VanDerWaalsContact O-N 3.13Å; G131-Q198 VanDerWaalsContact CA-CD 3.49Å
132	R	81.4	Confident	88.1	Confident	186 Å²	186	74.9 Å²	74.9	70%	0.702	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	136.4	-176.7	-60.9	178.8	-178.5	-169.7	-0.9	111.6	E129 D130 I134	E129-R132 PolarHBondContact N-O 3.33Å; E129-R132 VanDerWaalsContact N-O 3.09Å; E129-R132 WeakPolarHBondContact O-CA 3.28Å; E129-R132 WeakPolarHBondContact O-CB 3.36Å; E129-R132 PolarHBondContact O-N 2.87Å; D130-R132 PolarHBondContact O-N 3.48Å; R132-I134 PolarHBondContact O-N 2.91Å
133	R	84.9	Confident	88.1	Confident	98 Å²	98	70.5 Å²	70.5	37%	0.37	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	110.8	172.9	-173.3	-176.9	176.4	167.9	-11.3	110.3	S126 R135 E148 E150	S126-R133 PolarHBondContact OG-NE 3.39Å; S126-R133 PolarHBondContact OG-NH2 2.86Å; R133-R135 VanDerWaalsContact NH2-NH2 3.13Å; R133-E148 WeakPolarHBondContact CD-OE1 3.5Å; R133-E148 IonicContact CZ-OE1 3.16Å; R133-E148 IonicContact NE-OE1 3.55Å; R133-E148 PolarHBondContact NE-OE1 3.47Å; R133-E148 IonicContact NH1-OE1 3.61Å; R133-E148 PolarHBondContact NH1-OE1 3.13Å; R133-E150 IonicContact CZ-OE1 2.85Å; R133-E150 IonicContact CZ-OE2 2.79Å; R133-E150 IonicContact NH1-OE1 3.87Å; R133-E150 PolarHBondContact NH1-OE1 2.74Å; R133-E150 IonicContact NH2-OE1 3.68Å; R133-E150 PolarHBondContact NH2-OE1 3.11Å; R133-E150 IonicContact NH2-OE2 3.34Å; R133-E150 PolarHBondContact NH2-OE2 3.39Å
134	I	90.8	Very high	88.3	Confident	70 Å²	70	67.1 Å²	67.1	36%	0.359	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	116.8	179.7	-58.1	-175.8	0	0	0	109.1	V127 E129 R132 K136	V127-I134 PolarHBondContact N-O 2.95Å; V127-I134 PolarHBondContact O-N 2.86Å; E129-I134 HydrophobicContact CB-CD1 4.14Å; R132-I134 PolarHBondContact O-N 2.91Å; I134-K136 HydrophobicContact CG2-CG 4.15Å; I134-K136 PolarHBondContact O-N 3.03Å
135	R	90.7	Very high	88.3	Confident	146 Å²	146	58.6 Å²	58.6	55%	0.551	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	107	175.5	-78.3	-176.3	168.8	-174.2	-6.4	110.7	V125 R133 E150	V125-R135 CarbonylContact O-C 3.54Å; V125-R135 VanDerWaalsContact O-CA 3.3Å; V125-R135 WeakPolarHBondContact O-CA 3.36Å; R133-R135 VanDerWaalsContact NH2-NH2 3.13Å; R135-E150 IonicContact NH2-OE2 2.8Å; R135-E150 PolarHBondContact NH2-OE2 3.11Å; R135-E150 VanDerWaalsContact NH2-OE2 3.12Å
136	K	91.9	Very high	88.4	Confident	41 Å²	41	59 Å²	59	18%	0.178	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	167.5	175.7	-60.4	-170.2	-169.4	170.8	0	111.2	R124 V125 V127 E129 I134	R124-K136 CarbonylContact C-O 3.59Å; R124-K136 VanDerWaalsContact CA-O 3.25Å; R124-K136 WeakPolarHBondContact CA-O 3.48Å; V125-K136 PolarHBondContact N-O 3.39Å; V125-K136 PolarHBondContact O-N 2.86Å; V127-K136 HydrophobicContact CB-CD 4.28Å; V127-K136 HydrophobicContact CB-CG 4.38Å; V127-K136 HydrophobicContact CG2-CB 3.96Å; V127-K136 HydrophobicContact CG2-CD 3.8Å; V127-K136 HydrophobicContact CG2-CG 3.82Å; E129-K136 IonicContact OE1-NZ 3.65Å; E129-K136 PolarHBondContact OE1-NZ 3.48Å; E129-K136 WeakPolarHBondContact OE2-CE 3.34Å; E129-K136 IonicContact OE2-NZ 2.69Å; E129-K136 PolarHBondContact OE2-NZ 2.83Å; I134-K136 HydrophobicContact CG2-CG 4.15Å; I134-K136 PolarHBondContact O-N 3.03Å
137	M	92.6	Very high	88.3	Confident	82 Å²	82	59 Å²	59	40%	0.404	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	142.1	166.5	-71.4	155.7	158.2	0	0	109.8	Y123 A139 K140	Y123-M137 CarbonylContact O-C 3.57Å; Y123-M137 WeakPolarHBondContact O-CA 3.45Å; M137-A139 VanDerWaalsContact C-N 3.27Å; M137-A139 PolarHBondContact O-N 2.98Å; M137-K140 HydrophobicContact CB-CD 4.39Å; M137-K140 HydrophobicContact CB-CG 4.29Å; M137-K140 WeakPolarHBondContact O-CB 3.25Å; M137-K140 PolarHBondContact O-N 3.38Å; M137-K140 HydrophobicContact SD-CD 4.43Å
138	S	90.8	Very high	88.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-51.8	-43.6	-179.4	-171	0	0	0	0	112.6	N43 Y123 K140 I141 P156	N43-S138 PolarHBondContact ND2-O 2.87Å; Y123-S138 PolarHBondContact O-N 2.91Å; Y123-S138 PolarHBondContact OH-OG 2.98Å; S138-K140 PolarHBondContact O-N 3.14Å; S138-K140 VanDerWaalsContact O-N 3.07Å; S138-I141 WeakPolarHBondContact O-CB 3.37Å; S138-I141 WeakPolarHBondContact O-CD1 3.17Å; S138-I141 WeakPolarHBondContact O-CG1 3.31Å; S138-I141 PolarHBondContact O-N 3.47Å; S138-P156 WeakPolarHBondContact OG-CB 3.49Å
139	A	92.4	Very high	88.7	Confident	17 Å²	17	57.6 Å²	57.6	14%	0.14	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-69.6	0.1	177.7	0	0	0	0	0	115.8	R44 N121 M137	R44-A139 HydrophobicContact CB-CB 4.33Å; N121-A139 HydrophobicContact CB-CB 3.79Å; N121-A139 VanDerWaalsContact O-CB 3.31Å; N121-A139 WeakPolarHBondContact O-CB 3.23Å; N121-A139 PolarHBondContact O-N 2.93Å; M137-A139 VanDerWaalsContact C-N 3.27Å; M137-A139 PolarHBondContact O-N 2.98Å
140	K	92.7	Very high	89.1	Confident	130 Å²	130	57.1 Å²	57.1	57%	0.565	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-102.1	-2.1	174.3	-67.2	-175.9	179	178.8	0	113.8	M137 S138	M137-K140 HydrophobicContact CB-CD 4.39Å; M137-K140 HydrophobicContact CB-CG 4.29Å; M137-K140 WeakPolarHBondContact O-CB 3.25Å; M137-K140 PolarHBondContact O-N 3.38Å; M137-K140 HydrophobicContact SD-CD 4.43Å; S138-K140 PolarHBondContact O-N 3.14Å; S138-K140 VanDerWaalsContact O-N 3.07Å
141	I	92.2	Very high	89.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	24%	0.244	C	C	.	.			trans	-71.8	140.9	179.9	-61.2	166.3	0	0	0	110	N43 V125 S138 D145 L147 P156 A256	N43-I141 HydrophobicContact CB-CB 4.2Å; N43-I141 VanDerWaalsContact CB-O 3.29Å; N43-I141 WeakPolarHBondContact CB-O 3.5Å; V125-I141 HydrophobicContact CB-CD1 3.94Å; V125-I141 HydrophobicContact CG1-CD1 3.8Å; V125-I141 HydrophobicContact CG2-CD1 3.92Å; S138-I141 WeakPolarHBondContact O-CB 3.37Å; S138-I141 WeakPolarHBondContact O-CD1 3.17Å; S138-I141 WeakPolarHBondContact O-CG1 3.31Å; S138-I141 PolarHBondContact O-N 3.47Å; I141-D145 WeakPolarHBondContact CA-OD2 3.47Å; I141-D145 HydrophobicContact CG2-CB 4.13Å; I141-L147 HydrophobicContact CD1-CD1 4.16Å; I141-L147 HydrophobicContact CD1-CD2 4.26Å; I141-L147 HydrophobicContact CG1-CD2 4.34Å; I141-L147 HydrophobicContact CG2-CD1 4.35Å; I141-L147 HydrophobicContact CG2-CD2 4.13Å; I141-P156 HydrophobicContact CD1-CB 3.79Å; I141-P156 HydrophobicContact CD1-CG 3.74Å; I141-A256 HydrophobicContact CG2-CB 4.21Å
142	K	92.1	Very high	90.6	Very high	128 Å²	128	56.4 Å²	56.4	56%	0.557	25%	0.25	S	S	*	.			trans	-116.3	156.8	177	-59.1	173.3	-172.3	168.5	0	111.2	G144 D145 A256	K142-G144 PolarHBondContact O-N 2.9Å; K142-D145 PolarHBondContact N-OD2 3.5Å; K142-D145 VanDerWaalsContact O-CB 3.3Å; K142-D145 WeakPolarHBondContact O-CB 3.47Å; K142-D145 PolarHBondContact O-N 3.07Å; K142-D145 VanDerWaalsContact O-N 3.11Å; K142-A256 WeakPolarHBondContact O-CB 3.4Å
143	V	91.8	Very high	91	Very high	8 Å²	8	50.1 Å²	50.1	5%	0.048	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	129.8	166.6	178.6	0	0	0	0	108.7	I22 H26 F40 A256 T259	I22-V143 HydrophobicContact CB-CG1 4.29Å; I22-V143 HydrophobicContact CD1-CG1 3.66Å; I22-V143 HydrophobicContact CG1-CG1 3.64Å; I22-V143 HydrophobicContact CG2-CG1 3.73Å; H26-V143 PolarHBondContact CE1-O 3.2Å; H26-V143 VanDerWaalsContact CE1-O 3.26Å; F40-V143 HydrophobicContact CB-CB 4.27Å; F40-V143 HydrophobicContact CB-CG2 3.85Å; F40-V143 HydrophobicContact CD1-CB 4.48Å; F40-V143 HydrophobicContact CD1-CG1 4.39Å; F40-V143 HydrophobicContact CD1-CG2 4.26Å; F40-V143 HydrophobicContact CD2-CB 3.58Å; F40-V143 HydrophobicContact CD2-CG1 3.84Å; F40-V143 HydrophobicContact CD2-CG2 4.08Å; F40-V143 HydrophobicContact CE1-CG1 4.26Å; F40-V143 HydrophobicContact CE2-CB 3.94Å; F40-V143 HydrophobicContact CE2-CG1 3.66Å; F40-V143 HydrophobicContact CG-CB 3.87Å; F40-V143 HydrophobicContact CG-CG1 4.19Å; F40-V143 HydrophobicContact CG-CG2 3.82Å; F40-V143 HydrophobicContact CZ-CG1 3.9Å; V143-A256 WeakPolarHBondContact CA-O 3.2Å; V143-T259 HydrophobicContact CG2-CG2 3.83Å; V143-T259 WeakPolarHBondContact CG2-OG1 3.48Å
144	G	89.7	Confident	91.1	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.01	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	-14.1	-172.9	0	0	0	0	0	115.5	G25 K142 A256	G25-G144 PolarHBondContact N-O 3.21Å; K142-G144 PolarHBondContact O-N 2.9Å; G144-A256 PolarHBondContact N-O 3.26Å
145	D	90.9	Very high	91.2	Very high	6 Å²	6	45 Å²	45	3%	0.032	21%	0.212	C	C	.	.			trans	-64.3	137.2	172.6	-70.9	0.7	0	0	0	110.6	H26 V127 I141 K142 L147 V255 A256	H26-D145 IonicContact CD2-OD1 2.64Å; H26-D145 IonicContact CE1-OD1 2.67Å; H26-D145 IonicContact NE2-OD1 3.31Å; H26-D145 PolarHBondContact NE2-OD1 2.91Å; V127-D145 HydrophobicContact CG1-CB 4.26Å; I141-D145 WeakPolarHBondContact CA-OD2 3.47Å; I141-D145 HydrophobicContact CG2-CB 4.13Å; K142-D145 PolarHBondContact N-OD2 3.5Å; K142-D145 VanDerWaalsContact O-CB 3.3Å; K142-D145 WeakPolarHBondContact O-CB 3.47Å; K142-D145 PolarHBondContact O-N 3.07Å; K142-D145 VanDerWaalsContact O-N 3.11Å; D145-L147 HydrophobicContact CB-CD2 4.23Å; D145-V255 WeakPolarHBondContact O-CA 3.29Å; D145-A256 PolarHBondContact O-N 3.14Å
146	I	92.1	Very high	91.2	Very high	15 Å²	15	38.1 Å²	38.1	8%	0.077	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	128.7	170.1	-56.4	172.4	0	0	0	108.3	V24 V127 L128 L197	V24-I146 HydrophobicContact CG1-CD1 3.95Å; V24-I146 HydrophobicContact CG1-CG1 4.13Å; V127-I146 WeakPolarHBondContact CA-O 3.34Å; V127-I146 WeakPolarHBondContact CG1-O 3.47Å; L128-I146 HydrophobicContact CB-CB 4.24Å; L128-I146 HydrophobicContact CB-CG2 4.12Å; L128-I146 HydrophobicContact CD1-CG2 4.02Å; L128-I146 PolarHBondContact N-O 3.47Å; I146-L197 HydrophobicContact CG2-CD1 4.49Å
147	L	92.6	Very high	91.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.3	-178.3	-50.8	-176.4	0	0	0	110.7	V125 S126 V127 I141 D145 P156 L159 C253 G254	V125-L147 HydrophobicContact CG1-CD1 4.19Å; V125-L147 HydrophobicContact CG1-CD2 4.09Å; S126-L147 WeakPolarHBondContact O-CA 3.19Å; V127-L147 HydrophobicContact CB-CD2 4.3Å; V127-L147 HydrophobicContact CG1-CD2 4.17Å; V127-L147 HydrophobicContact CG2-CD2 3.75Å; I141-L147 HydrophobicContact CD1-CD1 4.16Å; I141-L147 HydrophobicContact CD1-CD2 4.26Å; I141-L147 HydrophobicContact CG1-CD2 4.34Å; I141-L147 HydrophobicContact CG2-CD1 4.35Å; I141-L147 HydrophobicContact CG2-CD2 4.13Å; D145-L147 HydrophobicContact CB-CD2 4.23Å; L147-P156 HydrophobicContact CD1-CG 3.51Å; L147-L159 HydrophobicContact CD1-CD1 4.13Å; L147-L159 HydrophobicContact CD1-CD2 3.6Å; L147-L159 HydrophobicContact CG-CD2 4.47Å; L147-C253 VanDerWaalsContact O-CA 3.31Å; L147-C253 WeakPolarHBondContact O-CA 3.24Å; L147-G254 PolarHBondContact N-O 3.09Å; L147-G254 PolarHBondContact O-N 2.95Å
148	E	93.1	Very high	91.3	Very high	15 Å²	15	32.2 Å²	32.2	7%	0.07	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.3	163	-173.9	178.6	63.7	0	0	107.6	S126 L128 R133 K251 I252	S126-E148 WeakPolarHBondContact CB-O 3.36Å; S126-E148 PolarHBondContact O-N 3.19Å; L128-E148 HydrophobicContact CD1-CB 4.31Å; R133-E148 WeakPolarHBondContact CD-OE1 3.5Å; R133-E148 IonicContact CZ-OE1 3.16Å; R133-E148 IonicContact NE-OE1 3.55Å; R133-E148 PolarHBondContact NE-OE1 3.47Å; R133-E148 IonicContact NH1-OE1 3.61Å; R133-E148 PolarHBondContact NH1-OE1 3.13Å; E148-K251 WeakPolarHBondContact OE2-CD 3.46Å; E148-K251 IonicContact OE2-NZ 3.96Å; E148-K251 PolarHBondContact OE2-NZ 2.73Å; E148-I252 WeakPolarHBondContact CA-O 3.35Å
149	V	92.8	Very high	91.5	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129	-179.8	-175.3	0	0	0	0	108.6	E153 F155 L159 K251 I252	V149-E153 HydrophobicContact CG1-CB 3.69Å; V149-F155 HydrophobicContact CB-CD1 4.46Å; V149-F155 HydrophobicContact CB-CE1 4.34Å; V149-F155 HydrophobicContact CG1-CD1 3.96Å; V149-F155 HydrophobicContact CG1-CE1 3.9Å; V149-F155 HydrophobicContact CG2-CD1 4.23Å; V149-L159 HydrophobicContact CG2-CD1 4.4Å; V149-K251 CarbonylContact O-C 3.6Å; V149-K251 VanDerWaalsContact O-CA 3.23Å; V149-K251 WeakPolarHBondContact O-CA 3.29Å; V149-I252 HydrophobicContact CB-CG1 3.99Å; V149-I252 PolarHBondContact N-O 2.89Å; V149-I252 PolarHBondContact O-N 2.85Å
150	E	92.4	Very high	91.6	Very high	58 Å²	58	31.4 Å²	31.4	27%	0.271	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	165.2	-177.3	-65.8	175.7	146.8	0	0	111.5	R133 R135 E153	R133-E150 IonicContact CZ-OE1 2.85Å; R133-E150 IonicContact CZ-OE2 2.79Å; R133-E150 IonicContact NH1-OE1 3.87Å; R133-E150 PolarHBondContact NH1-OE1 2.74Å; R133-E150 IonicContact NH2-OE1 3.68Å; R133-E150 PolarHBondContact NH2-OE1 3.11Å; R133-E150 IonicContact NH2-OE2 3.34Å; R133-E150 PolarHBondContact NH2-OE2 3.39Å; R135-E150 IonicContact NH2-OE2 2.8Å; R135-E150 PolarHBondContact NH2-OE2 3.11Å; R135-E150 VanDerWaalsContact NH2-OE2 3.12Å; E150-E153 HydrophobicContact CB-CG 4.2Å; E150-E153 PolarHBondContact N-OE2 2.84Å; E150-E153 WeakPolarHBondContact O-CB 3.47Å; E150-E153 PolarHBondContact O-N 2.84Å
151	E	89.5	Confident	91.7	Very high	84 Å²	84	25.2 Å²	25.2	39%	0.393	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	145.2	177.6	-169.9	159.6	-161.5	0	0	112.2	E153 N248 T249 Q250	E151-E153 PolarHBondContact O-N 2.9Å; E151-E153 VanDerWaalsContact O-N 3.08Å; E151-N248 WeakPolarHBondContact OE1-CA 3.32Å; E151-N248 PolarHBondContact OE1-N 2.96Å; E151-T249 WeakPolarHBondContact CB-O 3.27Å; E151-Q250 PolarHBondContact N-O 2.82Å
152	D	85.6	Confident	91.6	Very high	96 Å²	96	25.4 Å²	25.4	51%	0.513	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	-6.5	-173.9	-69.9	-20.2	0	0	0	116.4	L246 K247	D152-L246 WeakPolarHBondContact CA-O 3.4Å; D152-L246 PolarHBondContact N-O 3.33Å; D152-L246 VanDerWaalsContact N-O 3.09Å; D152-K247 VanDerWaalsContact OD1-CD 3.24Å; D152-K247 WeakPolarHBondContact OD1-CD 3.3Å; D152-K247 WeakPolarHBondContact OD1-CE 3.45Å; D152-K247 IonicContact OD1-NZ 3.29Å; D152-K247 PolarHBondContact OD1-NZ 3.41Å
153	E	88.8	Confident	91.5	Very high	55 Å²	55	22.8 Å²	22.8	26%	0.257	12%	0.116	S	C	.	.	P	Polyproline II helix	trans	-70.6	152	174.4	-67.4	-165.6	131.3	0	0	113.2	V149 E150 E151 N245 L246	V149-E153 HydrophobicContact CG1-CB 3.69Å; E150-E153 HydrophobicContact CB-CG 4.2Å; E150-E153 PolarHBondContact N-OE2 2.84Å; E150-E153 WeakPolarHBondContact O-CB 3.47Å; E150-E153 PolarHBondContact O-N 2.84Å; E151-E153 PolarHBondContact O-N 2.9Å; E151-E153 VanDerWaalsContact O-N 3.08Å; E153-N245 WeakPolarHBondContact O-CA 3.41Å; E153-L246 PolarHBondContact O-N 3.16Å
154	T	87.8	Confident	91.4	Very high	60 Å²	60	23.4 Å²	23.4	37%	0.368	12%	0.12	S	C	.	.	B	Isolated β-bridge	trans	-92.7	133.3	177.7	-57.5	0	0	0	0	111.8	G243 A244 N245	T154-G243 VanDerWaalsContact CG2-CA 3.48Å; T154-A244 WeakPolarHBondContact CA-O 3.47Å; T154-N245 WeakPolarHBondContact CA-OD1 3.33Å; T154-N245 VanDerWaalsContact CB-OD1 3.32Å; T154-N245 WeakPolarHBondContact CB-OD1 3.37Å; T154-N245 WeakPolarHBondContact CG2-OD1 3.2Å; T154-N245 PolarHBondContact OG1-OD1 3.3Å
155	F	91.8	Very high	91.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-65.5	131.5	178.6	-58.7	-44.4	0	0	0	112.5	V149 L159 V173 L240 K242 G243 A244 L246 I252	V149-F155 HydrophobicContact CB-CD1 4.46Å; V149-F155 HydrophobicContact CB-CE1 4.34Å; V149-F155 HydrophobicContact CG1-CD1 3.96Å; V149-F155 HydrophobicContact CG1-CE1 3.9Å; V149-F155 HydrophobicContact CG2-CD1 4.23Å; F155-L159 HydrophobicContact CD1-CD1 4.37Å; F155-V173 HydrophobicContact CE2-CB 4.42Å; F155-V173 HydrophobicContact CE2-CG1 3.79Å; F155-V173 HydrophobicContact CE2-CG2 3.74Å; F155-V173 HydrophobicContact CZ-CG2 4Å; F155-L240 HydrophobicContact CD2-CB 3.9Å; F155-L240 HydrophobicContact CE1-CD1 4.28Å; F155-L240 HydrophobicContact CE2-CB 3.85Å; F155-L240 HydrophobicContact CE2-CD1 4.46Å; F155-L240 HydrophobicContact CE2-CD2 4.16Å; F155-L240 HydrophobicContact CE2-CG 4.39Å; F155-L240 HydrophobicContact CG-CB 4.38Å; F155-L240 HydrophobicContact CZ-CB 4.3Å; F155-L240 HydrophobicContact CZ-CD1 4.09Å; F155-L240 HydrophobicContact CZ-CD2 4.28Å; F155-L240 HydrophobicContact CZ-CG 4.48Å; F155-K242 CarbonylContact O-C 3.08Å; F155-K242 WeakPolarHBondContact O-CA 3.26Å; F155-G243 PolarHBondContact O-N 3.26Å; F155-A244 HydrophobicContact CD2-CB 4.1Å; F155-A244 WeakPolarHBondContact CD2-O 3.1Å; F155-A244 HydrophobicContact CE2-CB 4.45Å; F155-A244 PolarHBondContact N-O 3.01Å; F155-L246 HydrophobicContact CE1-CB 4.1Å; F155-L246 HydrophobicContact CE1-CD1 4.45Å; F155-L246 HydrophobicContact CZ-CB 4.07Å; F155-L246 HydrophobicContact CZ-CD1 4.07Å; F155-I252 HydrophobicContact CE1-CD1 3.65Å; F155-I252 HydrophobicContact CZ-CD1 4.04Å
156	P	90.8	Very high	90.9	Very high	1 Å²	1	28 Å²	28	1%	0.006	14%	0.144	C	C	.	.	S	Bend	trans	-94.1	-12.7	-167.9	36.1	-37.5	0	0	0	115.5	N43 Y123 V125 S138 I141 L147 K242	N43-P156 PolarHBondContact ND2-O 2.81Å; N43-P156 PolarHBondContact OD1-O 2.84Å; Y123-P156 HydrophobicContact CE2-CB 4.23Å; Y123-P156 VanDerWaalsContact OH-CA 3.22Å; Y123-P156 WeakPolarHBondContact OH-CA 3.41Å; Y123-P156 VanDerWaalsContact OH-CB 3.32Å; Y123-P156 WeakPolarHBondContact OH-CB 3.3Å; V125-P156 HydrophobicContact CG1-CG 3.88Å; V125-P156 HydrophobicContact CG2-CB 3.69Å; V125-P156 HydrophobicContact CG2-CG 3.92Å; S138-P156 WeakPolarHBondContact OG-CB 3.49Å; I141-P156 HydrophobicContact CD1-CB 3.79Å; I141-P156 HydrophobicContact CD1-CG 3.74Å; L147-P156 HydrophobicContact CD1-CG 3.51Å; P156-K242 PolarHBondContact O-NZ 2.74Å
157	C	93.3	Very high	90	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-157.1	175.2	174.4	35.4	0	0	0	0	107	L159 Y258 T259 T263	C157-L159 HydrophobicContact CB-CD2 4.38Å; C157-L159 WeakPolarHBondContact O-CG 3.47Å; C157-L159 PolarHBondContact O-N 3.04Å; C157-L159 WeakPolarHBondContact SG-CD2 3.44Å; C157-Y258 VanDerWaalsContact CB-O 3.23Å; C157-Y258 WeakPolarHBondContact CB-O 3.28Å; C157-T259 HydrophobicContact CB-CG2 4.17Å; C157-T263 HydrophobicContact CB-CG2 4.49Å
158	D	94.7	Very high	89	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.9	177.1	-56.2	-25.4	0	0	0	108.4	L239 L240 K242 V257 Y258 T263 K264	D158-L239 HydrophobicContact CB-CD1 4.38Å; D158-L240 CarbonylContact C-O 3.53Å; D158-L240 VanDerWaalsContact CA-O 3.29Å; D158-L240 WeakPolarHBondContact CA-O 3.49Å; D158-K242 WeakPolarHBondContact OD1-CB 3.46Å; D158-K242 PolarHBondContact OD1-N 3.29Å; D158-V257 PolarHBondContact O-N 3.07Å; D158-Y258 HydrophobicContact CB-CD2 3.94Å; D158-Y258 HydrophobicContact CB-CG 4.48Å; D158-Y258 PolarHBondContact N-O 3.16Å; D158-Y258 PolarHBondContact O-N 3.12Å; D158-T263 WeakPolarHBondContact OD2-CA 3.29Å; D158-T263 WeakPolarHBondContact OD2-CB 3.31Å; D158-K264 PolarHBondContact OD2-N 2.73Å
159	L	95.2	Very high	88.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	152.3	-171	-40.6	-179.2	0	0	0	111.9	L147 V149 F155 C157 L239 L240 V255 A256	L147-L159 HydrophobicContact CD1-CD1 4.13Å; L147-L159 HydrophobicContact CD1-CD2 3.6Å; L147-L159 HydrophobicContact CG-CD2 4.47Å; V149-L159 HydrophobicContact CG2-CD1 4.4Å; F155-L159 HydrophobicContact CD1-CD1 4.37Å; C157-L159 HydrophobicContact CB-CD2 4.38Å; C157-L159 WeakPolarHBondContact O-CG 3.47Å; C157-L159 PolarHBondContact O-N 3.04Å; C157-L159 WeakPolarHBondContact SG-CD2 3.44Å; L159-L239 WeakPolarHBondContact O-CA 3.42Å; L159-L240 HydrophobicContact CB-CB 4.23Å; L159-L240 HydrophobicContact CB-CD1 4.46Å; L159-L240 PolarHBondContact N-O 2.92Å; L159-L240 PolarHBondContact O-N 3.05Å; L159-V255 CarbonylContact C-O 3.54Å; L159-V255 VanDerWaalsContact CA-O 3.27Å; L159-V255 WeakPolarHBondContact CA-O 3.23Å; L159-A256 HydrophobicContact CD2-CB 4.07Å
160	I	94.5	Very high	87.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129	161.2	-66.4	-68.9	0	0	0	109.5	L162 V190 I204 F216 L234 N238 L239 G254 V255 V257	I160-L162 PolarHBondContact O-N 3.4Å; I160-V190 HydrophobicContact CG2-CG2 4.12Å; I160-I204 HydrophobicContact CB-CD1 4.45Å; I160-F216 HydrophobicContact CD1-CD1 4.45Å; I160-F216 HydrophobicContact CD1-CE1 3.67Å; I160-F216 HydrophobicContact CD1-CZ 3.99Å; I160-L234 HydrophobicContact CD1-CD1 4.25Å; I160-L234 HydrophobicContact CG1-CD1 4.32Å; I160-L234 HydrophobicContact CG2-CD1 4.44Å; I160-L234 HydrophobicContact CG2-CD2 4.16Å; I160-N238 WeakPolarHBondContact CA-O 3.49Å; I160-N238 HydrophobicContact CD1-CB 4.32Å; I160-N238 HydrophobicContact CG2-CB 4.49Å; I160-L239 HydrophobicContact CD1-CB 4.28Å; I160-L239 HydrophobicContact CD1-CD1 3.93Å; I160-G254 CarbonylContact O-C 3.55Å; I160-G254 WeakPolarHBondContact O-CA 3.31Å; I160-V255 HydrophobicContact CB-CG1 4.11Å; I160-V255 PolarHBondContact N-O 2.87Å; I160-V255 PolarHBondContact O-N 3.38Å; I160-V257 HydrophobicContact CB-CG2 4.49Å; I160-V257 HydrophobicContact CG1-CG2 3.71Å
161	L	93.8	Very high	87.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	116.4	-180	178	57.5	0	0	0	111.2	Q163 C171 H187 T189 V190 N238 L240 I252	L161-Q163 WeakPolarHBondContact CD1-O 3.35Å; L161-C171 HydrophobicContact CD2-CB 4.48Å; L161-C171 VanDerWaalsContact CD2-SG 3.57Å; L161-H187 HydrophobicContact CD2-CB 4.1Å; L161-T189 HydrophobicContact CD1-CG2 4.25Å; L161-T189 HydrophobicContact CD2-CG2 4.25Å; L161-T189 HydrophobicContact CG-CG2 3.85Å; L161-V190 PolarHBondContact O-N 3.05Å; L161-N238 PolarHBondContact N-O 3.46Å; L161-L240 HydrophobicContact CB-CD1 4.02Å; L161-L240 HydrophobicContact CB-CG 4.25Å; L161-L240 HydrophobicContact CD1-CD1 4.28Å; L161-I252 HydrophobicContact CD1-CB 3.9Å; L161-I252 HydrophobicContact CD1-CD1 4.09Å; L161-I252 HydrophobicContact CD1-CG2 4.01Å
162	L	90.6	Very high	87.6	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.021	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-46.8	179.1	-61	180	0	0	0	111.9	V24 I160 T189 L193 L197 L200 M220 C253 V255	V24-L162 HydrophobicContact CG1-CD1 4.45Å; I160-L162 PolarHBondContact O-N 3.4Å; L162-T189 WeakPolarHBondContact O-CG2 3.48Å; L162-L193 HydrophobicContact CB-CD1 3.97Å; L162-L193 HydrophobicContact CD2-CD1 3.93Å; L162-L193 WeakPolarHBondContact O-CD1 3.33Å; L162-L197 HydrophobicContact CB-CD2 4.15Å; L162-L197 HydrophobicContact CD1-CD2 4.25Å; L162-L200 HydrophobicContact CD1-CD2 4.27Å; L162-M220 HydrophobicContact CD2-CE 3.96Å; L162-M220 HydrophobicContact CD2-SD 4.36Å; L162-C253 PolarHBondContact N-O 2.91Å; L162-V255 HydrophobicContact CD1-CB 4.05Å; L162-V255 HydrophobicContact CD1-CG1 4.04Å; L162-V255 HydrophobicContact CD2-CG1 4.2Å; L162-V255 HydrophobicContact CG-CG1 4.2Å
163	Q	89.9	Confident	87.6	Confident	73 Å²	73	29.2 Å²	29.2	34%	0.341	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	147.8	-175.4	-161	175.7	27.7	0	0	110.7	L161 S195 L197 I252 C253	L161-Q163 WeakPolarHBondContact CD1-O 3.35Å; Q163-S195 PolarHBondContact NE2-O 3.18Å; Q163-L197 HydrophobicContact CB-CD1 4.48Å; Q163-I252 CarbonylContact O-C 3.55Å; Q163-I252 WeakPolarHBondContact O-CA 3.44Å; Q163-I252 WeakPolarHBondContact O-CB 3.19Å; Q163-C253 HydrophobicContact CB-CB 4.01Å; Q163-C253 PolarHBondContact N-O 3.21Å; Q163-C253 PolarHBondContact O-N 3.37Å
164	S	89.8	Confident	87.3	Confident	21 Å²	21	27.4 Å²	27.4	15%	0.147	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	158.4	173.6	-178	0	0	0	0	110.4	R166 T170 T249	S164-R166 PolarHBondContact O-N 2.83Å; S164-R166 PolarHBondContact OG-N 3.4Å; S164-T170 VanDerWaalsContact CB-O 3.26Å; S164-T170 WeakPolarHBondContact CB-O 3.44Å; S164-T170 PolarHBondContact OG-O 2.97Å; S164-T249 WeakPolarHBondContact OG-CG2 3.49Å
165	S	88	Confident	86.6	Confident	47 Å²	47	24.9 Å²	24.9	33%	0.329	14%	0.136	S	C	.	.	S	Bend	trans	-75.2	-0.3	169.1	73	0	0	0	0	113.9	Q250 K251	S165-Q250 PolarHBondContact OG-N 2.92Å; S165-K251 WeakPolarHBondContact CB-O 3.4Å; S165-K251 PolarHBondContact N-O 2.85Å; S165-K251 PolarHBondContact OG-N 2.68Å; S165-K251 PolarHBondContact OG-O 3.06Å
166	R	81.7	Confident	85.3	Confident	57 Å²	57	25.9 Å²	25.9	22%	0.215	14%	0.144	C	C	.	.	S	Bend	trans	-101.6	136.1	179.9	-62.6	179.8	60.3	91.5	8.5	111.4	S164 D168 G169 T170 T249	S164-R166 PolarHBondContact O-N 2.83Å; S164-R166 PolarHBondContact OG-N 3.4Å; R166-D168 WeakPolarHBondContact CB-OD1 3.43Å; R166-D168 IonicContact CZ-OD2 3.2Å; R166-D168 VanDerWaalsContact CZ-OD2 3.29Å; R166-D168 IonicContact NE-OD1 2.89Å; R166-D168 PolarHBondContact NE-OD1 3.49Å; R166-D168 IonicContact NE-OD2 3.17Å; R166-D168 PolarHBondContact NE-OD2 3.14Å; R166-D168 IonicContact NH2-OD2 2.69Å; R166-D168 PolarHBondContact NH2-OD2 2.91Å; R166-D168 PolarHBondContact O-N 3.28Å; R166-G169 PolarHBondContact O-N 3.04Å; R166-T170 WeakPolarHBondContact CD-O 3.45Å; R166-T170 PolarHBondContact NE-OG1 3.33Å; R166-T249 HydrophobicContact CG-CG2 4.35Å
167	D	73.8	Confident	84	Confident	177 Å²	177	27.5 Å²	27.5	95%	0.947	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.4	177.3	-54.6	-34	0	0	0	114
168	D	72	Confident	82.6	Confident	77 Å²	77	27.7 Å²	27.7	41%	0.412	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.6	178.4	58.8	31.6	0	0	0	114.4	R166 T170	R166-D168 WeakPolarHBondContact CB-OD1 3.43Å; R166-D168 IonicContact CZ-OD2 3.2Å; R166-D168 VanDerWaalsContact CZ-OD2 3.29Å; R166-D168 IonicContact NE-OD1 2.89Å; R166-D168 PolarHBondContact NE-OD1 3.49Å; R166-D168 IonicContact NE-OD2 3.17Å; R166-D168 PolarHBondContact NE-OD2 3.14Å; R166-D168 IonicContact NH2-OD2 2.69Å; R166-D168 PolarHBondContact NH2-OD2 2.91Å; R166-D168 PolarHBondContact O-N 3.28Å; D168-T170 HydrophobicContact CB-CG2 4.41Å; D168-T170 VanDerWaalsContact CG-OG1 3.26Å; D168-T170 PolarHBondContact O-N 3.34Å; D168-T170 WeakPolarHBondContact OD1-CB 3.29Å; D168-T170 PolarHBondContact OD1-N 2.88Å; D168-T170 PolarHBondContact OD1-OG1 3.5Å; D168-T170 PolarHBondContact OD2-OG1 3.31Å
169	G	79.6	Confident	80.9	Confident	16 Å²	16	28 Å²	28	17%	0.165	16%	0.159	C	C	.	.	S	Bend	trans	69.1	16	-178.2	0	0	0	0	0	114.3	R166 T189	R166-G169 PolarHBondContact O-N 3.04Å; G169-T189 WeakPolarHBondContact O-CG2 3.48Å; G169-T189 PolarHBondContact O-N 2.91Å; G169-T189 PolarHBondContact O-OG1 3.08Å; G169-T189 VanDerWaalsContact O-OG1 3.09Å
170	T	83.4	Confident	78.7	Confident	12 Å²	12	28.1 Å²	28.1	7%	0.074	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	161.1	179.4	72.1	0	0	0	0	112.6	S164 R166 D168 T186 H187 Y188	S164-T170 VanDerWaalsContact CB-O 3.26Å; S164-T170 WeakPolarHBondContact CB-O 3.44Å; S164-T170 PolarHBondContact OG-O 2.97Å; R166-T170 WeakPolarHBondContact CD-O 3.45Å; R166-T170 PolarHBondContact NE-OG1 3.33Å; D168-T170 HydrophobicContact CB-CG2 4.41Å; D168-T170 VanDerWaalsContact CG-OG1 3.26Å; D168-T170 PolarHBondContact O-N 3.34Å; D168-T170 WeakPolarHBondContact OD1-CB 3.29Å; D168-T170 PolarHBondContact OD1-N 2.88Å; D168-T170 PolarHBondContact OD1-OG1 3.5Å; D168-T170 PolarHBondContact OD2-OG1 3.31Å; T170-T186 HydrophobicContact CG2-CG2 4.01Å; T170-H187 CarbonylContact C-O 3.58Å; T170-H187 VanDerWaalsContact CA-O 3.26Å; T170-H187 WeakPolarHBondContact CA-O 3.34Å; T170-Y188 HydrophobicContact CG2-CD1 3.82Å; T170-Y188 HydrophobicContact CG2-CE1 3.73Å
171	C	88.1	Confident	77.2	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	158.7	159.5	74.1	0	0	0	0	110.8	L161 H187 L246 T249 I252	L161-C171 HydrophobicContact CD2-CB 4.48Å; L161-C171 VanDerWaalsContact CD2-SG 3.57Å; C171-H187 PolarHBondContact N-O 3.09Å; C171-H187 PolarHBondContact O-N 2.87Å; C171-L246 HydrophobicContact CB-CD1 3.93Å; C171-T249 HydrophobicContact CB-CG2 3.75Å; C171-I252 HydrophobicContact CB-CG2 3.69Å
172	F	86.6	Confident	75.4	Confident	13 Å²	13	32.8 Å²	32.8	6%	0.057	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.4	177.7	-54.9	-84	0	0	0	111.1	H184 K185 T186 K247 N248 T249 Q469	F172-H184 HydrophobicContact CB-CB 4.45Å; F172-K185 WeakPolarHBondContact CA-O 3.42Å; F172-T186 HydrophobicContact CD1-CG2 4.41Å; F172-T186 HydrophobicContact CE1-CG2 3.85Å; F172-T186 WeakPolarHBondContact CE1-OG1 3.48Å; F172-T186 HydrophobicContact CZ-CG2 4.31Å; F172-K247 WeakPolarHBondContact CB-O 3.43Å; F172-K247 PolarHBondContact O-N 3.26Å; F172-K247 VanDerWaalsContact O-O 3.13Å; F172-N248 HydrophobicContact CD2-CB 4.03Å; F172-T249 PolarHBondContact N-OG1 2.88Å; F172-Q469 VanDerWaalsContact CZ-NE2 3.28Å
173	V	86.5	Confident	74.4	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	135.8	-176.2	178.6	0	0	0	0	109.2	F155 T175 K185 H187 L240 A244 N245	F155-V173 HydrophobicContact CE2-CB 4.42Å; F155-V173 HydrophobicContact CE2-CG1 3.79Å; F155-V173 HydrophobicContact CE2-CG2 3.74Å; F155-V173 HydrophobicContact CZ-CG2 4Å; V173-T175 HydrophobicContact CG1-CG2 4.07Å; V173-K185 PolarHBondContact N-O 2.96Å; V173-K185 PolarHBondContact O-N 3.13Å; V173-H187 VanDerWaalsContact CG2-CD2 3.46Å; V173-H187 WeakPolarHBondContact CG2-CD2 3.49Å; V173-L240 HydrophobicContact CG2-CD2 3.78Å; V173-A244 HydrophobicContact CG1-CB 3.54Å; V173-N245 WeakPolarHBondContact CA-O 3.44Å
174	T	82.6	Confident	73.6	Confident	17 Å²	17	32.1 Å²	32.1	10%	0.104	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	116.9	169	42.6	0	0	0	0	109.6	A244 N245 K247	T174-A244 WeakPolarHBondContact O-CA 3.33Å; T174-A244 WeakPolarHBondContact O-CB 3.44Å; T174-N245 PolarHBondContact N-O 3.31Å; T174-N245 PolarHBondContact O-N 3.35Å; T174-N245 VanDerWaalsContact O-N 3.09Å; T174-N245 PolarHBondContact OG1-O 2.93Å; T174-K247 HydrophobicContact CG2-CG 3.78Å; T174-K247 WeakPolarHBondContact OG1-CG 3.04Å
175	T	72.6	Confident	73.1	Confident	6 Å²	6	33 Å²	33	4%	0.037	19%	0.185	C	C	.	.			trans	-95.3	8.1	-175.3	52.8	0	0	0	0	113.5	V173 S177 L178 D179 K185 A244	V173-T175 HydrophobicContact CG1-CG2 4.07Å; T175-S177 PolarHBondContact O-N 2.81Å; T175-L178 WeakPolarHBondContact O-CA 3.33Å; T175-L178 WeakPolarHBondContact O-CB 3.2Å; T175-L178 PolarHBondContact O-N 3.02Å; T175-D179 VanDerWaalsContact C-OD1 3.29Å; T175-D179 WeakPolarHBondContact CB-OD1 3.07Å; T175-D179 WeakPolarHBondContact CB-OD2 3.35Å; T175-D179 PolarHBondContact O-N 3.18Å; T175-D179 PolarHBondContact OG1-OD1 2.9Å; T175-D179 PolarHBondContact OG1-OD2 3.29Å; T175-K185 HydrophobicContact CG2-CD 3.91Å; T175-K185 WeakPolarHBondContact OG1-CE 3.28Å; T175-K185 PolarHBondContact OG1-NZ 2.72Å; T175-A244 HydrophobicContact CG2-CB 4.16Å
176	A	65.1	Low	72.8	Confident	21 Å²	21	32.8 Å²	32.8	17%	0.174	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-34.5	178.8	0	0	0	0	0	115	L178 G180 E181 G861	A176-L178 PolarHBondContact O-N 3.12Å; A176-G180 WeakPolarHBondContact O-CA 3.46Å; A176-G180 PolarHBondContact O-N 2.57Å; A176-E181 WeakPolarHBondContact CA-O 3.19Å; A176-E181 PolarHBondContact N-O 2.96Å; A176-G861 WeakPolarHBondContact O-CA 3.36Å
177	S	62.7	Low	73.1	Confident	35 Å²	35	31.1 Å²	31.1	25%	0.245	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.9	173.7	-69.7	0	0	0	0	115.2	T175 G243 Q863	T175-S177 PolarHBondContact O-N 2.81Å; S177-G243 WeakPolarHBondContact CB-O 3.44Å; S177-G243 PolarHBondContact OG-O 2.71Å; S177-Q863 PolarHBondContact O-NE2 3.49Å
178	L	64	Low	73.6	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.021	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-45.6	-166.3	-74.8	-174.7	0	0	0	115.4	T175 A176 L241 K242 A244 M265 Q863	T175-L178 WeakPolarHBondContact O-CA 3.33Å; T175-L178 WeakPolarHBondContact O-CB 3.2Å; T175-L178 PolarHBondContact O-N 3.02Å; A176-L178 PolarHBondContact O-N 3.12Å; L178-L241 HydrophobicContact CD1-CB 3.3Å; L178-L241 HydrophobicContact CD1-CD1 4.09Å; L178-L241 HydrophobicContact CD1-CG 4.34Å; L178-K242 WeakPolarHBondContact CD1-O 3.39Å; L178-K242 WeakPolarHBondContact CD2-O 3.43Å; L178-A244 HydrophobicContact CD1-CB 3.98Å; L178-M265 HydrophobicContact CD2-CB 3.73Å; L178-M265 HydrophobicContact CD2-CE 4.25Å; L178-M265 HydrophobicContact CD2-CG 3.48Å; L178-M265 VanDerWaalsContact CD2-CG 3.48Å; L178-M265 HydrophobicContact CD2-SD 3.91Å; L178-Q863 WeakPolarHBondContact O-CG 3.4Å; L178-Q863 PolarHBondContact O-NE2 3Å; L178-Q863 VanDerWaalsContact O-NE2 3.12Å
179	D	57.9	Low	74.4	Confident	8 Å²	8	25.1 Å²	25.1	4%	0.043	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-13.2	177	47.9	32.7	0	0	0	112.7	T175 E181 K185 L213 Y214 A841	T175-D179 VanDerWaalsContact C-OD1 3.29Å; T175-D179 WeakPolarHBondContact CB-OD1 3.07Å; T175-D179 WeakPolarHBondContact CB-OD2 3.35Å; T175-D179 PolarHBondContact O-N 3.18Å; T175-D179 PolarHBondContact OG1-OD1 2.9Å; T175-D179 PolarHBondContact OG1-OD2 3.29Å; D179-E181 VanDerWaalsContact C-N 3.32Å; D179-E181 WeakPolarHBondContact OD1-CB 3.2Å; D179-E181 PolarHBondContact OD1-N 2.86Å; D179-K185 IonicContact OD1-NZ 2.74Å; D179-K185 IonicContact OD2-NZ 3.77Å; D179-K185 PolarHBondContact OD2-NZ 2.84Å; D179-L213 HydrophobicContact CB-CD1 4.48Å; D179-Y214 PolarHBondContact OD2-OH 3.37Å; D179-A841 HydrophobicContact CB-CB 4.48Å; D179-A841 WeakPolarHBondContact O-CB 3.29Å; D179-A841 PolarHBondContact O-N 3.21Å
180	G	50.4	Low	74.6	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.01	13%	0.134	C	C	.	.			trans	95.2	-22.1	-173.3	0	0	0	0	0	112.4	A176 S182 E860 G861	A176-G180 WeakPolarHBondContact O-CA 3.46Å; A176-G180 PolarHBondContact O-N 2.57Å; G180-S182 PolarHBondContact O-N 2.87Å; G180-S182 VanDerWaalsContact O-N 3.09Å; G180-E860 WeakPolarHBondContact CA-O 3.47Å; G180-E860 CarbonylContact O-C 3.52Å; G180-E860 WeakPolarHBondContact O-CA 2.8Å; G180-E860 WeakPolarHBondContact O-CB 3.17Å; G180-G861 PolarHBondContact O-N 3.43Å
181	E	61.3	Low	74	Confident	52 Å²	52	27 Å²	27	24%	0.243	15%	0.154	C	C	.	.			trans	-66.3	116.4	-171.1	-63	171.8	-150.9	0	0	110.8	A176 D179 N183 K185 Y214	A176-E181 WeakPolarHBondContact CA-O 3.19Å; A176-E181 PolarHBondContact N-O 2.96Å; D179-E181 VanDerWaalsContact C-N 3.32Å; D179-E181 WeakPolarHBondContact OD1-CB 3.2Å; D179-E181 PolarHBondContact OD1-N 2.86Å; E181-N183 PolarHBondContact O-N 2.91Å; E181-K185 VanDerWaalsContact CD-NZ 3.33Å; E181-K185 IonicContact OE1-NZ 3.78Å; E181-K185 WeakPolarHBondContact OE2-CE 3.17Å; E181-K185 IonicContact OE2-NZ 3.63Å; E181-K185 PolarHBondContact OE2-NZ 2.89Å; E181-Y214 PolarHBondContact OE1-OH 2.93Å
182	S	56.9	Low	72.9	Confident	47 Å²	47	31.2 Å²	31.2	33%	0.329	18%	0.176	S	C	.	.			trans	-74.7	-9.8	178.7	55.4	0	0	0	0	113.3	G180 E860	G180-S182 PolarHBondContact O-N 2.87Å; G180-S182 VanDerWaalsContact O-N 3.09Å; S182-E860 PolarHBondContact N-OE1 2.68Å; S182-E860 PolarHBondContact OG-OE1 3.29Å
183	N	68.9	Low	72	Confident	24 Å²	24	32.3 Å²	32.3	13%	0.128	18%	0.183	C	C	.	.	S	Bend	trans	-66.2	153.1	179	-65.3	-45.8	0	0	0	113	E181 S515 P517	E181-N183 PolarHBondContact O-N 2.91Å; N183-S515 VanDerWaalsContact CB-O 3.28Å; N183-S515 WeakPolarHBondContact CB-O 3.5Å; N183-S515 PolarHBondContact ND2-O 3.09Å; N183-P517 WeakPolarHBondContact OD1-CD 3.24Å
184	H	74.4	Confident	70.9	Confident	39 Å²	39	36.1 Å²	36.1	18%	0.181	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.1	177	-70.5	-116.8	0	0	0	109.8	F172 I513 A514	F172-H184 HydrophobicContact CB-CB 4.45Å; H184-I513 HydrophobicContact CB-CG2 3.92Å; H184-I513 VanDerWaalsContact CD2-CG2 3.49Å; H184-I513 WeakPolarHBondContact CD2-CG2 3.39Å; H184-I513 VanDerWaalsContact CG-CG2 3.47Å; H184-A514 PolarHBondContact N-O 2.83Å; H184-A514 VanDerWaalsContact N-O 3.12Å
185	K	78.9	Confident	69.9	Low	38 Å²	38	40.1 Å²	40.1	17%	0.165	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.4	179.6	-59.1	-174.1	-177.1	-176.1	0	109.9	F172 V173 T175 D179 E181 Y214	F172-K185 WeakPolarHBondContact CA-O 3.42Å; V173-K185 PolarHBondContact N-O 2.96Å; V173-K185 PolarHBondContact O-N 3.13Å; T175-K185 HydrophobicContact CG2-CD 3.91Å; T175-K185 WeakPolarHBondContact OG1-CE 3.28Å; T175-K185 PolarHBondContact OG1-NZ 2.72Å; D179-K185 IonicContact OD1-NZ 2.74Å; D179-K185 IonicContact OD2-NZ 3.77Å; D179-K185 PolarHBondContact OD2-NZ 2.84Å; E181-K185 VanDerWaalsContact CD-NZ 3.33Å; E181-K185 IonicContact OE1-NZ 3.78Å; E181-K185 WeakPolarHBondContact OE2-CE 3.17Å; E181-K185 IonicContact OE2-NZ 3.63Å; E181-K185 PolarHBondContact OE2-NZ 2.89Å; K185-Y214 PolarHBondContact NZ-OH 2.82Å
186	T	82.1	Confident	69.7	Low	44 Å²	44	44.2 Å²	44.2	27%	0.27	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	122.3	179.6	-43.6	0	0	0	0	110.6	T170 F172 Y188	T170-T186 HydrophobicContact CG2-CG2 4.01Å; F172-T186 HydrophobicContact CD1-CG2 4.41Å; F172-T186 HydrophobicContact CE1-CG2 3.85Å; F172-T186 WeakPolarHBondContact CE1-OG1 3.48Å; F172-T186 HydrophobicContact CZ-CG2 4.31Å; T186-Y188 HydrophobicContact CG2-CE2 4.11Å
187	H	86.8	Confident	70.1	Confident	22 Å²	22	44.2 Å²	44.2	10%	0.102	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	154.5	172.3	-70	-98.2	0	0	0	110.8	L161 T170 C171 V173 E237 L239 L240	L161-H187 HydrophobicContact CD2-CB 4.1Å; T170-H187 CarbonylContact C-O 3.58Å; T170-H187 VanDerWaalsContact CA-O 3.26Å; T170-H187 WeakPolarHBondContact CA-O 3.34Å; C171-H187 PolarHBondContact N-O 3.09Å; C171-H187 PolarHBondContact O-N 2.87Å; V173-H187 VanDerWaalsContact CG2-CD2 3.46Å; V173-H187 WeakPolarHBondContact CG2-CD2 3.49Å; H187-E237 CarbonylContact C-O 3.18Å; H187-E237 VanDerWaalsContact CA-O 3.28Å; H187-E237 WeakPolarHBondContact CA-O 3.4Å; H187-E237 WeakPolarHBondContact CB-O 3.41Å; H187-E237 PolarHBondContact ND1-O 3.46Å; H187-L239 PolarHBondContact CE1-O 3.43Å; H187-L239 PolarHBondContact ND1-O 3.4Å; H187-L240 HydrophobicContact CB-CD2 3.79Å
188	Y	85.9	Confident	70.3	Confident	92 Å²	92	47.9 Å²	47.9	36%	0.361	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.1	-170.3	-61.8	-97.3	0	0	0	112	T170 T186 E237 N238	T170-Y188 HydrophobicContact CG2-CD1 3.82Å; T170-Y188 HydrophobicContact CG2-CE1 3.73Å; T186-Y188 HydrophobicContact CG2-CE2 4.11Å; Y188-E237 HydrophobicContact CD2-CB 4.24Å; Y188-E237 PolarHBondContact N-O 2.86Å; Y188-N238 PolarHBondContact O-ND2 3.4Å
189	T	88.4	Confident	70.6	Confident	36 Å²	36	55.9 Å²	55.9	22%	0.221	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-62.7	151.3	171.6	52.5	0	0	0	0	111.7	L161 L162 G169 A191	L161-T189 HydrophobicContact CD1-CG2 4.25Å; L161-T189 HydrophobicContact CD2-CG2 4.25Å; L161-T189 HydrophobicContact CG-CG2 3.85Å; L162-T189 WeakPolarHBondContact O-CG2 3.48Å; G169-T189 WeakPolarHBondContact O-CG2 3.48Å; G169-T189 PolarHBondContact O-N 2.91Å; G169-T189 PolarHBondContact O-OG1 3.08Å; G169-T189 VanDerWaalsContact O-OG1 3.09Å; T189-A191 PolarHBondContact O-N 2.98Å
190	V	82.5	Confident	71.6	Confident	8 Å²	8	55.7 Å²	55.7	5%	0.048	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-63.8	133.7	169	-172.7	0	0	0	0	109.7	I160 L161 L193 M220 R232 L234	I160-V190 HydrophobicContact CG2-CG2 4.12Å; L161-V190 PolarHBondContact O-N 3.05Å; V190-L193 HydrophobicContact CB-CD1 3.88Å; V190-L193 HydrophobicContact CB-CG 4.27Å; V190-M220 HydrophobicContact CB-SD 4.45Å; V190-M220 HydrophobicContact CG1-SD 4.14Å; V190-M220 HydrophobicContact CG2-SD 4.14Å; V190-R232 HydrophobicContact CG1-CB 4Å; V190-R232 HydrophobicContact CG1-CG 4.25Å; V190-L234 HydrophobicContact CG2-CD2 3.57Å
191	A	70.6	Confident	73.1	Confident	58 Å²	58	57.5 Å²	57.5	48%	0.479	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	154.7	-179.4	0	0	0	0	0	112.8	T189 L193	T189-A191 PolarHBondContact O-N 2.98Å; A191-L193 VanDerWaalsContact C-N 3.26Å; A191-L193 PolarHBondContact O-N 3.37Å
192	D	65.6	Low	74.2	Confident	89 Å²	89	55.2 Å²	55.2	48%	0.476	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	19.3	175.1	-42.6	-45.7	0	0	0	116.2	R224 R232	D192-R224 PolarHBondContact O-NH2 3.16Å; D192-R232 IonicContact OD2-CZ 3.95Å; D192-R232 VanDerWaalsContact OD2-CZ 3.32Å; D192-R232 IonicContact OD2-NE 3.52Å; D192-R232 PolarHBondContact OD2-NE 3.02Å; D192-R232 VanDerWaalsContact OD2-NE 3.08Å; D192-R232 IonicContact OD2-NH2 2.95Å; D192-R232 PolarHBondContact OD2-NH2 2.83Å
193	L	67.9	Low	75.6	Confident	37 Å²	37	53.3 Å²	53.3	19%	0.194	28%	0.28	C	S	.	.			trans	-67.7	146	173	-74.6	173.4	0	0	0	112.4	L162 V190 A191 L200 M220 I222	L162-L193 HydrophobicContact CB-CD1 3.97Å; L162-L193 HydrophobicContact CD2-CD1 3.93Å; L162-L193 WeakPolarHBondContact O-CD1 3.33Å; V190-L193 HydrophobicContact CB-CD1 3.88Å; V190-L193 HydrophobicContact CB-CG 4.27Å; A191-L193 VanDerWaalsContact C-N 3.26Å; A191-L193 PolarHBondContact O-N 3.37Å; L193-L200 HydrophobicContact CD2-CD1 3.62Å; L193-L200 HydrophobicContact CD2-CD2 3.95Å; L193-L200 HydrophobicContact CD2-CG 4.46Å; L193-M220 HydrophobicContact CD2-CE 3.95Å; L193-I222 HydrophobicContact CD2-CD1 4.02Å
194	E	62.6	Low	76.6	Confident	81 Å²	81	52.2 Å²	52.2	38%	0.379	27%	0.274	S	S	.	.			trans	-74.1	143.2	174.6	-66.5	175.9	176.1	0	0	111	D196	E194-D196 PolarHBondContact O-N 3.2Å
195	S	62.8	Low	77.2	Confident	100 Å²	100	52.2 Å²	52.2	70%	0.699	27%	0.274	S	S	*	.	S	Bend	trans	-57.2	-34.2	-177.3	-46.7	0	0	0	0	113.6	Q163	Q163-S195 PolarHBondContact NE2-O 3.18Å
196	D	68.1	Low	77.6	Confident	93 Å²	93	50.6 Å²	50.6	50%	0.497	27%	0.268	S	S	.	.			trans	-100.9	97.7	179.5	-81.7	-51	0	0	0	111.2	E194 Q198 Y199	E194-D196 PolarHBondContact O-N 3.2Å; D196-Q198 PolarHBondContact O-N 2.89Å; D196-Y199 HydrophobicContact CB-CD2 3.84Å; D196-Y199 HydrophobicContact CB-CE2 4.36Å; D196-Y199 PolarHBondContact O-N 3.47Å
197	L	72.8	Confident	77.8	Confident	21 Å²	21	50.2 Å²	50.2	11%	0.11	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-13.3	173.8	-61.3	174	0	0	0	113.8	I146 L162 Q163 L200 C253	I146-L197 HydrophobicContact CG2-CD1 4.49Å; L162-L197 HydrophobicContact CB-CD2 4.15Å; L162-L197 HydrophobicContact CD1-CD2 4.25Å; Q163-L197 HydrophobicContact CB-CD1 4.48Å; L197-L200 HydrophobicContact CD2-CD2 3.95Å; L197-C253 HydrophobicContact CD1-CB 3.45Å; L197-C253 VanDerWaalsContact CD1-CB 3.45Å
198	Q	67.8	Low	77.8	Confident	112 Å²	112	53.3 Å²	53.3	52%	0.523	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-34.3	172.6	-65.7	-173.1	60.1	0	0	113	K27 G131 D196	K27-Q198 PolarHBondContact NZ-O 3.26Å; G131-Q198 VanDerWaalsContact CA-CD 3.49Å; D196-Q198 PolarHBondContact O-N 2.89Å
199	Y	70.1	Confident	77.8	Confident	172 Å²	172	50.3 Å²	50.3	68%	0.675	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-33.3	-179.9	-66.7	-70.2	0	0	0	112.6	K27 D196 S201	K27-Y199 PolarHBondContact NZ-O 2.83Å; D196-Y199 HydrophobicContact CB-CD2 3.84Å; D196-Y199 HydrophobicContact CB-CE2 4.36Å; D196-Y199 PolarHBondContact O-N 3.47Å; Y199-S201 PolarHBondContact O-N 2.8Å; Y199-S201 VanDerWaalsContact O-N 3.1Å
200	L	77.9	Confident	77.5	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	27%	0.268	C	S	.	.			trans	-40.1	113.6	179	-178.3	63.4	0	0	0	113.3	V24 K27 L162 L193 L197 A202 M220 I222	V24-L200 HydrophobicContact CG1-CD2 4.24Å; K27-L200 PolarHBondContact NZ-O 3.27Å; L162-L200 HydrophobicContact CD1-CD2 4.27Å; L193-L200 HydrophobicContact CD2-CD1 3.62Å; L193-L200 HydrophobicContact CD2-CD2 3.95Å; L193-L200 HydrophobicContact CD2-CG 4.46Å; L197-L200 HydrophobicContact CD2-CD2 3.95Å; L200-A202 HydrophobicContact CD1-CB 4.13Å; L200-A202 HydrophobicContact CG-CB 4.31Å; L200-M220 HydrophobicContact CD1-CE 4.43Å; L200-M220 HydrophobicContact CD2-CE 4.28Å; L200-I222 HydrophobicContact CD1-CG2 4.21Å
201	S	81.9	Confident	77.1	Confident	39 Å²	39	53.4 Å²	53.4	27%	0.273	29%	0.286	S	S	.	.			trans	-110.8	113.4	169.9	-173.3	0	0	0	0	108	Y199 Y223	Y199-S201 PolarHBondContact O-N 2.8Å; Y199-S201 VanDerWaalsContact O-N 3.1Å; S201-Y223 PolarHBondContact O-N 3.05Å
202	A	84.5	Confident	77.3	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.033	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	148	-174.7	0	0	0	0	0	113.3	V24 L200 M220 H221 I222	V24-A202 HydrophobicContact CB-CB 4.39Å; V24-A202 HydrophobicContact CG2-CB 4.06Å; V24-A202 WeakPolarHBondContact CG2-O 3.12Å; V24-A202 PolarHBondContact N-O 2.97Å; L200-A202 HydrophobicContact CD1-CB 4.13Å; L200-A202 HydrophobicContact CG-CB 4.31Å; A202-M220 HydrophobicContact CB-CE 3.41Å; A202-M220 VanDerWaalsContact CB-CE 3.41Å; A202-M220 HydrophobicContact CB-CG 4.33Å; A202-H221 CarbonylContact C-O 3.52Å; A202-H221 WeakPolarHBondContact CA-O 3.45Å; A202-H221 WeakPolarHBondContact CB-O 3.48Å; A202-I222 HydrophobicContact CB-CG1 4.49Å
203	T	87.5	Confident	77.7	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.043	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.1	176.8	-64.1	0	0	0	0	109.1	T21 I22 Y23 H221 Y223	T21-T203 HydrophobicContact CG2-CG2 3.3Å; I22-T203 CarbonylContact O-C 3.58Å; I22-T203 WeakPolarHBondContact O-CA 3.49Å; Y23-T203 HydrophobicContact CD1-CG2 4.41Å; Y23-T203 WeakPolarHBondContact CD1-OG1 3.39Å; Y23-T203 HydrophobicContact CE1-CG2 4.22Å; T203-H221 PolarHBondContact N-O 2.99Å; T203-H221 PolarHBondContact O-N 3.16Å; T203-Y223 WeakPolarHBondContact OG1-CE2 3.41Å
204	I	88.6	Confident	78.1	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124	175.3	-65.3	171.7	0	0	0	108.8	T21 I22 V24 I160 R219 M220 L234 V255	T21-I204 CarbonylContact C-O 3.54Å; T21-I204 WeakPolarHBondContact CA-O 3.24Å; I22-I204 HydrophobicContact CB-CB 4.38Å; I22-I204 PolarHBondContact N-O 3.41Å; I22-I204 PolarHBondContact O-N 3.23Å; V24-I204 HydrophobicContact CG2-CD1 4.06Å; V24-I204 HydrophobicContact CG2-CG1 4.31Å; I160-I204 HydrophobicContact CB-CD1 4.45Å; I204-R219 WeakPolarHBondContact CA-O 3.12Å; I204-M220 HydrophobicContact CD1-SD 4.48Å; I204-M220 HydrophobicContact CG1-CB 4.25Å; I204-M220 HydrophobicContact CG1-CG 3.94Å; I204-M220 HydrophobicContact CG1-SD 4.36Å; I204-L234 HydrophobicContact CG1-CD1 4.36Å; I204-L234 HydrophobicContact CG2-CD1 3.78Å; I204-V255 HydrophobicContact CD1-CG1 3.6Å
205	E	87.3	Confident	78.9	Confident	39 Å²	39	56.2 Å²	56.2	18%	0.182	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	133.9	165.8	-70.4	176.9	-136	0	0	109.8	R20 T21 G218 R219 H221	R20-E205 WeakPolarHBondContact O-CA 3.46Å; T21-E205 HydrophobicContact CG2-CG 4.22Å; E205-G218 CarbonylContact O-C 3.57Å; E205-G218 WeakPolarHBondContact O-CA 3.47Å; E205-R219 HydrophobicContact CB-CG 3.91Å; E205-R219 VanDerWaalsContact CD-NE 3.35Å; E205-R219 VanDerWaalsContact CD-NH2 3.26Å; E205-R219 PolarHBondContact N-O 3.35Å; E205-R219 PolarHBondContact O-N 2.84Å; E205-R219 IonicContact OE1-CZ 3.08Å; E205-R219 IonicContact OE1-NE 2.83Å; E205-R219 PolarHBondContact OE1-NE 2.98Å; E205-R219 IonicContact OE1-NH2 3.87Å; E205-R219 PolarHBondContact OE1-NH2 2.79Å; E205-R219 IonicContact OE2-CZ 2.75Å; E205-R219 VanDerWaalsContact OE2-CZ 3.24Å; E205-R219 IonicContact OE2-NE 2.73Å; E205-R219 PolarHBondContact OE2-NE 2.71Å; E205-R219 IonicContact OE2-NH2 3.17Å; E205-R219 PolarHBondContact OE2-NH2 3.39Å; E205-H221 IonicContact OE1-CD2 3.78Å; E205-H221 IonicContact OE1-CE1 2.72Å; E205-H221 IonicContact OE1-NE2 3Å; E205-H221 PolarHBondContact OE1-NE2 3.36Å
206	C	87.1	Confident	79.9	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.034	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	171	173.4	59.9	0	0	0	0	112.3	S19 R20 F216	S19-C206 WeakPolarHBondContact CA-O 3.36Å; R20-C206 VanDerWaalsContact CG-SG 3.57Å; R20-C206 PolarHBondContact N-O 2.9Å; R20-C206 PolarHBondContact O-N 3.4Å; C206-F216 HydrophobicContact CB-CE2 3.88Å; C206-F216 HydrophobicContact CB-CZ 3.74Å
207	E	86.6	Confident	80.7	Confident	36 Å²	36	51.3 Å²	51.3	17%	0.168	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-63.6	164.5	172.6	62.9	-168.4	158.6	0	0	113	Q210 F216 V217 Y258	E207-Q210 PolarHBondContact OE1-NE2 2.7Å; E207-Q210 PolarHBondContact OE2-NE2 3.26Å; E207-F216 VanDerWaalsContact OE1-CA 3.3Å; E207-F216 WeakPolarHBondContact OE1-CA 3.41Å; E207-V217 PolarHBondContact N-O 3.23Å; E207-V217 PolarHBondContact OE1-N 3.03Å; E207-Y258 PolarHBondContact O-OH 2.97Å
208	Q	87	Confident	81.3	Confident	87 Å²	87	50.9 Å²	50.9	41%	0.407	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-65.7	148.8	166.8	-67.1	-54.4	-32.1	0	0	110.3	H18 Q210	H18-Q208 VanDerWaalsContact O-CG 3.24Å; H18-Q208 WeakPolarHBondContact O-CG 3.45Å; H18-Q208 PolarHBondContact O-NE2 3.07Å; Q208-Q210 PolarHBondContact O-N 3.3Å
209	P	86.6	Confident	82.1	Confident	28 Å²	28	50.9 Å²	50.9	18%	0.182	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-59.9	123.6	-176.9	25.7	-35.9	0	0	0	111.3	Y258 E262 L267	P209-Y258 HydrophobicContact CB-CD1 3.68Å; P209-Y258 HydrophobicContact CB-CE1 3.72Å; P209-Y258 HydrophobicContact CB-CG 4.13Å; P209-Y258 HydrophobicContact CG-CD1 4.13Å; P209-Y258 HydrophobicContact CG-CE1 4.2Å; P209-E262 HydrophobicContact CB-CB 4.46Å; P209-E262 WeakPolarHBondContact CB-O 3.41Å; P209-E262 HydrophobicContact CG-CB 3.97Å; P209-E262 HydrophobicContact CG-CG 4.13Å; P209-L267 HydrophobicContact CB-CD1 3.9Å; P209-L267 WeakPolarHBondContact O-CD1 3.48Å
210	Q	82.5	Confident	82.9	Confident	44 Å²	44	42.7 Å²	42.7	21%	0.206	22%	0.215	C	C	.	.			trans	-111.3	151.8	176.3	65.1	-173.4	-27.5	0	0	110.8	E207 Q208 D212 K215	E207-Q210 PolarHBondContact OE1-NE2 2.7Å; E207-Q210 PolarHBondContact OE2-NE2 3.26Å; Q208-Q210 PolarHBondContact O-N 3.3Å; Q210-D212 HydrophobicContact CG-CB 4.3Å; Q210-D212 PolarHBondContact O-N 3.48Å; Q210-K215 PolarHBondContact NE2-O 2.67Å
211	P	73.8	Confident	83.2	Confident	65 Å²	65	43.5 Å²	43.5	42%	0.422	22%	0.218	S	C	.	.	S	Bend	trans	-72.2	-14.6	-179.3	29.8	-36	0	0	0	113.6	L213 L267 N268	P211-L213 PolarHBondContact O-N 2.73Å; P211-L213 VanDerWaalsContact O-N 3.13Å; P211-L267 HydrophobicContact CB-CB 4.2Å; P211-N268 PolarHBondContact O-ND2 3.15Å
212	D	74.4	Confident	83.4	Confident	73 Å²	73	41.9 Å²	41.9	39%	0.39	21%	0.206	S	C	.	.			trans	-64.9	112.1	175	-173.9	-23.5	0	0	0	110.3	Q210 Y214 K215 K264	Q210-D212 HydrophobicContact CG-CB 4.3Å; Q210-D212 PolarHBondContact O-N 3.48Å; D212-Y214 VanDerWaalsContact C-N 3.32Å; D212-Y214 PolarHBondContact O-N 2.89Å; D212-Y214 PolarHBondContact OD1-N 3.49Å; D212-K215 HydrophobicContact CB-CB 4.17Å; D212-K215 PolarHBondContact OD1-N 2.68Å; D212-K215 VanDerWaalsContact OD1-N 3.09Å; D212-K215 WeakPolarHBondContact OD2-CB 3.32Å; D212-K264 VanDerWaalsContact O-CD 3.3Å; D212-K264 WeakPolarHBondContact O-CD 3.33Å; D212-K264 WeakPolarHBondContact O-CE 3.45Å; D212-K264 PolarHBondContact O-NZ 2.86Å
213	L	73.7	Confident	83.2	Confident	27 Å²	27	45 Å²	45	14%	0.141	22%	0.218	C	C	.	.	S	Bend	trans	-61.3	-40.5	180	-64.7	172.8	0	0	0	111.7	D179 P211 L241 K264	D179-L213 HydrophobicContact CB-CD1 4.48Å; P211-L213 PolarHBondContact O-N 2.73Å; P211-L213 VanDerWaalsContact O-N 3.13Å; L213-L241 HydrophobicContact CB-CD1 4.33Å; L213-L241 HydrophobicContact CD2-CD1 4.21Å; L213-K264 HydrophobicContact CD2-CB 3.97Å; L213-K264 PolarHBondContact O-NZ 3.01Å
214	Y	76.9	Confident	82.5	Confident	117 Å²	117	48.8 Å²	48.8	46%	0.459	23%	0.231	S	C	.	.	S	Bend	trans	-88.3	-26.3	-167.3	-64.1	-58.1	0	0	0	113.8	D179 E181 K185 D212 P236	D179-Y214 PolarHBondContact OD2-OH 3.37Å; E181-Y214 PolarHBondContact OE1-OH 2.93Å; K185-Y214 PolarHBondContact NZ-OH 2.82Å; D212-Y214 VanDerWaalsContact C-N 3.32Å; D212-Y214 PolarHBondContact O-N 2.89Å; D212-Y214 PolarHBondContact OD1-N 3.49Å; Y214-P236 WeakPolarHBondContact O-CB 3.21Å; Y214-P236 WeakPolarHBondContact O-CG 3.47Å
215	K	78.5	Confident	81.3	Confident	107 Å²	107	57.4 Å²	57.4	47%	0.465	28%	0.277	S	S	.	.			trans	-86.7	120	176.9	-170.8	-180	176.3	-174.6	0	112.3	Q210 D212 K264	Q210-K215 PolarHBondContact NE2-O 2.67Å; D212-K215 HydrophobicContact CB-CB 4.17Å; D212-K215 PolarHBondContact OD1-N 2.68Å; D212-K215 VanDerWaalsContact OD1-N 3.09Å; D212-K215 WeakPolarHBondContact OD2-CB 3.32Å; K215-K264 PolarHBondContact O-NZ 2.8Å
216	F	85.4	Confident	79.8	Confident	7 Å²	7	59.6 Å²	59.6	3%	0.031	30%	0.297	C	S	.	.			trans	-139.9	130.4	168	179.3	-103.1	0	0	0	110.7	I160 C206 E207 L234 P236 L239 V257 Y258	I160-F216 HydrophobicContact CD1-CD1 4.45Å; I160-F216 HydrophobicContact CD1-CE1 3.67Å; I160-F216 HydrophobicContact CD1-CZ 3.99Å; C206-F216 HydrophobicContact CB-CE2 3.88Å; C206-F216 HydrophobicContact CB-CZ 3.74Å; E207-F216 VanDerWaalsContact OE1-CA 3.3Å; E207-F216 WeakPolarHBondContact OE1-CA 3.41Å; F216-L234 HydrophobicContact CE1-CB 3.92Å; F216-P236 HydrophobicContact CB-CB 4.36Å; F216-L239 HydrophobicContact CB-CD2 3.86Å; F216-L239 HydrophobicContact CD1-CB 4.35Å; F216-L239 HydrophobicContact CD2-CD1 4.33Å; F216-L239 HydrophobicContact CD2-CD2 3.86Å; F216-L239 HydrophobicContact CE2-CD1 4.27Å; F216-L239 HydrophobicContact CG-CB 4.38Å; F216-L239 HydrophobicContact CG-CD2 3.84Å; F216-L239 HydrophobicContact CG-CG 4.49Å; F216-L239 HydrophobicContact CZ-CD1 4.45Å; F216-V257 HydrophobicContact CE2-CG1 4.47Å; F216-Y258 HydrophobicContact CD2-CE2 4.18Å; F216-Y258 AromaticContact CE2-CE2 3.88Å; F216-Y258 HydrophobicContact CE2-CE2 3.88Å
217	V	83.9	Confident	78.3	Confident	84 Å²	84	69.1 Å²	69.1	51%	0.509	34%	0.341	S	S	.	.			trans	-125.5	121.9	175.3	-174	0	0	0	0	110.5	E207	E207-V217 PolarHBondContact N-O 3.23Å; E207-V217 PolarHBondContact OE1-N 3.03Å
218	G	85.8	Confident	77.2	Confident	11 Å²	11	75.3 Å²	75.3	11%	0.113	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	177.1	172	0	0	0	0	0	113.6	E205 L234	E205-G218 CarbonylContact O-C 3.57Å; E205-G218 WeakPolarHBondContact O-CA 3.47Å; G218-L234 PolarHBondContact N-O 3Å; G218-L234 VanDerWaalsContact N-O 3.16Å; G218-L234 PolarHBondContact O-N 2.8Å
219	R	84.6	Confident	76.4	Confident	113 Å²	113	73.7 Å²	73.7	43%	0.426	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	146	172.6	60	-177.6	179.8	167.2	5.8	110.3	I204 E205 V231 R232	I204-R219 WeakPolarHBondContact CA-O 3.12Å; E205-R219 HydrophobicContact CB-CG 3.91Å; E205-R219 VanDerWaalsContact CD-NE 3.35Å; E205-R219 VanDerWaalsContact CD-NH2 3.26Å; E205-R219 PolarHBondContact N-O 3.35Å; E205-R219 PolarHBondContact O-N 2.84Å; E205-R219 IonicContact OE1-CZ 3.08Å; E205-R219 IonicContact OE1-NE 2.83Å; E205-R219 PolarHBondContact OE1-NE 2.98Å; E205-R219 IonicContact OE1-NH2 3.87Å; E205-R219 PolarHBondContact OE1-NH2 2.79Å; E205-R219 IonicContact OE2-CZ 2.75Å; E205-R219 VanDerWaalsContact OE2-CZ 3.24Å; E205-R219 IonicContact OE2-NE 2.73Å; E205-R219 PolarHBondContact OE2-NE 2.71Å; E205-R219 IonicContact OE2-NH2 3.17Å; E205-R219 PolarHBondContact OE2-NH2 3.39Å; R219-V231 HydrophobicContact CB-CG1 4.47Å; R219-R232 CarbonylContact C-O 3.53Å; R219-R232 WeakPolarHBondContact CA-O 3.47Å
220	M	86.6	Confident	76	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.2	175.4	-172.2	169.3	-179.2	0	0	108.7	V24 L162 V190 L193 L200 A202 I204 I222 V231 R232 L234	V24-M220 HydrophobicContact CG2-CE 4.48Å; L162-M220 HydrophobicContact CD2-CE 3.96Å; L162-M220 HydrophobicContact CD2-SD 4.36Å; V190-M220 HydrophobicContact CB-SD 4.45Å; V190-M220 HydrophobicContact CG1-SD 4.14Å; V190-M220 HydrophobicContact CG2-SD 4.14Å; L193-M220 HydrophobicContact CD2-CE 3.95Å; L200-M220 HydrophobicContact CD1-CE 4.43Å; L200-M220 HydrophobicContact CD2-CE 4.28Å; A202-M220 HydrophobicContact CB-CE 3.41Å; A202-M220 VanDerWaalsContact CB-CE 3.41Å; A202-M220 HydrophobicContact CB-CG 4.33Å; I204-M220 HydrophobicContact CD1-SD 4.48Å; I204-M220 HydrophobicContact CG1-CB 4.25Å; I204-M220 HydrophobicContact CG1-CG 3.94Å; I204-M220 HydrophobicContact CG1-SD 4.36Å; M220-I222 HydrophobicContact CE-CG1 4.28Å; M220-I222 HydrophobicContact CG-CG1 4.09Å; M220-V231 CarbonylContact O-C 3.57Å; M220-V231 WeakPolarHBondContact O-CA 3.36Å; M220-R232 PolarHBondContact N-O 2.79Å; M220-R232 PolarHBondContact O-N 3.35Å; M220-L234 HydrophobicContact CB-CD1 4.17Å; M220-L234 HydrophobicContact CB-CD2 4.25Å; M220-L234 HydrophobicContact CB-CG 4.25Å
221	H	85.2	Confident	75.8	Confident	20 Å²	20	75.5 Å²	75.5	9%	0.093	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.3	169.8	-53.8	-79.5	0	0	0	108.2	A202 T203 E205 Y223 P229	A202-H221 CarbonylContact C-O 3.52Å; A202-H221 WeakPolarHBondContact CA-O 3.45Å; A202-H221 WeakPolarHBondContact CB-O 3.48Å; T203-H221 PolarHBondContact N-O 2.99Å; T203-H221 PolarHBondContact O-N 3.16Å; E205-H221 IonicContact OE1-CD2 3.78Å; E205-H221 IonicContact OE1-CE1 2.72Å; E205-H221 IonicContact OE1-NE2 3Å; E205-H221 PolarHBondContact OE1-NE2 3.36Å; H221-Y223 HydrophobicContact CB-CE2 4.12Å; H221-P229 HydrophobicContact CB-CB 4.23Å
222	I	84.5	Confident	76.2	Confident	6 Å²	6	75.1 Å²	75.1	3%	0.031	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	118.4	179.6	-57.2	174.3	0	0	0	108.5	L193 L200 A202 M220 R224 P229 D230 R232	L193-I222 HydrophobicContact CD2-CD1 4.02Å; L200-I222 HydrophobicContact CD1-CG2 4.21Å; A202-I222 HydrophobicContact CB-CG1 4.49Å; M220-I222 HydrophobicContact CE-CG1 4.28Å; M220-I222 HydrophobicContact CG-CG1 4.09Å; I222-R224 HydrophobicContact CG2-CG 4.48Å; I222-R224 PolarHBondContact O-N 3.47Å; I222-P229 WeakPolarHBondContact O-CA 3.32Å; I222-D230 HydrophobicContact CB-CB 4.02Å; I222-D230 PolarHBondContact N-O 3.15Å; I222-D230 PolarHBondContact O-N 2.83Å; I222-R232 HydrophobicContact CD1-CG 4.32Å
223	Y	80.1	Confident	76.5	Confident	68 Å²	68	74.3 Å²	74.3	27%	0.267	37%	0.368	S	S	.	.			trans	-95.4	93.9	-178.7	-55	-85.9	0	0	0	110	S201 T203 H221 P229	S201-Y223 PolarHBondContact O-N 3.05Å; T203-Y223 WeakPolarHBondContact OG1-CE2 3.41Å; H221-Y223 HydrophobicContact CB-CE2 4.12Å; Y223-P229 HydrophobicContact CD1-CB 3.87Å; Y223-P229 HydrophobicContact CE1-CB 3.81Å; Y223-P229 HydrophobicContact CE1-CG 4.3Å
224	R	73	Confident	77	Confident	87 Å²	87	73.1 Å²	73.1	33%	0.328	36%	0.363	S	S	.	.			trans	-80.4	179	164.6	-70.6	171.3	167.8	157.4	-7.4	109.8	D192 I222 S226 D230	D192-R224 PolarHBondContact O-NH2 3.16Å; I222-R224 HydrophobicContact CG2-CG 4.48Å; I222-R224 PolarHBondContact O-N 3.47Å; R224-S226 PolarHBondContact O-N 3.47Å; R224-D230 IonicContact CZ-OD2 3.86Å; R224-D230 IonicContact NE-OD2 3.12Å; R224-D230 IonicContact NH1-OD2 2.79Å; R224-D230 PolarHBondContact NH1-OD2 2.96Å
225	N	63.3	Low	77.3	Confident	181 Å²	181	67.9 Å²	67.9	97%	0.968	34%	0.344	S	S	*	.	S	Bend	trans	-67.7	10.4	175	-67.5	-29.8	0	0	0	114.7
226	S	55.8	Low	77.6	Confident	85 Å²	85	64.8 Å²	64.8	59%	0.594	34%	0.335	S	S	*	.	S	Bend	trans	-84.7	159.1	175.1	-57.5	0	0	0	0	111.3	R224	R224-S226 PolarHBondContact O-N 3.47Å
227	Q	56.2	Low	77.6	Confident	206 Å²	206	67.7 Å²	67.7	96%	0.963	35%	0.348	S	S	*	.	S	Bend	trans	-76.2	-20.1	179.2	-72.8	-174.2	-16.3	0	0	114.5
228	E	64.2	Low	77.9	Confident	166 Å²	166	64.2 Å²	64.2	78%	0.776	33%	0.327	S	S	*	.	S	Bend	trans	-112.1	141.3	174.2	-64.5	-169	148.9	0	0	110.8
229	P	68.9	Low	78.2	Confident	52 Å²	52	63.9 Å²	63.9	34%	0.338	32%	0.323	S	S	.	.			trans	-77.4	139.7	178.3	30.9	-33.7	0	0	0	112.2	H221 I222 Y223 V231	H221-P229 HydrophobicContact CB-CB 4.23Å; I222-P229 WeakPolarHBondContact O-CA 3.32Å; Y223-P229 HydrophobicContact CD1-CB 3.87Å; Y223-P229 HydrophobicContact CE1-CB 3.81Å; Y223-P229 HydrophobicContact CE1-CG 4.3Å; P229-V231 PolarHBondContact O-N 3.05Å; P229-V231 VanDerWaalsContact O-N 3.12Å
230	D	78.3	Confident	78.7	Confident	47 Å²	47	58.5 Å²	58.5	25%	0.251	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	103.9	171	-106.7	-60.3	0	0	0	109.3	I222 R224 R232	I222-D230 HydrophobicContact CB-CB 4.02Å; I222-D230 PolarHBondContact N-O 3.15Å; I222-D230 PolarHBondContact O-N 2.83Å; R224-D230 IonicContact CZ-OD2 3.86Å; R224-D230 IonicContact NE-OD2 3.12Å; R224-D230 IonicContact NH1-OD2 2.79Å; R224-D230 PolarHBondContact NH1-OD2 2.96Å; D230-R232 IonicContact OD1-CZ 2.71Å; D230-R232 VanDerWaalsContact OD1-CZ 3.23Å; D230-R232 IonicContact OD1-NH1 3.5Å; D230-R232 PolarHBondContact OD1-NH1 2.9Å; D230-R232 IonicContact OD1-NH2 2.71Å; D230-R232 PolarHBondContact OD1-NH2 3.38Å
231	V	78.9	Confident	78.9	Confident	63 Å²	63	59.4 Å²	59.4	38%	0.382	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	132.9	176.7	-168.9	0	0	0	0	109.9	R219 M220 P229	R219-V231 HydrophobicContact CB-CG1 4.47Å; M220-V231 CarbonylContact O-C 3.57Å; M220-V231 WeakPolarHBondContact O-CA 3.36Å; P229-V231 PolarHBondContact O-N 3.05Å; P229-V231 VanDerWaalsContact O-N 3.12Å
232	R	82.4	Confident	79.1	Confident	58 Å²	58	58.9 Å²	58.9	22%	0.219	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.3	171.5	-62.9	-65	177.7	-79.1	-1.9	110.1	V190 D192 R219 M220 I222 D230	V190-R232 HydrophobicContact CG1-CB 4Å; V190-R232 HydrophobicContact CG1-CG 4.25Å; D192-R232 IonicContact OD2-CZ 3.95Å; D192-R232 VanDerWaalsContact OD2-CZ 3.32Å; D192-R232 IonicContact OD2-NE 3.52Å; D192-R232 PolarHBondContact OD2-NE 3.02Å; D192-R232 VanDerWaalsContact OD2-NE 3.08Å; D192-R232 IonicContact OD2-NH2 2.95Å; D192-R232 PolarHBondContact OD2-NH2 2.83Å; R219-R232 CarbonylContact C-O 3.53Å; R219-R232 WeakPolarHBondContact CA-O 3.47Å; M220-R232 PolarHBondContact N-O 2.79Å; M220-R232 PolarHBondContact O-N 3.35Å; I222-R232 HydrophobicContact CD1-CG 4.32Å; D230-R232 IonicContact OD1-CZ 2.71Å; D230-R232 VanDerWaalsContact OD1-CZ 3.23Å; D230-R232 IonicContact OD1-NH1 3.5Å; D230-R232 PolarHBondContact OD1-NH1 2.9Å; D230-R232 IonicContact OD1-NH2 2.71Å; D230-R232 PolarHBondContact OD1-NH2 3.38Å
233	S	80.1	Confident	78.9	Confident	55 Å²	55	59 Å²	59	39%	0.385	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	147.3	174.7	-162.7	0	0	0	0	110.5
234	L	85.6	Confident	79.2	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.6	172.9	-58.6	176.2	0	0	0	109.9	I160 V190 I204 F216 G218 M220 N238	I160-L234 HydrophobicContact CD1-CD1 4.25Å; I160-L234 HydrophobicContact CG1-CD1 4.32Å; I160-L234 HydrophobicContact CG2-CD1 4.44Å; I160-L234 HydrophobicContact CG2-CD2 4.16Å; V190-L234 HydrophobicContact CG2-CD2 3.57Å; I204-L234 HydrophobicContact CG1-CD1 4.36Å; I204-L234 HydrophobicContact CG2-CD1 3.78Å; F216-L234 HydrophobicContact CE1-CB 3.92Å; G218-L234 PolarHBondContact N-O 3Å; G218-L234 VanDerWaalsContact N-O 3.16Å; G218-L234 PolarHBondContact O-N 2.8Å; M220-L234 HydrophobicContact CB-CD1 4.17Å; M220-L234 HydrophobicContact CB-CD2 4.25Å; M220-L234 HydrophobicContact CB-CG 4.25Å; L234-N238 HydrophobicContact CD2-CB 4.49Å
235	G	83.2	Confident	79.9	Confident	7 Å²	7	53.4 Å²	53.4	7%	0.072	29%	0.289	C	S	.	.			trans	-112.9	-178.7	175.4	0	0	0	0	0	112.8	E237 N238	G235-E237 PolarHBondContact O-N 2.92Å; G235-N238 PolarHBondContact N-OD1 3.37Å; G235-N238 PolarHBondContact O-N 3Å; G235-N238 VanDerWaalsContact O-N 3.07Å; G235-N238 PolarHBondContact O-OD1 2.87Å
236	P	84.4	Confident	81.1	Confident	42 Å²	42	44.8 Å²	44.8	27%	0.273	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-63.2	-25.6	176.6	27.3	-35	0	0	0	112.9	Y214 F216 N238 L239	Y214-P236 WeakPolarHBondContact O-CB 3.21Å; Y214-P236 WeakPolarHBondContact O-CG 3.47Å; F216-P236 HydrophobicContact CB-CB 4.36Å; P236-N238 PolarHBondContact O-N 2.76Å; P236-N238 VanDerWaalsContact O-N 3.16Å; P236-L239 PolarHBondContact O-N 3.08Å
237	E	84.9	Confident	82.5	Confident	67 Å²	67	43.2 Å²	43.2	31%	0.313	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-58.9	-20	171.6	66.1	-139.8	-143.2	0	0	114.6	H187 Y188 G235 R646	H187-E237 CarbonylContact C-O 3.18Å; H187-E237 VanDerWaalsContact CA-O 3.28Å; H187-E237 WeakPolarHBondContact CA-O 3.4Å; H187-E237 WeakPolarHBondContact CB-O 3.41Å; H187-E237 PolarHBondContact ND1-O 3.46Å; Y188-E237 HydrophobicContact CD2-CB 4.24Å; Y188-E237 PolarHBondContact N-O 2.86Å; G235-E237 PolarHBondContact O-N 2.92Å; E237-R646 IonicContact OE1-CZ 3.49Å; E237-R646 IonicContact OE1-NH1 2.67Å; E237-R646 PolarHBondContact OE1-NH1 3.1Å; E237-R646 IonicContact OE1-NH2 3.75Å; E237-R646 IonicContact OE2-CZ 3.73Å; E237-R646 IonicContact OE2-NH1 2.72Å; E237-R646 PolarHBondContact OE2-NH1 2.73Å; E237-R646 IonicContact OE2-NH2 4Å; E237-R646 PolarHBondContact OE2-NH2 3.01Å
238	N	90.3	Very high	83.7	Confident	11 Å²	11	35 Å²	35	6%	0.059	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-100.1	-11.1	176.3	-45.4	113.1	0	0	0	112.9	I160 L161 Y188 L234 G235 P236	I160-N238 WeakPolarHBondContact CA-O 3.49Å; I160-N238 HydrophobicContact CD1-CB 4.32Å; I160-N238 HydrophobicContact CG2-CB 4.49Å; L161-N238 PolarHBondContact N-O 3.46Å; Y188-N238 PolarHBondContact O-ND2 3.4Å; L234-N238 HydrophobicContact CD2-CB 4.49Å; G235-N238 PolarHBondContact N-OD1 3.37Å; G235-N238 PolarHBondContact O-N 3Å; G235-N238 VanDerWaalsContact O-N 3.07Å; G235-N238 PolarHBondContact O-OD1 2.87Å; P236-N238 PolarHBondContact O-N 2.76Å; P236-N238 VanDerWaalsContact O-N 3.16Å
239	L	92.9	Very high	84.7	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.8	-172.8	-174.3	75.5	0	0	0	111.6	D158 L159 I160 H187 F216 P236 L241 K264	D158-L239 HydrophobicContact CB-CD1 4.38Å; L159-L239 WeakPolarHBondContact O-CA 3.42Å; I160-L239 HydrophobicContact CD1-CB 4.28Å; I160-L239 HydrophobicContact CD1-CD1 3.93Å; H187-L239 PolarHBondContact CE1-O 3.43Å; H187-L239 PolarHBondContact ND1-O 3.4Å; F216-L239 HydrophobicContact CB-CD2 3.86Å; F216-L239 HydrophobicContact CD1-CB 4.35Å; F216-L239 HydrophobicContact CD2-CD1 4.33Å; F216-L239 HydrophobicContact CD2-CD2 3.86Å; F216-L239 HydrophobicContact CE2-CD1 4.27Å; F216-L239 HydrophobicContact CG-CB 4.38Å; F216-L239 HydrophobicContact CG-CD2 3.84Å; F216-L239 HydrophobicContact CG-CG 4.49Å; F216-L239 HydrophobicContact CZ-CD1 4.45Å; P236-L239 PolarHBondContact O-N 3.08Å; L239-L241 HydrophobicContact CD2-CD2 3.57Å; L239-L241 HydrophobicContact CG-CD2 3.98Å; L239-K264 HydrophobicContact CD2-CD 4.49Å
240	L	94.2	Very high	85.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.4	175.5	-52.5	174.3	0	0	0	108.8	F155 D158 L159 L161 V173 H187 I252	F155-L240 HydrophobicContact CD2-CB 3.9Å; F155-L240 HydrophobicContact CE1-CD1 4.28Å; F155-L240 HydrophobicContact CE2-CB 3.85Å; F155-L240 HydrophobicContact CE2-CD1 4.46Å; F155-L240 HydrophobicContact CE2-CD2 4.16Å; F155-L240 HydrophobicContact CE2-CG 4.39Å; F155-L240 HydrophobicContact CG-CB 4.38Å; F155-L240 HydrophobicContact CZ-CB 4.3Å; F155-L240 HydrophobicContact CZ-CD1 4.09Å; F155-L240 HydrophobicContact CZ-CD2 4.28Å; F155-L240 HydrophobicContact CZ-CG 4.48Å; D158-L240 CarbonylContact C-O 3.53Å; D158-L240 VanDerWaalsContact CA-O 3.29Å; D158-L240 WeakPolarHBondContact CA-O 3.49Å; L159-L240 HydrophobicContact CB-CB 4.23Å; L159-L240 HydrophobicContact CB-CD1 4.46Å; L159-L240 PolarHBondContact N-O 2.92Å; L159-L240 PolarHBondContact O-N 3.05Å; L161-L240 HydrophobicContact CB-CD1 4.02Å; L161-L240 HydrophobicContact CB-CG 4.25Å; L161-L240 HydrophobicContact CD1-CD1 4.28Å; V173-L240 HydrophobicContact CG2-CD2 3.78Å; H187-L240 HydrophobicContact CB-CD2 3.79Å; L240-I252 HydrophobicContact CD1-CD1 3.24Å
241	L	91.4	Very high	86.2	Confident	20 Å²	20	33.8 Å²	33.8	11%	0.105	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-95.4	137.3	-169.7	-61.4	175.3	0	0	0	112.7	L178 L213 L239 G243 A244 K264	L178-L241 HydrophobicContact CD1-CB 3.3Å; L178-L241 HydrophobicContact CD1-CD1 4.09Å; L178-L241 HydrophobicContact CD1-CG 4.34Å; L213-L241 HydrophobicContact CB-CD1 4.33Å; L213-L241 HydrophobicContact CD2-CD1 4.21Å; L239-L241 HydrophobicContact CD2-CD2 3.57Å; L239-L241 HydrophobicContact CG-CD2 3.98Å; L241-G243 PolarHBondContact O-N 3.01Å; L241-A244 WeakPolarHBondContact O-CB 3.43Å; L241-A244 PolarHBondContact O-N 3.39Å; L241-A244 VanDerWaalsContact O-N 3.11Å; L241-K264 HydrophobicContact CD2-CB 4.44Å; L241-K264 HydrophobicContact CD2-CD 3.83Å; L241-K264 HydrophobicContact CD2-CG 4.27Å
242	K	88.4	Confident	86.9	Confident	8 Å²	8	30.8 Å²	30.8	4%	0.035	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	126.1	176.7	-178.4	-178.5	179	107.9	0	110.5	N43 I45 F155 P156 D158 L178 T263 M265	N43-K242 PolarHBondContact OD1-NZ 2.79Å; I45-K242 HydrophobicContact CD1-CD 4.39Å; F155-K242 CarbonylContact O-C 3.08Å; F155-K242 WeakPolarHBondContact O-CA 3.26Å; P156-K242 PolarHBondContact O-NZ 2.74Å; D158-K242 WeakPolarHBondContact OD1-CB 3.46Å; D158-K242 PolarHBondContact OD1-N 3.29Å; L178-K242 WeakPolarHBondContact CD1-O 3.39Å; L178-K242 WeakPolarHBondContact CD2-O 3.43Å; K242-T263 HydrophobicContact CB-CG2 4.03Å; K242-T263 HydrophobicContact CD-CG2 3.78Å; K242-M265 HydrophobicContact CG-SD 4.45Å
243	G	80.3	Confident	87.4	Confident	9 Å²	9	28.4 Å²	28.4	9%	0.093	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	-13.5	177.1	0	0	0	0	0	115.1	T154 F155 S177 L241	T154-G243 VanDerWaalsContact CG2-CA 3.48Å; F155-G243 PolarHBondContact O-N 3.26Å; S177-G243 WeakPolarHBondContact CB-O 3.44Å; S177-G243 PolarHBondContact OG-O 2.71Å; L241-G243 PolarHBondContact O-N 3.01Å
244	A	86.8	Confident	88	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.			trans	-75.5	158.4	163.7	0	0	0	0	0	110.8	T154 F155 V173 T174 T175 L178 L241	T154-A244 WeakPolarHBondContact CA-O 3.47Å; F155-A244 HydrophobicContact CD2-CB 4.1Å; F155-A244 WeakPolarHBondContact CD2-O 3.1Å; F155-A244 HydrophobicContact CE2-CB 4.45Å; F155-A244 PolarHBondContact N-O 3.01Å; V173-A244 HydrophobicContact CG1-CB 3.54Å; T174-A244 WeakPolarHBondContact O-CA 3.33Å; T174-A244 WeakPolarHBondContact O-CB 3.44Å; T175-A244 HydrophobicContact CG2-CB 4.16Å; L178-A244 HydrophobicContact CD1-CB 3.98Å; L241-A244 WeakPolarHBondContact O-CB 3.43Å; L241-A244 PolarHBondContact O-N 3.39Å; L241-A244 VanDerWaalsContact O-N 3.11Å
245	N	86.8	Confident	88.3	Confident	37 Å²	37	25.7 Å²	25.7	20%	0.198	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.2	-175.4	-62.1	-11.2	0	0	0	111.7	E153 T154 V173 T174	E153-N245 WeakPolarHBondContact O-CA 3.41Å; T154-N245 WeakPolarHBondContact CA-OD1 3.33Å; T154-N245 VanDerWaalsContact CB-OD1 3.32Å; T154-N245 WeakPolarHBondContact CB-OD1 3.37Å; T154-N245 WeakPolarHBondContact CG2-OD1 3.2Å; T154-N245 PolarHBondContact OG1-OD1 3.3Å; V173-N245 WeakPolarHBondContact CA-O 3.44Å; T174-N245 PolarHBondContact N-O 3.31Å; T174-N245 PolarHBondContact O-N 3.35Å; T174-N245 VanDerWaalsContact O-N 3.09Å; T174-N245 PolarHBondContact OG1-O 2.93Å
246	L	89.8	Confident	88.9	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	142.3	171.8	-170	68.5	0	0	0	110.8	D152 E153 F155 C171 T249 I252	D152-L246 WeakPolarHBondContact CA-O 3.4Å; D152-L246 PolarHBondContact N-O 3.33Å; D152-L246 VanDerWaalsContact N-O 3.09Å; E153-L246 PolarHBondContact O-N 3.16Å; F155-L246 HydrophobicContact CE1-CB 4.1Å; F155-L246 HydrophobicContact CE1-CD1 4.45Å; F155-L246 HydrophobicContact CZ-CB 4.07Å; F155-L246 HydrophobicContact CZ-CD1 4.07Å; C171-L246 HydrophobicContact CB-CD1 3.93Å; L246-T249 HydrophobicContact CD1-CG2 4.36Å; L246-T249 WeakPolarHBondContact CD2-O 3.37Å; L246-I252 HydrophobicContact CD1-CD1 4.28Å; L246-I252 HydrophobicContact CD1-CG1 4.34Å; L246-I252 HydrophobicContact CD1-CG2 3.89Å; L246-I252 HydrophobicContact CD2-CG1 4.12Å; L246-I252 HydrophobicContact CD2-CG2 4.21Å
247	K	85.3	Confident	89.3	Confident	52 Å²	52	23.3 Å²	23.3	23%	0.226	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	155.4	179	-64.1	-65.6	174.7	-178	0	111.4	D152 F172 T174 T249	D152-K247 VanDerWaalsContact OD1-CD 3.24Å; D152-K247 WeakPolarHBondContact OD1-CD 3.3Å; D152-K247 WeakPolarHBondContact OD1-CE 3.45Å; D152-K247 IonicContact OD1-NZ 3.29Å; D152-K247 PolarHBondContact OD1-NZ 3.41Å; F172-K247 WeakPolarHBondContact CB-O 3.43Å; F172-K247 PolarHBondContact O-N 3.26Å; F172-K247 VanDerWaalsContact O-O 3.13Å; T174-K247 HydrophobicContact CG2-CG 3.78Å; T174-K247 WeakPolarHBondContact OG1-CG 3.04Å; K247-T249 WeakPolarHBondContact O-CB 3.22Å; K247-T249 PolarHBondContact O-N 2.68Å; K247-T249 PolarHBondContact O-OG1 2.85Å
248	N	79.9	Confident	89.7	Confident	35 Å²	35	20.2 Å²	20.2	19%	0.187	10%	0.099	C	C	.	.	S	Bend	trans	50	29.9	172.3	-154.5	50	0	0	0	113.7	E151 F172 Q469	E151-N248 WeakPolarHBondContact OE1-CA 3.32Å; E151-N248 PolarHBondContact OE1-N 2.96Å; F172-N248 HydrophobicContact CD2-CB 4.03Å; N248-Q469 PolarHBondContact ND2-OE1 3.05Å
249	T	85.4	Confident	89.9	Confident	3 Å²	3	19.7 Å²	19.7	2%	0.018	10%	0.096	C	C	.	.			trans	-155.9	110.5	-169.2	-45.8	0	0	0	0	107.1	E151 S164 R166 C171 F172 L246 K247 K251 I252	E151-T249 WeakPolarHBondContact CB-O 3.27Å; S164-T249 WeakPolarHBondContact OG-CG2 3.49Å; R166-T249 HydrophobicContact CG-CG2 4.35Å; C171-T249 HydrophobicContact CB-CG2 3.75Å; F172-T249 PolarHBondContact N-OG1 2.88Å; L246-T249 HydrophobicContact CD1-CG2 4.36Å; L246-T249 WeakPolarHBondContact CD2-O 3.37Å; K247-T249 WeakPolarHBondContact O-CB 3.22Å; K247-T249 PolarHBondContact O-N 2.68Å; K247-T249 PolarHBondContact O-OG1 2.85Å; T249-K251 VanDerWaalsContact C-N 3.33Å; T249-K251 PolarHBondContact O-N 2.89Å; T249-I252 HydrophobicContact CG2-CG2 3.86Å
250	Q	87.9	Confident	89.7	Confident	142 Å²	142	19.5 Å²	19.5	66%	0.664	10%	0.095	S	C	*	.	S	Bend	trans	-61.5	-40.6	-170.7	-66.6	-178.2	-7.8	0	0	113	E151 S165	E151-Q250 PolarHBondContact N-O 2.82Å; S165-Q250 PolarHBondContact OG-N 2.92Å
251	K	91	Very high	89.3	Confident	93 Å²	93	23.6 Å²	23.6	40%	0.404	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	158.5	173.2	65.5	176.6	-161.7	162.6	0	113.1	E148 V149 S165 T249	E148-K251 WeakPolarHBondContact OE2-CD 3.46Å; E148-K251 IonicContact OE2-NZ 3.96Å; E148-K251 PolarHBondContact OE2-NZ 2.73Å; V149-K251 CarbonylContact O-C 3.6Å; V149-K251 VanDerWaalsContact O-CA 3.23Å; V149-K251 WeakPolarHBondContact O-CA 3.29Å; S165-K251 WeakPolarHBondContact CB-O 3.4Å; S165-K251 PolarHBondContact N-O 2.85Å; S165-K251 PolarHBondContact OG-N 2.68Å; S165-K251 PolarHBondContact OG-O 3.06Å; T249-K251 VanDerWaalsContact C-N 3.33Å; T249-K251 PolarHBondContact O-N 2.89Å
252	I	93.8	Very high	89.3	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	161.2	167.9	62.8	161.1	0	0	0	111.4	E148 V149 F155 L161 Q163 C171 L240 L246 T249	E148-I252 WeakPolarHBondContact CA-O 3.35Å; V149-I252 HydrophobicContact CB-CG1 3.99Å; V149-I252 PolarHBondContact N-O 2.89Å; V149-I252 PolarHBondContact O-N 2.85Å; F155-I252 HydrophobicContact CE1-CD1 3.65Å; F155-I252 HydrophobicContact CZ-CD1 4.04Å; L161-I252 HydrophobicContact CD1-CB 3.9Å; L161-I252 HydrophobicContact CD1-CD1 4.09Å; L161-I252 HydrophobicContact CD1-CG2 4.01Å; Q163-I252 CarbonylContact O-C 3.55Å; Q163-I252 WeakPolarHBondContact O-CA 3.44Å; Q163-I252 WeakPolarHBondContact O-CB 3.19Å; C171-I252 HydrophobicContact CB-CG2 3.69Å; L240-I252 HydrophobicContact CD1-CD1 3.24Å; L246-I252 HydrophobicContact CD1-CD1 4.28Å; L246-I252 HydrophobicContact CD1-CG1 4.34Å; L246-I252 HydrophobicContact CD1-CG2 3.89Å; L246-I252 HydrophobicContact CD2-CG1 4.12Å; L246-I252 HydrophobicContact CD2-CG2 4.21Å; T249-I252 HydrophobicContact CG2-CG2 3.86Å
253	C	92.5	Very high	89.3	Confident	8 Å²	8	24.5 Å²	24.5	5%	0.054	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.3	165.5	-57.6	0	0	0	0	109.7	L147 L162 Q163 L197	L147-C253 VanDerWaalsContact O-CA 3.31Å; L147-C253 WeakPolarHBondContact O-CA 3.24Å; L162-C253 PolarHBondContact N-O 2.91Å; Q163-C253 HydrophobicContact CB-CB 4.01Å; Q163-C253 PolarHBondContact N-O 3.21Å; Q163-C253 PolarHBondContact O-N 3.37Å; L197-C253 HydrophobicContact CD1-CB 3.45Å; L197-C253 VanDerWaalsContact CD1-CB 3.45Å
254	G	93	Very high	89.5	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	159.5	178.3	0	0	0	0	0	113.4	L147 I160	L147-G254 PolarHBondContact N-O 3.09Å; L147-G254 PolarHBondContact O-N 2.95Å; I160-G254 CarbonylContact O-C 3.55Å; I160-G254 WeakPolarHBondContact O-CA 3.31Å
255	V	93.2	Very high	89.2	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132.3	-177.3	59.2	0	0	0	0	111.9	V24 D145 L159 I160 L162 I204 V257	V24-V255 HydrophobicContact CG1-CG2 4.26Å; V24-V255 HydrophobicContact CG2-CG1 4.34Å; V24-V255 HydrophobicContact CG2-CG2 4.2Å; D145-V255 WeakPolarHBondContact O-CA 3.29Å; L159-V255 CarbonylContact C-O 3.54Å; L159-V255 VanDerWaalsContact CA-O 3.27Å; L159-V255 WeakPolarHBondContact CA-O 3.23Å; I160-V255 HydrophobicContact CB-CG1 4.11Å; I160-V255 PolarHBondContact N-O 2.87Å; I160-V255 PolarHBondContact O-N 3.38Å; L162-V255 HydrophobicContact CD1-CB 4.05Å; L162-V255 HydrophobicContact CD1-CG1 4.04Å; L162-V255 HydrophobicContact CD2-CG1 4.2Å; L162-V255 HydrophobicContact CG-CG1 4.2Å; I204-V255 HydrophobicContact CD1-CG1 3.6Å; V255-V257 PolarHBondContact O-N 2.9Å
256	A	94.5	Very high	88.9	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	124.5	-176.6	0	0	0	0	0	113	I141 K142 V143 G144 D145 L159	I141-A256 HydrophobicContact CG2-CB 4.21Å; K142-A256 WeakPolarHBondContact O-CB 3.4Å; V143-A256 WeakPolarHBondContact CA-O 3.2Å; G144-A256 PolarHBondContact N-O 3.26Å; D145-A256 PolarHBondContact O-N 3.14Å; L159-A256 HydrophobicContact CD2-CB 4.07Å
257	V	93.3	Very high	88.3	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-44.3	-175.8	166.8	0	0	0	0	113.6	R20 I22 D158 I160 F216 V255	R20-V257 PolarHBondContact NH1-O 2.92Å; I22-V257 HydrophobicContact CD1-CB 4.14Å; I22-V257 HydrophobicContact CD1-CG1 3.8Å; I22-V257 HydrophobicContact CD1-CG2 4.12Å; D158-V257 PolarHBondContact O-N 3.07Å; I160-V257 HydrophobicContact CB-CG2 4.49Å; I160-V257 HydrophobicContact CG1-CG2 3.71Å; F216-V257 HydrophobicContact CE2-CG1 4.47Å; V255-V257 PolarHBondContact O-N 2.9Å
258	Y	93.3	Very high	87.5	Confident	1 Å²	1	28.4 Å²	28.4	0%	0.004	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.7	171.4	-51.3	-63.3	0	0	0	109.6	C157 D158 E207 P209 F216 T263	C157-Y258 VanDerWaalsContact CB-O 3.23Å; C157-Y258 WeakPolarHBondContact CB-O 3.28Å; D158-Y258 HydrophobicContact CB-CD2 3.94Å; D158-Y258 HydrophobicContact CB-CG 4.48Å; D158-Y258 PolarHBondContact N-O 3.16Å; D158-Y258 PolarHBondContact O-N 3.12Å; E207-Y258 PolarHBondContact O-OH 2.97Å; P209-Y258 HydrophobicContact CB-CD1 3.68Å; P209-Y258 HydrophobicContact CB-CE1 3.72Å; P209-Y258 HydrophobicContact CB-CG 4.13Å; P209-Y258 HydrophobicContact CG-CD1 4.13Å; P209-Y258 HydrophobicContact CG-CE1 4.2Å; F216-Y258 HydrophobicContact CD2-CE2 4.18Å; F216-Y258 AromaticContact CE2-CE2 3.88Å; F216-Y258 HydrophobicContact CE2-CE2 3.88Å; Y258-T263 WeakPolarHBondContact O-CG2 3.38Å
259	T	93.4	Very high	86.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.153	C	C	.	.			trans	-115.4	156.9	-178.2	43	0	0	0	0	111.3	C41 N43 V143 C157 M261 E262 T263	C41-T259 PolarHBondContact O-OG1 2.85Å; C41-T259 PolarHBondContact SG-O 3.05Å; N43-T259 HydrophobicContact CB-CG2 4.08Å; V143-T259 HydrophobicContact CG2-CG2 3.83Å; V143-T259 WeakPolarHBondContact CG2-OG1 3.48Å; C157-T259 HydrophobicContact CB-CG2 4.17Å; T259-M261 PolarHBondContact O-N 2.71Å; T259-E262 WeakPolarHBondContact O-CA 3.13Å; T259-E262 WeakPolarHBondContact O-CB 3.36Å; T259-E262 PolarHBondContact O-N 2.74Å; T259-T263 PolarHBondContact O-N 2.71Å
260	G	89.6	Confident	85.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	52.4	-126.3	165.9	0	0	0	0	0	113.6	N43 I45 E262 T263 A266	N43-G260 PolarHBondContact OD1-N 2.82Å; I45-G260 WeakPolarHBondContact CD1-O 3.21Å; G260-E262 PolarHBondContact O-N 3.27Å; G260-T263 PolarHBondContact O-N 3Å; G260-T263 PolarHBondContact O-OG1 3.38Å; G260-A266 WeakPolarHBondContact O-CB 3.28Å
261	M	86.1	Confident	83.4	Confident	86 Å²	86	36.3 Å²	36.3	42%	0.424	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-75.7	-4.6	-179.4	-59.2	-56	-58.1	0	0	114.4	I45 T259 A266	I45-M261 HydrophobicContact CD1-SD 4.33Å; T259-M261 PolarHBondContact O-N 2.71Å; M261-A266 HydrophobicContact CE-CB 4.19Å; M261-A266 HydrophobicContact SD-CB 4.26Å
262	E	90.3	Very high	81.7	Confident	48 Å²	48	35.2 Å²	35.2	22%	0.224	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-89.3	-11.3	170.1	-75.5	172.7	-177.4	0	0	112.5	R20 C41 P209 T259 G260	R20-E262 IonicContact CZ-OE2 3.93Å; R20-E262 IonicContact NH1-OE2 2.74Å; R20-E262 PolarHBondContact NH1-OE2 2.69Å; R20-E262 IonicContact NH2-OE1 2.62Å; R20-E262 IonicContact NH2-OE2 3.29Å; R20-E262 PolarHBondContact NH2-OE2 3.36Å; C41-E262 HydrophobicContact CB-CG 4.36Å; C41-E262 VanDerWaalsContact SG-CG 3.54Å; P209-E262 HydrophobicContact CB-CB 4.46Å; P209-E262 WeakPolarHBondContact CB-O 3.41Å; P209-E262 HydrophobicContact CG-CB 3.97Å; P209-E262 HydrophobicContact CG-CG 4.13Å; T259-E262 WeakPolarHBondContact O-CA 3.13Å; T259-E262 WeakPolarHBondContact O-CB 3.36Å; T259-E262 PolarHBondContact O-N 2.74Å; G260-E262 PolarHBondContact O-N 3.27Å
263	T	88.9	Confident	79.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.222	C	C	.	.	S	Bend	trans	-63.6	146.7	175.9	56	0	0	0	0	112.4	C157 D158 K242 Y258 T259 G260 M265 A266 L267	C157-T263 HydrophobicContact CB-CG2 4.49Å; D158-T263 WeakPolarHBondContact OD2-CA 3.29Å; D158-T263 WeakPolarHBondContact OD2-CB 3.31Å; K242-T263 HydrophobicContact CB-CG2 4.03Å; K242-T263 HydrophobicContact CD-CG2 3.78Å; Y258-T263 WeakPolarHBondContact O-CG2 3.38Å; T259-T263 PolarHBondContact O-N 2.71Å; G260-T263 PolarHBondContact O-N 3Å; G260-T263 PolarHBondContact O-OG1 3.38Å; T263-M265 PolarHBondContact O-N 2.62Å; T263-A266 PolarHBondContact O-N 2.53Å; T263-A266 WeakPolarHBondContact OG1-CB 3.4Å; T263-A266 PolarHBondContact OG1-N 2.73Å; T263-L267 PolarHBondContact O-N 3.34Å
264	K	85.3	Confident	78.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56.8	-36.1	179.1	-58.7	-161.5	179.6	-172.3	0	112.4	D158 D212 L213 K215 L239 L241 L267 N268	D158-K264 PolarHBondContact OD2-N 2.73Å; D212-K264 VanDerWaalsContact O-CD 3.3Å; D212-K264 WeakPolarHBondContact O-CD 3.33Å; D212-K264 WeakPolarHBondContact O-CE 3.45Å; D212-K264 PolarHBondContact O-NZ 2.86Å; L213-K264 HydrophobicContact CD2-CB 3.97Å; L213-K264 PolarHBondContact O-NZ 3.01Å; K215-K264 PolarHBondContact O-NZ 2.8Å; L239-K264 HydrophobicContact CD2-CD 4.49Å; L241-K264 HydrophobicContact CD2-CB 4.44Å; L241-K264 HydrophobicContact CD2-CD 3.83Å; L241-K264 HydrophobicContact CD2-CG 4.27Å; K264-L267 PolarHBondContact O-N 3.1Å; K264-N268 PolarHBondContact O-N 3.05Å; K264-N268 PolarHBondContact O-ND2 3.4Å
265	M	80.9	Confident	77.7	Confident	44 Å²	44	46.3 Å²	46.3	22%	0.217	25%	0.249	C	C	.	.	H	α-helix	trans	-57.9	-48.5	172.1	-173.7	-173	-169.3	0	0	111.9	L178 K242 T263 N268 Y269	L178-M265 HydrophobicContact CD2-CB 3.73Å; L178-M265 HydrophobicContact CD2-CE 4.25Å; L178-M265 HydrophobicContact CD2-CG 3.48Å; L178-M265 VanDerWaalsContact CD2-CG 3.48Å; L178-M265 HydrophobicContact CD2-SD 3.91Å; K242-M265 HydrophobicContact CG-SD 4.45Å; T263-M265 PolarHBondContact O-N 2.62Å; M265-N268 PolarHBondContact O-N 2.76Å; M265-Y269 PolarHBondContact O-N 2.78Å
266	A	79.7	Confident	76.9	Confident	11 Å²	11	52 Å²	52	9%	0.091	27%	0.27	C	S	.	.	H	α-helix	trans	-72.4	-31.3	-177.5	0	0	0	0	0	112.9	I45 G260 M261 T263 N268 Y269	I45-A266 HydrophobicContact CD1-CB 4.3Å; G260-A266 WeakPolarHBondContact O-CB 3.28Å; M261-A266 HydrophobicContact CE-CB 4.19Å; M261-A266 HydrophobicContact SD-CB 4.26Å; T263-A266 PolarHBondContact O-N 2.53Å; T263-A266 WeakPolarHBondContact OG1-CB 3.4Å; T263-A266 PolarHBondContact OG1-N 2.73Å; A266-N268 VanDerWaalsContact C-N 3.32Å; A266-N268 PolarHBondContact O-N 3.48Å; A266-Y269 VanDerWaalsContact O-CB 3.24Å; A266-Y269 WeakPolarHBondContact O-CB 3.28Å; A266-Y269 PolarHBondContact O-N 3.47Å; A266-Y269 VanDerWaalsContact O-N 3.13Å
267	L	77.7	Confident	76.3	Confident	50 Å²	50	52 Å²	52	26%	0.262	27%	0.271	S	S	.	.	H	α-helix	trans	-65.5	-33.4	173.4	-69.5	-175.4	0	0	0	113.1	P209 P211 T263 K264 Y269 Q270	P209-L267 HydrophobicContact CB-CD1 3.9Å; P209-L267 WeakPolarHBondContact O-CD1 3.48Å; P211-L267 HydrophobicContact CB-CB 4.2Å; T263-L267 PolarHBondContact O-N 3.34Å; K264-L267 PolarHBondContact O-N 3.1Å; L267-Y269 VanDerWaalsContact C-N 3.28Å; L267-Q270 VanDerWaalsContact O-CG 3.28Å; L267-Q270 WeakPolarHBondContact O-CG 3.37Å
268	N	67.7	Low	75.7	Confident	75 Å²	75	52.8 Å²	52.8	40%	0.401	28%	0.277	S	S	.	.	H	α-helix	trans	-77.4	-12.8	172.9	-75.1	-67.2	0	0	0	113.4	P211 K264 M265 A266 Q270	P211-N268 PolarHBondContact O-ND2 3.15Å; K264-N268 PolarHBondContact O-N 3.05Å; K264-N268 PolarHBondContact O-ND2 3.4Å; M265-N268 PolarHBondContact O-N 2.76Å; A266-N268 VanDerWaalsContact C-N 3.32Å; A266-N268 PolarHBondContact O-N 3.48Å; N268-Q270 PolarHBondContact O-N 3.09Å
269	Y	62.6	Low	75.3	Confident	114 Å²	114	52.7 Å²	52.7	45%	0.447	28%	0.277	S	S	.	.			trans	-75.9	32.5	176.8	-144.6	-89.8	0	0	0	112.8	M265 A266 L267 G271	M265-Y269 PolarHBondContact O-N 2.78Å; A266-Y269 VanDerWaalsContact O-CB 3.24Å; A266-Y269 WeakPolarHBondContact O-CB 3.28Å; A266-Y269 PolarHBondContact O-N 3.47Å; A266-Y269 VanDerWaalsContact O-N 3.13Å; L267-Y269 VanDerWaalsContact C-N 3.28Å; Y269-G271 PolarHBondContact O-N 2.72Å; Y269-G271 VanDerWaalsContact O-N 3.11Å
270	Q	52.6	Low	74.9	Confident	157 Å²	157	54.9 Å²	54.9	73%	0.734	29%	0.287	S	S	*	.			trans	-58.5	120	-174.8	-65.4	-154.2	9.8	0	0	110.7	L267 N268 K272	L267-Q270 VanDerWaalsContact O-CG 3.28Å; L267-Q270 WeakPolarHBondContact O-CG 3.37Å; N268-Q270 PolarHBondContact O-N 3.09Å; Q270-K272 PolarHBondContact O-N 3.1Å; Q270-K272 VanDerWaalsContact O-N 3.17Å
271	G	51.8	Low	74.8	Confident	74 Å²	74	60.1 Å²	60.1	76%	0.763	31%	0.31	S	S	*	.			trans	-55.1	119.4	-161.5	0	0	0	0	0	113.6	Y269 S273	Y269-G271 PolarHBondContact O-N 2.72Å; Y269-G271 VanDerWaalsContact O-N 3.11Å; G271-S273 PolarHBondContact O-N 3.17Å; G271-S273 VanDerWaalsContact O-N 3.09Å
272	K	56.2	Low	74.9	Confident	70 Å²	70	57 Å²	57	30%	0.304	30%	0.296	S	S	.	.			trans	-40.7	114.6	-177	-63.7	-168.2	-177.1	-170.1	0	111.8	Q270 Q274 L848 K866 N867 S868	Q270-K272 PolarHBondContact O-N 3.1Å; Q270-K272 VanDerWaalsContact O-N 3.17Å; K272-Q274 PolarHBondContact O-N 3.37Å; K272-L848 HydrophobicContact CG-CD2 4.26Å; K272-K866 WeakPolarHBondContact CE-O 3.32Å; K272-K866 PolarHBondContact NZ-O 3.17Å; K272-N867 WeakPolarHBondContact CE-O 3.37Å; K272-N867 VanDerWaalsContact NZ-C 3.29Å; K272-N867 PolarHBondContact NZ-O 3.35Å; K272-S868 PolarHBondContact NZ-O 3.09Å
273	S	55.4	Low	74.8	Confident	104 Å²	104	55 Å²	55	73%	0.727	29%	0.287	S	S	*	.			trans	-58.3	134.7	172.7	-173	0	0	0	0	109.6	G271 K275	G271-S273 PolarHBondContact O-N 3.17Å; G271-S273 VanDerWaalsContact O-N 3.09Å; S273-K275 PolarHBondContact O-N 3.11Å
274	Q	64.4	Low	74.8	Confident	97 Å²	97	56.5 Å²	56.5	45%	0.453	30%	0.295	S	S	.	.			trans	-72.9	97	-177	-171.2	178.8	24.9	0	0	110.2	K272	K272-Q274 PolarHBondContact O-N 3.37Å
275	K	75.4	Confident	75	Confident	41 Å²	41	58.2 Å²	58.2	18%	0.178	31%	0.309	C	S	.	.			trans	-58.5	147.6	169.8	-53.8	-169.4	-175	-173.8	0	109.6	S273 L389 I847 A850 H851 D869	S273-K275 PolarHBondContact O-N 3.11Å; K275-L389 HydrophobicContact CB-CD1 4.05Å; K275-L389 HydrophobicContact CB-CD2 4.19Å; K275-L389 HydrophobicContact CD-CD1 4.14Å; K275-I847 PolarHBondContact NZ-O 3.09Å; K275-A850 VanDerWaalsContact CE-O 3.26Å; K275-A850 WeakPolarHBondContact CE-O 3.43Å; K275-A850 PolarHBondContact NZ-O 2.94Å; K275-H851 WeakPolarHBondContact CD-O 3.35Å; K275-D869 WeakPolarHBondContact CD-OD2 3.34Å; K275-D869 WeakPolarHBondContact CE-OD2 3.29Å; K275-D869 IonicContact NZ-OD2 2.77Å; K275-D869 PolarHBondContact NZ-OD2 2.91Å
276	R	75.6	Confident	75.5	Confident	119 Å²	119	56.3 Å²	56.3	45%	0.449	30%	0.3	S	S	.	.			trans	-136.4	130.2	-179.8	-67.1	-170.6	-172	-178.3	-0.2	110.6	E280	R276-E280 WeakPolarHBondContact CB-OE2 3.49Å; R276-E280 WeakPolarHBondContact CD-OE2 3.48Å; R276-E280 WeakPolarHBondContact CG-OE2 3.47Å
277	S	81.5	Confident	76	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.007	30%	0.296	C	S	.	.			trans	-62.6	151.5	-178.9	171.4	0	0	0	0	113.2	V279 E280 E391 E392	S277-V279 PolarHBondContact O-N 3.5Å; S277-V279 PolarHBondContact OG-N 3.03Å; S277-E280 PolarHBondContact O-N 2.72Å; S277-E391 VanDerWaalsContact CB-OE1 3.31Å; S277-E391 WeakPolarHBondContact CB-OE1 3.24Å; S277-E391 WeakPolarHBondContact OG-CG 3.05Å; S277-E391 PolarHBondContact OG-OE1 2.82Å; S277-E391 VanDerWaalsContact OG-OE1 3.11Å; S277-E392 VanDerWaalsContact CA-OE2 3.23Å; S277-E392 WeakPolarHBondContact CA-OE2 3.33Å; S277-E392 WeakPolarHBondContact CB-OE2 3.36Å; S277-E392 PolarHBondContact OG-OE2 3.29Å
278	A	81.8	Confident	76.7	Confident	16 Å²	16	58.1 Å²	58.1	13%	0.132	31%	0.308	C	S	.	.	H	α-helix	trans	-55.4	-35.1	163.1	0	0	0	0	0	113.4	K281 S282 E392 I833	A278-K281 WeakPolarHBondContact O-CB 3.21Å; A278-K281 PolarHBondContact O-N 3.4Å; A278-S282 PolarHBondContact O-N 2.8Å; A278-S282 VanDerWaalsContact O-N 3.15Å; A278-E392 VanDerWaalsContact N-CD 3.34Å; A278-E392 PolarHBondContact N-OE1 3.37Å; A278-E392 PolarHBondContact N-OE2 3.2Å; A278-I833 HydrophobicContact CB-CD1 4.12Å
279	V	85.1	Confident	77.8	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.5	-39.2	179.5	172.7	0	0	0	0	111.4	S277 K281 S282 I283 E391 Y890 I893 L974	S277-V279 PolarHBondContact O-N 3.5Å; S277-V279 PolarHBondContact OG-N 3.03Å; V279-K281 VanDerWaalsContact C-N 3.26Å; V279-K281 PolarHBondContact O-N 3.24Å; V279-S282 WeakPolarHBondContact O-CB 3.36Å; V279-S282 PolarHBondContact O-N 3.08Å; V279-S282 VanDerWaalsContact O-N 3.16Å; V279-I283 HydrophobicContact CG1-CD1 3.96Å; V279-I283 HydrophobicContact CG1-CG1 4.35Å; V279-I283 WeakPolarHBondContact O-CG1 3.31Å; V279-I283 PolarHBondContact O-N 3.09Å; V279-E391 HydrophobicContact CB-CG 3.93Å; V279-E391 HydrophobicContact CG2-CG 3.66Å; V279-Y890 HydrophobicContact CG2-CD2 4.28Å; V279-Y890 HydrophobicContact CG2-CE2 4.17Å; V279-I893 HydrophobicContact CG1-CD1 4.08Å; V279-I893 HydrophobicContact CG1-CG1 4.34Å; V279-I893 HydrophobicContact CG1-CG2 4.22Å; V279-I893 HydrophobicContact CG2-CG2 4.36Å; V279-L974 HydrophobicContact CB-CD1 4.17Å; V279-L974 HydrophobicContact CG1-CD1 3.73Å; V279-L974 HydrophobicContact CG2-CD1 3.84Å
280	E	84.9	Confident	79.2	Confident	46 Å²	46	51.7 Å²	51.7	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-59.8	-37.3	173.8	-161.1	-159.3	152.6	0	0	111.6	R276 S277 I283 N284	R276-E280 WeakPolarHBondContact CB-OE2 3.49Å; R276-E280 WeakPolarHBondContact CD-OE2 3.48Å; R276-E280 WeakPolarHBondContact CG-OE2 3.47Å; S277-E280 PolarHBondContact O-N 2.72Å; E280-I283 PolarHBondContact O-N 2.88Å; E280-N284 PolarHBondContact O-N 3.21Å; E280-N284 VanDerWaalsContact O-N 3.1Å; E280-N284 PolarHBondContact O-ND2 2.78Å
281	K	86.3	Confident	81.1	Confident	110 Å²	110	46.5 Å²	46.5	48%	0.478	26%	0.26	S	S	.	.	H	α-helix	trans	-65.1	-43	176.7	-56.7	166.5	-161.3	156.6	0	110.7	A278 V279 N284 A285	A278-K281 WeakPolarHBondContact O-CB 3.21Å; A278-K281 PolarHBondContact O-N 3.4Å; V279-K281 VanDerWaalsContact C-N 3.26Å; V279-K281 PolarHBondContact O-N 3.24Å; K281-N284 PolarHBondContact O-N 3.06Å; K281-A285 PolarHBondContact O-N 2.79Å; K281-A285 VanDerWaalsContact O-N 3.13Å
282	S	88	Confident	83.1	Confident	20 Å²	20	50.2 Å²	50.2	14%	0.14	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-44	174	-73	0	0	0	0	113.1	A278 V279 N284 A285 F286 N971	A278-S282 PolarHBondContact O-N 2.8Å; A278-S282 VanDerWaalsContact O-N 3.15Å; V279-S282 WeakPolarHBondContact O-CB 3.36Å; V279-S282 PolarHBondContact O-N 3.08Å; V279-S282 VanDerWaalsContact O-N 3.16Å; S282-N284 VanDerWaalsContact C-N 3.31Å; S282-N284 PolarHBondContact O-N 3.37Å; S282-A285 PolarHBondContact O-N 3.31Å; S282-A285 VanDerWaalsContact O-N 3.16Å; S282-F286 WeakPolarHBondContact O-CG 3.48Å; S282-F286 PolarHBondContact O-N 2.75Å; S282-N971 PolarHBondContact OG-ND2 2.99Å
283	I	89.3	Confident	84.8	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-56.9	-46.4	177	-69	165.9	0	0	0	110.6	V279 E280 A285 F286 L287 M352 Y353 V897	V279-I283 HydrophobicContact CG1-CD1 3.96Å; V279-I283 HydrophobicContact CG1-CG1 4.35Å; V279-I283 WeakPolarHBondContact O-CG1 3.31Å; V279-I283 PolarHBondContact O-N 3.09Å; E280-I283 PolarHBondContact O-N 2.88Å; I283-A285 PolarHBondContact O-N 3.32Å; I283-F286 PolarHBondContact O-N 3.48Å; I283-L287 WeakPolarHBondContact O-CB 3.28Å; I283-L287 PolarHBondContact O-N 2.9Å; I283-M352 HydrophobicContact CG2-CE 3.49Å; I283-M352 VanDerWaalsContact CG2-CE 3.49Å; I283-M352 HydrophobicContact CG2-SD 4.35Å; I283-Y353 HydrophobicContact CG2-CE1 4.27Å; I283-V897 HydrophobicContact CD1-CG2 3.67Å; I283-V897 HydrophobicContact CG1-CB 4.49Å; I283-V897 HydrophobicContact CG1-CG1 3.83Å; I283-V897 HydrophobicContact CG1-CG2 3.75Å
284	N	88.6	Confident	86.6	Confident	32 Å²	32	43.9 Å²	43.9	17%	0.171	22%	0.216	C	C	.	.	H	α-helix	trans	-65.9	-35.7	178.9	-71.1	-54.8	0	0	0	112.4	E280 K281 S282 L287 L288 Y353	E280-N284 PolarHBondContact O-N 3.21Å; E280-N284 VanDerWaalsContact O-N 3.1Å; E280-N284 PolarHBondContact O-ND2 2.78Å; K281-N284 PolarHBondContact O-N 3.06Å; S282-N284 VanDerWaalsContact C-N 3.31Å; S282-N284 PolarHBondContact O-N 3.37Å; N284-L287 PolarHBondContact O-N 3.4Å; N284-L288 WeakPolarHBondContact O-CG 3.28Å; N284-L288 PolarHBondContact O-N 3.33Å; N284-Y353 PolarHBondContact OD1-OH 2.82Å
285	A	90.2	Very high	88.1	Confident	36 Å²	36	42 Å²	42	30%	0.298	21%	0.211	S	C	.	.	H	α-helix	trans	-65.6	-40.6	173.8	0	0	0	0	0	112.5	K281 S282 I283 L288 V289 W976	K281-A285 PolarHBondContact O-N 2.79Å; K281-A285 VanDerWaalsContact O-N 3.13Å; S282-A285 PolarHBondContact O-N 3.31Å; S282-A285 VanDerWaalsContact O-N 3.16Å; I283-A285 PolarHBondContact O-N 3.32Å; A285-L288 PolarHBondContact O-N 2.86Å; A285-V289 PolarHBondContact O-N 2.87Å; A285-W976 HydrophobicContact CB-CH2 4.41Å; A285-W976 HydrophobicContact CB-CZ2 4.39Å
286	F	91.6	Very high	89	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.013	22%	0.219	C	C	.	.	H	α-helix	trans	-66.6	-39.9	174.7	-65.6	-13.4	0	0	0	112.2	S282 I283 L288 V289 Y290 V897 F901 L974 W976 F979	S282-F286 WeakPolarHBondContact O-CG 3.48Å; S282-F286 PolarHBondContact O-N 2.75Å; I283-F286 PolarHBondContact O-N 3.48Å; F286-L288 VanDerWaalsContact C-N 3.31Å; F286-L288 PolarHBondContact O-N 3.44Å; F286-V289 PolarHBondContact O-N 3.34Å; F286-V289 VanDerWaalsContact O-N 3.16Å; F286-Y290 WeakPolarHBondContact O-CD2 3.23Å; F286-Y290 PolarHBondContact O-N 3.24Å; F286-V897 HydrophobicContact CD2-CG1 4.24Å; F286-V897 HydrophobicContact CE2-CG1 4.46Å; F286-F901 HydrophobicContact CB-CD2 4.37Å; F286-F901 HydrophobicContact CB-CE2 3.68Å; F286-F901 HydrophobicContact CB-CZ 3.79Å; F286-F901 HydrophobicContact CD2-CD2 4.33Å; F286-F901 HydrophobicContact CD2-CE2 4.02Å; F286-F901 HydrophobicContact CG-CE2 4.38Å; F286-L974 HydrophobicContact CE2-CB 4.34Å; F286-L974 HydrophobicContact CE2-CD2 4.06Å; F286-L974 HydrophobicContact CZ-CB 4.24Å; F286-L974 WeakPolarHBondContact CZ-O 3.39Å; F286-W976 HydrophobicContact CD1-CE3 4.3Å; F286-W976 AromaticContact CD1-CH2 3.95Å; F286-W976 HydrophobicContact CD1-CH2 3.95Å; F286-W976 AromaticContact CD1-CZ3 3.71Å; F286-W976 HydrophobicContact CD1-CZ3 3.71Å; F286-W976 HydrophobicContact CE1-CD2 4.47Å; F286-W976 AromaticContact CE1-CE3 4Å; F286-W976 HydrophobicContact CE1-CE3 4Å; F286-W976 HydrophobicContact CE1-CH2 4.25Å; F286-W976 AromaticContact CE1-CZ3 3.87Å; F286-W976 HydrophobicContact CE1-CZ3 3.87Å; F286-F979 HydrophobicContact CB-CD2 4.24Å; F286-F979 HydrophobicContact CB-CE2 3.54Å; F286-F979 HydrophobicContact CB-CZ 3.9Å; F286-F979 HydrophobicContact CD1-CD1 4.14Å; F286-F979 AromaticContact CD1-CD2 3.64Å; F286-F979 HydrophobicContact CD1-CD2 3.64Å; F286-F979 HydrophobicContact CD1-CE1 4.19Å; F286-F979 AromaticContact CD1-CE2 3.69Å; F286-F979 HydrophobicContact CD1-CE2 3.69Å; F286-F979 AromaticContact CD1-CG 3.86Å; F286-F979 HydrophobicContact CD1-CG 3.86Å; F286-F979 AromaticContact CD1-CZ 3.95Å; F286-F979 HydrophobicContact CD1-CZ 3.95Å; F286-F979 AromaticContact CD2-CD2 3.47Å; F286-F979 HydrophobicContact CD2-CD2 3.47Å; F286-F979 VanDerWaalsContact CD2-CD2 3.47Å; F286-F979 AromaticContact CD2-CE2 3.64Å; F286-F979 HydrophobicContact CD2-CE2 3.64Å; F286-F979 HydrophobicContact CD2-CG 4.35Å; F286-F979 HydrophobicContact CE1-CB 3.85Å; F286-F979 HydrophobicContact CE1-CD1 4.12Å; F286-F979 AromaticContact CE1-CD2 3.74Å; F286-F979 HydrophobicContact CE1-CD2 3.74Å; F286-F979 HydrophobicContact CE1-CE2 4.27Å; F286-F979 AromaticContact CE1-CG 3.63Å; F286-F979 HydrophobicContact CE1-CG 3.63Å; F286-F979 HydrophobicContact CE2-CB 4.23Å; F286-F979 AromaticContact CE2-CD2 3.56Å; F286-F979 HydrophobicContact CE2-CD2 3.56Å; F286-F979 HydrophobicContact CE2-CE2 4.21Å; F286-F979 HydrophobicContact CE2-CG 4.14Å; F286-F979 AromaticContact CG-CD2 3.52Å; F286-F979 HydrophobicContact CG-CD2 3.52Å; F286-F979 AromaticContact CG-CE2 3.34Å; F286-F979 HydrophobicContact CG-CE2 3.34Å; F286-F979 HydrophobicContact CG-CG 4.22Å; F286-F979 AromaticContact CG-CZ 3.93Å; F286-F979 HydrophobicContact CG-CZ 3.93Å; F286-F979 HydrophobicContact CZ-CB 3.66Å; F286-F979 AromaticContact CZ-CD2 3.69Å; F286-F979 HydrophobicContact CZ-CD2 3.69Å; F286-F979 AromaticContact CZ-CG 3.78Å; F286-F979 HydrophobicContact CZ-CG 3.78Å
287	L	90.3	Very high	89.8	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-37.9	177.1	-174.6	146.7	0	0	0	112.2	I67 A68 I283 N284 Y290 L291 I348 Y353	I67-L287 HydrophobicContact CG2-CD2 3.96Å; A68-L287 HydrophobicContact CB-CD1 3.68Å; I283-L287 WeakPolarHBondContact O-CB 3.28Å; I283-L287 PolarHBondContact O-N 2.9Å; N284-L287 PolarHBondContact O-N 3.4Å; L287-Y290 PolarHBondContact O-N 3.24Å; L287-L291 WeakPolarHBondContact O-CB 3.48Å; L287-L291 PolarHBondContact O-N 2.83Å; L287-I348 HydrophobicContact CD1-CG2 3.83Å; L287-I348 HydrophobicContact CG-CG2 4.15Å; L287-Y353 HydrophobicContact CD1-CE2 4.09Å
288	L	90.6	Very high	90.4	Very high	98 Å²	98	37.5 Å²	37.5	51%	0.513	20%	0.201	S	C	.	.	H	α-helix	trans	-63.9	-38.2	174.7	-71	171	0	0	0	112.6	N284 A285 F286 L291 F292	N284-L288 WeakPolarHBondContact O-CG 3.28Å; N284-L288 PolarHBondContact O-N 3.33Å; A285-L288 PolarHBondContact O-N 2.86Å; F286-L288 VanDerWaalsContact C-N 3.31Å; F286-L288 PolarHBondContact O-N 3.44Å; L288-L291 PolarHBondContact O-N 2.86Å; L288-F292 PolarHBondContact O-N 2.93Å
289	V	92.3	Very high	91.1	Very high	53 Å²	53	41.3 Å²	41.3	32%	0.321	22%	0.218	S	C	.	.	H	α-helix	trans	-65.7	-43.1	173.8	175.4	0	0	0	0	110.9	A285 F286 L291 F292 I293 W976 F979	A285-V289 PolarHBondContact O-N 2.87Å; F286-V289 PolarHBondContact O-N 3.34Å; F286-V289 VanDerWaalsContact O-N 3.16Å; V289-L291 VanDerWaalsContact C-N 3.35Å; V289-L291 PolarHBondContact O-N 3.3Å; V289-F292 PolarHBondContact O-N 2.84Å; V289-I293 HydrophobicContact CG1-CD1 4.02Å; V289-I293 WeakPolarHBondContact O-CG1 3.48Å; V289-I293 PolarHBondContact O-N 3.17Å; V289-W976 HydrophobicContact CG2-CH2 3.82Å; V289-W976 HydrophobicContact CG2-CZ3 3.9Å; V289-F979 HydrophobicContact CG1-CE1 4.29Å
290	Y	91.8	Very high	91.6	Very high	1 Å²	1	44.4 Å²	44.4	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-32.4	176.5	-89.5	-79.2	0	0	0	113.5	F286 L287 I293 L294 I347 F901 L905 F979 T983	F286-Y290 WeakPolarHBondContact O-CD2 3.23Å; F286-Y290 PolarHBondContact O-N 3.24Å; L287-Y290 PolarHBondContact O-N 3.24Å; Y290-I293 PolarHBondContact O-N 2.93Å; Y290-L294 PolarHBondContact O-N 2.77Å; Y290-I347 HydrophobicContact CD1-CD1 3.94Å; Y290-I347 HydrophobicContact CD1-CG1 3.78Å; Y290-I347 HydrophobicContact CE1-CD1 4.33Å; Y290-I347 HydrophobicContact CE1-CG1 4.14Å; Y290-F901 HydrophobicContact CD1-CD1 4.46Å; Y290-F901 AromaticContact CD2-CD1 3.26Å; Y290-F901 HydrophobicContact CD2-CD1 3.26Å; Y290-F901 AromaticContact CD2-CE1 3.55Å; Y290-F901 HydrophobicContact CD2-CE1 3.55Å; Y290-F901 HydrophobicContact CD2-CG 4.02Å; Y290-F901 HydrophobicContact CD2-CZ 4.49Å; Y290-F901 HydrophobicContact CE2-CB 3.73Å; Y290-F901 AromaticContact CE2-CD1 3.36Å; Y290-F901 HydrophobicContact CE2-CD1 3.36Å; Y290-F901 HydrophobicContact CE2-CE1 4.11Å; Y290-F901 AromaticContact CE2-CG 3.69Å; Y290-F901 HydrophobicContact CE2-CG 3.69Å; Y290-F901 AromaticContact CG-CD1 3.87Å; Y290-F901 HydrophobicContact CG-CD1 3.87Å; Y290-F901 HydrophobicContact CG-CE1 4.07Å; Y290-L905 HydrophobicContact CE1-CB 4.25Å; Y290-L905 HydrophobicContact CE1-CD1 4.49Å; Y290-L905 HydrophobicContact CE1-CD2 4.29Å; Y290-L905 WeakPolarHBondContact OH-CD2 3.34Å; Y290-F979 HydrophobicContact CD2-CE2 4.21Å; Y290-F979 AromaticContact CD2-CZ 3.87Å; Y290-F979 HydrophobicContact CD2-CZ 3.87Å; Y290-F979 AromaticContact CE2-CE2 3.65Å; Y290-F979 HydrophobicContact CE2-CE2 3.65Å; Y290-F979 AromaticContact CE2-CZ 3.48Å; Y290-F979 HydrophobicContact CE2-CZ 3.48Å; Y290-F979 VanDerWaalsContact CE2-CZ 3.48Å; Y290-T983 PolarHBondContact OH-OG1 2.87Å
291	L	91.8	Very high	92	Very high	48 Å²	48	42.2 Å²	42.2	25%	0.251	23%	0.227	S	C	.	.	H	α-helix	trans	-65.6	-39.6	171.1	-177	63.4	0	0	0	111.7	Y71 L287 L288 V289 L294 V295 I348	Y71-L291 HydrophobicContact CD2-CD1 4.02Å; Y71-L291 HydrophobicContact CE2-CD1 3.94Å; L287-L291 WeakPolarHBondContact O-CB 3.48Å; L287-L291 PolarHBondContact O-N 2.83Å; L288-L291 PolarHBondContact O-N 2.86Å; V289-L291 VanDerWaalsContact C-N 3.35Å; V289-L291 PolarHBondContact O-N 3.3Å; L291-L294 HydrophobicContact CD1-CD2 4.4Å; L291-L294 WeakPolarHBondContact O-CB 2.93Å; L291-L294 PolarHBondContact O-N 2.72Å; L291-V295 WeakPolarHBondContact O-CG2 3.4Å; L291-V295 PolarHBondContact O-N 3.11Å; L291-I348 HydrophobicContact CB-CD1 4.26Å; L291-I348 HydrophobicContact CD1-CD1 4.17Å
292	F	93.7	Very high	92.5	Very high	153 Å²	153	37.3 Å²	37.3	67%	0.671	21%	0.206	S	C	*	.	H	α-helix	trans	-65.4	-41	173.4	-175	-98.9	0	0	0	112.1	L288 V289 L294 V295 S296	L288-F292 PolarHBondContact O-N 2.93Å; V289-F292 PolarHBondContact O-N 2.84Å; F292-L294 VanDerWaalsContact C-N 3.33Å; F292-L294 PolarHBondContact O-N 3.48Å; F292-V295 PolarHBondContact O-N 3.31Å; F292-S296 PolarHBondContact O-N 2.92Å; F292-S296 PolarHBondContact O-OG 3.08Å
293	I	92.3	Very high	92.7	Very high	41 Å²	41	40.1 Å²	40.1	21%	0.21	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-36.2	174.2	-66.5	166.1	0	0	0	111.6	V289 Y290 S296 K297 I347	V289-I293 HydrophobicContact CG1-CD1 4.02Å; V289-I293 WeakPolarHBondContact O-CG1 3.48Å; V289-I293 PolarHBondContact O-N 3.17Å; Y290-I293 PolarHBondContact O-N 2.93Å; I293-S296 PolarHBondContact O-OG 2.77Å; I293-K297 HydrophobicContact CG2-CD 4.3Å; I293-K297 WeakPolarHBondContact O-CB 3.15Å; I293-K297 VanDerWaalsContact O-CG 3.29Å; I293-K297 WeakPolarHBondContact O-CG 3.39Å; I293-K297 PolarHBondContact O-N 3Å; I293-K297 VanDerWaalsContact O-N 3.07Å; I293-I347 HydrophobicContact CB-CD1 4.48Å; I293-I347 HydrophobicContact CG2-CD1 3.74Å
294	L	94	Very high	93	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-51.8	173.7	174.1	61.4	0	0	0	111.3	Y71 Y290 L291 F292 S296 K297 A298 M341 F344 I347	Y71-L294 HydrophobicContact CE2-CD2 3.95Å; Y71-L294 WeakPolarHBondContact OH-CD2 3.16Å; Y290-L294 PolarHBondContact O-N 2.77Å; L291-L294 HydrophobicContact CD1-CD2 4.4Å; L291-L294 WeakPolarHBondContact O-CB 2.93Å; L291-L294 PolarHBondContact O-N 2.72Å; F292-L294 VanDerWaalsContact C-N 3.33Å; F292-L294 PolarHBondContact O-N 3.48Å; L294-S296 VanDerWaalsContact C-N 3.34Å; L294-S296 PolarHBondContact O-N 2.86Å; L294-K297 PolarHBondContact O-N 3.07Å; L294-A298 PolarHBondContact O-N 2.9Å; L294-M341 HydrophobicContact CD2-CE 3.84Å; L294-M341 HydrophobicContact CG-CE 4.19Å; L294-F344 HydrophobicContact CD1-CB 3.45Å; L294-F344 VanDerWaalsContact CD1-CB 3.45Å; L294-I347 HydrophobicContact CB-CG2 3.94Å; L294-I347 HydrophobicContact CD1-CG2 4.03Å; L294-I347 HydrophobicContact CD2-CG2 4.49Å; L294-I347 HydrophobicContact CG-CG2 4.37Å
295	V	94.2	Very high	93.2	Very high	56 Å²	56	41.8 Å²	41.8	34%	0.339	23%	0.231	S	C	.	.	H	α-helix	trans	-63.6	-40.1	-178.3	171.5	0	0	0	0	111.1	L291 F292 A298 L299 F337 M341	L291-V295 WeakPolarHBondContact O-CG2 3.4Å; L291-V295 PolarHBondContact O-N 3.11Å; F292-V295 PolarHBondContact O-N 3.31Å; V295-A298 PolarHBondContact O-N 2.83Å; V295-L299 VanDerWaalsContact O-CB 3.29Å; V295-L299 WeakPolarHBondContact O-CB 3.42Å; V295-L299 PolarHBondContact O-N 2.84Å; V295-F337 HydrophobicContact CG1-CZ 4.38Å; V295-M341 HydrophobicContact CG2-CE 3.99Å; V295-M341 HydrophobicContact CG2-SD 4.48Å
296	S	94.6	Very high	93.2	Very high	49 Å²	49	42.3 Å²	42.3	34%	0.343	23%	0.225	S	C	.	.	H	α-helix	trans	-67.3	-39.7	177.1	72	0	0	0	0	112.6	F292 I293 L294 L299 V300	F292-S296 PolarHBondContact O-N 2.92Å; F292-S296 PolarHBondContact O-OG 3.08Å; I293-S296 PolarHBondContact O-OG 2.77Å; L294-S296 VanDerWaalsContact C-N 3.34Å; L294-S296 PolarHBondContact O-N 2.86Å; S296-L299 PolarHBondContact O-N 3.39Å; S296-V300 WeakPolarHBondContact O-CB 3.21Å; S296-V300 VanDerWaalsContact O-CG2 3.26Å; S296-V300 WeakPolarHBondContact O-CG2 3.43Å; S296-V300 PolarHBondContact O-N 3.37Å
297	K	93.2	Very high	93.3	Very high	18 Å²	18	46.6 Å²	46.6	8%	0.078	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-47.2	172.3	-76.6	179.2	177.7	-176.9	0	112.1	I293 L294 V300 C301 F344 I347 F912	I293-K297 HydrophobicContact CG2-CD 4.3Å; I293-K297 WeakPolarHBondContact O-CB 3.15Å; I293-K297 VanDerWaalsContact O-CG 3.29Å; I293-K297 WeakPolarHBondContact O-CG 3.39Å; I293-K297 PolarHBondContact O-N 3Å; I293-K297 VanDerWaalsContact O-N 3.07Å; L294-K297 PolarHBondContact O-N 3.07Å; K297-V300 PolarHBondContact O-N 2.83Å; K297-C301 WeakPolarHBondContact O-CB 3.35Å; K297-C301 PolarHBondContact O-N 2.86Å; K297-C301 PolarHBondContact O-SG 2.97Å; K297-F344 HydrophobicContact CB-CD2 4.03Å; K297-F344 HydrophobicContact CB-CE2 4.21Å; K297-I347 HydrophobicContact CD-CD1 4.45Å; K297-F912 HydrophobicContact CB-CD2 3.89Å; K297-F912 HydrophobicContact CB-CE2 3.81Å; K297-F912 HydrophobicContact CD-CD2 3.98Å; K297-F912 HydrophobicContact CD-CE2 4.36Å; K297-F912 HydrophobicContact CD-CG 4.21Å; K297-F912 HydrophobicContact CG-CD2 3.79Å; K297-F912 HydrophobicContact CG-CE2 3.69Å; K297-F912 HydrophobicContact CG-CG 4.41Å; K297-F912 HydrophobicContact CG-CZ 4.21Å
298	A	94.8	Very high	93.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-43.3	178.8	0	0	0	0	0	111.9	L294 V295 T302 F337 F340 M341	L294-A298 PolarHBondContact O-N 2.9Å; V295-A298 PolarHBondContact O-N 2.83Å; A298-T302 WeakPolarHBondContact O-CB 3Å; A298-T302 PolarHBondContact O-N 2.83Å; A298-T302 PolarHBondContact O-OG1 3.1Å; A298-F337 HydrophobicContact CB-CD2 4.09Å; A298-F337 HydrophobicContact CB-CE2 3.82Å; A298-F340 HydrophobicContact CB-CB 3.92Å; A298-M341 HydrophobicContact CB-CG 3.72Å
299	L	95.1	Very high	93.1	Very high	96 Å²	96	47.9 Å²	47.9	50%	0.503	25%	0.251	S	S	.	.	H	α-helix	trans	-62.5	-49	176.6	-176.8	62.9	0	0	0	111.7	V295 S296 C301 T302 T303 F337	V295-L299 VanDerWaalsContact O-CB 3.29Å; V295-L299 WeakPolarHBondContact O-CB 3.42Å; V295-L299 PolarHBondContact O-N 2.84Å; S296-L299 PolarHBondContact O-N 3.39Å; L299-C301 PolarHBondContact O-N 3.06Å; L299-T302 PolarHBondContact O-N 2.83Å; L299-T302 VanDerWaalsContact O-N 3.15Å; L299-T303 PolarHBondContact O-N 3.19Å; L299-T303 PolarHBondContact O-OG1 2.83Å; L299-F337 HydrophobicContact CB-CE2 4.34Å
300	V	95.4	Very high	92.8	Very high	66 Å²	66	50.3 Å²	50.3	40%	0.4	27%	0.27	S	S	.	.	H	α-helix	trans	-59.6	-46.8	178.3	167.4	0	0	0	0	111.3	S296 K297 T302 T303 L304	S296-V300 WeakPolarHBondContact O-CB 3.21Å; S296-V300 VanDerWaalsContact O-CG2 3.26Å; S296-V300 WeakPolarHBondContact O-CG2 3.43Å; S296-V300 PolarHBondContact O-N 3.37Å; K297-V300 PolarHBondContact O-N 2.83Å; V300-T302 VanDerWaalsContact C-N 3.32Å; V300-T302 PolarHBondContact O-N 2.89Å; V300-T303 PolarHBondContact O-N 2.83Å; V300-L304 HydrophobicContact CG1-CD1 3.7Å; V300-L304 HydrophobicContact CG1-CG 4.41Å; V300-L304 WeakPolarHBondContact O-CB 3.39Å; V300-L304 VanDerWaalsContact O-CG 3.24Å; V300-L304 WeakPolarHBondContact O-CG 3.42Å; V300-L304 PolarHBondContact O-N 2.83Å
301	C	94.9	Very high	92.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-35.2	176.1	-71.3	0	0	0	0	112.7	K297 L299 K305 F340 F344 F912	K297-C301 WeakPolarHBondContact O-CB 3.35Å; K297-C301 PolarHBondContact O-N 2.86Å; K297-C301 PolarHBondContact O-SG 2.97Å; L299-C301 PolarHBondContact O-N 3.06Å; C301-K305 WeakPolarHBondContact O-CB 3.35Å; C301-K305 PolarHBondContact O-N 2.93Å; C301-F340 HydrophobicContact CB-CD1 3.83Å; C301-F340 HydrophobicContact CB-CD2 3.95Å; C301-F340 HydrophobicContact CB-CE1 3.68Å; C301-F340 HydrophobicContact CB-CE2 3.76Å; C301-F340 HydrophobicContact CB-CG 3.97Å; C301-F340 HydrophobicContact CB-CZ 3.62Å; C301-F344 HydrophobicContact CB-CE2 4.39Å; C301-F912 VanDerWaalsContact SG-CE2 3.52Å
302	T	94.9	Very high	91.7	Very high	7 Å²	7	60.7 Å²	60.7	4%	0.043	31%	0.314	C	S	.	.	H	α-helix	trans	-67.7	-49.9	176.6	-52.3	0	0	0	0	111.2	A298 L299 V300 L304 K305 Y306 M333 F337 F340	A298-T302 WeakPolarHBondContact O-CB 3Å; A298-T302 PolarHBondContact O-N 2.83Å; A298-T302 PolarHBondContact O-OG1 3.1Å; L299-T302 PolarHBondContact O-N 2.83Å; L299-T302 VanDerWaalsContact O-N 3.15Å; V300-T302 VanDerWaalsContact C-N 3.32Å; V300-T302 PolarHBondContact O-N 2.89Å; T302-L304 VanDerWaalsContact C-N 3.33Å; T302-L304 PolarHBondContact O-N 2.8Å; T302-K305 WeakPolarHBondContact O-CB 3.48Å; T302-K305 PolarHBondContact O-N 2.93Å; T302-Y306 HydrophobicContact CG2-CD2 4.14Å; T302-Y306 HydrophobicContact CG2-CE2 4.09Å; T302-Y306 WeakPolarHBondContact O-CD2 3.06Å; T302-Y306 PolarHBondContact O-N 3.48Å; T302-M333 HydrophobicContact CG2-CG 4.11Å; T302-F337 HydrophobicContact CG2-CB 4.24Å; T302-F337 WeakPolarHBondContact OG1-CA 3.25Å; T302-F340 WeakPolarHBondContact OG1-CD2 3.27Å
303	T	94.1	Very high	90.4	Very high	78 Å²	78	57.2 Å²	57.2	48%	0.479	30%	0.302	S	S	.	.	H	α-helix	trans	-59.7	-43.7	177.4	-57.5	0	0	0	0	111.4	L299 V300 Y306 V307	L299-T303 PolarHBondContact O-N 3.19Å; L299-T303 PolarHBondContact O-OG1 2.83Å; V300-T303 PolarHBondContact O-N 2.83Å; T303-Y306 PolarHBondContact O-N 3.02Å; T303-V307 HydrophobicContact CG2-CG2 4.46Å; T303-V307 VanDerWaalsContact O-CG2 3.31Å; T303-V307 WeakPolarHBondContact O-CG2 3.37Å; T303-V307 PolarHBondContact O-N 2.99Å
304	L	94.3	Very high	89.3	Confident	57 Å²	57	59.6 Å²	59.6	30%	0.298	31%	0.313	S	S	.	.	H	α-helix	trans	-69.1	-31.8	178.1	-67.1	173.4	0	0	0	112.9	V300 T302 W308 F916 Y920	V300-L304 HydrophobicContact CG1-CD1 3.7Å; V300-L304 HydrophobicContact CG1-CG 4.41Å; V300-L304 WeakPolarHBondContact O-CB 3.39Å; V300-L304 VanDerWaalsContact O-CG 3.24Å; V300-L304 WeakPolarHBondContact O-CG 3.42Å; V300-L304 PolarHBondContact O-N 2.83Å; T302-L304 VanDerWaalsContact C-N 3.33Å; T302-L304 PolarHBondContact O-N 2.8Å; L304-W308 VanDerWaalsContact O-CB 3.27Å; L304-W308 WeakPolarHBondContact O-CB 3.31Å; L304-W308 PolarHBondContact O-N 3.13Å; L304-F916 HydrophobicContact CD1-CD1 4.46Å; L304-F916 HydrophobicContact CD1-CE1 3.71Å; L304-F916 HydrophobicContact CD1-CZ 4.33Å; L304-Y920 HydrophobicContact CB-CD1 4.22Å; L304-Y920 HydrophobicContact CB-CD2 4.38Å; L304-Y920 HydrophobicContact CB-CE1 3.71Å; L304-Y920 HydrophobicContact CB-CE2 3.9Å; L304-Y920 HydrophobicContact CD1-CE1 4.11Å
305	K	92.8	Very high	88.5	Confident	17 Å²	17	61.4 Å²	61.4	7%	0.074	32%	0.324	C	S	.	.	H	α-helix	trans	-56.8	-53.4	170.2	-170.9	-177.1	-170	178.4	0	110.9	C301 T302 W308 Q309 D336 F340 Y920	C301-K305 WeakPolarHBondContact O-CB 3.35Å; C301-K305 PolarHBondContact O-N 2.93Å; T302-K305 WeakPolarHBondContact O-CB 3.48Å; T302-K305 PolarHBondContact O-N 2.93Å; K305-W308 PolarHBondContact O-N 3.37Å; K305-Q309 HydrophobicContact CG-CG 4.43Å; K305-Q309 WeakPolarHBondContact O-CB 3.29Å; K305-Q309 WeakPolarHBondContact O-CG 3.39Å; K305-Q309 PolarHBondContact O-N 3Å; K305-D336 HydrophobicContact CD-CB 4.47Å; K305-D336 WeakPolarHBondContact CD-OD2 3.49Å; K305-D336 WeakPolarHBondContact CE-OD2 3.08Å; K305-D336 IonicContact NZ-OD1 3.48Å; K305-D336 PolarHBondContact NZ-OD1 2.73Å; K305-D336 IonicContact NZ-OD2 2.72Å; K305-D336 PolarHBondContact NZ-OD2 3.16Å; K305-F340 HydrophobicContact CB-CE2 4.49Å; K305-F340 HydrophobicContact CD-CE2 4.41Å; K305-Y920 HydrophobicContact CB-CG 4.34Å; K305-Y920 WeakPolarHBondContact CD-O 3.37Å; K305-Y920 WeakPolarHBondContact CE-O 3.12Å
306	Y	91.8	Very high	88	Confident	46 Å²	46	69.5 Å²	69.5	18%	0.18	35%	0.348	C	S	.	.	H	α-helix	trans	-68.9	-36.5	-177.8	-77.9	-72.9	0	0	0	113.3	T302 T303 W308 Q309 S310 M333 D336	T302-Y306 HydrophobicContact CG2-CD2 4.14Å; T302-Y306 HydrophobicContact CG2-CE2 4.09Å; T302-Y306 WeakPolarHBondContact O-CD2 3.06Å; T302-Y306 PolarHBondContact O-N 3.48Å; T303-Y306 PolarHBondContact O-N 3.02Å; Y306-W308 VanDerWaalsContact C-N 3.31Å; Y306-W308 PolarHBondContact O-N 3.14Å; Y306-Q309 PolarHBondContact O-N 3.24Å; Y306-S310 WeakPolarHBondContact O-CB 3.15Å; Y306-S310 PolarHBondContact O-N 3.4Å; Y306-M333 HydrophobicContact CD2-CG 4.09Å; Y306-M333 HydrophobicContact CE2-CB 3.72Å; Y306-M333 HydrophobicContact CE2-CG 3.6Å; Y306-M333 WeakPolarHBondContact OH-CA 3.47Å; Y306-M333 PolarHBondContact OH-N 3.46Å; Y306-M333 VanDerWaalsContact OH-N 3.15Å; Y306-D336 PolarHBondContact OH-OD2 3.27Å
307	V	91.8	Very high	87.5	Confident	93 Å²	93	74.8 Å²	74.8	56%	0.564	36%	0.362	S	S	*	.	H	α-helix	trans	-64.4	-34.9	172.8	170.2	0	0	0	0	112	T303	T303-V307 HydrophobicContact CG2-CG2 4.46Å; T303-V307 VanDerWaalsContact O-CG2 3.31Å; T303-V307 WeakPolarHBondContact O-CG2 3.37Å; T303-V307 PolarHBondContact O-N 2.99Å
308	W	90.1	Very high	87	Confident	103 Å²	103	79.6 Å²	79.6	39%	0.39	39%	0.389	S	S	.	.	H	α-helix	trans	-75.9	-44.2	175.5	-177.7	87.5	0	0	0	112.4	L304 K305 Y306 S310 K311 H312 Y920	L304-W308 VanDerWaalsContact O-CB 3.27Å; L304-W308 WeakPolarHBondContact O-CB 3.31Å; L304-W308 PolarHBondContact O-N 3.13Å; K305-W308 PolarHBondContact O-N 3.37Å; Y306-W308 VanDerWaalsContact C-N 3.31Å; Y306-W308 PolarHBondContact O-N 3.14Å; W308-S310 VanDerWaalsContact C-N 3.26Å; W308-S310 PolarHBondContact O-N 3.34Å; W308-K311 PolarHBondContact O-N 2.84Å; W308-K311 VanDerWaalsContact O-N 3.07Å; W308-H312 AromaticContact CE2-ND1 3.78Å; W308-H312 HydrophobicContact CH2-CB 3.82Å; W308-H312 HydrophobicContact CZ2-CB 3.88Å; W308-H312 HydrophobicContact CZ3-CB 4.15Å; W308-H312 AromaticContact NE1-ND1 3.74Å; W308-H312 PolarHBondContact O-N 2.87Å; W308-Y920 HydrophobicContact CB-CD2 4.14Å; W308-Y920 HydrophobicContact CB-CE2 4.23Å; W308-Y920 HydrophobicContact CG-CD2 4.48Å
309	Q	87.5	Confident	86.4	Confident	24 Å²	24	86.6 Å²	86.6	11%	0.112	42%	0.421	C	S	.	.	H	α-helix	trans	-58.3	-37	175.5	-81.3	-179.8	-41.4	0	0	111.7	K305 Y306 K311 H312 D313	K305-Q309 HydrophobicContact CG-CG 4.43Å; K305-Q309 WeakPolarHBondContact O-CB 3.29Å; K305-Q309 WeakPolarHBondContact O-CG 3.39Å; K305-Q309 PolarHBondContact O-N 3Å; Y306-Q309 PolarHBondContact O-N 3.24Å; Q309-K311 PolarHBondContact O-N 2.91Å; Q309-H312 PolarHBondContact O-N 3.44Å; Q309-D313 HydrophobicContact CB-CB 4.38Å; Q309-D313 WeakPolarHBondContact CB-OD1 3.39Å; Q309-D313 WeakPolarHBondContact CG-OD1 3.5Å; Q309-D313 PolarHBondContact NE2-OD1 3.44Å; Q309-D313 WeakPolarHBondContact O-CA 3.21Å; Q309-D313 VanDerWaalsContact O-CB 3.25Å; Q309-D313 WeakPolarHBondContact O-CB 3.13Å; Q309-D313 PolarHBondContact O-N 2.95Å
310	S	86.4	Confident	85.9	Confident	104 Å²	104	83.4 Å²	83.4	73%	0.727	40%	0.403	S	S	*	.	H	α-helix	trans	-53.9	-8.8	173.6	-173.7	0	0	0	0	115.3	Y306 W308	Y306-S310 WeakPolarHBondContact O-CB 3.15Å; Y306-S310 PolarHBondContact O-N 3.4Å; W308-S310 VanDerWaalsContact C-N 3.26Å; W308-S310 PolarHBondContact O-N 3.34Å
311	K	82.8	Confident	85.4	Confident	175 Å²	175	84.9 Å²	84.9	76%	0.761	41%	0.413	S	S	*	.	H	α-helix	trans	-119.8	-15	172.6	-62.9	-175.8	179.3	-175.7	0	114.9	W308 Q309	W308-K311 PolarHBondContact O-N 2.84Å; W308-K311 VanDerWaalsContact O-N 3.07Å; Q309-K311 PolarHBondContact O-N 2.91Å
312	H	76.4	Confident	84.7	Confident	91 Å²	91	91.4 Å²	91.4	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-146.7	30.4	-168.6	-52.1	102	0	0	0	113.2	W308 Q309 E314	W308-H312 AromaticContact CE2-ND1 3.78Å; W308-H312 HydrophobicContact CH2-CB 3.82Å; W308-H312 HydrophobicContact CZ2-CB 3.88Å; W308-H312 HydrophobicContact CZ3-CB 4.15Å; W308-H312 AromaticContact NE1-ND1 3.74Å; W308-H312 PolarHBondContact O-N 2.87Å; Q309-H312 PolarHBondContact O-N 3.44Å; H312-E314 VanDerWaalsContact C-N 3.34Å; H312-E314 PolarHBondContact O-N 2.79Å
313	D	66.4	Low	84	Confident	80 Å²	80	98.4 Å²	98.4	43%	0.428	47%	0.473	S	S	.	.	S	Bend	trans	-63.9	-32	-163.8	-161.3	29.8	0	0	0	114.7	Q309 K320	Q309-D313 HydrophobicContact CB-CB 4.38Å; Q309-D313 WeakPolarHBondContact CB-OD1 3.39Å; Q309-D313 WeakPolarHBondContact CG-OD1 3.5Å; Q309-D313 PolarHBondContact NE2-OD1 3.44Å; Q309-D313 WeakPolarHBondContact O-CA 3.21Å; Q309-D313 VanDerWaalsContact O-CB 3.25Å; Q309-D313 WeakPolarHBondContact O-CB 3.13Å; Q309-D313 PolarHBondContact O-N 2.95Å; D313-K320 WeakPolarHBondContact O-CE 3.36Å; D313-K320 PolarHBondContact O-NZ 3.36Å; D313-K320 IonicContact OD1-NZ 3.8Å; D313-K320 PolarHBondContact OD1-NZ 2.96Å; D313-K320 IonicContact OD2-NZ 3.69Å; D313-K320 PolarHBondContact OD2-NZ 3.07Å
314	E	70.7	Confident	83.4	Confident	91 Å²	91	98.2 Å²	98.2	43%	0.425	47%	0.467	S	S	.	.	S	Bend	trans	-130.2	136.5	167	-60.5	-159.2	136.7	0	0	109.2	H312 K320 K325	H312-E314 VanDerWaalsContact C-N 3.34Å; H312-E314 PolarHBondContact O-N 2.79Å; E314-K320 HydrophobicContact CG-CD 4.15Å; E314-K320 HydrophobicContact CG-CG 4.33Å; E314-K320 WeakPolarHBondContact OE1-CB 3.44Å; E314-K320 WeakPolarHBondContact OE1-CD 3.45Å; E314-K320 WeakPolarHBondContact OE1-CG 3.36Å; E314-K325 WeakPolarHBondContact OE1-CE 3.35Å; E314-K325 IonicContact OE1-NZ 2.85Å; E314-K325 PolarHBondContact OE1-NZ 3.05Å; E314-K325 IonicContact OE2-NZ 2.78Å; E314-K325 PolarHBondContact OE2-NZ 2.84Å
315	T	77.5	Confident	82.7	Confident	39 Å²	39	100.3 Å²	100.3	24%	0.239	47%	0.473	C	S	.	.	B	Isolated β-bridge	trans	-125.8	143.8	176.6	53	0	0	0	0	109.1	Y317 N318	T315-Y317 HydrophobicContact CG2-CE1 4.36Å; T315-Y317 PolarHBondContact O-N 2.85Å; T315-N318 CarbonylContact O-C 3.41Å; T315-N318 PolarHBondContact O-N 2.69Å
316	W	83.3	Confident	82.2	Confident	225 Å²	225	105.9 Å²	105.9	85%	0.852	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.9	-167.6	68.2	-96	0	0	0	115.4
317	Y	82.9	Confident	81.9	Confident	161 Å²	161	106.1 Å²	106.1	63%	0.631	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-1.1	-179.6	58.6	-96.9	0	0	0	113.8	T315	T315-Y317 HydrophobicContact CG2-CE1 4.36Å; T315-Y317 PolarHBondContact O-N 2.85Å
318	N	83.8	Confident	81.7	Confident	119 Å²	119	106.5 Å²	106.5	64%	0.636	51%	0.505	S	S	*	.	B	Isolated β-bridge	trans	-153.5	70.8	-179.3	-170.5	40.8	0	0	0	110.5	T315	T315-N318 CarbonylContact O-C 3.41Å; T315-N318 PolarHBondContact O-N 2.69Å
319	E	82.1	Confident	81.5	Confident	146 Å²	146	108 Å²	108	68%	0.682	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-69.3	141.5	177	-60.7	-168.3	163	0	0	112
320	K	83.9	Confident	81.5	Confident	29 Å²	29	115.1 Å²	115.1	13%	0.126	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-70.8	145.1	176.6	-63.6	176	-179.8	135	0	111.4	D313 E314 E324 K325	D313-K320 WeakPolarHBondContact O-CE 3.36Å; D313-K320 PolarHBondContact O-NZ 3.36Å; D313-K320 IonicContact OD1-NZ 3.8Å; D313-K320 PolarHBondContact OD1-NZ 2.96Å; D313-K320 IonicContact OD2-NZ 3.69Å; D313-K320 PolarHBondContact OD2-NZ 3.07Å; E314-K320 HydrophobicContact CG-CD 4.15Å; E314-K320 HydrophobicContact CG-CG 4.33Å; E314-K320 WeakPolarHBondContact OE1-CB 3.44Å; E314-K320 WeakPolarHBondContact OE1-CD 3.45Å; E314-K320 WeakPolarHBondContact OE1-CG 3.36Å; K320-E324 HydrophobicContact CB-CB 4.42Å; K320-E324 WeakPolarHBondContact CB-OE2 3.38Å; K320-K325 HydrophobicContact CB-CG 3.92Å; K320-K325 WeakPolarHBondContact O-CE 3.29Å
321	T	85.1	Confident	81.6	Confident	97 Å²	97	115 Å²	115	60%	0.595	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-64.1	143.5	175	-63	0	0	0	0	110.5	K323 E324 K325	T321-K323 VanDerWaalsContact C-N 3.34Å; T321-K323 HydrophobicContact CG2-CB 4.41Å; T321-K323 PolarHBondContact O-N 2.9Å; T321-E324 WeakPolarHBondContact O-CA 3.3Å; T321-E324 WeakPolarHBondContact O-CB 3.43Å; T321-E324 PolarHBondContact O-N 3.33Å; T321-K325 PolarHBondContact O-N 2.84Å
322	Q	80.6	Confident	81.9	Confident	137 Å²	137	108.2 Å²	108.2	64%	0.64	50%	0.504	S	S	*	.	H	α-helix	trans	-38.2	-57.6	176.9	-171.5	74.9	25.9	0	0	113.5	E324 K325 E326	Q322-E324 PolarHBondContact O-N 3.39Å; Q322-E324 VanDerWaalsContact O-N 3.14Å; Q322-K325 WeakPolarHBondContact O-CB 3.43Å; Q322-K325 PolarHBondContact O-N 3.03Å; Q322-E326 WeakPolarHBondContact CG-OE1 3.37Å; Q322-E326 PolarHBondContact NE2-OE1 3.29Å; Q322-E326 WeakPolarHBondContact O-CG 3.2Å; Q322-E326 PolarHBondContact O-N 3.49Å; Q322-E326 VanDerWaalsContact O-N 3.07Å
323	K	80.6	Confident	82.6	Confident	155 Å²	155	108 Å²	108	67%	0.674	51%	0.505	S	S	*	.	H	α-helix	trans	-53	-33	176	-177.5	-173	176.7	-168.7	0	114.1	T321 T327	T321-K323 VanDerWaalsContact C-N 3.34Å; T321-K323 HydrophobicContact CG2-CB 4.41Å; T321-K323 PolarHBondContact O-N 2.9Å; K323-T327 PolarHBondContact O-N 3.21Å; K323-T327 PolarHBondContact O-OG1 3.11Å
324	E	80.1	Confident	83.8	Confident	73 Å²	73	110 Å²	110	34%	0.341	51%	0.51	S	S	.	.	H	α-helix	trans	-83	-21.7	-177.5	-155.4	-145.7	135.4	0	0	112.8	K320 T321 Q322 K332	K320-E324 HydrophobicContact CB-CB 4.42Å; K320-E324 WeakPolarHBondContact CB-OE2 3.38Å; T321-E324 WeakPolarHBondContact O-CA 3.3Å; T321-E324 WeakPolarHBondContact O-CB 3.43Å; T321-E324 PolarHBondContact O-N 3.33Å; Q322-E324 PolarHBondContact O-N 3.39Å; Q322-E324 VanDerWaalsContact O-N 3.14Å; E324-K332 PolarHBondContact O-NZ 3.13Å; E324-K332 VanDerWaalsContact OE1-CE 3.29Å; E324-K332 WeakPolarHBondContact OE1-CE 3.45Å; E324-K332 IonicContact OE1-NZ 2.77Å; E324-K332 PolarHBondContact OE1-NZ 2.91Å
325	K	79.9	Confident	84.7	Confident	101 Å²	101	107.9 Å²	107.9	44%	0.439	50%	0.503	S	S	.	.	H	α-helix	trans	-80.4	-35.1	168.4	-52.5	-161.8	-169.3	-148	0	111.5	E314 K320 T321 Q322 T327	E314-K325 WeakPolarHBondContact OE1-CE 3.35Å; E314-K325 IonicContact OE1-NZ 2.85Å; E314-K325 PolarHBondContact OE1-NZ 3.05Å; E314-K325 IonicContact OE2-NZ 2.78Å; E314-K325 PolarHBondContact OE2-NZ 2.84Å; K320-K325 HydrophobicContact CB-CG 3.92Å; K320-K325 WeakPolarHBondContact O-CE 3.29Å; T321-K325 PolarHBondContact O-N 2.84Å; Q322-K325 WeakPolarHBondContact O-CB 3.43Å; Q322-K325 PolarHBondContact O-N 3.03Å; K325-T327 VanDerWaalsContact C-N 3.31Å; K325-T327 PolarHBondContact O-N 3.32Å
326	E	82.9	Confident	85.4	Confident	134 Å²	134	106.7 Å²	106.7	63%	0.626	50%	0.495	S	S	*	.	S	Bend	trans	-78	-9.9	178.3	-68.8	164.8	-177.1	0	0	113.9	Q322	Q322-E326 WeakPolarHBondContact CG-OE1 3.37Å; Q322-E326 PolarHBondContact NE2-OE1 3.29Å; Q322-E326 WeakPolarHBondContact O-CG 3.2Å; Q322-E326 PolarHBondContact O-N 3.49Å; Q322-E326 VanDerWaalsContact O-N 3.07Å
327	T	84.7	Confident	85.9	Confident	52 Å²	52	98 Å²	98	32%	0.319	46%	0.464	S	S	.	.	S	Bend	trans	-79.3	129.5	-179.2	-65.5	0	0	0	0	112	K323 K325 Q329 K332	K323-T327 PolarHBondContact O-N 3.21Å; K323-T327 PolarHBondContact O-OG1 3.11Å; K325-T327 VanDerWaalsContact C-N 3.31Å; K325-T327 PolarHBondContact O-N 3.32Å; T327-Q329 PolarHBondContact O-N 3.34Å; T327-K332 HydrophobicContact CG2-CB 4.22Å
328	N	88.3	Confident	86.4	Confident	101 Å²	101	91.8 Å²	91.8	54%	0.54	44%	0.441	S	S	.	.			trans	-52.3	126.1	175.8	179	-19.6	0	0	0	112.2	Y330 L331 K332	N328-Y330 VanDerWaalsContact C-N 3.3Å; N328-Y330 PolarHBondContact O-N 2.76Å; N328-Y330 PolarHBondContact OD1-N 3.35Å; N328-L331 HydrophobicContact CB-CB 4.24Å; N328-L331 WeakPolarHBondContact O-CB 3.48Å; N328-L331 PolarHBondContact O-N 2.79Å; N328-K332 PolarHBondContact O-N 3.07Å
329	Q	85.3	Confident	86.8	Confident	134 Å²	134	86.4 Å²	86.4	63%	0.626	41%	0.413	S	S	*	.	H	α-helix	trans	-51.9	-40.9	-178.4	-172.2	-179.9	9.5	0	0	113.9	T327 K332 M333	T327-Q329 PolarHBondContact O-N 3.34Å; Q329-K332 PolarHBondContact O-N 3.39Å; Q329-M333 WeakPolarHBondContact O-CB 3.37Å; Q329-M333 PolarHBondContact O-N 3.05Å
330	Y	88.1	Confident	87.3	Confident	173 Å²	173	79.5 Å²	79.5	68%	0.678	38%	0.381	S	S	*	.	H	α-helix	trans	-69.8	-37.7	179.5	-68.1	-77.6	0	0	0	112.4	N328 M333 F334	N328-Y330 VanDerWaalsContact C-N 3.3Å; N328-Y330 PolarHBondContact O-N 2.76Å; N328-Y330 PolarHBondContact OD1-N 3.35Å; Y330-M333 HydrophobicContact CD1-CE 4.35Å; Y330-M333 PolarHBondContact O-N 3.24Å; Y330-F334 PolarHBondContact O-N 2.87Å; Y330-F334 VanDerWaalsContact O-N 3.14Å
331	L	88.6	Confident	87.7	Confident	101 Å²	101	79.2 Å²	79.2	53%	0.529	38%	0.38	S	S	.	.	H	α-helix	trans	-66.3	-43.6	174.3	-179.9	61.5	0	0	0	110.2	N328 M333 F334 T335	N328-L331 HydrophobicContact CB-CB 4.24Å; N328-L331 WeakPolarHBondContact O-CB 3.48Å; N328-L331 PolarHBondContact O-N 2.79Å; L331-M333 PolarHBondContact O-N 3.12Å; L331-F334 PolarHBondContact O-N 2.79Å; L331-T335 PolarHBondContact O-N 3.21Å; L331-T335 PolarHBondContact O-OG1 2.88Å
332	K	88	Confident	88.1	Confident	33 Å²	33	74.6 Å²	74.6	14%	0.143	35%	0.352	C	S	.	.	H	α-helix	trans	-60	-42.5	175.8	-165.7	172.9	-174.4	172.2	0	112.2	E324 T327 N328 Q329 F334 T335 D336	E324-K332 PolarHBondContact O-NZ 3.13Å; E324-K332 VanDerWaalsContact OE1-CE 3.29Å; E324-K332 WeakPolarHBondContact OE1-CE 3.45Å; E324-K332 IonicContact OE1-NZ 2.77Å; E324-K332 PolarHBondContact OE1-NZ 2.91Å; T327-K332 HydrophobicContact CG2-CB 4.22Å; N328-K332 PolarHBondContact O-N 3.07Å; Q329-K332 PolarHBondContact O-N 3.39Å; K332-F334 VanDerWaalsContact C-N 3.32Å; K332-F334 PolarHBondContact O-N 3.39Å; K332-T335 PolarHBondContact O-N 2.77Å; K332-D336 WeakPolarHBondContact O-CB 3.49Å; K332-D336 PolarHBondContact O-N 2.87Å
333	M	90.8	Very high	88.6	Confident	87 Å²	87	68.1 Å²	68.1	43%	0.429	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-38.7	176.1	-177.8	-179.7	71.8	0	0	112.3	T302 Y306 Q329 Y330 L331 F337	T302-M333 HydrophobicContact CG2-CG 4.11Å; Y306-M333 HydrophobicContact CD2-CG 4.09Å; Y306-M333 HydrophobicContact CE2-CB 3.72Å; Y306-M333 HydrophobicContact CE2-CG 3.6Å; Y306-M333 WeakPolarHBondContact OH-CA 3.47Å; Y306-M333 PolarHBondContact OH-N 3.46Å; Y306-M333 VanDerWaalsContact OH-N 3.15Å; Q329-M333 WeakPolarHBondContact O-CB 3.37Å; Q329-M333 PolarHBondContact O-N 3.05Å; Y330-M333 HydrophobicContact CD1-CE 4.35Å; Y330-M333 PolarHBondContact O-N 3.24Å; L331-M333 PolarHBondContact O-N 3.12Å; M333-F337 WeakPolarHBondContact O-CB 3.39Å; M333-F337 PolarHBondContact O-N 3.23Å
334	F	91.8	Very high	89.2	Confident	121 Å²	121	60.7 Å²	60.7	53%	0.531	29%	0.289	S	S	.	.	H	α-helix	trans	-69.2	-42.2	174.8	-174.4	-110.6	0	0	0	112.1	Y330 L331 K332 F337 L338	Y330-F334 PolarHBondContact O-N 2.87Å; Y330-F334 VanDerWaalsContact O-N 3.14Å; L331-F334 PolarHBondContact O-N 2.79Å; K332-F334 VanDerWaalsContact C-N 3.32Å; K332-F334 PolarHBondContact O-N 3.39Å; F334-F337 PolarHBondContact O-N 3.14Å; F334-L338 HydrophobicContact CD1-CD1 4.03Å; F334-L338 HydrophobicContact CE1-CD1 3.6Å; F334-L338 HydrophobicContact CE1-CG 4.27Å; F334-L338 HydrophobicContact CZ-CD1 4Å; F334-L338 HydrophobicContact CZ-CD2 4.44Å; F334-L338 HydrophobicContact CZ-CG 4.3Å; F334-L338 WeakPolarHBondContact O-CG 3.25Å; F334-L338 PolarHBondContact O-N 2.95Å
335	T	90.9	Very high	89.7	Confident	47 Å²	47	57.4 Å²	57.4	29%	0.288	27%	0.274	S	S	.	.	H	α-helix	trans	-59.5	-44.5	172.7	-68.5	0	0	0	0	112.1	V82 L331 K332 L338 S339	V82-T335 HydrophobicContact CG1-CG2 3.8Å; L331-T335 PolarHBondContact O-N 3.21Å; L331-T335 PolarHBondContact O-OG1 2.88Å; K332-T335 PolarHBondContact O-N 2.77Å; T335-L338 PolarHBondContact O-N 2.78Å; T335-S339 WeakPolarHBondContact O-CB 3.27Å; T335-S339 PolarHBondContact O-N 3.32Å; T335-S339 PolarHBondContact O-OG 2.81Å
336	D	91.4	Very high	90.1	Very high	14 Å²	14	53 Å²	53	8%	0.075	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-41	177.6	-85.8	-26.9	0	0	0	112.2	K305 Y306 K332 S339 F340	K305-D336 HydrophobicContact CD-CB 4.47Å; K305-D336 WeakPolarHBondContact CD-OD2 3.49Å; K305-D336 WeakPolarHBondContact CE-OD2 3.08Å; K305-D336 IonicContact NZ-OD1 3.48Å; K305-D336 PolarHBondContact NZ-OD1 2.73Å; K305-D336 IonicContact NZ-OD2 2.72Å; K305-D336 PolarHBondContact NZ-OD2 3.16Å; Y306-D336 PolarHBondContact OH-OD2 3.27Å; K332-D336 WeakPolarHBondContact O-CB 3.49Å; K332-D336 PolarHBondContact O-N 2.87Å; D336-S339 PolarHBondContact O-N 3.16Å; D336-F340 VanDerWaalsContact O-CD2 3.3Å; D336-F340 WeakPolarHBondContact O-CD2 3.29Å; D336-F340 PolarHBondContact O-N 2.6Å
337	F	94	Very high	90.5	Very high	43 Å²	43	46.7 Å²	46.7	19%	0.189	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-45.4	173.2	173	-98.4	0	0	0	112.2	V295 A298 L299 T302 M333 F334 F340 M341	V295-F337 HydrophobicContact CG1-CZ 4.38Å; A298-F337 HydrophobicContact CB-CD2 4.09Å; A298-F337 HydrophobicContact CB-CE2 3.82Å; L299-F337 HydrophobicContact CB-CE2 4.34Å; T302-F337 HydrophobicContact CG2-CB 4.24Å; T302-F337 WeakPolarHBondContact OG1-CA 3.25Å; M333-F337 WeakPolarHBondContact O-CB 3.39Å; M333-F337 PolarHBondContact O-N 3.23Å; F334-F337 PolarHBondContact O-N 3.14Å; F337-F340 PolarHBondContact O-N 3.08Å; F337-M341 HydrophobicContact CD1-SD 4.49Å; F337-M341 HydrophobicContact CE1-CG 4.07Å; F337-M341 HydrophobicContact CE1-SD 3.58Å; F337-M341 VanDerWaalsContact CE1-SD 3.58Å; F337-M341 HydrophobicContact CE2-CG 4.47Å; F337-M341 HydrophobicContact CZ-CG 4.01Å; F337-M341 HydrophobicContact CZ-SD 3.68Å; F337-M341 PolarHBondContact O-N 3.33Å
338	L	92.9	Very high	90.8	Very high	31 Å²	31	44.2 Å²	44.2	16%	0.162	21%	0.21	C	C	.	.	H	α-helix	trans	-62.9	-41.1	174.9	-71.6	179.9	0	0	0	111.9	V78 V82 F334 T335 F340 M341 V342	V78-L338 HydrophobicContact CG1-CB 4.11Å; V78-L338 HydrophobicContact CG1-CD1 4.43Å; V82-L338 HydrophobicContact CG2-CD1 4.36Å; F334-L338 HydrophobicContact CD1-CD1 4.03Å; F334-L338 HydrophobicContact CE1-CD1 3.6Å; F334-L338 HydrophobicContact CE1-CG 4.27Å; F334-L338 HydrophobicContact CZ-CD1 4Å; F334-L338 HydrophobicContact CZ-CD2 4.44Å; F334-L338 HydrophobicContact CZ-CG 4.3Å; F334-L338 WeakPolarHBondContact O-CG 3.25Å; F334-L338 PolarHBondContact O-N 2.95Å; T335-L338 PolarHBondContact O-N 2.78Å; L338-F340 VanDerWaalsContact C-N 3.34Å; L338-F340 PolarHBondContact O-N 3.4Å; L338-M341 WeakPolarHBondContact O-CB 3.02Å; L338-M341 PolarHBondContact O-N 3.19Å; L338-M341 VanDerWaalsContact O-N 3.16Å; L338-V342 WeakPolarHBondContact O-CG2 3.33Å; L338-V342 PolarHBondContact O-N 2.85Å
339	S	91.9	Very high	90.5	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-64	-34.9	175.4	-79.6	0	0	0	0	112.8	T335 D336 L343	T335-S339 WeakPolarHBondContact O-CB 3.27Å; T335-S339 PolarHBondContact O-N 3.32Å; T335-S339 PolarHBondContact O-OG 2.81Å; D336-S339 PolarHBondContact O-N 3.16Å; S339-L343 VanDerWaalsContact O-CB 3.3Å; S339-L343 WeakPolarHBondContact O-CB 2.97Å; S339-L343 PolarHBondContact O-N 3.49Å
340	F	94	Very high	90.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.9	-38	169.5	-79.2	-57.4	0	0	0	113.1	A298 C301 T302 K305 D336 F337 L338 V342 L343 F344 Q915 Y920 Q922	A298-F340 HydrophobicContact CB-CB 3.92Å; C301-F340 HydrophobicContact CB-CD1 3.83Å; C301-F340 HydrophobicContact CB-CD2 3.95Å; C301-F340 HydrophobicContact CB-CE1 3.68Å; C301-F340 HydrophobicContact CB-CE2 3.76Å; C301-F340 HydrophobicContact CB-CG 3.97Å; C301-F340 HydrophobicContact CB-CZ 3.62Å; T302-F340 WeakPolarHBondContact OG1-CD2 3.27Å; K305-F340 HydrophobicContact CB-CE2 4.49Å; K305-F340 HydrophobicContact CD-CE2 4.41Å; D336-F340 VanDerWaalsContact O-CD2 3.3Å; D336-F340 WeakPolarHBondContact O-CD2 3.29Å; D336-F340 PolarHBondContact O-N 2.6Å; F337-F340 PolarHBondContact O-N 3.08Å; L338-F340 VanDerWaalsContact C-N 3.34Å; L338-F340 PolarHBondContact O-N 3.4Å; F340-V342 VanDerWaalsContact C-N 3.3Å; F340-V342 PolarHBondContact O-N 3.24Å; F340-L343 HydrophobicContact CD1-CD2 4.14Å; F340-L343 HydrophobicContact CE1-CD2 4.42Å; F340-L343 PolarHBondContact O-N 3.13Å; F340-F344 HydrophobicContact CB-CE2 4.37Å; F340-F344 HydrophobicContact CD1-CE2 4.01Å; F340-F344 HydrophobicContact CD1-CZ 4.14Å; F340-F344 VanDerWaalsContact O-CD2 3.3Å; F340-F344 WeakPolarHBondContact O-CD2 3.4Å; F340-F344 WeakPolarHBondContact O-CG 3.23Å; F340-F344 PolarHBondContact O-N 3.09Å; F340-Q915 HydrophobicContact CE1-CG 4.18Å; F340-Y920 WeakPolarHBondContact CZ-O 3.42Å; F340-Q922 HydrophobicContact CD1-CG 4.35Å; F340-Q922 HydrophobicContact CE1-CG 4.13Å; F340-Q922 HydrophobicContact CZ-CG 4.29Å
341	M	92.4	Very high	90.4	Very high	24 Å²	24	26 Å²	26	12%	0.118	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-37.8	172.9	-76.7	-159.1	71.4	0	0	112.3	L294 V295 A298 F337 L338 N345	L294-M341 HydrophobicContact CD2-CE 3.84Å; L294-M341 HydrophobicContact CG-CE 4.19Å; V295-M341 HydrophobicContact CG2-CE 3.99Å; V295-M341 HydrophobicContact CG2-SD 4.48Å; A298-M341 HydrophobicContact CB-CG 3.72Å; F337-M341 HydrophobicContact CD1-SD 4.49Å; F337-M341 HydrophobicContact CE1-CG 4.07Å; F337-M341 HydrophobicContact CE1-SD 3.58Å; F337-M341 VanDerWaalsContact CE1-SD 3.58Å; F337-M341 HydrophobicContact CE2-CG 4.47Å; F337-M341 HydrophobicContact CZ-CG 4.01Å; F337-M341 HydrophobicContact CZ-SD 3.68Å; F337-M341 PolarHBondContact O-N 3.33Å; L338-M341 WeakPolarHBondContact O-CB 3.02Å; L338-M341 PolarHBondContact O-N 3.19Å; L338-M341 VanDerWaalsContact O-N 3.16Å; M341-N345 PolarHBondContact O-N 3.46Å
342	V	92.4	Very high	90.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67.2	-49.1	172.6	168.2	0	0	0	0	110.9	V78 Q79 T84 T86 L338 F340 F344 N345	V78-V342 HydrophobicContact CB-CG2 4.44Å; V78-V342 HydrophobicContact CG1-CG2 3.75Å; Q79-V342 HydrophobicContact CG-CB 4.5Å; Q79-V342 HydrophobicContact CG-CG1 3.57Å; Q79-V342 HydrophobicContact CG-CG2 4.04Å; T84-V342 HydrophobicContact CG2-CB 4.32Å; T84-V342 HydrophobicContact CG2-CG1 4.31Å; T84-V342 HydrophobicContact CG2-CG2 4.11Å; T86-V342 WeakPolarHBondContact OG1-CG1 3.5Å; L338-V342 WeakPolarHBondContact O-CG2 3.33Å; L338-V342 PolarHBondContact O-N 2.85Å; F340-V342 VanDerWaalsContact C-N 3.3Å; F340-V342 PolarHBondContact O-N 3.24Å; V342-F344 PolarHBondContact O-N 2.88Å; V342-F344 VanDerWaalsContact O-N 3.16Å; V342-N345 WeakPolarHBondContact O-CB 3.28Å; V342-N345 PolarHBondContact O-N 2.84Å; V342-N345 VanDerWaalsContact O-N 3.12Å; V342-N345 PolarHBondContact O-OD1 2.85Å; V342-N345 VanDerWaalsContact O-OD1 3.11Å
343	L	91.9	Very high	90.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57.7	-32.2	-179	-172.9	68	0	0	0	113	P85 S339 F340 Q911 Q915 Q922 P924	P85-L343 HydrophobicContact CB-CD1 4.38Å; P85-L343 HydrophobicContact CG-CB 4.26Å; P85-L343 HydrophobicContact CG-CD1 3.97Å; S339-L343 VanDerWaalsContact O-CB 3.3Å; S339-L343 WeakPolarHBondContact O-CB 2.97Å; S339-L343 PolarHBondContact O-N 3.49Å; F340-L343 HydrophobicContact CD1-CD2 4.14Å; F340-L343 HydrophobicContact CE1-CD2 4.42Å; F340-L343 PolarHBondContact O-N 3.13Å; L343-Q911 VanDerWaalsContact CD1-NE2 3.26Å; L343-Q911 PolarHBondContact O-NE2 2.86Å; L343-Q915 HydrophobicContact CD2-CG 4.3Å; L343-Q922 WeakPolarHBondContact CD1-O 3.22Å; L343-Q922 WeakPolarHBondContact CD2-O 3.37Å; L343-P924 HydrophobicContact CD1-CB 4.08Å
344	F	93	Very high	89.9	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	5.7	-179.1	-57.5	-35.7	0	0	0	114.5	L294 K297 C301 F340 V342 F346 I347 I908 F912 Q915	L294-F344 HydrophobicContact CD1-CB 3.45Å; L294-F344 VanDerWaalsContact CD1-CB 3.45Å; K297-F344 HydrophobicContact CB-CD2 4.03Å; K297-F344 HydrophobicContact CB-CE2 4.21Å; C301-F344 HydrophobicContact CB-CE2 4.39Å; F340-F344 HydrophobicContact CB-CE2 4.37Å; F340-F344 HydrophobicContact CD1-CE2 4.01Å; F340-F344 HydrophobicContact CD1-CZ 4.14Å; F340-F344 VanDerWaalsContact O-CD2 3.3Å; F340-F344 WeakPolarHBondContact O-CD2 3.4Å; F340-F344 WeakPolarHBondContact O-CG 3.23Å; F340-F344 PolarHBondContact O-N 3.09Å; V342-F344 PolarHBondContact O-N 2.88Å; V342-F344 VanDerWaalsContact O-N 3.16Å; F344-F346 PolarHBondContact O-N 2.85Å; F344-F346 VanDerWaalsContact O-N 3.14Å; F344-I347 WeakPolarHBondContact O-CB 3Å; F344-I347 VanDerWaalsContact O-CG2 3.29Å; F344-I347 WeakPolarHBondContact O-CG2 3.4Å; F344-I347 PolarHBondContact O-N 3.38Å; F344-I347 VanDerWaalsContact O-N 3.08Å; F344-I908 HydrophobicContact CB-CG1 4.32Å; F344-I908 HydrophobicContact CD1-CD1 4.3Å; F344-I908 HydrophobicContact CD1-CG1 4.14Å; F344-F912 HydrophobicContact CE1-CB 3.96Å; F344-F912 HydrophobicContact CE1-CD2 4.42Å; F344-F912 AromaticContact CE2-CD2 3.92Å; F344-F912 HydrophobicContact CE2-CD2 3.92Å; F344-F912 HydrophobicContact CZ-CB 4.12Å; F344-F912 AromaticContact CZ-CD2 3.75Å; F344-F912 HydrophobicContact CZ-CD2 3.75Å; F344-F912 HydrophobicContact CZ-CG 4.42Å; F344-Q915 HydrophobicContact CE1-CG 4.16Å; F344-Q915 HydrophobicContact CZ-CG 3.83Å
345	N	90.5	Very high	89.8	Confident	4 Å²	4	11.7 Å²	11.7	2%	0.021	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-56.8	-33.3	-173.5	68.6	-4.4	0	0	0	113.9	I75 S91 M341 V342 I347 I348	I75-N345 HydrophobicContact CG2-CB 3.94Å; I75-N345 VanDerWaalsContact CG2-ND2 3.29Å; I75-N345 WeakPolarHBondContact CG2-ND2 3.42Å; S91-N345 PolarHBondContact OG-ND2 2.89Å; M341-N345 PolarHBondContact O-N 3.46Å; V342-N345 WeakPolarHBondContact O-CB 3.28Å; V342-N345 PolarHBondContact O-N 2.84Å; V342-N345 VanDerWaalsContact O-N 3.12Å; V342-N345 PolarHBondContact O-OD1 2.85Å; V342-N345 VanDerWaalsContact O-OD1 3.11Å; N345-I347 PolarHBondContact O-N 3.19Å; N345-I348 PolarHBondContact O-N 2.92Å
346	F	89.1	Confident	89.7	Confident	9 Å²	9	10 Å²	10	4%	0.039	5%	0.052	C	C	.	.	G	3₁₀ helix	trans	-63.6	-4.7	178.7	-54.4	-76	0	0	0	114.3	F344 I348 N904 F907 I908 L931	F344-F346 PolarHBondContact O-N 2.85Å; F344-F346 VanDerWaalsContact O-N 3.14Å; F346-I348 PolarHBondContact O-N 3.49Å; F346-N904 PolarHBondContact O-OD1 3.43Å; F346-N904 VanDerWaalsContact O-OD1 3.09Å; F346-F907 HydrophobicContact CB-CD1 4.16Å; F346-F907 HydrophobicContact CB-CE1 3.71Å; F346-F907 HydrophobicContact CG-CE1 4.04Å; F346-I908 HydrophobicContact CB-CD1 4.35Å; F346-L931 HydrophobicContact CD2-CD2 4.3Å; F346-L931 HydrophobicContact CE1-CB 4.45Å; F346-L931 HydrophobicContact CE2-CB 4.15Å; F346-L931 HydrophobicContact CE2-CD1 3.95Å; F346-L931 HydrophobicContact CE2-CD2 4.1Å; F346-L931 HydrophobicContact CE2-CG 4.29Å; F346-L931 HydrophobicContact CZ-CB 3.91Å; F346-L931 HydrophobicContact CZ-CD1 4.31Å
347	I	91.6	Very high	89.5	Confident	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.052	C	C	.	.	G	3₁₀ helix	trans	-62.8	-30.5	167.6	-159.4	176.5	0	0	0	112.2	Y290 I293 L294 K297 F344 N345 L905 I908	Y290-I347 HydrophobicContact CD1-CD1 3.94Å; Y290-I347 HydrophobicContact CD1-CG1 3.78Å; Y290-I347 HydrophobicContact CE1-CD1 4.33Å; Y290-I347 HydrophobicContact CE1-CG1 4.14Å; I293-I347 HydrophobicContact CB-CD1 4.48Å; I293-I347 HydrophobicContact CG2-CD1 3.74Å; L294-I347 HydrophobicContact CB-CG2 3.94Å; L294-I347 HydrophobicContact CD1-CG2 4.03Å; L294-I347 HydrophobicContact CD2-CG2 4.49Å; L294-I347 HydrophobicContact CG-CG2 4.37Å; K297-I347 HydrophobicContact CD-CD1 4.45Å; F344-I347 WeakPolarHBondContact O-CB 3Å; F344-I347 VanDerWaalsContact O-CG2 3.29Å; F344-I347 WeakPolarHBondContact O-CG2 3.4Å; F344-I347 PolarHBondContact O-N 3.38Å; F344-I347 VanDerWaalsContact O-N 3.08Å; N345-I347 PolarHBondContact O-N 3.19Å; I347-L905 HydrophobicContact CD1-CD1 4.47Å; I347-I908 HydrophobicContact CB-CG2 3.88Å; I347-I908 HydrophobicContact CD1-CG2 4.17Å; I347-I908 HydrophobicContact CG1-CG2 3.77Å
348	I	89.2	Confident	89.2	Confident	1 Å²	1	11 Å²	11	1%	0.005	6%	0.057	C	C	.	.	S	Bend	trans	-93.1	122.1	174.6	-52	-167.8	0	0	0	108	Y71 F72 L287 L291 N345 F346 V350	Y71-I348 HydrophobicContact CD1-CD1 4.09Å; Y71-I348 HydrophobicContact CE1-CB 4.12Å; Y71-I348 HydrophobicContact CE1-CD1 3.76Å; Y71-I348 HydrophobicContact CE1-CG1 4.23Å; Y71-I348 HydrophobicContact CE2-CD1 4.36Å; F72-I348 HydrophobicContact CE1-CB 4.29Å; F72-I348 HydrophobicContact CE1-CG2 4.46Å; F72-I348 HydrophobicContact CE2-CG2 4.35Å; F72-I348 HydrophobicContact CZ-CB 3.94Å; F72-I348 HydrophobicContact CZ-CG2 3.69Å; F72-I348 WeakPolarHBondContact CZ-O 3.3Å; L287-I348 HydrophobicContact CD1-CG2 3.83Å; L287-I348 HydrophobicContact CG-CG2 4.15Å; L291-I348 HydrophobicContact CB-CD1 4.26Å; L291-I348 HydrophobicContact CD1-CD1 4.17Å; N345-I348 PolarHBondContact O-N 2.92Å; F346-I348 PolarHBondContact O-N 3.49Å; I348-V350 PolarHBondContact O-N 2.95Å; I348-V350 VanDerWaalsContact O-N 3.09Å
349	P	83.8	Confident	89.2	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.05	C	C	.	.			trans	-80.1	97.2	-169.2	31	-36.5	0	0	0	112.7	S351 M352 F900 F901	P349-S351 VanDerWaalsContact C-N 3.29Å; P349-S351 PolarHBondContact O-N 3.35Å; P349-M352 HydrophobicContact CB-CB 3.85Å; P349-M352 HydrophobicContact CG-CB 3.72Å; P349-M352 HydrophobicContact CG-CE 4Å; P349-M352 HydrophobicContact CG-CG 4.38Å; P349-M352 HydrophobicContact CG-SD 3.84Å; P349-M352 WeakPolarHBondContact O-CB 3.39Å; P349-M352 PolarHBondContact O-N 3.38Å; P349-M352 VanDerWaalsContact O-N 3.12Å; P349-F900 HydrophobicContact CB-CD1 3.94Å; P349-F901 HydrophobicContact CG-CD1 4.32Å; P349-F901 HydrophobicContact CG-CE1 4.25Å
350	V	83.5	Confident	89.2	Confident	17 Å²	17	10.1 Å²	10.1	10%	0.103	5%	0.052	C	C	.	.	H	α-helix	trans	-49.2	-49.4	177	-174.6	0	0	0	0	111.8	F72 P94 V98 I348 M352	F72-V350 HydrophobicContact CD1-CG2 3.76Å; F72-V350 HydrophobicContact CD2-CG1 4.41Å; F72-V350 HydrophobicContact CD2-CG2 4.27Å; F72-V350 HydrophobicContact CE1-CB 4.42Å; F72-V350 HydrophobicContact CE1-CG2 3.35Å; F72-V350 HydrophobicContact CE2-CB 4.17Å; F72-V350 HydrophobicContact CE2-CG1 4.4Å; F72-V350 HydrophobicContact CE2-CG2 3.93Å; F72-V350 HydrophobicContact CG-CG2 4.22Å; F72-V350 HydrophobicContact CZ-CB 4.07Å; F72-V350 HydrophobicContact CZ-CG2 3.45Å; F72-V350 VanDerWaalsContact CZ-CG2 3.45Å; P94-V350 HydrophobicContact CB-CB 4.36Å; P94-V350 HydrophobicContact CB-CG1 3.85Å; V98-V350 HydrophobicContact CG2-CG1 4.02Å; I348-V350 PolarHBondContact O-N 2.95Å; I348-V350 VanDerWaalsContact O-N 3.09Å; V350-M352 VanDerWaalsContact C-N 3.3Å; V350-M352 PolarHBondContact O-N 2.85Å
351	S	85.9	Confident	88.9	Confident	8 Å²	8	12.3 Å²	12.3	6%	0.056	6%	0.061	C	C	.	.	H	α-helix	trans	-76	-10.6	-174.7	48.6	0	0	0	0	114.8	P349 Y353 V354 T355 N935	P349-S351 VanDerWaalsContact C-N 3.29Å; P349-S351 PolarHBondContact O-N 3.35Å; S351-Y353 VanDerWaalsContact C-N 3.32Å; S351-Y353 PolarHBondContact O-N 2.67Å; S351-V354 WeakPolarHBondContact O-CG1 3.43Å; S351-V354 PolarHBondContact O-N 2.76Å; S351-T355 PolarHBondContact O-N 3.44Å; S351-T355 PolarHBondContact O-OG1 2.94Å; S351-N935 WeakPolarHBondContact CB-O 3.49Å; S351-N935 PolarHBondContact OG-O 2.85Å
352	M	88.1	Confident	88.9	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-57.6	-44.4	179.6	178	-177.3	66.5	0	0	111.9	I283 P349 V350 T355 V356 F900 F901	I283-M352 HydrophobicContact CG2-CE 3.49Å; I283-M352 VanDerWaalsContact CG2-CE 3.49Å; I283-M352 HydrophobicContact CG2-SD 4.35Å; P349-M352 HydrophobicContact CB-CB 3.85Å; P349-M352 HydrophobicContact CG-CB 3.72Å; P349-M352 HydrophobicContact CG-CE 4Å; P349-M352 HydrophobicContact CG-CG 4.38Å; P349-M352 HydrophobicContact CG-SD 3.84Å; P349-M352 WeakPolarHBondContact O-CB 3.39Å; P349-M352 PolarHBondContact O-N 3.38Å; P349-M352 VanDerWaalsContact O-N 3.12Å; V350-M352 VanDerWaalsContact C-N 3.3Å; V350-M352 PolarHBondContact O-N 2.85Å; M352-T355 PolarHBondContact O-N 2.9Å; M352-V356 HydrophobicContact CG-CG2 4.42Å; M352-V356 WeakPolarHBondContact O-CB 3.47Å; M352-V356 VanDerWaalsContact O-CG2 3.31Å; M352-V356 WeakPolarHBondContact O-CG2 2.95Å; M352-V356 PolarHBondContact O-N 2.8Å; M352-F900 HydrophobicContact CB-CB 4.2Å; M352-F900 HydrophobicContact CB-CD1 3.75Å; M352-F900 HydrophobicContact CB-CE1 4.22Å; M352-F900 HydrophobicContact CB-CG 3.9Å; M352-F900 HydrophobicContact CG-CB 4Å; M352-F900 HydrophobicContact CG-CD1 4.38Å; M352-F900 HydrophobicContact CG-CD2 4.38Å; M352-F900 HydrophobicContact CG-CG 4.01Å; M352-F900 HydrophobicContact SD-CB 4.15Å; M352-F901 HydrophobicContact CE-CE2 4.34Å; M352-F901 HydrophobicContact CE-CZ 4.04Å; M352-F901 HydrophobicContact SD-CD2 4.43Å; M352-F901 HydrophobicContact SD-CE2 3.91Å; M352-F901 HydrophobicContact SD-CZ 4.14Å
353	Y	83.7	Confident	88.8	Confident	19 Å²	19	14.1 Å²	14.1	8%	0.075	7%	0.071	C	C	.	.	H	α-helix	trans	-67.1	-42.4	-176.4	-75.8	-88.5	0	0	0	112.4	A68 I283 N284 L287 S351 V356 E357	A68-Y353 HydrophobicContact CB-CD2 3.87Å; A68-Y353 HydrophobicContact CB-CE2 3.25Å; I283-Y353 HydrophobicContact CG2-CE1 4.27Å; N284-Y353 PolarHBondContact OD1-OH 2.82Å; L287-Y353 HydrophobicContact CD1-CE2 4.09Å; S351-Y353 VanDerWaalsContact C-N 3.32Å; S351-Y353 PolarHBondContact O-N 2.67Å; Y353-V356 PolarHBondContact O-N 2.7Å; Y353-E357 WeakPolarHBondContact O-CG 3.38Å; Y353-E357 PolarHBondContact O-N 3.26Å
354	V	85.8	Confident	88.8	Confident	11 Å²	11	14.6 Å²	14.6	7%	0.067	7%	0.074	C	C	.	.	H	α-helix	trans	-69.9	-35.8	176.1	71	0	0	0	0	111.9	V98 V101 S351 E357 M358	V98-V354 HydrophobicContact CB-CB 4.48Å; V98-V354 HydrophobicContact CG1-CB 4.27Å; V98-V354 HydrophobicContact CG2-CB 4.02Å; V98-V354 HydrophobicContact CG2-CG1 3.78Å; V101-V354 HydrophobicContact CB-CG2 3.78Å; V101-V354 HydrophobicContact CG1-CG2 3.52Å; V101-V354 HydrophobicContact CG2-CG2 4.45Å; S351-V354 WeakPolarHBondContact O-CG1 3.43Å; S351-V354 PolarHBondContact O-N 2.76Å; V354-E357 PolarHBondContact O-N 3.19Å; V354-M358 WeakPolarHBondContact O-CB 3.5Å; V354-M358 PolarHBondContact O-N 2.8Å
355	T	89.6	Confident	88.8	Confident	10 Å²	10	17.8 Å²	17.8	6%	0.061	9%	0.088	C	C	.	.	H	α-helix	trans	-68.4	-37	175.9	-50.4	0	0	0	0	111.5	S351 M352 Q359 L896 F900 L944	S351-T355 PolarHBondContact O-N 3.44Å; S351-T355 PolarHBondContact O-OG1 2.94Å; M352-T355 PolarHBondContact O-N 2.9Å; T355-Q359 WeakPolarHBondContact O-CB 3.26Å; T355-Q359 PolarHBondContact O-N 3.38Å; T355-L896 HydrophobicContact CG2-CD1 4.07Å; T355-F900 HydrophobicContact CG2-CE2 3.9Å; T355-F900 HydrophobicContact CG2-CZ 4.06Å; T355-F900 WeakPolarHBondContact OG1-CZ 3.23Å; T355-L944 HydrophobicContact CG2-CB 3.93Å; T355-L944 HydrophobicContact CG2-CD1 3.98Å; T355-L944 HydrophobicContact CG2-CG 4.42Å
356	V	89.9	Confident	88.9	Confident	13 Å²	13	20.8 Å²	20.8	8%	0.079	10%	0.101	C	C	.	.	H	α-helix	trans	-63.1	-49.3	170.9	166.3	0	0	0	0	111.4	M352 Y353 M358 Q359 K360 I893 L896	M352-V356 HydrophobicContact CG-CG2 4.42Å; M352-V356 WeakPolarHBondContact O-CB 3.47Å; M352-V356 VanDerWaalsContact O-CG2 3.31Å; M352-V356 WeakPolarHBondContact O-CG2 2.95Å; M352-V356 PolarHBondContact O-N 2.8Å; Y353-V356 PolarHBondContact O-N 2.7Å; V356-M358 VanDerWaalsContact C-N 3.34Å; V356-M358 PolarHBondContact O-N 3.11Å; V356-Q359 PolarHBondContact O-N 2.76Å; V356-K360 HydrophobicContact CG1-CD 4.18Å; V356-K360 WeakPolarHBondContact O-CB 3.22Å; V356-K360 WeakPolarHBondContact O-CG 3.33Å; V356-K360 PolarHBondContact O-N 2.92Å; V356-I893 HydrophobicContact CG1-CD1 3.93Å; V356-L896 HydrophobicContact CG2-CD2 3.55Å
357	E	86.6	Confident	89.2	Confident	15 Å²	15	20.5 Å²	20.5	7%	0.07	10%	0.1	C	C	.	.	H	α-helix	trans	-64.3	-38.1	-180	-75.1	-172.6	155.2	0	0	112.8	R66 T102 Y353 V354 F361	R66-E357 IonicContact CZ-OE1 3.17Å; R66-E357 IonicContact NH1-OE1 3.53Å; R66-E357 PolarHBondContact NH1-OE1 3.11Å; R66-E357 IonicContact NH1-OE2 2.84Å; R66-E357 IonicContact NH2-OE1 2.7Å; R66-E357 PolarHBondContact NH2-OE1 2.98Å; T102-E357 WeakPolarHBondContact CB-OE2 3.35Å; T102-E357 VanDerWaalsContact CG2-OE2 3.24Å; T102-E357 WeakPolarHBondContact CG2-OE2 3.48Å; T102-E357 PolarHBondContact OG1-OE2 2.7Å; Y353-E357 WeakPolarHBondContact O-CG 3.38Å; Y353-E357 PolarHBondContact O-N 3.26Å; V354-E357 PolarHBondContact O-N 3.19Å; E357-F361 VanDerWaalsContact O-CB 3.28Å; E357-F361 WeakPolarHBondContact O-CB 3.35Å; E357-F361 PolarHBondContact O-N 2.79Å
358	M	88.3	Confident	89.2	Confident	61 Å²	61	22.9 Å²	22.9	30%	0.3	12%	0.115	S	C	.	.	H	α-helix	trans	-68.5	-41.6	175.4	-170.4	61.9	70.2	0	0	111.7	V101 V354 V356 K360 F361 L362 L944	V101-M358 HydrophobicContact CG1-CE 3.73Å; V354-M358 WeakPolarHBondContact O-CB 3.5Å; V354-M358 PolarHBondContact O-N 2.8Å; V356-M358 VanDerWaalsContact C-N 3.34Å; V356-M358 PolarHBondContact O-N 3.11Å; M358-K360 VanDerWaalsContact C-N 3.34Å; M358-K360 PolarHBondContact O-N 2.97Å; M358-F361 PolarHBondContact O-N 3.11Å; M358-F361 HydrophobicContact SD-CD1 4.44Å; M358-L362 HydrophobicContact CG-CD1 3.79Å; M358-L362 HydrophobicContact CG-CG 4.27Å; M358-L362 WeakPolarHBondContact O-CB 3.4Å; M358-L362 WeakPolarHBondContact O-CG 3.37Å; M358-L362 PolarHBondContact O-N 2.66Å; M358-L362 HydrophobicContact SD-CD1 3.9Å; M358-L362 HydrophobicContact SD-CG 3.96Å; M358-L944 HydrophobicContact CG-CD1 4.48Å; M358-L944 HydrophobicContact CG-CD2 4.26Å
359	Q	92.5	Very high	89.5	Confident	3 Å²	3	31 Å²	31	1%	0.014	15%	0.146	C	C	.	.	H	α-helix	trans	-61.9	-41.3	175.9	-177.2	-86.2	-9.7	0	0	111.7	T355 V356 G363 L944 S947 L948	T355-Q359 WeakPolarHBondContact O-CB 3.26Å; T355-Q359 PolarHBondContact O-N 3.38Å; V356-Q359 PolarHBondContact O-N 2.76Å; Q359-G363 WeakPolarHBondContact O-CA 3.2Å; Q359-G363 PolarHBondContact O-N 3.27Å; Q359-L944 HydrophobicContact CB-CD1 3.97Å; Q359-S947 WeakPolarHBondContact CG-O 3.46Å; Q359-S947 PolarHBondContact NE2-O 3Å; Q359-L948 HydrophobicContact CG-CD2 4.14Å; Q359-L948 HydrophobicContact CG-CG 4.35Å; Q359-L948 WeakPolarHBondContact O-CD2 3.36Å
360	K	90.9	Very high	90	Very high	17 Å²	17	32.3 Å²	32.3	7%	0.074	15%	0.152	C	C	.	.	H	α-helix	trans	-65.7	-48.9	175	-75.1	-177.9	175.6	-151.6	0	112.6	V356 M358 G363 S364 D388 N390 E391	V356-K360 HydrophobicContact CG1-CD 4.18Å; V356-K360 WeakPolarHBondContact O-CB 3.22Å; V356-K360 WeakPolarHBondContact O-CG 3.33Å; V356-K360 PolarHBondContact O-N 2.92Å; M358-K360 VanDerWaalsContact C-N 3.34Å; M358-K360 PolarHBondContact O-N 2.97Å; K360-G363 PolarHBondContact O-N 3.07Å; K360-S364 PolarHBondContact O-N 2.98Å; K360-D388 PolarHBondContact NZ-O 3.25Å; K360-N390 PolarHBondContact O-ND2 3.33Å; K360-E391 VanDerWaalsContact CE-CD 3.44Å; K360-E391 WeakPolarHBondContact CE-OE1 3.49Å; K360-E391 WeakPolarHBondContact CE-OE2 3.5Å; K360-E391 IonicContact NZ-OE1 2.71Å; K360-E391 PolarHBondContact NZ-OE1 3.13Å; K360-E391 IonicContact NZ-OE2 3.75Å; K360-E391 PolarHBondContact NZ-OE2 3.42Å
361	F	89.1	Confident	90.5	Very high	46 Å²	46	40 Å²	40	20%	0.202	19%	0.185	C	C	.	.	H	α-helix	trans	-60.8	-53.3	179.4	177.2	-110.5	0	0	0	111.4	K105 E357 M358 G363 S364 F365	K105-F361 HydrophobicContact CD-CB 4.42Å; K105-F361 HydrophobicContact CD-CD2 4.48Å; K105-F361 HydrophobicContact CG-CD2 4.33Å; E357-F361 VanDerWaalsContact O-CB 3.28Å; E357-F361 WeakPolarHBondContact O-CB 3.35Å; E357-F361 PolarHBondContact O-N 2.79Å; M358-F361 PolarHBondContact O-N 3.11Å; M358-F361 HydrophobicContact SD-CD1 4.44Å; F361-G363 PolarHBondContact O-N 3.04Å; F361-S364 PolarHBondContact O-N 3.21Å; F361-S364 PolarHBondContact O-OG 3.46Å; F361-F365 HydrophobicContact CD1-CE2 4.26Å; F361-F365 AromaticContact CE1-CE2 3.85Å; F361-F365 HydrophobicContact CE1-CE2 3.85Å; F361-F365 HydrophobicContact CE1-CZ 4.25Å; F361-F365 HydrophobicContact CE2-CE2 4.21Å; F361-F365 HydrophobicContact CE2-CZ 4.05Å; F361-F365 AromaticContact CZ-CE2 3.83Å; F361-F365 HydrophobicContact CZ-CE2 3.83Å; F361-F365 AromaticContact CZ-CZ 3.76Å; F361-F365 HydrophobicContact CZ-CZ 3.76Å
362	L	91.3	Very high	90.8	Very high	61 Å²	61	44.2 Å²	44.2	32%	0.319	21%	0.206	S	C	.	.	H	α-helix	trans	-64.7	-39	178	-65.7	176.6	0	0	0	112.1	M358 S364 F365 L948	M358-L362 HydrophobicContact CG-CD1 3.79Å; M358-L362 HydrophobicContact CG-CG 4.27Å; M358-L362 WeakPolarHBondContact O-CB 3.4Å; M358-L362 WeakPolarHBondContact O-CG 3.37Å; M358-L362 PolarHBondContact O-N 2.66Å; M358-L362 HydrophobicContact SD-CD1 3.9Å; M358-L362 HydrophobicContact SD-CG 3.96Å; L362-S364 VanDerWaalsContact C-N 3.28Å; L362-S364 PolarHBondContact O-N 2.76Å; L362-F365 PolarHBondContact O-N 3.07Å; L362-L948 HydrophobicContact CB-CD1 4.3Å; L362-L948 HydrophobicContact CB-CD2 3.82Å; L362-L948 HydrophobicContact CD1-CD1 3.95Å
363	G	90.8	Very high	91	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-33	175.6	0	0	0	0	0	113.6	Q359 K360 F361 F365 F366 Y889	Q359-G363 WeakPolarHBondContact O-CA 3.2Å; Q359-G363 PolarHBondContact O-N 3.27Å; K360-G363 PolarHBondContact O-N 3.07Å; F361-G363 PolarHBondContact O-N 3.04Å; G363-F365 PolarHBondContact O-N 2.79Å; G363-F366 PolarHBondContact O-N 3.25Å; G363-Y889 PolarHBondContact O-OH 3.33Å
364	S	91.4	Very high	91.4	Very high	10 Å²	10	48.4 Å²	48.4	7%	0.07	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-27.3	178.8	70.2	0	0	0	0	113.3	K360 F361 L362 I367 T368 V384 N390	K360-S364 PolarHBondContact O-N 2.98Å; F361-S364 PolarHBondContact O-N 3.21Å; F361-S364 PolarHBondContact O-OG 3.46Å; L362-S364 VanDerWaalsContact C-N 3.28Å; L362-S364 PolarHBondContact O-N 2.76Å; S364-I367 PolarHBondContact O-N 2.71Å; S364-T368 PolarHBondContact O-N 2.86Å; S364-T368 PolarHBondContact O-OG1 3.47Å; S364-V384 WeakPolarHBondContact O-CG2 3.13Å; S364-N390 PolarHBondContact N-ND2 3.4Å
365	F	92.4	Very high	91.6	Very high	67 Å²	67	48.1 Å²	48.1	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-70.3	-32.3	174.4	-61.6	-65.1	0	0	0	112.9	F361 L362 G363 I367 T368 W369	F361-F365 HydrophobicContact CD1-CE2 4.26Å; F361-F365 AromaticContact CE1-CE2 3.85Å; F361-F365 HydrophobicContact CE1-CE2 3.85Å; F361-F365 HydrophobicContact CE1-CZ 4.25Å; F361-F365 HydrophobicContact CE2-CE2 4.21Å; F361-F365 HydrophobicContact CE2-CZ 4.05Å; F361-F365 AromaticContact CZ-CE2 3.83Å; F361-F365 HydrophobicContact CZ-CE2 3.83Å; F361-F365 AromaticContact CZ-CZ 3.76Å; F361-F365 HydrophobicContact CZ-CZ 3.76Å; L362-F365 PolarHBondContact O-N 3.07Å; G363-F365 PolarHBondContact O-N 2.79Å; F365-I367 PolarHBondContact O-N 2.7Å; F365-T368 PolarHBondContact O-N 3.23Å; F365-T368 VanDerWaalsContact O-N 3.14Å; F365-W369 HydrophobicContact CB-CD2 4.01Å; F365-W369 HydrophobicContact CB-CE3 4Å; F365-W369 HydrophobicContact CB-CH2 3.78Å; F365-W369 HydrophobicContact CB-CZ2 3.79Å; F365-W369 HydrophobicContact CB-CZ3 3.88Å; F365-W369 HydrophobicContact CD1-CZ2 4.37Å; F365-W369 HydrophobicContact CG-CH2 4.3Å; F365-W369 HydrophobicContact CG-CZ2 4.16Å; F365-W369 WeakPolarHBondContact O-CB 3.44Å; F365-W369 PolarHBondContact O-N 3.01Å
366	F	94.3	Very high	91.5	Very high	67 Å²	67	52.3 Å²	52.3	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-67.8	-19.7	176.6	-58.8	-30.5	0	0	0	113.3	G363 W369 H885 Y889 L948 L949	G363-F366 PolarHBondContact O-N 3.25Å; F366-W369 HydrophobicContact CD1-CE3 4.01Å; F366-W369 HydrophobicContact CD1-CZ3 4.15Å; F366-W369 HydrophobicContact CE1-CE3 4.48Å; F366-W369 HydrophobicContact CE1-CZ3 4.21Å; F366-H885 PolarHBondContact O-CE1 2.93Å; F366-Y889 WeakPolarHBondContact CB-OH 3.41Å; F366-L948 HydrophobicContact CE2-CB 4.19Å; F366-L948 HydrophobicContact CE2-CD2 4.14Å; F366-L949 HydrophobicContact CZ-CD2 4.22Å
367	I	94.3	Very high	91.3	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.015	27%	0.274	C	S	.	.	H	α-helix	trans	-76.8	-48.8	168.6	-60.8	173	0	0	0	109.2	S364 F365 W369 D370 F373 A382 V384 L393 Y870 L881 Y889	S364-I367 PolarHBondContact O-N 2.71Å; F365-I367 PolarHBondContact O-N 2.7Å; I367-W369 VanDerWaalsContact C-N 3.28Å; I367-W369 PolarHBondContact O-N 3.36Å; I367-D370 PolarHBondContact O-N 2.84Å; I367-F373 HydrophobicContact CG2-CD2 4.35Å; I367-F373 HydrophobicContact CG2-CE2 4Å; I367-F373 WeakPolarHBondContact O-CD2 3.3Å; I367-A382 HydrophobicContact CG2-CB 4.38Å; I367-V384 HydrophobicContact CB-CG2 3.84Å; I367-V384 HydrophobicContact CD1-CG2 4.23Å; I367-V384 HydrophobicContact CG2-CG2 3.87Å; I367-L393 HydrophobicContact CD1-CD1 4.45Å; I367-Y870 HydrophobicContact CD1-CE1 4.03Å; I367-L881 HydrophobicContact CD1-CD1 4.35Å; I367-L881 HydrophobicContact CG2-CD1 4.01Å; I367-Y889 HydrophobicContact CD1-CE2 3.84Å; I367-Y889 HydrophobicContact CG1-CE2 3.87Å
368	T	92.9	Very high	91	Very high	51 Å²	51	59 Å²	59	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-64	-27.7	-179.9	-53.2	0	0	0	0	113.7	S364 F365	S364-T368 PolarHBondContact O-N 2.86Å; S364-T368 PolarHBondContact O-OG1 3.47Å; F365-T368 PolarHBondContact O-N 3.23Å; F365-T368 VanDerWaalsContact O-N 3.14Å
369	W	93.8	Very high	90.9	Very high	172 Å²	172	63.2 Å²	63.2	65%	0.652	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-1.4	180	-61.8	-25.4	0	0	0	114.7	F365 F366 I367 K371	F365-W369 HydrophobicContact CB-CD2 4.01Å; F365-W369 HydrophobicContact CB-CE3 4Å; F365-W369 HydrophobicContact CB-CH2 3.78Å; F365-W369 HydrophobicContact CB-CZ2 3.79Å; F365-W369 HydrophobicContact CB-CZ3 3.88Å; F365-W369 HydrophobicContact CD1-CZ2 4.37Å; F365-W369 HydrophobicContact CG-CH2 4.3Å; F365-W369 HydrophobicContact CG-CZ2 4.16Å; F365-W369 WeakPolarHBondContact O-CB 3.44Å; F365-W369 PolarHBondContact O-N 3.01Å; F366-W369 HydrophobicContact CD1-CE3 4.01Å; F366-W369 HydrophobicContact CD1-CZ3 4.15Å; F366-W369 HydrophobicContact CE1-CE3 4.48Å; F366-W369 HydrophobicContact CE1-CZ3 4.21Å; I367-W369 VanDerWaalsContact C-N 3.28Å; I367-W369 PolarHBondContact O-N 3.36Å; W369-K371 PolarHBondContact O-N 3.12Å
370	D	94.9	Very high	90.5	Very high	26 Å²	26	65.7 Å²	65.7	14%	0.139	31%	0.313	C	S	.	.			trans	-73.6	116.5	178.7	-167.9	-20.8	0	0	0	110.4	I367 D372 F373 K880 H885	I367-D370 PolarHBondContact O-N 2.84Å; D370-D372 PolarHBondContact O-N 3.31Å; D370-D372 PolarHBondContact OD1-N 2.67Å; D370-F373 HydrophobicContact CB-CD2 3.69Å; D370-F373 HydrophobicContact CB-CE2 3.92Å; D370-F373 HydrophobicContact CB-CG 4.44Å; D370-F373 PolarHBondContact O-N 3.46Å; D370-F373 VanDerWaalsContact O-N 3.15Å; D370-K880 IonicContact OD1-NZ 2.68Å; D370-K880 PolarHBondContact OD1-NZ 3.27Å; D370-K880 WeakPolarHBondContact OD2-CE 3.29Å; D370-K880 IonicContact OD2-NZ 2.68Å; D370-K880 PolarHBondContact OD2-NZ 3.39Å; D370-H885 IonicContact OD2-CD2 2.69Å; D370-H885 IonicContact OD2-CE1 2.73Å; D370-H885 IonicContact OD2-NE2 3.18Å; D370-H885 PolarHBondContact OD2-NE2 2.92Å
371	K	93.2	Very high	90.5	Very high	179 Å²	179	65.9 Å²	65.9	78%	0.778	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-62.9	-29	-175.1	-66.4	-173.9	178	-175.5	0	112.8	W369 F373 F374	W369-K371 PolarHBondContact O-N 3.12Å; K371-F373 PolarHBondContact O-N 2.69Å; K371-F373 VanDerWaalsContact O-N 3.11Å; K371-F374 WeakPolarHBondContact O-CB 3.48Å; K371-F374 PolarHBondContact O-N 2.75Å
372	D	92.6	Very high	90.6	Very high	96 Å²	96	64 Å²	64	51%	0.513	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-73.6	-0.7	-179	-57	7.3	0	0	0	112.4	D370 H877 K880	D370-D372 PolarHBondContact O-N 3.31Å; D370-D372 PolarHBondContact OD1-N 2.67Å; D372-H877 PolarHBondContact O-CD2 3.01Å; D372-H877 PolarHBondContact O-NE2 2.64Å; D372-K880 HydrophobicContact CB-CD 3.9Å; D372-K880 IonicContact OD1-NZ 2.66Å; D372-K880 IonicContact OD2-NZ 2.74Å; D372-K880 PolarHBondContact OD2-NZ 3.16Å
373	F	93.8	Very high	90.5	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-104	1.7	169.1	-59.2	-35.6	0	0	0	113.6	I367 D370 K371 G381 A382 P873 H877 K880 L881 H885	I367-F373 HydrophobicContact CG2-CD2 4.35Å; I367-F373 HydrophobicContact CG2-CE2 4Å; I367-F373 WeakPolarHBondContact O-CD2 3.3Å; D370-F373 HydrophobicContact CB-CD2 3.69Å; D370-F373 HydrophobicContact CB-CE2 3.92Å; D370-F373 HydrophobicContact CB-CG 4.44Å; D370-F373 PolarHBondContact O-N 3.46Å; D370-F373 VanDerWaalsContact O-N 3.15Å; K371-F373 PolarHBondContact O-N 2.69Å; K371-F373 VanDerWaalsContact O-N 3.11Å; F373-G381 CarbonylContact O-C 3.57Å; F373-G381 WeakPolarHBondContact O-CA 3.34Å; F373-A382 HydrophobicContact CB-CB 3.65Å; F373-A382 HydrophobicContact CD2-CB 3.71Å; F373-A382 HydrophobicContact CG-CB 3.93Å; F373-A382 PolarHBondContact O-N 3.29Å; F373-P873 WeakPolarHBondContact O-CD 3.27Å; F373-P873 WeakPolarHBondContact O-CG 3.46Å; F373-H877 HydrophobicContact CD1-CB 3.6Å; F373-H877 AromaticContact CD1-CG 3.88Å; F373-H877 HydrophobicContact CE1-CB 3.93Å; F373-H877 WeakPolarHBondContact CE1-O 3.37Å; F373-K880 HydrophobicContact CE1-CB 3.95Å; F373-K880 HydrophobicContact CE1-CD 4.25Å; F373-K880 HydrophobicContact CE1-CG 4.23Å; F373-K880 HydrophobicContact CZ-CB 4.31Å; F373-K880 HydrophobicContact CZ-CD 4.41Å; F373-K880 HydrophobicContact CZ-CG 4.24Å; F373-L881 HydrophobicContact CE1-CB 4.39Å; F373-L881 HydrophobicContact CZ-CB 4.03Å; F373-L881 HydrophobicContact CZ-CD1 4.33Å; F373-H885 AromaticContact CE2-CD2 3.87Å; F373-H885 AromaticContact CE2-NE2 3.79Å; F373-H885 AromaticContact CZ-CD2 3.77Å
374	F	92.1	Very high	90.5	Very high	108 Å²	108	65.5 Å²	65.5	47%	0.474	32%	0.321	S	S	.	.			trans	-81.6	123.4	174.6	-176	-95.6	0	0	0	110.8	K371 Q379	K371-F374 WeakPolarHBondContact O-CB 3.48Å; K371-F374 PolarHBondContact O-N 2.75Å; F374-Q379 WeakPolarHBondContact CE2-O 3.49Å; F374-Q379 HydrophobicContact CZ-CB 4.46Å
375	D	88.8	Confident	90.1	Very high	5 Å²	5	67.7 Å²	67.7	3%	0.027	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-101.5	126.8	175.8	-176	91.3	0	0	0	111.3	E377 I378 Q379 E380 P873 K874	D375-E377 WeakPolarHBondContact OD2-CA 3.46Å; D375-E377 WeakPolarHBondContact OD2-CB 3.32Å; D375-E377 PolarHBondContact OD2-N 3.22Å; D375-I378 HydrophobicContact CB-CB 4.41Å; D375-I378 HydrophobicContact CB-CD1 4.31Å; D375-I378 PolarHBondContact OD2-N 3Å; D375-Q379 WeakPolarHBondContact O-CA 3.33Å; D375-Q379 PolarHBondContact O-N 3.17Å; D375-E380 PolarHBondContact N-O 2.92Å; D375-E380 VanDerWaalsContact N-O 3.13Å; D375-P873 HydrophobicContact CB-CB 3.52Å; D375-P873 HydrophobicContact CB-CG 3.57Å; D375-K874 WeakPolarHBondContact OD1-CE 3.3Å; D375-K874 WeakPolarHBondContact OD1-CG 3.26Å
376	P	88.1	Confident	89.7	Confident	99 Å²	99	66.1 Å²	66.1	64%	0.643	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-20.7	-175.8	31.6	-35.7	0	0	0	114
377	E	84.4	Confident	89.2	Confident	120 Å²	120	63.3 Å²	63.3	56%	0.561	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-42.3	176.3	-53	-176.4	153	0	0	110.8	D375 K874	D375-E377 WeakPolarHBondContact OD2-CA 3.46Å; D375-E377 WeakPolarHBondContact OD2-CB 3.32Å; D375-E377 PolarHBondContact OD2-N 3.22Å; E377-K874 IonicContact OE1-NZ 3.66Å; E377-K874 IonicContact OE2-NZ 3.58Å; E377-K874 PolarHBondContact OE2-NZ 3.34Å
378	I	80.5	Confident	88.8	Confident	47 Å²	47	65 Å²	65	24%	0.241	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-19.3	-176.3	-60.2	156.7	0	0	0	111.4	D375 E380 K857 P873	D375-I378 HydrophobicContact CB-CB 4.41Å; D375-I378 HydrophobicContact CB-CD1 4.31Å; D375-I378 PolarHBondContact OD2-N 3Å; I378-E380 HydrophobicContact CG2-CB 4.09Å; I378-E380 HydrophobicContact CG2-CG 4.26Å; I378-E380 PolarHBondContact O-N 2.85Å; I378-K857 VanDerWaalsContact CD1-O 3.28Å; I378-K857 WeakPolarHBondContact CD1-O 3.14Å; I378-P873 HydrophobicContact CD1-CB 3.73Å
379	Q	86.3	Confident	88.6	Confident	151 Å²	151	62.6 Å²	62.6	71%	0.706	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	27.7	-173.7	-57.2	-170.7	-10.3	0	0	114.1	F374 D375	F374-Q379 WeakPolarHBondContact CE2-O 3.49Å; F374-Q379 HydrophobicContact CZ-CB 4.46Å; D375-Q379 WeakPolarHBondContact O-CA 3.33Å; D375-Q379 PolarHBondContact O-N 3.17Å
380	E	84.8	Confident	88.6	Confident	54 Å²	54	54.4 Å²	54.4	25%	0.252	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-128.9	145	177.3	-66.8	-171.5	-161.1	0	0	112.7	D375 I378 K857 R862	D375-E380 PolarHBondContact N-O 2.92Å; D375-E380 VanDerWaalsContact N-O 3.13Å; I378-E380 HydrophobicContact CG2-CB 4.09Å; I378-E380 HydrophobicContact CG2-CG 4.26Å; I378-E380 PolarHBondContact O-N 2.85Å; E380-K857 HydrophobicContact CB-CD 4.34Å; E380-K857 WeakPolarHBondContact OE2-CE 3.47Å; E380-K857 IonicContact OE2-NZ 3.01Å; E380-K857 PolarHBondContact OE2-NZ 3.12Å; E380-R862 IonicContact OE1-CZ 2.68Å; E380-R862 IonicContact OE1-NH1 2.92Å; E380-R862 PolarHBondContact OE1-NH1 2.88Å; E380-R862 IonicContact OE1-NH2 2.74Å; E380-R862 PolarHBondContact OE1-NH2 3.07Å; E380-R862 IonicContact OE2-NH1 2.67Å
381	G	90	Very high	88.5	Confident	21 Å²	21	53.4 Å²	53.4	22%	0.216	27%	0.274	C	S	.	.			trans	-83.6	-173.7	169.3	0	0	0	0	0	114.1	F373 K857	F373-G381 CarbonylContact O-C 3.57Å; F373-G381 WeakPolarHBondContact O-CA 3.34Å; G381-K857 WeakPolarHBondContact O-CE 3.17Å; G381-K857 PolarHBondContact O-NZ 3.02Å
382	A	91.8	Very high	88.5	Confident	6 Å²	6	44.9 Å²	44.9	5%	0.05	24%	0.238	C	C	.	.			trans	-63.1	156.1	166.1	0	0	0	0	0	112.1	I367 F373 A871 I872	I367-A382 HydrophobicContact CG2-CB 4.38Å; F373-A382 HydrophobicContact CB-CB 3.65Å; F373-A382 HydrophobicContact CD2-CB 3.71Å; F373-A382 HydrophobicContact CG-CB 3.93Å; F373-A382 PolarHBondContact O-N 3.29Å; A382-A871 CarbonylContact C-O 3.59Å; A382-A871 VanDerWaalsContact CA-O 3.28Å; A382-A871 WeakPolarHBondContact CA-O 3.3Å; A382-I872 HydrophobicContact CB-CG2 4.41Å
383	L	89.4	Confident	88.6	Confident	72 Å²	72	40.3 Å²	40.3	38%	0.377	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	133.9	175.7	176.8	65.2	0	0	0	110.3	Y870 A871	L383-Y870 CarbonylContact O-C 3.58Å; L383-Y870 WeakPolarHBondContact O-CA 3.22Å; L383-A871 HydrophobicContact CB-CB 4.41Å; L383-A871 PolarHBondContact N-O 2.94Å; L383-A871 PolarHBondContact O-N 3.32Å
384	V	90.1	Very high	88.5	Confident	22 Å²	22	40.3 Å²	40.3	13%	0.133	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	113.3	172.9	-172	0	0	0	0	109.8	S364 I367 Y870	S364-V384 WeakPolarHBondContact O-CG2 3.13Å; I367-V384 HydrophobicContact CB-CG2 3.84Å; I367-V384 HydrophobicContact CD1-CG2 4.23Å; I367-V384 HydrophobicContact CG2-CG2 3.87Å; V384-Y870 HydrophobicContact CB-CD1 4.38Å; V384-Y870 HydrophobicContact CG1-CD1 3.95Å; V384-Y870 HydrophobicContact CG1-CE1 3.77Å; V384-Y870 HydrophobicContact CG2-CD1 4.05Å; V384-Y870 HydrophobicContact CG2-CE1 4.28Å
385	N	83.8	Confident	88.6	Confident	56 Å²	56	35.5 Å²	35.5	30%	0.299	19%	0.192	S	C	.	.	S	Bend	trans	-86.9	-29.3	176	-67	-35.4	0	0	0	112.5	V865 S868 D869	N385-V865 PolarHBondContact ND2-O 2.94Å; N385-S868 WeakPolarHBondContact CB-O 3.38Å; N385-S868 PolarHBondContact ND2-O 3.39Å; N385-D869 WeakPolarHBondContact CA-O 3.31Å; N385-D869 WeakPolarHBondContact CB-O 3.14Å; N385-D869 PolarHBondContact N-O 3.3Å
386	T	83.2	Confident	88.9	Confident	33 Å²	33	35.3 Å²	35.3	20%	0.202	19%	0.191	C	C	.	.			trans	-125.2	95.9	-176.2	-55.2	0	0	0	0	110.4	D388 L389 D869	T386-D388 PolarHBondContact O-N 3.2Å; T386-L389 HydrophobicContact CG2-CD1 3.73Å; T386-L389 HydrophobicContact CG2-CG 3.83Å; T386-D869 WeakPolarHBondContact CB-OD1 3.34Å; T386-D869 PolarHBondContact N-O 3.1Å; T386-D869 PolarHBondContact OG1-OD1 3.1Å
387	S	84.2	Confident	89.1	Confident	9 Å²	9	32.5 Å²	32.5	6%	0.063	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-65.5	-17.1	-178	63.5	0	0	0	0	114.6	K105 E109 L389	K105-S387 VanDerWaalsContact CE-OG 3.29Å; K105-S387 WeakPolarHBondContact CE-OG 3.3Å; K105-S387 PolarHBondContact NZ-OG 3.17Å; E109-S387 PolarHBondContact OE1-OG 3.17Å; S387-L389 PolarHBondContact O-N 2.83Å
388	D	85.2	Confident	89.5	Confident	37 Å²	37	27.4 Å²	27.4	20%	0.198	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-83.2	-0.2	-172.2	-73.3	-14.8	0	0	0	115	K105 K360 T386	K105-D388 IonicContact NZ-OD1 3.88Å; K105-D388 PolarHBondContact NZ-OD1 3.33Å; K360-D388 PolarHBondContact NZ-O 3.25Å; T386-D388 PolarHBondContact O-N 3.2Å
389	L	90.2	Very high	90.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-119.2	9.2	-168.7	-63.5	177.1	0	0	0	115.8	K275 T386 S387 E391 E392 D869 Y870	K275-L389 HydrophobicContact CB-CD1 4.05Å; K275-L389 HydrophobicContact CB-CD2 4.19Å; K275-L389 HydrophobicContact CD-CD1 4.14Å; T386-L389 HydrophobicContact CG2-CD1 3.73Å; T386-L389 HydrophobicContact CG2-CG 3.83Å; S387-L389 PolarHBondContact O-N 2.83Å; L389-E391 PolarHBondContact O-N 2.8Å; L389-E391 VanDerWaalsContact O-N 3.11Å; L389-E392 WeakPolarHBondContact O-CB 3.44Å; L389-E392 PolarHBondContact O-N 3.27Å; L389-D869 HydrophobicContact CD1-CB 4.08Å; L389-Y870 PolarHBondContact O-OH 2.82Å
390	N	92.6	Very high	90.8	Very high	1 Å²	1	18 Å²	18	1%	0.005	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-33.9	-171	-60.8	-9.7	0	0	0	113.6	K360 S364 Y870 Y889	K360-N390 PolarHBondContact O-ND2 3.33Å; S364-N390 PolarHBondContact N-ND2 3.4Å; N390-Y870 VanDerWaalsContact CA-OH 3.22Å; N390-Y870 WeakPolarHBondContact CA-OH 3.35Å; N390-Y870 PolarHBondContact N-OH 3.3Å; N390-Y870 VanDerWaalsContact N-OH 3.15Å; N390-Y870 PolarHBondContact OD1-OH 3.25Å; N390-Y889 HydrophobicContact CB-CD1 4.2Å; N390-Y889 HydrophobicContact CB-CD2 4.1Å; N390-Y889 HydrophobicContact CB-CG 3.93Å; N390-Y889 WeakPolarHBondContact O-CB 3.42Å
391	E	92.8	Very high	91.2	Very high	4 Å²	4	15.4 Å²	15.4	2%	0.019	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-20.3	179.8	77.3	-86.7	-144.5	0	0	114.4	S277 V279 K360 L389 L393 G394 I893	S277-E391 VanDerWaalsContact CB-OE1 3.31Å; S277-E391 WeakPolarHBondContact CB-OE1 3.24Å; S277-E391 WeakPolarHBondContact OG-CG 3.05Å; S277-E391 PolarHBondContact OG-OE1 2.82Å; S277-E391 VanDerWaalsContact OG-OE1 3.11Å; V279-E391 HydrophobicContact CB-CG 3.93Å; V279-E391 HydrophobicContact CG2-CG 3.66Å; K360-E391 VanDerWaalsContact CE-CD 3.44Å; K360-E391 WeakPolarHBondContact CE-OE1 3.49Å; K360-E391 WeakPolarHBondContact CE-OE2 3.5Å; K360-E391 IonicContact NZ-OE1 2.71Å; K360-E391 PolarHBondContact NZ-OE1 3.13Å; K360-E391 IonicContact NZ-OE2 3.75Å; K360-E391 PolarHBondContact NZ-OE2 3.42Å; L389-E391 PolarHBondContact O-N 2.8Å; L389-E391 VanDerWaalsContact O-N 3.11Å; E391-L393 VanDerWaalsContact C-N 3.25Å; E391-L393 PolarHBondContact O-N 3.31Å; E391-G394 PolarHBondContact O-N 2.95Å; E391-G394 VanDerWaalsContact O-N 3.12Å; E391-I893 HydrophobicContact CB-CD1 4.49Å; E391-I893 HydrophobicContact CB-CG2 3.57Å; E391-I893 HydrophobicContact CG-CD1 4.23Å; E391-I893 HydrophobicContact CG-CG2 3.97Å
392	E	93.6	Very high	91.2	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.005	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-71.8	-26.4	-177.5	-153.4	77.8	162.2	0	0	111	S277 A278 L389 G394 Q395 V396 I833 V852	S277-E392 VanDerWaalsContact CA-OE2 3.23Å; S277-E392 WeakPolarHBondContact CA-OE2 3.33Å; S277-E392 WeakPolarHBondContact CB-OE2 3.36Å; S277-E392 PolarHBondContact OG-OE2 3.29Å; A278-E392 VanDerWaalsContact N-CD 3.34Å; A278-E392 PolarHBondContact N-OE1 3.37Å; A278-E392 PolarHBondContact N-OE2 3.2Å; L389-E392 WeakPolarHBondContact O-CB 3.44Å; L389-E392 PolarHBondContact O-N 3.27Å; E392-G394 PolarHBondContact O-N 2.8Å; E392-Q395 PolarHBondContact O-N 2.86Å; E392-V396 PolarHBondContact O-N 3.31Å; E392-I833 HydrophobicContact CG-CG2 3.86Å; E392-V852 HydrophobicContact CB-CG2 3.9Å; E392-V852 HydrophobicContact CG-CG2 3.95Å
393	L	94.4	Very high	91	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-55.9	-31.8	169.1	-67.7	172.5	0	0	0	112.5	I367 E391 Q395 V852 Y870 L881 L882 Y965	I367-L393 HydrophobicContact CD1-CD1 4.45Å; E391-L393 VanDerWaalsContact C-N 3.25Å; E391-L393 PolarHBondContact O-N 3.31Å; L393-Q395 VanDerWaalsContact C-N 3.27Å; L393-Q395 PolarHBondContact O-N 3.23Å; L393-V852 HydrophobicContact CD2-CG1 3.97Å; L393-Y870 HydrophobicContact CD1-CE1 3.96Å; L393-Y870 HydrophobicContact CD1-CE2 4.07Å; L393-Y870 HydrophobicContact CD2-CD2 4.15Å; L393-Y870 HydrophobicContact CD2-CE2 3.8Å; L393-Y870 HydrophobicContact CG-CE2 3.98Å; L393-L881 HydrophobicContact CD1-CD1 3.82Å; L393-L881 HydrophobicContact CD1-CG 4.16Å; L393-L881 HydrophobicContact CD2-CG 4.34Å; L393-L882 HydrophobicContact CB-CD2 4.1Å; L393-L882 HydrophobicContact CD2-CD2 3.71Å; L393-L882 WeakPolarHBondContact O-CD2 3.49Å; L393-Y965 PolarHBondContact O-OH 2.98Å
394	G	93.1	Very high	90.7	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-83.3	5.7	176.9	0	0	0	0	0	114.5	E391 E392 G886 Y965 I968	E391-G394 PolarHBondContact O-N 2.95Å; E391-G394 VanDerWaalsContact O-N 3.12Å; E392-G394 PolarHBondContact O-N 2.8Å; G394-G886 VanDerWaalsContact CA-O 3.24Å; G394-G886 WeakPolarHBondContact CA-O 2.94Å; G394-Y965 VanDerWaalsContact C-OH 3.32Å; G394-I968 VanDerWaalsContact O-CD1 3.23Å; G394-I968 WeakPolarHBondContact O-CD1 3.44Å
395	Q	93.4	Very high	90.1	Very high	6 Å²	6	11.8 Å²	11.8	3%	0.028	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.2	-2.3	-174.5	-68.4	-65.4	-73.9	0	0	114.5	E392 L393 E397 I833 Y890 Y965 I968	E392-Q395 PolarHBondContact O-N 2.86Å; L393-Q395 VanDerWaalsContact C-N 3.27Å; L393-Q395 PolarHBondContact O-N 3.23Å; Q395-E397 PolarHBondContact O-N 2.72Å; Q395-I833 HydrophobicContact CB-CG1 4.09Å; Q395-I833 WeakPolarHBondContact O-CB 3.15Å; Q395-Y890 VanDerWaalsContact CD-CE2 3.49Å; Q395-Y890 HydrophobicContact CG-CD2 3.55Å; Q395-Y890 HydrophobicContact CG-CE2 3.81Å; Q395-Y890 HydrophobicContact CG-CG 4.26Å; Q395-Y965 PolarHBondContact N-OH 3.27Å; Q395-I968 PolarHBondContact NE2-O 3.06Å
396	V	94.6	Very high	90.3	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.006	5%	0.05	C	C	.	.			trans	-51.7	129.6	175.5	-179.5	0	0	0	0	111.3	E392 Y398 I399 I833 L835 L882 Y965	E392-V396 PolarHBondContact O-N 3.31Å; V396-Y398 WeakPolarHBondContact CG1-O 3.35Å; V396-I399 HydrophobicContact CG1-CG1 3.87Å; V396-I833 HydrophobicContact CG2-CG2 4.48Å; V396-L835 HydrophobicContact CB-CB 4.42Å; V396-L835 HydrophobicContact CG1-CB 3.54Å; V396-L835 HydrophobicContact CG1-CD1 4.36Å; V396-L835 HydrophobicContact CG2-CB 3.92Å; V396-L835 HydrophobicContact CG2-CD1 3.85Å; V396-L882 HydrophobicContact CG2-CD2 4.16Å; V396-Y965 PolarHBondContact N-OH 3.41Å; V396-Y965 WeakPolarHBondContact O-CE1 3.07Å; V396-Y965 PolarHBondContact O-OH 2.97Å
397	E	91.9	Very high	90.6	Very high	40 Å²	40	7.6 Å²	7.6	19%	0.187	4%	0.04	C	C	.	.			trans	-112.6	-30.9	171.8	-73.9	-169.5	-135.1	0	0	112.8	Q395 M689 K690 P832 I833 K970	Q395-E397 PolarHBondContact O-N 2.72Å; E397-M689 WeakPolarHBondContact O-CA 3.25Å; E397-K690 PolarHBondContact O-N 3.26Å; E397-P832 HydrophobicContact CB-CB 4.4Å; E397-I833 PolarHBondContact N-O 3.42Å; E397-K970 WeakPolarHBondContact OE1-CE 3.22Å; E397-K970 WeakPolarHBondContact OE1-CG 3.34Å; E397-K970 WeakPolarHBondContact OE2-CE 3.2Å; E397-K970 IonicContact OE2-NZ 2.78Å; E397-K970 PolarHBondContact OE2-NZ 2.83Å; E397-K970 VanDerWaalsContact OE2-NZ 3.17Å
398	Y	94.3	Very high	90.7	Very high	13 Å²	13	7.2 Å²	7.2	5%	0.051	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.7	179.4	-67.4	-103.9	0	0	0	110	V396 K690 W692 V825 P832 I833 L835	V396-Y398 WeakPolarHBondContact CG1-O 3.35Å; Y398-K690 WeakPolarHBondContact CA-O 3.49Å; Y398-K690 HydrophobicContact CD1-CB 4.05Å; Y398-K690 HydrophobicContact CD1-CD 4.32Å; Y398-K690 HydrophobicContact CE1-CB 4.2Å; Y398-K690 HydrophobicContact CE1-CD 3.64Å; Y398-K690 PolarHBondContact OH-NZ 3.4Å; Y398-W692 AromaticContact CD1-CE2 3.9Å; Y398-W692 HydrophobicContact CD1-CZ2 4.13Å; Y398-W692 AromaticContact CD1-NE1 3.72Å; Y398-W692 AromaticContact CE1-CE2 3.99Å; Y398-W692 AromaticContact CE1-CZ2 3.85Å; Y398-W692 HydrophobicContact CE1-CZ2 3.85Å; Y398-W692 AromaticContact CE1-NE1 3.85Å; Y398-V825 HydrophobicContact CD1-CG1 3.97Å; Y398-V825 HydrophobicContact CD2-CG1 4.14Å; Y398-V825 HydrophobicContact CE1-CG1 4.18Å; Y398-V825 HydrophobicContact CE2-CG1 4.37Å; Y398-V825 HydrophobicContact CG-CG1 3.97Å; Y398-P832 HydrophobicContact CD2-CB 3.78Å; Y398-P832 HydrophobicContact CD2-CG 4.2Å; Y398-P832 HydrophobicContact CE2-CB 3.68Å; Y398-P832 HydrophobicContact CE2-CG 4Å; Y398-I833 PolarHBondContact N-O 3.32Å; Y398-L835 PolarHBondContact O-N 3.07Å
399	I	96.3	Very high	90.6	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.04	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	121.3	172.9	-65.1	178.7	0	0	0	107.9	V396 L684 M689 K690 V691 W692 L835 I837 L882	V396-I399 HydrophobicContact CG1-CG1 3.87Å; I399-L684 HydrophobicContact CD1-CB 4.48Å; I399-L684 HydrophobicContact CD1-CD1 3.94Å; I399-L684 HydrophobicContact CD1-CD2 4.21Å; I399-L684 HydrophobicContact CD1-CG 4.44Å; I399-M689 HydrophobicContact CD1-SD 3.62Å; I399-M689 HydrophobicContact CG1-SD 4.36Å; I399-K690 PolarHBondContact N-O 3.07Å; I399-V691 HydrophobicContact CB-CG2 4.46Å; I399-V691 CarbonylContact O-C 3.57Å; I399-V691 WeakPolarHBondContact O-CA 3.39Å; I399-W692 PolarHBondContact O-N 3.49Å; I399-L835 CarbonylContact C-O 3.54Å; I399-L835 WeakPolarHBondContact CA-O 3.39Å; I399-L835 HydrophobicContact CB-CD2 4.48Å; I399-L835 HydrophobicContact CG1-CB 4.35Å; I399-L835 HydrophobicContact CG1-CD2 4.18Å; I399-L835 HydrophobicContact CG2-CD2 3.98Å; I399-I837 HydrophobicContact CG2-CG2 4.33Å; I399-L882 HydrophobicContact CD1-CD1 3.79Å
400	F	96.4	Very high	89.9	Confident	0 Å²	0	9 Å²	9	0%	0	5%	0.046	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.9	169.3	-57	-78.8	0	0	0	109.4	W692 L694 I821 V822 V825 T834 L835 S836 I837 M846	F400-W692 WeakPolarHBondContact CA-O 3.35Å; F400-W692 HydrophobicContact CD1-CB 3.74Å; F400-W692 HydrophobicContact CD1-CD2 4.45Å; F400-W692 HydrophobicContact CD1-CE3 4.3Å; F400-W692 HydrophobicContact CD1-CG 4.31Å; F400-W692 HydrophobicContact CE1-CB 4.01Å; F400-W692 AromaticContact CE1-CD2 3.82Å; F400-W692 HydrophobicContact CE1-CD2 3.82Å; F400-W692 AromaticContact CE1-CE3 3.56Å; F400-W692 HydrophobicContact CE1-CE3 3.56Å; F400-W692 HydrophobicContact CE1-CG 4.08Å; F400-W692 HydrophobicContact CE1-CZ3 4.21Å; F400-L694 HydrophobicContact CB-CD1 4.06Å; F400-L694 HydrophobicContact CB-CG 4.42Å; F400-L694 HydrophobicContact CD1-CD1 3.64Å; F400-L694 HydrophobicContact CD1-CD2 4.43Å; F400-L694 HydrophobicContact CD1-CG 4.06Å; F400-L694 HydrophobicContact CE1-CD1 4.47Å; F400-L694 HydrophobicContact CG-CD1 4.13Å; F400-I821 HydrophobicContact CD1-CG2 4.24Å; F400-I821 HydrophobicContact CE1-CG2 3.76Å; F400-V822 HydrophobicContact CB-CG2 4.3Å; F400-V822 HydrophobicContact CD1-CG2 4.35Å; F400-V822 HydrophobicContact CD2-CB 4.42Å; F400-V822 HydrophobicContact CD2-CG1 4.34Å; F400-V822 HydrophobicContact CD2-CG2 3.63Å; F400-V822 HydrophobicContact CE2-CB 4.35Å; F400-V822 HydrophobicContact CE2-CG1 4.24Å; F400-V822 HydrophobicContact CE2-CG2 3.99Å; F400-V822 HydrophobicContact CG-CG2 3.83Å; F400-V822 HydrophobicContact CZ-CG2 4.49Å; F400-V825 HydrophobicContact CE1-CG2 4.37Å; F400-V825 HydrophobicContact CZ-CB 3.85Å; F400-V825 HydrophobicContact CZ-CG1 4.05Å; F400-V825 HydrophobicContact CZ-CG2 3.92Å; F400-T834 HydrophobicContact CE2-CG2 3.74Å; F400-T834 HydrophobicContact CZ-CG2 4.43Å; F400-L835 WeakPolarHBondContact CD2-O 3.49Å; F400-L835 PolarHBondContact N-O 3.48Å; F400-S836 CarbonylContact O-C 3.59Å; F400-S836 WeakPolarHBondContact O-CA 3.21Å; F400-I837 PolarHBondContact O-N 3.17Å; F400-M846 HydrophobicContact CB-SD 3.81Å
401	T	94.3	Very high	89.4	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.8	-178.8	-172.6	0	0	0	0	110	T406 L407 V691 W692 V693 L694	T401-T406 WeakPolarHBondContact OG1-CG2 3.27Å; T401-L407 HydrophobicContact CG2-CD1 4.36Å; T401-L407 HydrophobicContact CG2-CD2 4.34Å; T401-L407 HydrophobicContact CG2-CG 4.43Å; T401-V691 HydrophobicContact CG2-CG1 3.91Å; T401-W692 PolarHBondContact N-O 3.12Å; T401-V693 HydrophobicContact CG2-CB 4.36Å; T401-V693 HydrophobicContact CG2-CG2 3.87Å; T401-V693 CarbonylContact O-C 3.59Å; T401-V693 WeakPolarHBondContact O-CA 3.46Å; T401-L694 PolarHBondContact O-N 2.91Å
402	D	90.2	Very high	88.9	Confident	16 Å²	16	12.5 Å²	12.5	9%	0.086	6%	0.064	C	C	.	.			trans	-75.9	164.7	157.1	-155.6	-12.3	0	0	0	109.7	T695 K818 I837 D843	D402-T695 VanDerWaalsContact OD1-CA 3.25Å; D402-T695 WeakPolarHBondContact OD1-CA 3.38Å; D402-T695 WeakPolarHBondContact OD1-CB 3.39Å; D402-T695 PolarHBondContact OD1-OG1 3.41Å; D402-K818 IonicContact OD1-NZ 2.68Å; D402-K818 IonicContact OD2-NZ 2.68Å; D402-K818 PolarHBondContact OD2-NZ 3.11Å; D402-I837 PolarHBondContact N-O 2.62Å; D402-D843 WeakPolarHBondContact CB-OD2 3.38Å
403	K	87.9	Confident	88.6	Confident	1 Å²	1	15.4 Å²	15.4	0%	0.004	8%	0.078	C	C	.	.	S	Bend	trans	-85.1	-56.5	172.9	-171.4	-117	63.4	-177.1	0	110.9	L407 T408 D671 V693 T695 D697 T705	K403-L407 HydrophobicContact CG-CD1 4.46Å; K403-L407 WeakPolarHBondContact O-CA 3.03Å; K403-L407 WeakPolarHBondContact O-CB 3.42Å; K403-L407 PolarHBondContact O-N 3.07Å; K403-T408 HydrophobicContact CD-CG2 4.42Å; K403-T408 PolarHBondContact O-N 3.49Å; K403-T408 VanDerWaalsContact O-N 3.08Å; K403-D671 IonicContact NZ-OD2 2.75Å; K403-D671 PolarHBondContact NZ-OD2 2.9Å; K403-V693 HydrophobicContact CB-CG1 4.14Å; K403-T695 HydrophobicContact CB-CG2 4.32Å; K403-D697 WeakPolarHBondContact CE-OD2 3.43Å; K403-D697 IonicContact NZ-OD2 3.13Å; K403-D697 PolarHBondContact NZ-OD2 3.13Å; K403-T705 HydrophobicContact CD-CG2 4.23Å; K403-T705 HydrophobicContact CG-CG2 3.74Å
404	T	81.8	Confident	88.3	Confident	26 Å²	26	15.7 Å²	15.7	16%	0.16	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	139.6	-173.9	-55.9	0	0	0	0	109.6	T406	T404-T406 PolarHBondContact O-N 2.82Å
405	G	78.9	Confident	88	Confident	3 Å²	3	17.3 Å²	17.3	3%	0.031	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	69	-19.1	177.9	0	0	0	0	0	115.7	T408 Q674 D839	G405-T408 CarbonylContact C-O 3.47Å; G405-T408 WeakPolarHBondContact CA-O 3.39Å; G405-T408 PolarHBondContact N-OG1 2.76Å; G405-Q674 PolarHBondContact O-NE2 3.03Å; G405-D839 VanDerWaalsContact CA-OD2 3.25Å; G405-D839 WeakPolarHBondContact CA-OD2 3.18Å
406	T	86.9	Confident	87.9	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-52.7	-176.1	-69.2	0	0	0	0	113.3	T401 T404 Q674 I837 G838 D839 I856 L875	T401-T406 WeakPolarHBondContact OG1-CG2 3.27Å; T404-T406 PolarHBondContact O-N 2.82Å; T406-Q674 PolarHBondContact O-NE2 2.9Å; T406-I837 HydrophobicContact CG2-CG1 4.23Å; T406-I837 HydrophobicContact CG2-CG2 4.14Å; T406-G838 WeakPolarHBondContact OG1-CA 3.26Å; T406-D839 PolarHBondContact OG1-OD1 2.9Å; T406-I856 HydrophobicContact CG2-CD1 3.83Å; T406-L875 WeakPolarHBondContact O-CD2 3.39Å
407	L	89.7	Confident	87.7	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-32.2	167.9	-63.6	179.4	0	0	0	111.4	T401 K403 L673 Q674 M681 V693 T705 L875	T401-L407 HydrophobicContact CG2-CD1 4.36Å; T401-L407 HydrophobicContact CG2-CD2 4.34Å; T401-L407 HydrophobicContact CG2-CG 4.43Å; K403-L407 HydrophobicContact CG-CD1 4.46Å; K403-L407 WeakPolarHBondContact O-CA 3.03Å; K403-L407 WeakPolarHBondContact O-CB 3.42Å; K403-L407 PolarHBondContact O-N 3.07Å; L407-L673 WeakPolarHBondContact O-CA 3.23Å; L407-Q674 PolarHBondContact O-N 2.79Å; L407-M681 HydrophobicContact CD2-CE 3.79Å; L407-M681 HydrophobicContact CD2-CG 4.37Å; L407-V693 HydrophobicContact CD1-CG1 4.36Å; L407-V693 HydrophobicContact CD1-CG2 4.25Å; L407-T705 HydrophobicContact CB-CG2 4.44Å; L407-T705 HydrophobicContact CD1-CG2 4.39Å; L407-L875 HydrophobicContact CD2-CD2 3.78Å
408	T	87.4	Confident	87.6	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.006	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	165	176.6	76.1	0	0	0	0	112.1	K403 G405 N410 D671 Q672 L673 Q674 T705	K403-T408 HydrophobicContact CD-CG2 4.42Å; K403-T408 PolarHBondContact O-N 3.49Å; K403-T408 VanDerWaalsContact O-N 3.08Å; G405-T408 CarbonylContact C-O 3.47Å; G405-T408 WeakPolarHBondContact CA-O 3.39Å; G405-T408 PolarHBondContact N-OG1 2.76Å; T408-N410 VanDerWaalsContact C-N 3.34Å; T408-D671 WeakPolarHBondContact CB-OD1 3.49Å; T408-D671 HydrophobicContact CG2-CB 4.49Å; T408-D671 WeakPolarHBondContact CG2-O 3.32Å; T408-D671 PolarHBondContact OG1-OD1 3.47Å; T408-Q672 CarbonylContact C-O 3.56Å; T408-Q672 WeakPolarHBondContact CA-O 3.35Å; T408-Q672 VanDerWaalsContact CB-O 3.27Å; T408-Q672 WeakPolarHBondContact CB-O 3.37Å; T408-L673 HydrophobicContact CG2-CD2 4.36Å; T408-Q674 WeakPolarHBondContact O-CG 3.32Å; T408-Q674 PolarHBondContact O-NE2 3.35Å; T408-Q674 VanDerWaalsContact O-NE2 3.12Å; T408-T705 HydrophobicContact CG2-CG2 4.36Å
409	Q	82.1	Confident	87.4	Confident	51 Å²	51	14.9 Å²	14.9	24%	0.238	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-4.7	177.1	-47.8	-149.7	26.1	0	0	113.1	N411 Q672 L673 Q674 D675	Q409-N411 HydrophobicContact CB-CB 4.31Å; Q409-N411 PolarHBondContact O-N 2.99Å; Q409-N411 VanDerWaalsContact O-N 3.16Å; Q409-Q672 PolarHBondContact N-O 3.39Å; Q409-L673 WeakPolarHBondContact CG-O 3.27Å; Q409-L673 PolarHBondContact NE2-O 2.83Å; Q409-Q674 HydrophobicContact CG-CB 4.5Å; Q409-Q674 HydrophobicContact CG-CG 4.2Å; Q409-D675 PolarHBondContact NE2-OD1 3.11Å; Q409-D675 VanDerWaalsContact NE2-OD1 3.11Å
410	N	75.8	Confident	87	Confident	26 Å²	26	16.3 Å²	16.3	14%	0.139	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.5	21.7	-166.7	-154.1	32.5	0	0	0	113.6	T408 M412 E860	T408-N410 VanDerWaalsContact C-N 3.34Å; N410-M412 HydrophobicContact CB-CE 4.49Å; N410-M412 WeakPolarHBondContact OD1-CE 3.46Å; N410-E860 VanDerWaalsContact ND2-CD 3.3Å; N410-E860 PolarHBondContact ND2-OE1 3.24Å; N410-E860 PolarHBondContact ND2-OE2 3.02Å
411	N	81.3	Confident	86.3	Confident	64 Å²	64	17.4 Å²	17.4	34%	0.342	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	113.2	170.3	-176.4	44.3	0	0	0	108.5	Q409 E413 Q672	Q409-N411 HydrophobicContact CB-CB 4.31Å; Q409-N411 PolarHBondContact O-N 2.99Å; Q409-N411 VanDerWaalsContact O-N 3.16Å; N411-E413 PolarHBondContact ND2-OE1 2.82Å; N411-E413 VanDerWaalsContact ND2-OE1 3.1Å; N411-Q672 PolarHBondContact ND2-OE1 3.4Å; N411-Q672 PolarHBondContact O-N 2.83Å
412	M	83.4	Confident	85.9	Confident	14 Å²	14	20.3 Å²	20.3	7%	0.069	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.4	-177.2	-62	-54.1	145.5	0	0	110.8	N410 P517 A521 R615 V669 E670 D671	N410-M412 HydrophobicContact CB-CE 4.49Å; N410-M412 WeakPolarHBondContact OD1-CE 3.46Å; M412-P517 HydrophobicContact CB-CB 4.37Å; M412-P517 HydrophobicContact CE-CG 4.35Å; M412-P517 HydrophobicContact CG-CB 3.76Å; M412-P517 HydrophobicContact CG-CG 3.84Å; M412-A521 HydrophobicContact CB-CB 3.7Å; M412-A521 WeakPolarHBondContact O-CB 3.49Å; M412-R615 VanDerWaalsContact SD-CZ 3.59Å; M412-V669 HydrophobicContact CB-CG1 3.74Å; M412-V669 HydrophobicContact CG-CG1 4.35Å; M412-V669 HydrophobicContact SD-CG1 4.25Å; M412-E670 WeakPolarHBondContact CA-O 3.45Å; M412-D671 HydrophobicContact CE-CB 4.07Å; M412-D671 WeakPolarHBondContact CE-OD1 3.42Å; M412-D671 HydrophobicContact SD-CB 3.88Å
413	E	86.2	Confident	85.6	Confident	62 Å²	62	22.9 Å²	22.9	29%	0.29	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.6	177.6	-68	-160.2	-156.3	0	0	112.9	N411 I415 V669 E670 Q672	N411-E413 PolarHBondContact ND2-OE1 2.82Å; N411-E413 VanDerWaalsContact ND2-OE1 3.1Å; E413-I415 HydrophobicContact CB-CD1 4.2Å; E413-I415 PolarHBondContact O-N 2.85Å; E413-V669 CarbonylContact O-C 3.6Å; E413-V669 VanDerWaalsContact O-CA 3.27Å; E413-V669 WeakPolarHBondContact O-CA 3.28Å; E413-E670 PolarHBondContact N-O 3.07Å; E413-E670 PolarHBondContact O-N 3.34Å; E413-Q672 PolarHBondContact OE1-NE2 3.13Å
414	F	88.9	Confident	85.4	Confident	6 Å²	6	24 Å²	24	3%	0.026	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	111.6	176.5	-169.5	-73.1	0	0	0	109.6	C417 L462 L522 Y529 T667	F414-C417 HydrophobicContact CE1-CB 4.3Å; F414-C417 HydrophobicContact CZ-CB 3.82Å; F414-L462 HydrophobicContact CE2-CD1 4.08Å; F414-L462 HydrophobicContact CZ-CD1 4.49Å; F414-L522 HydrophobicContact CD2-CD2 3.98Å; F414-L522 HydrophobicContact CE2-CD2 3.91Å; F414-Y529 HydrophobicContact CD1-CE2 4.39Å; F414-Y529 HydrophobicContact CE1-CD2 4.5Å; F414-Y529 AromaticContact CE1-CE2 3.79Å; F414-Y529 HydrophobicContact CE1-CE2 3.79Å; F414-T667 HydrophobicContact CE2-CG2 3.7Å; F414-T667 HydrophobicContact CZ-CG2 4.07Å
415	I	87.4	Confident	85.2	Confident	33 Å²	33	27.2 Å²	27.2	17%	0.169	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-50.2	-176.5	-55	-53.2	0	0	0	111.4	E413 H426 Y614 A668 E670	E413-I415 HydrophobicContact CB-CD1 4.2Å; E413-I415 PolarHBondContact O-N 2.85Å; I415-H426 VanDerWaalsContact O-CB 3.28Å; I415-H426 WeakPolarHBondContact O-CB 3.18Å; I415-H426 PolarHBondContact O-N 2.97Å; I415-Y614 HydrophobicContact CB-CE1 4.48Å; I415-Y614 HydrophobicContact CG1-CD1 4.44Å; I415-Y614 HydrophobicContact CG1-CE1 4.1Å; I415-Y614 HydrophobicContact CG2-CE1 4.42Å; I415-A668 PolarHBondContact N-O 2.64Å; I415-E670 HydrophobicContact CD1-CB 4.12Å; I415-E670 HydrophobicContact CG1-CB 3.64Å
416	E	89.4	Confident	84.2	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	166.9	-179.3	69.3	161.7	-115.3	0	0	113.8	Q423 Y424 K425 R608 N609 A668	E416-Q423 PolarHBondContact OE1-NE2 3.02Å; E416-Q423 PolarHBondContact OE2-NE2 3Å; E416-Y424 VanDerWaalsContact CA-O 3.25Å; E416-Y424 WeakPolarHBondContact CA-O 3.24Å; E416-Y424 VanDerWaalsContact CB-O 3.25Å; E416-Y424 WeakPolarHBondContact CB-O 3.41Å; E416-K425 HydrophobicContact CB-CG 4.2Å; E416-K425 WeakPolarHBondContact OE2-CE 3.46Å; E416-K425 WeakPolarHBondContact OE2-CG 3.07Å; E416-R608 IonicContact OE1-NH2 3.56Å; E416-R608 PolarHBondContact OE1-NH2 3.02Å; E416-R608 IonicContact OE2-NH2 3.24Å; E416-N609 PolarHBondContact OE1-ND2 2.82Å; E416-N609 PolarHBondContact OE1-OD1 3.46Å; E416-A668 HydrophobicContact CG-CB 3.72Å; E416-A668 PolarHBondContact O-N 3.3Å
417	C	90.4	Very high	82.5	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.02	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	160.6	167.3	56.6	0	0	0	0	112.4	F414 Y424 F458 A666 T667	F414-C417 HydrophobicContact CE1-CB 4.3Å; F414-C417 HydrophobicContact CZ-CB 3.82Å; C417-Y424 PolarHBondContact N-O 3.46Å; C417-Y424 VanDerWaalsContact N-O 3.07Å; C417-Y424 PolarHBondContact O-N 3.39Å; C417-F458 HydrophobicContact CB-CE1 3.88Å; C417-F458 HydrophobicContact CB-CZ 3.93Å; C417-A666 CarbonylContact C-O 3.54Å; C417-A666 VanDerWaalsContact CA-O 3.29Å; C417-A666 WeakPolarHBondContact CA-O 3.43Å; C417-A666 VanDerWaalsContact CB-O 3.31Å; C417-A666 WeakPolarHBondContact CB-O 3.25Å; C417-T667 HydrophobicContact CB-CG2 4.2Å
418	C	90.6	Very high	80.2	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.02	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124	171.1	178.4	0	0	0	0	108.8	G421 F422 H605 G665 A666	C418-G421 VanDerWaalsContact SG-CA 3.55Å; C418-F422 CarbonylContact C-O 3.54Å; C418-F422 VanDerWaalsContact CA-O 3.27Å; C418-F422 WeakPolarHBondContact CA-O 3.25Å; C418-H605 HydrophobicContact CB-CB 4.01Å; C418-G665 CarbonylContact O-C 3.48Å; C418-G665 WeakPolarHBondContact O-CA 3.43Å; C418-A666 PolarHBondContact N-O 3.32Å; C418-A666 PolarHBondContact O-N 3.49Å
419	I	90.8	Very high	77.8	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.015	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.3	-177.6	-51.2	176.1	0	0	0	107.8	G421 F422 Y424 A450 E455 F458 I664	I419-G421 PolarHBondContact O-N 3.06Å; I419-F422 PolarHBondContact N-O 3.37Å; I419-F422 PolarHBondContact O-N 3.01Å; I419-Y424 HydrophobicContact CB-CE2 4Å; I419-Y424 HydrophobicContact CD1-CD2 4.17Å; I419-Y424 HydrophobicContact CD1-CE2 3.97Å; I419-Y424 HydrophobicContact CG1-CD2 4.21Å; I419-Y424 HydrophobicContact CG1-CE2 4.08Å; I419-A450 HydrophobicContact CB-CB 4.22Å; I419-A450 HydrophobicContact CG2-CB 3.9Å; I419-E455 HydrophobicContact CD1-CG 4.21Å; I419-F458 HydrophobicContact CD1-CB 4.15Å; I419-F458 HydrophobicContact CD1-CD1 3.45Å; I419-F458 VanDerWaalsContact CD1-CD1 3.45Å; I419-F458 HydrophobicContact CD1-CE1 3.91Å; I419-F458 HydrophobicContact CD1-CG 3.88Å; I419-F458 HydrophobicContact CG1-CB 4.48Å; I419-F458 HydrophobicContact CG1-CD1 3.75Å; I419-F458 HydrophobicContact CG1-CD2 4.27Å; I419-F458 HydrophobicContact CG1-CE1 3.89Å; I419-F458 HydrophobicContact CG1-CE2 4.4Å; I419-F458 HydrophobicContact CG1-CG 3.93Å; I419-F458 HydrophobicContact CG1-CZ 4.2Å; I419-F458 HydrophobicContact CG2-CB 4.23Å; I419-F458 HydrophobicContact CG2-CG 4.41Å; I419-I664 HydrophobicContact CG2-CG2 4.45Å
420	D	86.1	Confident	75.6	Confident	30 Å²	30	48.2 Å²	48.2	16%	0.16	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	50	26.5	-174.9	-156.3	20.1	0	0	0	115.3	A450 R454 R601 I664	D420-A450 HydrophobicContact CB-CB 4.46Å; D420-R454 IonicContact OD1-CZ 3.3Å; D420-R454 IonicContact OD1-NH1 2.69Å; D420-R454 PolarHBondContact OD1-NH1 3.2Å; D420-R454 WeakPolarHBondContact OD2-CD 3.43Å; D420-R454 IonicContact OD2-CZ 2.73Å; D420-R454 IonicContact OD2-NE 2.74Å; D420-R454 PolarHBondContact OD2-NE 3.01Å; D420-R454 IonicContact OD2-NH1 3.78Å; D420-R454 PolarHBondContact OD2-NH1 3.27Å; D420-R454 IonicContact OD2-NH2 3.91Å; D420-R601 IonicContact OD1-CZ 2.7Å; D420-R601 IonicContact OD1-NH1 3.52Å; D420-R601 PolarHBondContact OD1-NH1 3.25Å; D420-I664 PolarHBondContact N-O 2.67Å
421	G	82.4	Confident	73.4	Confident	22 Å²	22	52.5 Å²	52.5	23%	0.227	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-0.6	-176.1	0	0	0	0	0	115.5	C418 I419	C418-G421 VanDerWaalsContact SG-CA 3.55Å; I419-G421 PolarHBondContact O-N 3.06Å
422	F	85.9	Confident	71.3	Confident	62 Å²	62	57.5 Å²	57.5	27%	0.272	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	131.3	177.4	-57	-74.6	0	0	0	111.5	C418 I419 Y424 Q448 A450	C418-F422 CarbonylContact C-O 3.54Å; C418-F422 VanDerWaalsContact CA-O 3.27Å; C418-F422 WeakPolarHBondContact CA-O 3.25Å; I419-F422 PolarHBondContact N-O 3.37Å; I419-F422 PolarHBondContact O-N 3.01Å; F422-Y424 HydrophobicContact CB-CE2 4.08Å; F422-Y424 VanDerWaalsContact O-CD2 3.29Å; F422-Y424 WeakPolarHBondContact O-CD2 3.33Å; F422-Y424 WeakPolarHBondContact O-CE2 3.27Å; F422-Q448 HydrophobicContact CD1-CB 3.93Å; F422-Q448 WeakPolarHBondContact CD1-O 3.42Å; F422-Q448 HydrophobicContact CE1-CB 3.44Å; F422-Q448 VanDerWaalsContact CE1-CB 3.44Å; F422-Q448 HydrophobicContact CZ-CB 4.21Å; F422-A450 HydrophobicContact CD2-CB 4Å
423	Q	84.7	Confident	69.2	Low	70 Å²	70	64.7 Å²	64.7	33%	0.327	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	140.1	-176	-176.3	178.3	-7.6	0	0	112.5	E416 K425 R608	E416-Q423 PolarHBondContact OE1-NE2 3.02Å; E416-Q423 PolarHBondContact OE2-NE2 3Å; Q423-K425 HydrophobicContact CG-CG 4.5Å; Q423-R608 VanDerWaalsContact CD-NH2 3.26Å
424	Y	82.9	Confident	66.4	Low	23 Å²	23	70 Å²	70	9%	0.09	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	104.2	178.5	-63.9	-109.6	0	0	0	108.9	E416 C417 I419 F422 A450	E416-Y424 VanDerWaalsContact CA-O 3.25Å; E416-Y424 WeakPolarHBondContact CA-O 3.24Å; E416-Y424 VanDerWaalsContact CB-O 3.25Å; E416-Y424 WeakPolarHBondContact CB-O 3.41Å; C417-Y424 PolarHBondContact N-O 3.46Å; C417-Y424 VanDerWaalsContact N-O 3.07Å; C417-Y424 PolarHBondContact O-N 3.39Å; I419-Y424 HydrophobicContact CB-CE2 4Å; I419-Y424 HydrophobicContact CD1-CD2 4.17Å; I419-Y424 HydrophobicContact CD1-CE2 3.97Å; I419-Y424 HydrophobicContact CG1-CD2 4.21Å; I419-Y424 HydrophobicContact CG1-CE2 4.08Å; F422-Y424 HydrophobicContact CB-CE2 4.08Å; F422-Y424 VanDerWaalsContact O-CD2 3.29Å; F422-Y424 WeakPolarHBondContact O-CD2 3.33Å; F422-Y424 WeakPolarHBondContact O-CE2 3.27Å; Y424-A450 PolarHBondContact OH-N 3.47Å; Y424-A450 VanDerWaalsContact OH-N 3.08Å
425	K	76.9	Confident	63.7	Low	95 Å²	95	72.5 Å²	72.5	41%	0.413	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	147.3	176.1	-76.6	-158	174.3	-157.3	0	112.3	E416 Q423 G427	E416-K425 HydrophobicContact CB-CG 4.2Å; E416-K425 WeakPolarHBondContact OE2-CE 3.46Å; E416-K425 WeakPolarHBondContact OE2-CG 3.07Å; Q423-K425 HydrophobicContact CG-CG 4.5Å; K425-G427 PolarHBondContact O-N 2.85Å
426	H	58.2	Low	61	Low	117 Å²	117	80.3 Å²	80.3	54%	0.542	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	116.5	161	-170.3	54.2	0	0	0	109.6	I415	I415-H426 VanDerWaalsContact O-CB 3.28Å; I415-H426 WeakPolarHBondContact O-CB 3.18Å; I415-H426 PolarHBondContact O-N 2.97Å
427	G	51.4	Low	58.2	Low	56 Å²	56	85.9 Å²	85.9	58%	0.577	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	143	-30.3	174.4	0	0	0	0	0	115.8	K425 G429	K425-G427 PolarHBondContact O-N 2.85Å; G427-G429 PolarHBondContact O-N 3.38Å
428	D	42.1	Very low	55.4	Low	133 Å²	133	92.4 Å²	92.4	71%	0.711	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	45.1	-172.7	-65.9	-22	0	0	0	114.2
429	G	37.7	Very low	52.8	Low	75 Å²	75	97.3 Å²	97.3	77%	0.773	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-36.7	166.3	0	0	0	0	0	113	G427	G427-G429 PolarHBondContact O-N 3.38Å
430	S	36	Very low	49.9	Very low	115 Å²	115	105.8 Å²	105.8	80%	0.804	62%	0.62	S	S	*	*	S	Bend	trans	-167.4	77.6	-176.5	60.9	0	0	0	0	114.8
431	S	27.6	Very low	47.4	Very low	115 Å²	115	106.7 Å²	106.7	80%	0.804	64%	0.636	S	S	*	*			trans	-159.5	141.7	144.4	-167	0	0	0	0	110.3
432	E	37.6	Very low	45.3	Very low	169 Å²	169	112.1 Å²	112.1	79%	0.79	67%	0.667	S	S	*	*			trans	-82.2	162.6	164.9	-61.8	-177.5	124.2	0	0	110.4
433	L	39.4	Very low	42.7	Very low	165 Å²	165	114 Å²	114	86%	0.864	68%	0.684	S	S	*	*			trans	53.4	93	157.1	-68.4	158.4	0	0	0	117.5
434	D	26.9	Very low	40.3	Very low	174 Å²	174	119.3 Å²	119.3	93%	0.93	71%	0.714	S	S	*	*			trans	-125	136.4	138.7	-157.7	-4.3	0	0	0	110.1
435	G	34.2	Very low	37.9	Very low	59 Å²	59	125.2 Å²	125.2	61%	0.608	74%	0.741	S	S	*	*			trans	-113.2	87.4	-150	0	0	0	0	0	115.1
436	F	29.3	Very low	36.1	Very low	197 Å²	197	128.3 Å²	128.3	86%	0.864	76%	0.76	S	S	*	*			trans	-142.8	63.5	167.4	-111.5	-75.6	0	0	0	114.3
437	C	30.3	Very low	35.6	Very low	118 Å²	118	130 Å²	130	80%	0.797	77%	0.768	S	S	*	*			trans	-119.1	97.6	164.3	-66	0	0	0	0	110.3	T439	C437-T439 PolarHBondContact O-N 2.96Å
438	V	31.9	Very low	35.6	Very low	140 Å²	140	133.2 Å²	133.2	85%	0.848	77%	0.768	S	S	*	*			trans	-73.3	104.2	162.6	177.9	0	0	0	0	106.9
439	T	35.9	Very low	36.6	Very low	106 Å²	106	133.8 Å²	133.8	65%	0.65	77%	0.765	S	S	*	*			trans	-79.7	137.7	-178.3	50.9	0	0	0	0	111.8	C437	C437-T439 PolarHBondContact O-N 2.96Å
440	D	31.4	Very low	38.3	Very low	180 Å²	180	130.5 Å²	130.5	96%	0.963	73%	0.73	S	S	*	*			trans	-139.9	92.5	142.3	-105.7	-33.4	0	0	0	108.2
441	G	32.7	Very low	40.2	Very low	49 Å²	49	127.4 Å²	127.4	51%	0.505	72%	0.716	S	S	.	*	S	Bend	trans	147	110	-176.3	0	0	0	0	0	113.5	V443	G441-V443 PolarHBondContact O-N 2.92Å
442	P	37.4	Very low	42.8	Very low	136 Å²	136	129 Å²	129	88%	0.883	70%	0.704	S	S	*	*			trans	-82.2	104.1	179.7	31.6	-32.6	0	0	0	111.1
443	V	32.6	Very low	45	Very low	102 Å²	102	129 Å²	129	62%	0.618	70%	0.704	S	S	*	*			trans	-133.1	87	179.2	-172.2	0	0	0	0	111.5	G441 K445	G441-V443 PolarHBondContact O-N 2.92Å; V443-K445 VanDerWaalsContact C-N 3.25Å; V443-K445 HydrophobicContact CG1-CB 3.99Å; V443-K445 HydrophobicContact CG1-CD 3.7Å; V443-K445 HydrophobicContact CG1-CG 3.55Å; V443-K445 PolarHBondContact O-N 3.34Å
444	N	33.8	Very low	47.1	Very low	181 Å²	181	125.4 Å²	125.4	97%	0.968	68%	0.679	S	S	*	*			trans	-67.8	86.8	156.8	-83.5	-7.8	0	0	0	108.8
445	K	33.6	Very low	50	Low	147 Å²	147	118.2 Å²	118.2	64%	0.639	64%	0.64	S	S	*	*			trans	-102.5	120.6	164.3	-91.3	177.1	-176.3	-177.8	0	109.3	V443	V443-K445 VanDerWaalsContact C-N 3.25Å; V443-K445 HydrophobicContact CG1-CB 3.99Å; V443-K445 HydrophobicContact CG1-CD 3.7Å; V443-K445 HydrophobicContact CG1-CG 3.55Å; V443-K445 PolarHBondContact O-N 3.34Å
446	I	38.8	Very low	52.7	Low	160 Å²	160	116.5 Å²	116.5	82%	0.821	62%	0.616	S	S	*	*			trans	-46.2	137.9	162.3	-63.5	161.3	0	0	0	108.4	Q448	I446-Q448 WeakPolarHBondContact O-CG 3.45Å; I446-Q448 PolarHBondContact O-N 3.31Å
447	Q	46	Very low	55.6	Low	153 Å²	153	108.5 Å²	108.5	72%	0.715	58%	0.582	S	S	*	*			trans	-55	92.9	-179.4	-144.2	86.9	-10.7	0	0	110.7	K449	Q447-K449 PolarHBondContact O-N 3.31Å
448	Q	53.1	Low	58.6	Low	124 Å²	124	102.9 Å²	102.9	58%	0.579	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-72	124.6	179.2	-70.4	-174.5	-49.6	0	0	108.3	F422 I446	F422-Q448 HydrophobicContact CD1-CB 3.93Å; F422-Q448 WeakPolarHBondContact CD1-O 3.42Å; F422-Q448 HydrophobicContact CE1-CB 3.44Å; F422-Q448 VanDerWaalsContact CE1-CB 3.44Å; F422-Q448 HydrophobicContact CZ-CB 4.21Å; I446-Q448 WeakPolarHBondContact O-CG 3.45Å; I446-Q448 PolarHBondContact O-N 3.31Å
449	K	63.4	Low	61.4	Low	145 Å²	145	96.4 Å²	96.4	63%	0.63	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-103.4	156.6	173.5	-67.2	-171.7	177	-173.2	0	109.4	Q447	Q447-K449 PolarHBondContact O-N 3.31Å
450	A	71.9	Confident	64.1	Low	6 Å²	6	93.4 Å²	93.4	5%	0.05	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-58.8	154	169.2	0	0	0	0	0	110.6	I419 D420 F422 Y424 R452	I419-A450 HydrophobicContact CB-CB 4.22Å; I419-A450 HydrophobicContact CG2-CB 3.9Å; D420-A450 HydrophobicContact CB-CB 4.46Å; F422-A450 HydrophobicContact CD2-CB 4Å; Y424-A450 PolarHBondContact OH-N 3.47Å; Y424-A450 VanDerWaalsContact OH-N 3.08Å; A450-R452 PolarHBondContact O-N 3.05Å
451	G	77	Confident	67	Low	49 Å²	49	84.9 Å²	84.9	51%	0.505	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-58	133.9	172.9	0	0	0	0	0	110.7	E453 R454 E455	G451-E453 PolarHBondContact O-N 3.15Å; G451-R454 WeakPolarHBondContact O-CA 3.13Å; G451-R454 WeakPolarHBondContact O-CB 3.41Å; G451-R454 PolarHBondContact O-N 3.17Å; G451-E455 PolarHBondContact O-N 3.34Å
452	R	80.9	Confident	69.8	Low	149 Å²	149	82.8 Å²	82.8	56%	0.562	41%	0.414	S	S	*	.	H	α-helix	trans	-50.8	-38.1	-170.9	-178	175.2	171.1	163.6	1.6	113.6	A450 R454 E455 E456	A450-R452 PolarHBondContact O-N 3.05Å; R452-R454 PolarHBondContact O-N 3.36Å; R452-E455 PolarHBondContact O-N 3.35Å; R452-E456 HydrophobicContact CG-CG 4.39Å; R452-E456 IonicContact CZ-OE1 3.44Å; R452-E456 VanDerWaalsContact CZ-OE1 3.3Å; R452-E456 IonicContact NE-OE1 2.75Å; R452-E456 PolarHBondContact NE-OE1 2.98Å; R452-E456 IonicContact NH2-OE1 3.86Å; R452-E456 PolarHBondContact NH2-OE1 2.93Å; R452-E456 WeakPolarHBondContact O-CG 3.37Å; R452-E456 PolarHBondContact O-N 2.89Å
453	E	83.7	Confident	72.4	Confident	169 Å²	169	76.3 Å²	76.3	79%	0.79	37%	0.371	S	S	*	.	H	α-helix	trans	-59.8	-40.7	176.1	-62	177	163.4	0	0	112.9	G451 L457	G451-E453 PolarHBondContact O-N 3.15Å; E453-L457 WeakPolarHBondContact O-CB 3.18Å; E453-L457 PolarHBondContact O-N 2.86Å
454	R	84.8	Confident	75.2	Confident	89 Å²	89	71.5 Å²	71.5	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-72.5	-35.9	175.8	-71.2	-167	179.7	-154.6	17.6	112.4	D420 G451 R452 L457 F458	D420-R454 IonicContact OD1-CZ 3.3Å; D420-R454 IonicContact OD1-NH1 2.69Å; D420-R454 PolarHBondContact OD1-NH1 3.2Å; D420-R454 WeakPolarHBondContact OD2-CD 3.43Å; D420-R454 IonicContact OD2-CZ 2.73Å; D420-R454 IonicContact OD2-NE 2.74Å; D420-R454 PolarHBondContact OD2-NE 3.01Å; D420-R454 IonicContact OD2-NH1 3.78Å; D420-R454 PolarHBondContact OD2-NH1 3.27Å; D420-R454 IonicContact OD2-NH2 3.91Å; G451-R454 WeakPolarHBondContact O-CA 3.13Å; G451-R454 WeakPolarHBondContact O-CB 3.41Å; G451-R454 PolarHBondContact O-N 3.17Å; R452-R454 PolarHBondContact O-N 3.36Å; R454-L457 PolarHBondContact O-N 2.85Å; R454-F458 WeakPolarHBondContact O-CB 3.47Å; R454-F458 PolarHBondContact O-N 3.08Å
455	E	87.9	Confident	77.9	Confident	24 Å²	24	62.9 Å²	62.9	11%	0.112	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-48	175.1	-167.4	-172.2	153.6	0	0	110.7	I419 G451 R452 F458 L459 R546	I419-E455 HydrophobicContact CD1-CG 4.21Å; G451-E455 PolarHBondContact O-N 3.34Å; R452-E455 PolarHBondContact O-N 3.35Å; E455-F458 PolarHBondContact O-N 2.94Å; E455-L459 HydrophobicContact CG-CD1 4.45Å; E455-L459 WeakPolarHBondContact O-CG 3.24Å; E455-L459 PolarHBondContact O-N 3.21Å; E455-L459 VanDerWaalsContact O-N 3.08Å; E455-R546 IonicContact OE1-CZ 3.71Å; E455-R546 IonicContact OE1-NH1 3.62Å; E455-R546 PolarHBondContact OE1-NH1 3.36Å; E455-R546 IonicContact OE1-NH2 2.68Å; E455-R546 PolarHBondContact OE1-NH2 3.41Å; E455-R546 IonicContact OE2-NH1 3.58Å
456	E	89.6	Confident	80.6	Confident	23 Å²	23	56.4 Å²	56.4	11%	0.107	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-37.1	175.7	-68.2	-174.8	-167.1	0	0	112.1	R452 L459 R460 F531	R452-E456 HydrophobicContact CG-CG 4.39Å; R452-E456 IonicContact CZ-OE1 3.44Å; R452-E456 VanDerWaalsContact CZ-OE1 3.3Å; R452-E456 IonicContact NE-OE1 2.75Å; R452-E456 PolarHBondContact NE-OE1 2.98Å; R452-E456 IonicContact NH2-OE1 3.86Å; R452-E456 PolarHBondContact NH2-OE1 2.93Å; R452-E456 WeakPolarHBondContact O-CG 3.37Å; R452-E456 PolarHBondContact O-N 2.89Å; E456-L459 PolarHBondContact O-N 3.38Å; E456-R460 WeakPolarHBondContact O-CB 3.35Å; E456-R460 VanDerWaalsContact O-CG 3.3Å; E456-R460 WeakPolarHBondContact O-CG 3.47Å; E456-R460 PolarHBondContact O-N 3.07Å; E456-R460 IonicContact OE2-NH1 2.8Å; E456-R460 IonicContact OE2-NH2 2.82Å; E456-F531 HydrophobicContact CB-CE2 4.32Å; E456-F531 HydrophobicContact CB-CZ 3.84Å; E456-F531 HydrophobicContact CG-CE2 4.05Å; E456-F531 HydrophobicContact CG-CZ 3.9Å
457	L	91.2	Very high	82.7	Confident	28 Å²	28	50.8 Å²	50.8	15%	0.147	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-38.8	174.1	-175.5	67.9	0	0	0	112.6	E453 R454 R460 A461 F582 Y621 I664	E453-L457 WeakPolarHBondContact O-CB 3.18Å; E453-L457 PolarHBondContact O-N 2.86Å; R454-L457 PolarHBondContact O-N 2.85Å; L457-R460 PolarHBondContact O-N 2.74Å; L457-A461 WeakPolarHBondContact O-CB 3.25Å; L457-A461 PolarHBondContact O-N 3.39Å; L457-F582 HydrophobicContact CD1-CE1 3.88Å; L457-F582 HydrophobicContact CD1-CZ 4.02Å; L457-F582 HydrophobicContact CG-CE1 4.49Å; L457-Y621 HydrophobicContact CD2-CD1 4.06Å; L457-Y621 HydrophobicContact CD2-CD2 4.04Å; L457-Y621 HydrophobicContact CD2-CE1 3.72Å; L457-Y621 HydrophobicContact CD2-CE2 3.71Å; L457-Y621 HydrophobicContact CD2-CG 4.21Å; L457-I664 HydrophobicContact CD2-CD1 4.2Å; L457-I664 HydrophobicContact CG-CD1 4.09Å
458	F	92.6	Very high	84.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.4	-45.7	174.8	-175.6	-103	0	0	0	111.3	C417 I419 R454 E455 A461 L462 V619 I664 T667	C417-F458 HydrophobicContact CB-CE1 3.88Å; C417-F458 HydrophobicContact CB-CZ 3.93Å; I419-F458 HydrophobicContact CD1-CB 4.15Å; I419-F458 HydrophobicContact CD1-CD1 3.45Å; I419-F458 VanDerWaalsContact CD1-CD1 3.45Å; I419-F458 HydrophobicContact CD1-CE1 3.91Å; I419-F458 HydrophobicContact CD1-CG 3.88Å; I419-F458 HydrophobicContact CG1-CB 4.48Å; I419-F458 HydrophobicContact CG1-CD1 3.75Å; I419-F458 HydrophobicContact CG1-CD2 4.27Å; I419-F458 HydrophobicContact CG1-CE1 3.89Å; I419-F458 HydrophobicContact CG1-CE2 4.4Å; I419-F458 HydrophobicContact CG1-CG 3.93Å; I419-F458 HydrophobicContact CG1-CZ 4.2Å; I419-F458 HydrophobicContact CG2-CB 4.23Å; I419-F458 HydrophobicContact CG2-CG 4.41Å; R454-F458 WeakPolarHBondContact O-CB 3.47Å; R454-F458 PolarHBondContact O-N 3.08Å; E455-F458 PolarHBondContact O-N 2.94Å; F458-A461 WeakPolarHBondContact O-CB 3.34Å; F458-A461 PolarHBondContact O-N 2.96Å; F458-L462 HydrophobicContact CD1-CD1 4.26Å; F458-L462 HydrophobicContact CE1-CD1 3.87Å; F458-L462 HydrophobicContact CE1-CG 4.39Å; F458-L462 HydrophobicContact CZ-CD1 4.49Å; F458-L462 PolarHBondContact O-N 3.06Å; F458-V619 HydrophobicContact CD2-CB 4.35Å; F458-V619 HydrophobicContact CE2-CB 3.98Å; F458-V619 HydrophobicContact CE2-CG2 4.07Å; F458-I664 HydrophobicContact CB-CG2 3.78Å; F458-I664 HydrophobicContact CD2-CB 4.11Å; F458-I664 HydrophobicContact CD2-CG2 3.84Å; F458-I664 HydrophobicContact CG-CG2 4.3Å; F458-T667 HydrophobicContact CE1-CG2 4.16Å; F458-T667 HydrophobicContact CZ-CG2 3.57Å
459	L	91.6	Very high	85.9	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-68.5	-37.4	179	-65	170.6	0	0	0	112.1	E455 E456 L462 C463 A526 Y529 F531	E455-L459 HydrophobicContact CG-CD1 4.45Å; E455-L459 WeakPolarHBondContact O-CG 3.24Å; E455-L459 PolarHBondContact O-N 3.21Å; E455-L459 VanDerWaalsContact O-N 3.08Å; E456-L459 PolarHBondContact O-N 3.38Å; L459-L462 PolarHBondContact O-N 3.14Å; L459-C463 PolarHBondContact O-N 3.38Å; L459-C463 VanDerWaalsContact O-N 3.13Å; L459-A526 HydrophobicContact CD2-CB 4.3Å; L459-Y529 HydrophobicContact CD2-CG 4.41Å; L459-F531 HydrophobicContact CB-CB 4Å; L459-F531 HydrophobicContact CB-CD1 4.18Å; L459-F531 HydrophobicContact CB-CD2 3.52Å; L459-F531 HydrophobicContact CB-CE2 3.95Å; L459-F531 HydrophobicContact CB-CG 3.63Å; L459-F531 HydrophobicContact CB-CZ 4.45Å; L459-F531 HydrophobicContact CD1-CD2 3.54Å; L459-F531 HydrophobicContact CD1-CE2 3.86Å; L459-F531 HydrophobicContact CD1-CG 4.43Å; L459-F531 HydrophobicContact CG-CD2 4.14Å
460	R	92.4	Very high	86.9	Confident	44 Å²	44	33.9 Å²	33.9	17%	0.166	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-45.3	167.1	-74.1	176.1	-177.4	111.3	0.5	111.7	E456 L457 L462 C463 L464 F531 N545 E551	E456-R460 WeakPolarHBondContact O-CB 3.35Å; E456-R460 VanDerWaalsContact O-CG 3.3Å; E456-R460 WeakPolarHBondContact O-CG 3.47Å; E456-R460 PolarHBondContact O-N 3.07Å; E456-R460 IonicContact OE2-NH1 2.8Å; E456-R460 IonicContact OE2-NH2 2.82Å; L457-R460 PolarHBondContact O-N 2.74Å; R460-L462 VanDerWaalsContact C-N 3.32Å; R460-L462 PolarHBondContact O-N 2.84Å; R460-C463 CarbonylContact O-C 3.59Å; R460-C463 PolarHBondContact O-N 3.32Å; R460-C463 VanDerWaalsContact O-N 3.15Å; R460-L464 HydrophobicContact CB-CD1 4.31Å; R460-L464 WeakPolarHBondContact O-CB 3.46Å; R460-L464 VanDerWaalsContact O-CG 3.27Å; R460-L464 WeakPolarHBondContact O-CG 3.34Å; R460-L464 PolarHBondContact O-N 3.28Å; R460-F531 HydrophobicContact CG-CD1 4.31Å; R460-F531 HydrophobicContact CG-CE1 3.73Å; R460-N545 PolarHBondContact NH2-ND2 3.25Å; R460-E551 IonicContact CZ-OE1 2.8Å; R460-E551 IonicContact CZ-OE2 2.7Å; R460-E551 IonicContact NE-OE1 3.69Å; R460-E551 IonicContact NE-OE2 2.7Å; R460-E551 PolarHBondContact NE-OE2 3.44Å; R460-E551 IonicContact NH2-OE1 3.73Å; R460-E551 PolarHBondContact NH2-OE1 3.46Å; R460-E551 IonicContact NH2-OE2 2.72Å
461	A	92.6	Very high	86.9	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-39.9	178.7	0	0	0	0	0	112.3	L457 F458 L464 C465 F582 V619 I664	L457-A461 WeakPolarHBondContact O-CB 3.25Å; L457-A461 PolarHBondContact O-N 3.39Å; F458-A461 WeakPolarHBondContact O-CB 3.34Å; F458-A461 PolarHBondContact O-N 2.96Å; A461-L464 PolarHBondContact O-N 3Å; A461-C465 WeakPolarHBondContact O-CB 3.28Å; A461-C465 PolarHBondContact O-N 2.94Å; A461-F582 HydrophobicContact CB-CD1 3.38Å; A461-F582 HydrophobicContact CB-CE1 3.68Å; A461-F582 HydrophobicContact CB-CG 4.19Å; A461-V619 HydrophobicContact CB-CG1 3.63Å; A461-I664 HydrophobicContact CB-CD1 4.16Å
462	L	91.5	Very high	86.3	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-35.7	174.9	-66.2	-172.6	0	0	0	113.2	F414 F458 L459 R460 H466 L522 A526 V619 T667	F414-L462 HydrophobicContact CE2-CD1 4.08Å; F414-L462 HydrophobicContact CZ-CD1 4.49Å; F458-L462 HydrophobicContact CD1-CD1 4.26Å; F458-L462 HydrophobicContact CE1-CD1 3.87Å; F458-L462 HydrophobicContact CE1-CG 4.39Å; F458-L462 HydrophobicContact CZ-CD1 4.49Å; F458-L462 PolarHBondContact O-N 3.06Å; L459-L462 PolarHBondContact O-N 3.14Å; R460-L462 VanDerWaalsContact C-N 3.32Å; R460-L462 PolarHBondContact O-N 2.84Å; L462-H466 PolarHBondContact O-CD2 3.21Å; L462-H466 VanDerWaalsContact O-CD2 3.29Å; L462-L522 HydrophobicContact CD2-CB 4.48Å; L462-L522 HydrophobicContact CD2-CD1 4.45Å; L462-L522 HydrophobicContact CD2-CD2 4.03Å; L462-A526 HydrophobicContact CB-CB 4.1Å; L462-A526 HydrophobicContact CD1-CB 4.44Å; L462-V619 HydrophobicContact CD2-CG2 4Å; L462-T667 HydrophobicContact CD1-CG2 4.28Å; L462-T667 HydrophobicContact CD2-CG2 4.07Å
463	C	91.3	Very high	84.8	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-89.9	-1.2	179	-71	0	0	0	0	115.2	L459 R460 H466 A526 F531 F533 I543	L459-C463 PolarHBondContact O-N 3.38Å; L459-C463 VanDerWaalsContact O-N 3.13Å; R460-C463 CarbonylContact O-C 3.59Å; R460-C463 PolarHBondContact O-N 3.32Å; R460-C463 VanDerWaalsContact O-N 3.15Å; C463-H466 PolarHBondContact O-NE2 3.42Å; C463-A526 WeakPolarHBondContact SG-CB 3.4Å; C463-F531 PolarHBondContact SG-O 3.15Å; C463-F533 HydrophobicContact CB-CB 4.4Å; C463-F533 WeakPolarHBondContact O-CD2 3.29Å; C463-I543 HydrophobicContact CB-CD1 3.57Å; C463-I543 HydrophobicContact CB-CG1 4.04Å
464	L	90.8	Very high	82.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-116.6	-36.2	178.3	-69.4	170.7	0	0	0	112.8	R460 A461 H466 M541 I543 Y553 V572 F582	R460-L464 HydrophobicContact CB-CD1 4.31Å; R460-L464 WeakPolarHBondContact O-CB 3.46Å; R460-L464 VanDerWaalsContact O-CG 3.27Å; R460-L464 WeakPolarHBondContact O-CG 3.34Å; R460-L464 PolarHBondContact O-N 3.28Å; A461-L464 PolarHBondContact O-N 3Å; L464-H466 VanDerWaalsContact C-N 3.32Å; L464-H466 PolarHBondContact O-N 2.89Å; L464-M541 HydrophobicContact CD2-CB 4.06Å; L464-M541 HydrophobicContact CD2-CE 4.21Å; L464-M541 HydrophobicContact CD2-SD 4.01Å; L464-I543 HydrophobicContact CD1-CD1 4.27Å; L464-I543 HydrophobicContact CD2-CD1 3.47Å; L464-I543 VanDerWaalsContact CD2-CD1 3.47Å; L464-I543 HydrophobicContact CG-CD1 3.54Å; L464-Y553 HydrophobicContact CD1-CD1 4.33Å; L464-Y553 HydrophobicContact CD1-CD2 3.98Å; L464-Y553 HydrophobicContact CD1-CE1 4.39Å; L464-Y553 HydrophobicContact CD1-CE2 4.03Å; L464-Y553 HydrophobicContact CD1-CG 4.13Å; L464-Y553 HydrophobicContact CD2-CD2 3.82Å; L464-Y553 HydrophobicContact CD2-CG 3.98Å; L464-Y553 HydrophobicContact CG-CD2 4.49Å; L464-V572 HydrophobicContact CD1-CG2 4.35Å; L464-V572 HydrophobicContact CD2-CG1 4.49Å; L464-F582 HydrophobicContact CB-CD2 4.13Å; L464-F582 HydrophobicContact CB-CE2 4.36Å; L464-F582 HydrophobicContact CD1-CD2 4.11Å; L464-F582 HydrophobicContact CD1-CE2 3.5Å; L464-F582 HydrophobicContact CD1-CZ 4.15Å
465	C	91.4	Very high	80.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.007	23%	0.228	C	C	.	.	S	Bend	trans	-87.5	61.7	-174.8	-166.5	0	0	0	0	111.9	A461 F582 K584	A461-C465 WeakPolarHBondContact O-CB 3.28Å; A461-C465 PolarHBondContact O-N 2.94Å; C465-F582 HydrophobicContact CB-CB 3.84Å; C465-K584 VanDerWaalsContact O-CD 3.29Å; C465-K584 WeakPolarHBondContact O-CD 3.39Å; C465-K584 WeakPolarHBondContact O-CE 3.24Å; C465-K584 PolarHBondContact O-NZ 2.8Å
466	H	89.3	Confident	77.8	Confident	11 Å²	11	50.6 Å²	50.6	5%	0.051	25%	0.254	C	S	.	.	S	Bend	trans	-155.6	165.4	-177.9	63	44.5	0	0	0	115.5	L462 C463 L464 V468 E519 V523 F533	L462-H466 PolarHBondContact O-CD2 3.21Å; L462-H466 VanDerWaalsContact O-CD2 3.29Å; C463-H466 PolarHBondContact O-NE2 3.42Å; L464-H466 VanDerWaalsContact C-N 3.32Å; L464-H466 PolarHBondContact O-N 2.89Å; H466-V468 HydrophobicContact CB-CB 4.48Å; H466-V468 HydrophobicContact CB-CG2 3.93Å; H466-V468 PolarHBondContact ND1-N 3.46Å; H466-E519 WeakPolarHBondContact CA-OE1 3.43Å; H466-E519 HydrophobicContact CB-CB 4.46Å; H466-V523 WeakPolarHBondContact CD2-CG2 3.28Å; H466-V523 WeakPolarHBondContact NE2-CG2 3.36Å; H466-F533 AromaticContact CE1-CD1 3.77Å; H466-F533 AromaticContact CE1-CD2 3.86Å; H466-F533 AromaticContact CE1-CE1 3.75Å; H466-F533 AromaticContact CE1-CE2 3.85Å; H466-F533 AromaticContact CE1-CG 3.82Å; H466-F533 AromaticContact CE1-CZ 3.79Å; H466-F533 AromaticContact NE2-CD1 3.97Å; H466-F533 AromaticContact NE2-CD2 3.96Å; H466-F533 AromaticContact NE2-CG 3.73Å
467	T	84.6	Confident	75	Confident	42 Å²	42	61.1 Å²	61.1	26%	0.258	29%	0.293	S	S	.	.			trans	-90.3	-2.6	168.5	68.6	0	0	0	0	114.2	Q469 S515 E519 M568	T467-Q469 PolarHBondContact O-N 3.24Å; T467-S515 WeakPolarHBondContact OG1-CB 3.28Å; T467-S515 PolarHBondContact OG1-N 2.98Å; T467-S515 PolarHBondContact OG1-OG 2.83Å; T467-E519 WeakPolarHBondContact CA-OE2 3.47Å; T467-E519 WeakPolarHBondContact CB-OE2 3.12Å; T467-E519 PolarHBondContact N-OE1 3.43Å; T467-E519 PolarHBondContact N-OE2 3.49Å; T467-E519 PolarHBondContact OG1-OE2 3.03Å; T467-M568 HydrophobicContact CG2-CE 3.62Å; T467-M568 HydrophobicContact CG2-SD 4.33Å
468	V	85.1	Confident	72.1	Confident	5 Å²	5	67.9 Å²	67.9	3%	0.03	32%	0.324	C	S	.	.			trans	-56.2	132.6	-175.2	-172.2	0	0	0	0	111.9	H466 F512 I513 A514 E519 V523 F533	H466-V468 HydrophobicContact CB-CB 4.48Å; H466-V468 HydrophobicContact CB-CG2 3.93Å; H466-V468 PolarHBondContact ND1-N 3.46Å; V468-F512 HydrophobicContact CG1-CB 3.81Å; V468-F512 HydrophobicContact CG1-CD1 3.75Å; V468-F512 HydrophobicContact CG1-CG 4.16Å; V468-I513 CarbonylContact C-O 3.51Å; V468-I513 WeakPolarHBondContact CA-O 3.3Å; V468-A514 HydrophobicContact CB-CB 4.36Å; V468-A514 HydrophobicContact CG2-CB 3.82Å; V468-E519 HydrophobicContact CG2-CB 3.51Å; V468-V523 HydrophobicContact CB-CG2 4.17Å; V468-V523 HydrophobicContact CG1-CG2 4.4Å; V468-V523 HydrophobicContact CG2-CG2 3.76Å; V468-F533 VanDerWaalsContact O-CE1 3.23Å; V468-F533 WeakPolarHBondContact O-CE1 3.38Å
469	Q	80	Confident	69.2	Low	34 Å²	34	75 Å²	75	16%	0.159	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	152.2	168.7	-60.9	-163	-17.8	0	0	110.5	F172 N248 T467 I513	F172-Q469 VanDerWaalsContact CZ-NE2 3.28Å; N248-Q469 PolarHBondContact ND2-OE1 3.05Å; T467-Q469 PolarHBondContact O-N 3.24Å; Q469-I513 PolarHBondContact N-O 2.99Å; Q469-I513 PolarHBondContact O-N 2.85Å
470	V	84	Confident	66.4	Low	27 Å²	27	84 Å²	84	16%	0.164	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132.2	170	-178.6	0	0	0	0	108.2	E472 M510 F512 F533	V470-E472 PolarHBondContact O-N 3.31Å; V470-M510 HydrophobicContact CG1-CB 4.3Å; V470-M510 HydrophobicContact CG1-SD 4.28Å; V470-F512 HydrophobicContact CG2-CD1 4.15Å; V470-F512 HydrophobicContact CG2-CE1 3.89Å; V470-F533 HydrophobicContact CG2-CD1 4.02Å; V470-F533 HydrophobicContact CG2-CE1 4.24Å
471	K	73.7	Confident	63.5	Low	133 Å²	133	89.3 Å²	89.3	58%	0.578	44%	0.436	S	S	*	.			trans	-69.4	111.3	176.2	-174.5	176.7	-177.2	176.4	0	109.8	S473 G511 I513	K471-S473 PolarHBondContact O-N 2.82Å; K471-G511 WeakPolarHBondContact CB-O 3.14Å; K471-G511 PolarHBondContact N-O 2.68Å; K471-I513 HydrophobicContact CB-CD1 3.82Å; K471-I513 HydrophobicContact CB-CG1 4.28Å; K471-I513 HydrophobicContact CD-CD1 4.24Å; K471-I513 HydrophobicContact CG-CD1 3.97Å
472	E	63.3	Low	60.5	Low	153 Å²	153	97.1 Å²	97.1	72%	0.715	48%	0.477	S	S	*	.			trans	-61.9	131.6	173.2	-68	-176	-158.7	0	0	110.3	V470 T474	V470-E472 PolarHBondContact O-N 3.31Å; E472-T474 PolarHBondContact O-N 3.05Å
473	S	49.1	Very low	57.6	Low	88 Å²	88	105.5 Å²	105.5	62%	0.615	52%	0.516	S	S	*	.			trans	-93.4	94.2	-178.9	43.9	0	0	0	0	110	K471 K475	K471-S473 PolarHBondContact O-N 2.82Å; S473-K475 PolarHBondContact O-N 2.88Å
474	T	38.9	Very low	54.8	Low	126 Å²	126	114.2 Å²	114.2	77%	0.773	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-57.9	-13.7	-173.9	-18.8	0	0	0	0	114.9	E472 Q476	E472-T474 PolarHBondContact O-N 3.05Å; T474-Q476 VanDerWaalsContact C-N 3.26Å; T474-Q476 PolarHBondContact O-N 3.25Å; T474-Q476 VanDerWaalsContact O-N 3.14Å
475	K	37.7	Very low	51.8	Low	194 Å²	194	120.8 Å²	120.8	84%	0.843	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-76.7	19.5	-176.4	-70.3	-166.1	169.9	-168	0	116	S473	S473-K475 PolarHBondContact O-N 2.88Å
476	Q	32.6	Very low	48.7	Very low	143 Å²	143	129.9 Å²	129.9	67%	0.668	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-129.3	27.2	177.9	-60.5	-151.3	-96.3	0	0	114.5	T474	T474-Q476 VanDerWaalsContact C-N 3.26Å; T474-Q476 PolarHBondContact O-N 3.25Å; T474-Q476 VanDerWaalsContact O-N 3.14Å
477	R	31.9	Very low	45.9	Very low	245 Å²	245	136.7 Å²	136.7	93%	0.925	67%	0.667	S	S	*	*	S	Bend	trans	-131.6	6.9	177.6	-84.3	-168.6	176.9	175.2	2	117
478	Q	29.9	Very low	43.2	Very low	169 Å²	169	141.3 Å²	141.3	79%	0.79	69%	0.69	S	S	*	*	S	Bend	trans	-109.6	-29.8	174.6	-89.5	176	-60	0	0	114.2	Q480	Q478-Q480 VanDerWaalsContact C-N 3.29Å; Q478-Q480 PolarHBondContact O-N 2.89Å
479	D	32.2	Very low	40.5	Very low	149 Å²	149	150 Å²	150	80%	0.797	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	56.8	-171.9	-50.7	-28.7	0	0	0	113.4
480	Q	32.9	Very low	38.2	Very low	193 Å²	193	155.5 Å²	155.5	90%	0.902	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	-2.8	170.9	-83.9	-161.7	-17.7	0	0	115.8	Q478	Q478-Q480 VanDerWaalsContact C-N 3.29Å; Q478-Q480 PolarHBondContact O-N 2.89Å
481	N	30.4	Very low	35.5	Very low	157 Å²	157	161.1 Å²	161.1	84%	0.84	79%	0.788	S	S	*	*	S	Bend	trans	-118	-11.6	-174.7	-103.5	15.3	0	0	0	116.5
482	D	30.6	Very low	33.4	Very low	164 Å²	164	162.5 Å²	162.5	88%	0.877	80%	0.797	S	S	*	*			trans	-103.5	81.8	178.1	-70.3	-51.3	0	0	0	111.2
483	Q	30.7	Very low	31.9	Very low	182 Å²	182	161.3 Å²	161.3	85%	0.85	80%	0.8	S	S	*	*			trans	-82.1	111	154.4	-76.5	-173.8	-15.4	0	0	108.5
484	F	30.7	Very low	30.8	Very low	183 Å²	183	164.1 Å²	164.1	80%	0.803	81%	0.808	S	S	*	*			trans	165.7	155.8	132.7	-104.4	-91.5	0	0	0	109.9
485	D	28.9	Very low	30.2	Very low	138 Å²	138	160.3 Å²	160.3	74%	0.738	79%	0.794	S	S	*	*			trans	47.3	101.1	165.9	-54.3	-21.5	0	0	0	117.4
486	Q	27.2	Very low	29.7	Very low	191 Å²	191	159.5 Å²	159.5	89%	0.893	80%	0.798	S	S	*	*				-159.5	164.1	67.2	-89.3	173.8	6.3	0	0	114.2
487	I	29.9	Very low	29.4	Very low	154 Å²	154	156.4 Å²	156.4	79%	0.79	80%	0.804	S	S	*	*			trans	-118.9	164.2	178.2	-64.8	173	0	0	0	108.1
488	D	28.1	Very low	29.3	Very low	139 Å²	139	153 Å²	153	74%	0.743	80%	0.804	S	S	*	*			trans	70.8	95.9	173.9	-60.8	-35.9	0	0	0	118.6
489	Q	28.2	Very low	29.2	Very low	189 Å²	189	151.6 Å²	151.6	88%	0.883	80%	0.801	S	S	*	*				-163.4	139.2	99.6	-103.7	155.1	71	0	0	112.5
490	I	31	Very low	29.1	Very low	148 Å²	148	152.9 Å²	152.9	76%	0.759	80%	0.802	S	S	*	*			trans	-139.7	118.8	178.5	-60	174.7	0	0	0	109.3
491	D	28.4	Very low	28.9	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	79%	0.79	S	S	*	*			trans	-129.9	125.4	155.6	-74.7	-52.9	0	0	0	105.8
492	Q	28.5	Very low	28.8	Very low	162 Å²	162	149.7 Å²	149.7	76%	0.757	80%	0.796	S	S	*	*				61.5	131.7	61.7	-62.9	-167.9	61.8	0	0	112.4
493	V	31.2	Very low	28.7	Very low	128 Å²	128	149.9 Å²	149.9	78%	0.776	80%	0.796	S	S	*	*			cis	-162.7	158.5	-5.1	95.1	0	0	0	0	106.7
494	D	27	Very low	28.7	Very low	147 Å²	147	147.2 Å²	147.2	79%	0.786	79%	0.788	S	S	*	*			cis	-137.1	-143.4	10.7	-154.5	8.9	0	0	0	108.7
495	G	25.8	Very low	28.6	Very low	47 Å²	47	143.2 Å²	143.2	49%	0.485	78%	0.78	S	S	.	*			cis	162.6	140.8	-4.4	0	0	0	0	0	113.9
496	L	27.8	Very low	28.8	Very low	177 Å²	177	142.7 Å²	142.7	93%	0.927	79%	0.785	S	S	*	*			trans	58.3	138.5	178.3	-66.1	88.2	0	0	0	116.8
497	G	26.1	Very low	29.4	Very low	77 Å²	77	140.6 Å²	140.6	79%	0.794	78%	0.775	S	S	*	*			cis	-165.9	157	-4.2	0	0	0	0	0	112.2
498	L	30.8	Very low	30	Very low	175 Å²	175	140.6 Å²	140.6	92%	0.916	77%	0.769	S	S	*	*			trans	-92.7	137.8	176.7	-71.3	153.4	0	0	0	110.1
499	D	27.2	Very low	31	Very low	138 Å²	138	143.5 Å²	143.5	74%	0.738	78%	0.778	S	S	*	*				-164.3	160.5	117.8	-135.9	-38.7	0	0	0	113.2
500	H	29.9	Very low	32.6	Very low	176 Å²	176	137.8 Å²	137.8	82%	0.815	75%	0.752	S	S	*	*			trans	62.5	117.6	168.2	-66	10.7	0	0	0	116.8
501	G	28.5	Very low	34.6	Very low	63 Å²	63	132.4 Å²	132.4	65%	0.649	73%	0.733	S	S	*	*			trans	-124.1	145.4	-172	0	0	0	0	0	115
502	F	28.5	Very low	37.2	Very low	220 Å²	220	126.5 Å²	126.5	97%	0.965	70%	0.701	S	S	*	*			trans	-145.4	60.8	150.3	-113.2	-78.9	0	0	0	107.4	D504	F502-D504 PolarHBondContact O-N 3.4Å
503	L	29.5	Very low	39.5	Very low	168 Å²	168	120 Å²	120	88%	0.88	67%	0.671	S	S	*	*			trans	-86.7	107.5	-178	-75.2	169.3	0	0	0	110.3
504	D	29.6	Very low	41.6	Very low	127 Å²	127	114.3 Å²	114.3	68%	0.679	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-51.9	147.4	154.8	-89.7	-55.8	0	0	0	109.9	F502	F502-D504 PolarHBondContact O-N 3.4Å
505	P	29.6	Very low	43.6	Very low	99 Å²	99	109.7 Å²	109.7	64%	0.643	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-58.3	138.1	173.7	26.5	-34.2	0	0	0	109.3	Q507	P505-Q507 PolarHBondContact O-N 3.33Å
506	P	32.3	Very low	45.9	Very low	127 Å²	127	108.8 Å²	108.8	83%	0.825	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-57.9	116.9	-172.4	22.7	-33.6	0	0	0	110	K508	P506-K508 PolarHBondContact O-N 2.62Å
507	Q	39.4	Very low	48.3	Very low	146 Å²	146	101.5 Å²	101.5	68%	0.682	57%	0.566	S	S	*	*			trans	-60.6	110.1	174.7	-65.1	-175.5	6.3	0	0	107.5	P505 E509	P505-Q507 PolarHBondContact O-N 3.33Å; Q507-E509 PolarHBondContact O-N 2.72Å; Q507-E509 VanDerWaalsContact O-N 3.14Å
508	K	43.5	Very low	51	Low	155 Å²	155	99.4 Å²	99.4	67%	0.674	54%	0.537	S	S	*	.			trans	-51.3	124.2	168.3	-80	-170.5	173.3	-173	0	107.2	P506 M510	P506-K508 PolarHBondContact O-N 2.62Å; K508-M510 VanDerWaalsContact C-N 3.28Å; K508-M510 PolarHBondContact O-N 3.07Å
509	E	48.2	Very low	53.6	Low	200 Å²	200	91.6 Å²	91.6	94%	0.935	50%	0.495	S	S	*	.			trans	-64.3	89.9	176.3	-69.5	-166.1	121.7	0	0	110.1	Q507 G511	Q507-E509 PolarHBondContact O-N 2.72Å; Q507-E509 VanDerWaalsContact O-N 3.14Å; E509-G511 PolarHBondContact O-N 3.04Å; E509-G511 VanDerWaalsContact O-N 3.07Å
510	M	62.9	Low	56.5	Low	68 Å²	68	86.7 Å²	86.7	34%	0.335	47%	0.469	S	S	.	.			trans	-72.9	102.7	174.7	-68.5	-161.3	-64.4	0	0	108.4	V470 K508 F512 T532 L534	V470-M510 HydrophobicContact CG1-CB 4.3Å; V470-M510 HydrophobicContact CG1-SD 4.28Å; K508-M510 VanDerWaalsContact C-N 3.28Å; K508-M510 PolarHBondContact O-N 3.07Å; M510-F512 HydrophobicContact CB-CZ 4.39Å; M510-F512 VanDerWaalsContact O-CD2 3.3Å; M510-F512 WeakPolarHBondContact O-CD2 3.48Å; M510-F512 PolarHBondContact O-N 2.83Å; M510-F512 VanDerWaalsContact O-N 3.16Å; M510-T532 HydrophobicContact CE-CG2 3.43Å; M510-T532 VanDerWaalsContact CE-CG2 3.43Å; M510-L534 HydrophobicContact CE-CD2 4.42Å
511	G	72.8	Confident	59.3	Low	35 Å²	35	78.4 Å²	78.4	36%	0.361	43%	0.431	S	S	.	.			trans	-63.4	113.7	173.6	0	0	0	0	0	110.2	K471 E509	K471-G511 WeakPolarHBondContact CB-O 3.14Å; K471-G511 PolarHBondContact N-O 2.68Å; E509-G511 PolarHBondContact O-N 3.04Å; E509-G511 VanDerWaalsContact O-N 3.07Å
512	F	82.7	Confident	62.3	Low	21 Å²	21	75.6 Å²	75.6	9%	0.092	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	137.2	172.9	-65.1	-72.3	0	0	0	110.4	V468 V470 M510 I520 V523 K524 M527	V468-F512 HydrophobicContact CG1-CB 3.81Å; V468-F512 HydrophobicContact CG1-CD1 3.75Å; V468-F512 HydrophobicContact CG1-CG 4.16Å; V470-F512 HydrophobicContact CG2-CD1 4.15Å; V470-F512 HydrophobicContact CG2-CE1 3.89Å; M510-F512 HydrophobicContact CB-CZ 4.39Å; M510-F512 VanDerWaalsContact O-CD2 3.3Å; M510-F512 WeakPolarHBondContact O-CD2 3.48Å; M510-F512 PolarHBondContact O-N 2.83Å; M510-F512 VanDerWaalsContact O-N 3.16Å; F512-I520 HydrophobicContact CB-CG2 4.18Å; F512-V523 HydrophobicContact CD1-CG1 3.98Å; F512-V523 HydrophobicContact CE1-CG1 3.67Å; F512-V523 HydrophobicContact CE2-CG1 4.3Å; F512-V523 HydrophobicContact CG-CG1 4.42Å; F512-V523 HydrophobicContact CZ-CG1 3.84Å; F512-K524 HydrophobicContact CD2-CG 4.17Å; F512-K524 HydrophobicContact CE2-CG 4.43Å; F512-M527 HydrophobicContact CE2-SD 3.99Å; F512-M527 HydrophobicContact CZ-SD 4.15Å
513	I	75.9	Confident	65.2	Low	27 Å²	27	65.1 Å²	65.1	14%	0.138	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.6	179.6	-58.8	175.3	0	0	0	107.8	H184 V468 Q469 K471	H184-I513 HydrophobicContact CB-CG2 3.92Å; H184-I513 VanDerWaalsContact CD2-CG2 3.49Å; H184-I513 WeakPolarHBondContact CD2-CG2 3.39Å; H184-I513 VanDerWaalsContact CG-CG2 3.47Å; V468-I513 CarbonylContact C-O 3.51Å; V468-I513 WeakPolarHBondContact CA-O 3.3Å; Q469-I513 PolarHBondContact N-O 2.99Å; Q469-I513 PolarHBondContact O-N 2.85Å; K471-I513 HydrophobicContact CB-CD1 3.82Å; K471-I513 HydrophobicContact CB-CG1 4.28Å; K471-I513 HydrophobicContact CD-CD1 4.24Å; K471-I513 HydrophobicContact CG-CD1 3.97Å
514	A	76.4	Confident	68.1	Low	7 Å²	7	61.9 Å²	61.9	6%	0.058	33%	0.334	C	S	.	.			trans	-151.2	173.9	-177	0	0	0	0	0	113.2	H184 V468 E519 I520	H184-A514 PolarHBondContact N-O 2.83Å; H184-A514 VanDerWaalsContact N-O 3.12Å; V468-A514 HydrophobicContact CB-CB 4.36Å; V468-A514 HydrophobicContact CG2-CB 3.82Å; A514-E519 HydrophobicContact CB-CB 4.26Å; A514-I520 HydrophobicContact CB-CD1 3.98Å; A514-I520 HydrophobicContact CB-CG1 3.63Å
515	S	67.4	Low	70.9	Confident	50 Å²	50	55.8 Å²	55.8	35%	0.35	30%	0.301	S	S	.	.	S	Bend	trans	-85.3	-8.5	171.1	66.5	0	0	0	0	114.6	N183 T467	N183-S515 VanDerWaalsContact CB-O 3.28Å; N183-S515 WeakPolarHBondContact CB-O 3.5Å; N183-S515 PolarHBondContact ND2-O 3.09Å; T467-S515 WeakPolarHBondContact OG1-CB 3.28Å; T467-S515 PolarHBondContact OG1-N 2.98Å; T467-S515 PolarHBondContact OG1-OG 2.83Å
516	S	75.1	Confident	73.7	Confident	28 Å²	28	51.1 Å²	51.1	20%	0.196	27%	0.271	C	S	.	.			trans	-147.5	144.3	169.1	154.4	0	0	0	0	110.9	D518 E519	S516-D518 VanDerWaalsContact C-N 3.25Å; S516-D518 PolarHBondContact O-N 2.92Å; S516-D518 WeakPolarHBondContact OG-CB 3.37Å; S516-D518 PolarHBondContact OG-N 3.17Å; S516-D518 PolarHBondContact OG-OD2 2.69Å; S516-E519 PolarHBondContact O-N 3.1Å
517	P	78	Confident	76.4	Confident	25 Å²	25	47.6 Å²	47.6	16%	0.162	24%	0.244	C	C	.	.	H	α-helix	trans	-68.9	-24.1	175.9	31.9	-36.9	0	0	0	112.6	N183 M412 E519 I520 A521	N183-P517 WeakPolarHBondContact OD1-CD 3.24Å; M412-P517 HydrophobicContact CB-CB 4.37Å; M412-P517 HydrophobicContact CE-CG 4.35Å; M412-P517 HydrophobicContact CG-CB 3.76Å; M412-P517 HydrophobicContact CG-CG 3.84Å; P517-E519 PolarHBondContact O-N 3.36Å; P517-I520 PolarHBondContact O-N 3.47Å; P517-I520 VanDerWaalsContact O-N 3.16Å; P517-A521 PolarHBondContact O-N 3.49Å
518	D	82.1	Confident	78.6	Confident	33 Å²	33	46.8 Å²	46.8	18%	0.176	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-37.6	174.7	-52.8	-66.8	0	0	0	109.9	S516 A521 L522 R615	S516-D518 VanDerWaalsContact C-N 3.25Å; S516-D518 PolarHBondContact O-N 2.92Å; S516-D518 WeakPolarHBondContact OG-CB 3.37Å; S516-D518 PolarHBondContact OG-N 3.17Å; S516-D518 PolarHBondContact OG-OD2 2.69Å; D518-A521 PolarHBondContact O-N 2.99Å; D518-L522 VanDerWaalsContact O-CG 3.28Å; D518-L522 WeakPolarHBondContact O-CG 3.45Å; D518-L522 PolarHBondContact O-N 2.99Å; D518-R615 VanDerWaalsContact OD1-CD 3.3Å; D518-R615 WeakPolarHBondContact OD1-CD 3.4Å; D518-R615 IonicContact OD1-CZ 3.71Å; D518-R615 IonicContact OD1-NE 3.97Å; D518-R615 IonicContact OD1-NH1 3.1Å; D518-R615 PolarHBondContact OD1-NH1 3.18Å; D518-R615 IonicContact OD2-NH1 2.73Å; D518-R615 PolarHBondContact OD2-NH1 3.31Å
519	E	86.3	Confident	80.5	Confident	10 Å²	10	41.9 Å²	41.9	5%	0.047	21%	0.212	C	C	.	.	H	α-helix	trans	-67.3	-38.6	177.4	-49.8	-154.1	120	0	0	112.6	H466 T467 V468 A514 S516 P517 A521 L522 V523 K584	H466-E519 WeakPolarHBondContact CA-OE1 3.43Å; H466-E519 HydrophobicContact CB-CB 4.46Å; T467-E519 WeakPolarHBondContact CA-OE2 3.47Å; T467-E519 WeakPolarHBondContact CB-OE2 3.12Å; T467-E519 PolarHBondContact N-OE1 3.43Å; T467-E519 PolarHBondContact N-OE2 3.49Å; T467-E519 PolarHBondContact OG1-OE2 3.03Å; V468-E519 HydrophobicContact CG2-CB 3.51Å; A514-E519 HydrophobicContact CB-CB 4.26Å; S516-E519 PolarHBondContact O-N 3.1Å; P517-E519 PolarHBondContact O-N 3.36Å; E519-A521 VanDerWaalsContact C-N 3.32Å; E519-L522 PolarHBondContact O-N 3.47Å; E519-V523 WeakPolarHBondContact O-CG2 3.1Å; E519-V523 PolarHBondContact O-N 3.02Å; E519-K584 WeakPolarHBondContact OE1-CE 3.36Å; E519-K584 IonicContact OE1-NZ 3.78Å; E519-K584 PolarHBondContact OE1-NZ 3.46Å
520	I	87.4	Confident	82.3	Confident	35 Å²	35	33.9 Å²	33.9	18%	0.179	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-39.9	177.6	-61	175.1	0	0	0	109.8	F512 A514 P517 K524	F512-I520 HydrophobicContact CB-CG2 4.18Å; A514-I520 HydrophobicContact CB-CD1 3.98Å; A514-I520 HydrophobicContact CB-CG1 3.63Å; P517-I520 PolarHBondContact O-N 3.47Å; P517-I520 VanDerWaalsContact O-N 3.16Å; I520-K524 HydrophobicContact CG2-CD 4.04Å; I520-K524 HydrophobicContact CG2-CG 4.43Å; I520-K524 WeakPolarHBondContact O-CB 3.46Å; I520-K524 VanDerWaalsContact O-CG 3.28Å; I520-K524 WeakPolarHBondContact O-CG 3.14Å; I520-K524 PolarHBondContact O-N 3.21Å
521	A	88.8	Confident	83.6	Confident	3 Å²	3	30.6 Å²	30.6	3%	0.025	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-45.1	173.3	0	0	0	0	0	111.9	M412 P517 D518 E519 K524 G525 V669	M412-A521 HydrophobicContact CB-CB 3.7Å; M412-A521 WeakPolarHBondContact O-CB 3.49Å; P517-A521 PolarHBondContact O-N 3.49Å; D518-A521 PolarHBondContact O-N 2.99Å; E519-A521 VanDerWaalsContact C-N 3.32Å; A521-K524 PolarHBondContact O-N 2.88Å; A521-G525 PolarHBondContact O-N 3.09Å; A521-V669 HydrophobicContact CB-CG1 3.93Å; A521-V669 HydrophobicContact CB-CG2 4.45Å
522	L	91	Very high	84.4	Confident	3 Å²	3	30 Å²	30	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-44.8	177.4	-68.9	175.1	0	0	0	112.8	F414 L462 D518 E519 G525 A526 K584 L617 T667 V669	F414-L522 HydrophobicContact CD2-CD2 3.98Å; F414-L522 HydrophobicContact CE2-CD2 3.91Å; L462-L522 HydrophobicContact CD2-CB 4.48Å; L462-L522 HydrophobicContact CD2-CD1 4.45Å; L462-L522 HydrophobicContact CD2-CD2 4.03Å; D518-L522 VanDerWaalsContact O-CG 3.28Å; D518-L522 WeakPolarHBondContact O-CG 3.45Å; D518-L522 PolarHBondContact O-N 2.99Å; E519-L522 PolarHBondContact O-N 3.47Å; L522-G525 PolarHBondContact O-N 3.17Å; L522-A526 PolarHBondContact O-N 2.79Å; L522-K584 HydrophobicContact CD1-CD 4.16Å; L522-L617 HydrophobicContact CD1-CD1 4.12Å; L522-T667 HydrophobicContact CD2-CG2 3.76Å; L522-T667 WeakPolarHBondContact CD2-OG1 3.47Å; L522-V669 HydrophobicContact CD2-CG2 4.25Å
523	V	91.1	Very high	84.8	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.2	-42.3	178.8	174.4	0	0	0	0	111.7	H466 V468 F512 E519 G525 A526 M527 F533	H466-V523 WeakPolarHBondContact CD2-CG2 3.28Å; H466-V523 WeakPolarHBondContact NE2-CG2 3.36Å; V468-V523 HydrophobicContact CB-CG2 4.17Å; V468-V523 HydrophobicContact CG1-CG2 4.4Å; V468-V523 HydrophobicContact CG2-CG2 3.76Å; F512-V523 HydrophobicContact CD1-CG1 3.98Å; F512-V523 HydrophobicContact CE1-CG1 3.67Å; F512-V523 HydrophobicContact CE2-CG1 4.3Å; F512-V523 HydrophobicContact CG-CG1 4.42Å; F512-V523 HydrophobicContact CZ-CG1 3.84Å; E519-V523 WeakPolarHBondContact O-CG2 3.1Å; E519-V523 PolarHBondContact O-N 3.02Å; V523-G525 VanDerWaalsContact C-N 3.26Å; V523-G525 PolarHBondContact O-N 3.09Å; V523-A526 PolarHBondContact O-N 3.36Å; V523-M527 WeakPolarHBondContact O-CB 3.41Å; V523-M527 PolarHBondContact O-N 2.68Å; V523-F533 HydrophobicContact CG1-CB 4.12Å
524	K	88.8	Confident	85.4	Confident	100 Å²	100	30.5 Å²	30.5	44%	0.435	16%	0.16	S	C	.	.	H	α-helix	trans	-61.3	-36.2	171.6	-73.8	177.7	177.9	-177.3	0	111.8	F512 I520 A521 M527 R528	F512-K524 HydrophobicContact CD2-CG 4.17Å; F512-K524 HydrophobicContact CE2-CG 4.43Å; I520-K524 HydrophobicContact CG2-CD 4.04Å; I520-K524 HydrophobicContact CG2-CG 4.43Å; I520-K524 WeakPolarHBondContact O-CB 3.46Å; I520-K524 VanDerWaalsContact O-CG 3.28Å; I520-K524 WeakPolarHBondContact O-CG 3.14Å; I520-K524 PolarHBondContact O-N 3.21Å; A521-K524 PolarHBondContact O-N 2.88Å; K524-M527 PolarHBondContact O-N 2.81Å; K524-R528 WeakPolarHBondContact O-CG 3.49Å; K524-R528 PolarHBondContact O-N 3.32Å
525	G	88.9	Confident	85.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-53.6	172.4	0	0	0	0	0	112	A521 L522 V523 M527 R528 Y529	A521-G525 PolarHBondContact O-N 3.09Å; L522-G525 PolarHBondContact O-N 3.17Å; V523-G525 VanDerWaalsContact C-N 3.26Å; V523-G525 PolarHBondContact O-N 3.09Å; G525-M527 VanDerWaalsContact C-N 3.28Å; G525-M527 PolarHBondContact O-N 2.72Å; G525-R528 WeakPolarHBondContact O-CB 3.44Å; G525-R528 PolarHBondContact O-N 3.02Å; G525-R528 VanDerWaalsContact O-N 3.14Å; G525-Y529 VanDerWaalsContact O-CD2 3.29Å; G525-Y529 WeakPolarHBondContact O-CD2 3.32Å; G525-Y529 PolarHBondContact O-N 3.03Å; G525-Y529 VanDerWaalsContact O-N 3.12Å
526	A	89.6	Confident	86.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-38.3	177.2	0	0	0	0	0	112.6	L459 L462 C463 L522 V523 Y529 G530 F531	L459-A526 HydrophobicContact CD2-CB 4.3Å; L462-A526 HydrophobicContact CB-CB 4.1Å; L462-A526 HydrophobicContact CD1-CB 4.44Å; C463-A526 WeakPolarHBondContact SG-CB 3.4Å; L522-A526 PolarHBondContact O-N 2.79Å; V523-A526 PolarHBondContact O-N 3.36Å; A526-Y529 CarbonylContact O-C 3.5Å; A526-Y529 WeakPolarHBondContact O-CA 3.18Å; A526-Y529 PolarHBondContact O-N 2.96Å; A526-G530 PolarHBondContact O-N 3.17Å; A526-G530 VanDerWaalsContact O-N 3.12Å; A526-F531 CarbonylContact C-O 3.6Å; A526-F531 HydrophobicContact CB-CB 4.45Å; A526-F531 PolarHBondContact O-N 3.08Å
527	M	88.5	Confident	86.7	Confident	53 Å²	53	35.1 Å²	35.1	26%	0.261	18%	0.176	S	C	.	.	H	α-helix	trans	-60.7	-44.4	174.6	-170.5	-179.8	83.7	0	0	111.9	F512 V523 K524 G525 Y529 G530 F531 T532	F512-M527 HydrophobicContact CE2-SD 3.99Å; F512-M527 HydrophobicContact CZ-SD 4.15Å; V523-M527 WeakPolarHBondContact O-CB 3.41Å; V523-M527 PolarHBondContact O-N 2.68Å; K524-M527 PolarHBondContact O-N 2.81Å; G525-M527 VanDerWaalsContact C-N 3.28Å; G525-M527 PolarHBondContact O-N 2.72Å; M527-Y529 PolarHBondContact O-N 3.02Å; M527-G530 PolarHBondContact O-N 3Å; M527-F531 VanDerWaalsContact CA-O 3.27Å; M527-F531 WeakPolarHBondContact CA-O 3.32Å; M527-F531 PolarHBondContact N-O 3.11Å; M527-F531 VanDerWaalsContact N-O 3.1Å; M527-T532 HydrophobicContact CG-CG2 3.99Å; M527-T532 HydrophobicContact SD-CG2 4.15Å
528	R	84.9	Confident	86.7	Confident	129 Å²	129	39.3 Å²	39.3	49%	0.487	21%	0.206	S	C	.	.	H	α-helix	trans	-60.2	-31.6	172.6	-70.7	168.6	175.8	-176.4	-2	112.5	K524 G525 G530	K524-R528 WeakPolarHBondContact O-CG 3.49Å; K524-R528 PolarHBondContact O-N 3.32Å; G525-R528 WeakPolarHBondContact O-CB 3.44Å; G525-R528 PolarHBondContact O-N 3.02Å; G525-R528 VanDerWaalsContact O-N 3.14Å; R528-G530 VanDerWaalsContact C-N 3.32Å
529	Y	84.8	Confident	86.6	Confident	53 Å²	53	45.1 Å²	45.1	21%	0.208	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	10.8	174.1	-73.3	-72.2	0	0	0	114.3	F414 L459 G525 A526 M527 R546	F414-Y529 HydrophobicContact CD1-CE2 4.39Å; F414-Y529 HydrophobicContact CE1-CD2 4.5Å; F414-Y529 AromaticContact CE1-CE2 3.79Å; F414-Y529 HydrophobicContact CE1-CE2 3.79Å; L459-Y529 HydrophobicContact CD2-CG 4.41Å; G525-Y529 VanDerWaalsContact O-CD2 3.29Å; G525-Y529 WeakPolarHBondContact O-CD2 3.32Å; G525-Y529 PolarHBondContact O-N 3.03Å; G525-Y529 VanDerWaalsContact O-N 3.12Å; A526-Y529 CarbonylContact O-C 3.5Å; A526-Y529 WeakPolarHBondContact O-CA 3.18Å; A526-Y529 PolarHBondContact O-N 2.96Å; M527-Y529 PolarHBondContact O-N 3.02Å; Y529-R546 PolarHBondContact O-NE 2.89Å; Y529-R546 PolarHBondContact O-NH2 2.89Å
530	G	85.3	Confident	86.7	Confident	31 Å²	31	47.7 Å²	47.7	32%	0.32	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.1	14.9	171.9	0	0	0	0	0	116.1	A526 M527 R528 N545 R546	A526-G530 PolarHBondContact O-N 3.17Å; A526-G530 VanDerWaalsContact O-N 3.12Å; M527-G530 PolarHBondContact O-N 3Å; R528-G530 VanDerWaalsContact C-N 3.32Å; G530-N545 CarbonylContact O-C 3.58Å; G530-R546 WeakPolarHBondContact O-CA 3.44Å; G530-R546 WeakPolarHBondContact O-CG 3.29Å; G530-R546 PolarHBondContact O-N 3.43Å
531	F	90.1	Very high	86.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.			trans	-114.4	110.7	171.1	-88.5	-103	0	0	0	110.1	E456 L459 R460 C463 A526 M527 I543 L544 N545 R546	E456-F531 HydrophobicContact CB-CE2 4.32Å; E456-F531 HydrophobicContact CB-CZ 3.84Å; E456-F531 HydrophobicContact CG-CE2 4.05Å; E456-F531 HydrophobicContact CG-CZ 3.9Å; L459-F531 HydrophobicContact CB-CB 4Å; L459-F531 HydrophobicContact CB-CD1 4.18Å; L459-F531 HydrophobicContact CB-CD2 3.52Å; L459-F531 HydrophobicContact CB-CE2 3.95Å; L459-F531 HydrophobicContact CB-CG 3.63Å; L459-F531 HydrophobicContact CB-CZ 4.45Å; L459-F531 HydrophobicContact CD1-CD2 3.54Å; L459-F531 HydrophobicContact CD1-CE2 3.86Å; L459-F531 HydrophobicContact CD1-CG 4.43Å; L459-F531 HydrophobicContact CG-CD2 4.14Å; R460-F531 HydrophobicContact CG-CD1 4.31Å; R460-F531 HydrophobicContact CG-CE1 3.73Å; C463-F531 PolarHBondContact SG-O 3.15Å; A526-F531 CarbonylContact C-O 3.6Å; A526-F531 HydrophobicContact CB-CB 4.45Å; A526-F531 PolarHBondContact O-N 3.08Å; M527-F531 VanDerWaalsContact CA-O 3.27Å; M527-F531 WeakPolarHBondContact CA-O 3.32Å; M527-F531 PolarHBondContact N-O 3.11Å; M527-F531 VanDerWaalsContact N-O 3.1Å; F531-I543 HydrophobicContact CD1-CG2 3.96Å; F531-L544 WeakPolarHBondContact CA-O 3.39Å; F531-N545 HydrophobicContact CE1-CB 4.07Å; F531-N545 WeakPolarHBondContact CE2-OD1 3.46Å; F531-N545 HydrophobicContact CZ-CB 4.3Å; F531-N545 VanDerWaalsContact CZ-CG 3.41Å; F531-N545 WeakPolarHBondContact CZ-OD1 3.35Å; F531-R546 HydrophobicContact CD2-CG 3.99Å; F531-R546 HydrophobicContact CE2-CG 3.87Å
532	T	90.2	Very high	86.9	Confident	21 Å²	21	48.9 Å²	48.9	13%	0.129	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.6	-174.3	-49	0	0	0	0	111.2	M510 M527 L534 I543 L544	M510-T532 HydrophobicContact CE-CG2 3.43Å; M510-T532 VanDerWaalsContact CE-CG2 3.43Å; M527-T532 HydrophobicContact CG-CG2 3.99Å; M527-T532 HydrophobicContact SD-CG2 4.15Å; T532-L534 HydrophobicContact CG2-CD2 4.33Å; T532-L534 PolarHBondContact O-N 3.28Å; T532-I543 CarbonylContact O-C 3.54Å; T532-I543 WeakPolarHBondContact O-CA 3.45Å; T532-L544 PolarHBondContact N-O 2.91Å; T532-L544 PolarHBondContact O-N 3.35Å
533	F	90.8	Very high	87	Confident	1 Å²	1	48.7 Å²	48.7	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	125.4	168.7	179	-109.4	0	0	0	110	C463 H466 V468 V470 V523 G535 L536 M541 I543	C463-F533 HydrophobicContact CB-CB 4.4Å; C463-F533 WeakPolarHBondContact O-CD2 3.29Å; H466-F533 AromaticContact CE1-CD1 3.77Å; H466-F533 AromaticContact CE1-CD2 3.86Å; H466-F533 AromaticContact CE1-CE1 3.75Å; H466-F533 AromaticContact CE1-CE2 3.85Å; H466-F533 AromaticContact CE1-CG 3.82Å; H466-F533 AromaticContact CE1-CZ 3.79Å; H466-F533 AromaticContact NE2-CD1 3.97Å; H466-F533 AromaticContact NE2-CD2 3.96Å; H466-F533 AromaticContact NE2-CG 3.73Å; V468-F533 VanDerWaalsContact O-CE1 3.23Å; V468-F533 WeakPolarHBondContact O-CE1 3.38Å; V470-F533 HydrophobicContact CG2-CD1 4.02Å; V470-F533 HydrophobicContact CG2-CE1 4.24Å; V523-F533 HydrophobicContact CG1-CB 4.12Å; F533-G535 VanDerWaalsContact CE2-O 3.31Å; F533-G535 WeakPolarHBondContact CE2-O 3.49Å; F533-G535 WeakPolarHBondContact CZ-O 3.29Å; F533-L536 HydrophobicContact CZ-CB 4.5Å; F533-M541 HydrophobicContact CD2-CE 4.25Å; F533-M541 HydrophobicContact CE2-CB 4.16Å; F533-M541 HydrophobicContact CE2-CE 3.53Å; F533-M541 HydrophobicContact CE2-CG 4.35Å; F533-M541 HydrophobicContact CZ-CE 4.08Å; F533-I543 HydrophobicContact CD2-CG1 4.21Å
534	L	87.1	Confident	87	Confident	59 Å²	59	51 Å²	51	31%	0.309	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-20.5	-174.8	-61.8	177.6	0	0	0	113.4	M510 T532 K542 L544 V550	M510-L534 HydrophobicContact CE-CD2 4.42Å; T532-L534 HydrophobicContact CG2-CD2 4.33Å; T532-L534 PolarHBondContact O-N 3.28Å; L534-K542 HydrophobicContact CB-CB 3.94Å; L534-K542 HydrophobicContact CD1-CB 4.46Å; L534-K542 PolarHBondContact N-O 3.36Å; L534-L544 HydrophobicContact CD1-CB 4.16Å; L534-L544 HydrophobicContact CD2-CB 4.3Å; L534-L544 HydrophobicContact CG-CB 4.27Å; L534-V550 HydrophobicContact CD1-CG1 4.18Å; L534-V550 HydrophobicContact CD1-CG2 4.13Å
535	G	85.1	Confident	86.9	Confident	8 Å²	8	46.5 Å²	46.5	8%	0.082	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	142.2	179.7	179.8	0	0	0	0	0	114.5	F533 K542	F533-G535 VanDerWaalsContact CE2-O 3.31Å; F533-G535 WeakPolarHBondContact CE2-O 3.49Å; F533-G535 WeakPolarHBondContact CZ-O 3.29Å; G535-K542 PolarHBondContact O-N 3.36Å
536	L	82.2	Confident	86.7	Confident	68 Å²	68	50.4 Å²	50.4	36%	0.356	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	109.3	176.3	175.4	72.2	0	0	0	108.6	F533 N540 M541 L555	F533-L536 HydrophobicContact CZ-CB 4.5Å; L536-N540 WeakPolarHBondContact CA-O 3.43Å; L536-M541 HydrophobicContact CD1-CG 3.59Å; L536-L555 HydrophobicContact CD1-CB 4.31Å; L536-L555 HydrophobicContact CD1-CD2 3.9Å; L536-L555 HydrophobicContact CD2-CD2 4.13Å
537	E	80.7	Confident	86.4	Confident	106 Å²	106	55.2 Å²	55.2	50%	0.495	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.1	179.1	-76.8	170.6	-128.1	0	0	110	K539 N540 K542	E537-K539 VanDerWaalsContact C-N 3.31Å; E537-K539 PolarHBondContact O-N 3.13Å; E537-N540 PolarHBondContact N-O 2.87Å; E537-N540 WeakPolarHBondContact O-CA 3.33Å; E537-N540 WeakPolarHBondContact O-CB 3.34Å; E537-N540 PolarHBondContact O-N 2.86Å; E537-K542 VanDerWaalsContact OE1-CE 3.31Å; E537-K542 WeakPolarHBondContact OE1-CE 3.44Å; E537-K542 IonicContact OE1-NZ 2.65Å; E537-K542 PolarHBondContact OE1-NZ 3.23Å; E537-K542 WeakPolarHBondContact OE2-CE 3.09Å; E537-K542 IonicContact OE2-NZ 3.88Å; E537-K542 PolarHBondContact OE2-NZ 3.18Å
538	S	77.4	Confident	86.1	Confident	113 Å²	113	60.1 Å²	60.1	79%	0.79	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	49.8	175.3	-52.4	0	0	0	0	113.4	N540	S538-N540 VanDerWaalsContact C-N 3.27Å; S538-N540 PolarHBondContact O-N 2.75Å; S538-N540 PolarHBondContact O-ND2 2.82Å; S538-N540 VanDerWaalsContact O-ND2 3.13Å
539	K	80.7	Confident	86.3	Confident	154 Å²	154	58.4 Å²	58.4	67%	0.67	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	5.9	-172.7	-54.5	-176	-179.4	-179.9	0	116.8	E537 L555	E537-K539 VanDerWaalsContact C-N 3.31Å; E537-K539 PolarHBondContact O-N 3.13Å; K539-L555 VanDerWaalsContact O-CB 3.28Å; K539-L555 WeakPolarHBondContact O-CB 3.39Å; K539-L555 PolarHBondContact O-N 3.09Å
540	N	88.2	Confident	86.5	Confident	64 Å²	64	59.3 Å²	59.3	34%	0.342	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116.2	175.9	-64.5	-81.3	0	0	0	111.1	L536 E537 S538 Y553	L536-N540 WeakPolarHBondContact CA-O 3.43Å; E537-N540 PolarHBondContact N-O 2.87Å; E537-N540 WeakPolarHBondContact O-CA 3.33Å; E537-N540 WeakPolarHBondContact O-CB 3.34Å; E537-N540 PolarHBondContact O-N 2.86Å; S538-N540 VanDerWaalsContact C-N 3.27Å; S538-N540 PolarHBondContact O-N 2.75Å; S538-N540 PolarHBondContact O-ND2 2.82Å; S538-N540 VanDerWaalsContact O-ND2 3.13Å; N540-Y553 CarbonylContact C-O 2.86Å; N540-Y553 WeakPolarHBondContact CA-O 3.25Å
541	M	89.3	Confident	86.8	Confident	7 Å²	7	59.5 Å²	59.5	3%	0.034	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	129.9	170.8	-66.8	-176	78.8	0	0	109.5	L464 F533 L536 T552 Y553 L555	L464-M541 HydrophobicContact CD2-CB 4.06Å; L464-M541 HydrophobicContact CD2-CE 4.21Å; L464-M541 HydrophobicContact CD2-SD 4.01Å; F533-M541 HydrophobicContact CD2-CE 4.25Å; F533-M541 HydrophobicContact CE2-CB 4.16Å; F533-M541 HydrophobicContact CE2-CE 3.53Å; F533-M541 HydrophobicContact CE2-CG 4.35Å; F533-M541 HydrophobicContact CZ-CE 4.08Å; L536-M541 HydrophobicContact CD1-CG 3.59Å; M541-T552 CarbonylContact O-C 3.56Å; M541-T552 VanDerWaalsContact O-CA 3.32Å; M541-T552 WeakPolarHBondContact O-CA 3.44Å; M541-Y553 PolarHBondContact N-O 3.29Å; M541-Y553 PolarHBondContact O-N 3.15Å; M541-L555 HydrophobicContact CG-CB 4.44Å; M541-L555 HydrophobicContact SD-CD1 4.29Å
542	K	90.8	Very high	86.8	Confident	56 Å²	56	61 Å²	61	24%	0.243	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132	179.3	-62.4	-174	-178.4	174.6	0	110.9	L534 G535 E537 V550 E551 T552	L534-K542 HydrophobicContact CB-CB 3.94Å; L534-K542 HydrophobicContact CD1-CB 4.46Å; L534-K542 PolarHBondContact N-O 3.36Å; G535-K542 PolarHBondContact O-N 3.36Å; E537-K542 VanDerWaalsContact OE1-CE 3.31Å; E537-K542 WeakPolarHBondContact OE1-CE 3.44Å; E537-K542 IonicContact OE1-NZ 2.65Å; E537-K542 PolarHBondContact OE1-NZ 3.23Å; E537-K542 WeakPolarHBondContact OE2-CE 3.09Å; E537-K542 IonicContact OE2-NZ 3.88Å; E537-K542 PolarHBondContact OE2-NZ 3.18Å; K542-V550 HydrophobicContact CB-CG1 4.4Å; K542-E551 WeakPolarHBondContact CA-O 3.46Å; K542-T552 HydrophobicContact CG-CG2 4.26Å
543	I	92.3	Very high	86.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134.4	178.7	-66.5	171.7	0	0	0	109.7	C463 L464 F531 T532 F533 V550 E551	C463-I543 HydrophobicContact CB-CD1 3.57Å; C463-I543 HydrophobicContact CB-CG1 4.04Å; L464-I543 HydrophobicContact CD1-CD1 4.27Å; L464-I543 HydrophobicContact CD2-CD1 3.47Å; L464-I543 VanDerWaalsContact CD2-CD1 3.47Å; L464-I543 HydrophobicContact CG-CD1 3.54Å; F531-I543 HydrophobicContact CD1-CG2 3.96Å; T532-I543 CarbonylContact O-C 3.54Å; T532-I543 WeakPolarHBondContact O-CA 3.45Å; F533-I543 HydrophobicContact CD2-CG1 4.21Å; I543-V550 CarbonylContact O-C 3.51Å; I543-V550 WeakPolarHBondContact O-CA 3.27Å; I543-E551 PolarHBondContact N-O 2.97Å; I543-E551 PolarHBondContact O-N 3.49Å
544	L	90.6	Very high	87	Confident	47 Å²	47	64.4 Å²	64.4	25%	0.246	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	115.3	166.8	-164.4	71.9	0	0	0	109.1	F531 T532 L534 K548 D549 V550	F531-L544 WeakPolarHBondContact CA-O 3.39Å; T532-L544 PolarHBondContact N-O 2.91Å; T532-L544 PolarHBondContact O-N 3.35Å; L534-L544 HydrophobicContact CD1-CB 4.16Å; L534-L544 HydrophobicContact CD2-CB 4.3Å; L534-L544 HydrophobicContact CG-CB 4.27Å; L544-K548 HydrophobicContact CD1-CB 4.41Å; L544-K548 VanDerWaalsContact CD1-O 3.28Å; L544-K548 WeakPolarHBondContact CD1-O 3.47Å; L544-D549 WeakPolarHBondContact CA-O 3.29Å; L544-V550 HydrophobicContact CD1-CG2 3.93Å
545	N	87.3	Confident	87.1	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.037	32%	0.319	C	S	.	.			trans	-79.5	165.5	172.7	-169.9	-21.1	0	0	0	109.9	R460 G530 F531 N547 K548 D549 E551	R460-N545 PolarHBondContact NH2-ND2 3.25Å; G530-N545 CarbonylContact O-C 3.58Å; F531-N545 HydrophobicContact CE1-CB 4.07Å; F531-N545 WeakPolarHBondContact CE2-OD1 3.46Å; F531-N545 HydrophobicContact CZ-CB 4.3Å; F531-N545 VanDerWaalsContact CZ-CG 3.41Å; F531-N545 WeakPolarHBondContact CZ-OD1 3.35Å; N545-N547 PolarHBondContact O-N 2.87Å; N545-N547 VanDerWaalsContact O-N 3.07Å; N545-K548 WeakPolarHBondContact O-CA 3.43Å; N545-K548 PolarHBondContact O-N 3.45Å; N545-D549 PolarHBondContact N-O 2.74Å; N545-E551 HydrophobicContact CB-CG 4.48Å; N545-E551 PolarHBondContact ND2-OE1 3.22Å
546	R	84.3	Confident	87.4	Confident	82 Å²	82	63.7 Å²	63.7	31%	0.309	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-33.1	178.4	-72.8	177.5	169.1	174.4	-2.4	114.4	E455 Y529 G530 F531 K548	E455-R546 IonicContact OE1-CZ 3.71Å; E455-R546 IonicContact OE1-NH1 3.62Å; E455-R546 PolarHBondContact OE1-NH1 3.36Å; E455-R546 IonicContact OE1-NH2 2.68Å; E455-R546 PolarHBondContact OE1-NH2 3.41Å; E455-R546 IonicContact OE2-NH1 3.58Å; Y529-R546 PolarHBondContact O-NE 2.89Å; Y529-R546 PolarHBondContact O-NH2 2.89Å; G530-R546 WeakPolarHBondContact O-CA 3.44Å; G530-R546 WeakPolarHBondContact O-CG 3.29Å; G530-R546 PolarHBondContact O-N 3.43Å; F531-R546 HydrophobicContact CD2-CG 3.99Å; F531-R546 HydrophobicContact CE2-CG 3.87Å; R546-K548 PolarHBondContact O-N 2.75Å
547	N	84.3	Confident	87.7	Confident	100 Å²	100	62.4 Å²	62.4	54%	0.535	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-5.9	176.8	-64.1	-4.8	0	0	0	113.8	N545 D549	N545-N547 PolarHBondContact O-N 2.87Å; N545-N547 VanDerWaalsContact O-N 3.07Å; N547-D549 VanDerWaalsContact C-N 3.28Å; N547-D549 WeakPolarHBondContact CB-OD2 3.36Å; N547-D549 PolarHBondContact ND2-OD2 2.98Å
548	K	82.4	Confident	88	Confident	157 Å²	157	59.2 Å²	59.2	68%	0.683	30%	0.3	S	S	*	.	S	Bend	trans	69.8	16.6	-168.2	-52.3	-179.6	-178.7	179.7	0	114.8	L544 N545 R546	L544-K548 HydrophobicContact CD1-CB 4.41Å; L544-K548 VanDerWaalsContact CD1-O 3.28Å; L544-K548 WeakPolarHBondContact CD1-O 3.47Å; N545-K548 WeakPolarHBondContact O-CA 3.43Å; N545-K548 PolarHBondContact O-N 3.45Å; R546-K548 PolarHBondContact O-N 2.75Å
549	D	88.4	Confident	88.6	Confident	93 Å²	93	53.9 Å²	53.9	50%	0.497	26%	0.262	S	S	.	.			trans	-76.6	141.4	169.7	-64.4	-54.5	0	0	0	111.7	L544 N545 N547	L544-D549 WeakPolarHBondContact CA-O 3.29Å; N545-D549 PolarHBondContact N-O 2.74Å; N547-D549 VanDerWaalsContact C-N 3.28Å; N547-D549 WeakPolarHBondContact CB-OD2 3.36Å; N547-D549 PolarHBondContact ND2-OD2 2.98Å
550	V	89.2	Confident	88.6	Confident	72 Å²	72	50.1 Å²	50.1	44%	0.436	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	99.2	176.4	-177.4	0	0	0	0	110.9	L534 K542 I543 L544 T552	L534-V550 HydrophobicContact CD1-CG1 4.18Å; L534-V550 HydrophobicContact CD1-CG2 4.13Å; K542-V550 HydrophobicContact CB-CG1 4.4Å; I543-V550 CarbonylContact O-C 3.51Å; I543-V550 WeakPolarHBondContact O-CA 3.27Å; L544-V550 HydrophobicContact CD1-CG2 3.93Å; V550-T552 HydrophobicContact CG1-CG2 4.25Å
551	E	90.5	Very high	88.3	Confident	35 Å²	35	53 Å²	53	16%	0.164	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	144.7	168.6	-63.8	-177.7	-177.7	0	0	110.1	R460 K542 I543 N545 Y553	R460-E551 IonicContact CZ-OE1 2.8Å; R460-E551 IonicContact CZ-OE2 2.7Å; R460-E551 IonicContact NE-OE1 3.69Å; R460-E551 IonicContact NE-OE2 2.7Å; R460-E551 PolarHBondContact NE-OE2 3.44Å; R460-E551 IonicContact NH2-OE1 3.73Å; R460-E551 PolarHBondContact NH2-OE1 3.46Å; R460-E551 IonicContact NH2-OE2 2.72Å; K542-E551 WeakPolarHBondContact CA-O 3.46Å; I543-E551 PolarHBondContact N-O 2.97Å; I543-E551 PolarHBondContact O-N 3.49Å; N545-E551 HydrophobicContact CB-CG 4.48Å; N545-E551 PolarHBondContact ND2-OE1 3.22Å; E551-Y553 HydrophobicContact CB-CE2 3.96Å
552	T	90.8	Very high	87.4	Confident	31 Å²	31	54.7 Å²	54.7	19%	0.19	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	127.7	-179	62.5	0	0	0	0	110.3	M541 K542 V550 K575	M541-T552 CarbonylContact O-C 3.56Å; M541-T552 VanDerWaalsContact O-CA 3.32Å; M541-T552 WeakPolarHBondContact O-CA 3.44Å; K542-T552 HydrophobicContact CG-CG2 4.26Å; V550-T552 HydrophobicContact CG1-CG2 4.25Å; T552-K575 WeakPolarHBondContact OG1-CD 2.94Å; T552-K575 WeakPolarHBondContact OG1-CE 3.24Å; T552-K575 PolarHBondContact OG1-NZ 3.15Å
553	Y	92.5	Very high	86.1	Confident	18 Å²	18	56.7 Å²	56.7	7%	0.071	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.5	-175.8	-72.6	-86.4	0	0	0	110.2	L464 N540 M541 E551 L555 V572 R573	L464-Y553 HydrophobicContact CD1-CD1 4.33Å; L464-Y553 HydrophobicContact CD1-CD2 3.98Å; L464-Y553 HydrophobicContact CD1-CE1 4.39Å; L464-Y553 HydrophobicContact CD1-CE2 4.03Å; L464-Y553 HydrophobicContact CD1-CG 4.13Å; L464-Y553 HydrophobicContact CD2-CD2 3.82Å; L464-Y553 HydrophobicContact CD2-CG 3.98Å; L464-Y553 HydrophobicContact CG-CD2 4.49Å; N540-Y553 CarbonylContact C-O 2.86Å; N540-Y553 WeakPolarHBondContact CA-O 3.25Å; M541-Y553 PolarHBondContact N-O 3.29Å; M541-Y553 PolarHBondContact O-N 3.15Å; E551-Y553 HydrophobicContact CB-CE2 3.96Å; Y553-L555 PolarHBondContact O-N 3.2Å; Y553-V572 HydrophobicContact CD1-CB 4.37Å; Y553-V572 HydrophobicContact CD1-CG2 3.91Å; Y553-V572 HydrophobicContact CG-CG2 4.49Å; Y553-R573 WeakPolarHBondContact CA-O 3.15Å
554	E	92.7	Very high	85.1	Confident	76 Å²	76	62.1 Å²	62.1	36%	0.355	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	120.7	175.4	179.5	-165	161.9	0	0	109	L556 V572 R573	E554-L556 HydrophobicContact CG-CD2 4.1Å; E554-L556 PolarHBondContact O-N 3.18Å; E554-L556 WeakPolarHBondContact OE1-CD2 3.38Å; E554-V572 CarbonylContact O-C 3.44Å; E554-V572 VanDerWaalsContact O-CA 3.24Å; E554-V572 WeakPolarHBondContact O-CA 3.22Å; E554-R573 HydrophobicContact CB-CB 4.19Å; E554-R573 PolarHBondContact N-O 3.34Å; E554-R573 PolarHBondContact O-N 2.87Å; E554-R573 IonicContact OE1-CZ 2.73Å; E554-R573 IonicContact OE1-NH1 2.66Å; E554-R573 PolarHBondContact OE1-NH1 3.24Å; E554-R573 IonicContact OE2-CZ 2.83Å; E554-R573 IonicContact OE2-NE 2.8Å; E554-R573 IonicContact OE2-NH1 2.66Å; E554-R573 PolarHBondContact OE2-NH1 2.99Å
555	L	90.4	Very high	84.6	Confident	31 Å²	31	60.2 Å²	60.2	16%	0.162	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	111.7	179.5	178.5	59.9	0	0	0	110.2	L536 K539 M541 Y553 V558 V570 V572	L536-L555 HydrophobicContact CD1-CB 4.31Å; L536-L555 HydrophobicContact CD1-CD2 3.9Å; L536-L555 HydrophobicContact CD2-CD2 4.13Å; K539-L555 VanDerWaalsContact O-CB 3.28Å; K539-L555 WeakPolarHBondContact O-CB 3.39Å; K539-L555 PolarHBondContact O-N 3.09Å; M541-L555 HydrophobicContact CG-CB 4.44Å; M541-L555 HydrophobicContact SD-CD1 4.29Å; Y553-L555 PolarHBondContact O-N 3.2Å; L555-V558 HydrophobicContact CD1-CG2 3.95Å; L555-V558 HydrophobicContact CD2-CG2 4.11Å; L555-V558 HydrophobicContact CG-CG2 4.44Å; L555-V570 HydrophobicContact CD1-CG1 3.33Å; L555-V572 HydrophobicContact CD1-CG1 4.44Å
556	L	90.4	Very high	84.3	Confident	20 Å²	20	64.3 Å²	64.3	11%	0.105	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-55.7	-177.2	-54.7	178.2	0	0	0	111.1	E554 M571 R573 I579 Y629	E554-L556 HydrophobicContact CG-CD2 4.1Å; E554-L556 PolarHBondContact O-N 3.18Å; E554-L556 WeakPolarHBondContact OE1-CD2 3.38Å; L556-M571 HydrophobicContact CB-CB 4.07Å; L556-M571 PolarHBondContact N-O 2.95Å; L556-R573 HydrophobicContact CD1-CB 4.19Å; L556-R573 HydrophobicContact CD2-CB 4.3Å; L556-R573 HydrophobicContact CG-CB 4.41Å; L556-I579 HydrophobicContact CD1-CD1 4.45Å; L556-I579 HydrophobicContact CD1-CG1 4.44Å; L556-I579 HydrophobicContact CD1-CG2 3.85Å; L556-Y629 HydrophobicContact CB-CE2 3.81Å; L556-Y629 HydrophobicContact CD1-CD2 3.91Å; L556-Y629 HydrophobicContact CD1-CE2 3.47Å; L556-Y629 VanDerWaalsContact CD1-CE2 3.47Å; L556-Y629 HydrophobicContact CG-CE2 4.22Å
557	H	88.1	Confident	84.5	Confident	42 Å²	42	60.9 Å²	60.9	19%	0.194	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	141.7	177.2	-69.7	-49.9	0	0	0	112	M571 D633 R640	H557-M571 HydrophobicContact CB-CB 4.36Å; H557-M571 HydrophobicContact CB-SD 4.24Å; H557-M571 PolarHBondContact N-O 3.48Å; H557-M571 PolarHBondContact O-N 2.95Å; H557-D633 IonicContact NE2-OD1 3.24Å; H557-D633 PolarHBondContact NE2-OD1 3.31Å; H557-R640 PolarHBondContact ND1-NH1 3.21Å; H557-R640 PolarHBondContact NE2-NH1 2.93Å
558	V	87	Confident	84.8	Confident	39 Å²	39	56.3 Å²	56.3	24%	0.236	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.6	161	-175.2	0	0	0	0	108.3	L555 N560 M568 V570	L555-V558 HydrophobicContact CD1-CG2 3.95Å; L555-V558 HydrophobicContact CD2-CG2 4.11Å; L555-V558 HydrophobicContact CG-CG2 4.44Å; V558-N560 WeakPolarHBondContact CG1-OD1 3.47Å; V558-M568 HydrophobicContact CG1-CE 3.51Å; V558-V570 HydrophobicContact CG1-CG2 4.42Å
559	L	89.6	Confident	85.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	83	172.5	-61.3	165.1	0	0	0	106.7	R565 S569 M571 L581 L636 Y654 V657	L559-R565 PolarHBondContact O-NH2 3.17Å; L559-S569 WeakPolarHBondContact CA-O 3.28Å; L559-S569 WeakPolarHBondContact CB-O 3.44Å; L559-S569 PolarHBondContact N-O 3.47Å; L559-S569 PolarHBondContact O-N 2.89Å; L559-S569 VanDerWaalsContact O-N 3.1Å; L559-M571 HydrophobicContact CD1-CE 4.31Å; L559-L581 HydrophobicContact CD1-CD1 3.99Å; L559-L636 HydrophobicContact CD2-CD1 4.18Å; L559-L636 HydrophobicContact CD2-CD2 3.83Å; L559-Y654 HydrophobicContact CD2-CD1 3.5Å; L559-Y654 VanDerWaalsContact CD2-CD1 3.5Å; L559-Y654 HydrophobicContact CD2-CE1 3.47Å; L559-Y654 VanDerWaalsContact CD2-CE1 3.47Å; L559-Y654 HydrophobicContact CD2-CG 4.27Å; L559-V657 HydrophobicContact CD1-CG1 4.22Å
560	N	82.3	Confident	85.6	Confident	76 Å²	76	44.4 Å²	44.4	41%	0.406	23%	0.231	S	C	.	.			trans	-45.3	148.7	-171.1	-66.6	-13.7	0	0	0	113.7	V558 D562 R565	V558-N560 WeakPolarHBondContact CG1-OD1 3.47Å; N560-D562 PolarHBondContact O-N 3.16Å; N560-R565 PolarHBondContact O-NH2 3.45Å
561	F	80.8	Confident	85.9	Confident	125 Å²	125	41 Å²	41	55%	0.548	21%	0.21	S	C	.	.			trans	-57	135.1	172.7	-177.4	-92.5	0	0	0	110.9	P563 M568	F561-P563 HydrophobicContact CE1-CG 4.36Å; F561-M568 HydrophobicContact CB-CB 4.15Å
562	D	71.2	Confident	86	Confident	42 Å²	42	39.3 Å²	39.3	23%	0.225	20%	0.203	C	C	.	.			trans	-126.1	130.6	177	171.7	-74.4	0	0	0	108.8	N560 V564 R565 R566 M651	N560-D562 PolarHBondContact O-N 3.16Å; D562-V564 VanDerWaalsContact C-N 3.29Å; D562-V564 PolarHBondContact O-N 3.06Å; D562-V564 VanDerWaalsContact OD1-CA 3.3Å; D562-V564 WeakPolarHBondContact OD1-CA 3.5Å; D562-V564 VanDerWaalsContact OD1-CB 3.27Å; D562-V564 WeakPolarHBondContact OD1-CB 3.37Å; D562-V564 PolarHBondContact OD1-N 2.92Å; D562-R565 HydrophobicContact CB-CB 3.78Å; D562-R565 PolarHBondContact O-N 3.3Å; D562-R565 WeakPolarHBondContact OD1-CB 3.14Å; D562-R565 PolarHBondContact OD1-N 3.21Å; D562-R566 WeakPolarHBondContact O-CA 3.01Å; D562-R566 PolarHBondContact O-N 3.49Å; D562-M651 HydrophobicContact CB-SD 4.43Å
563	P	63.7	Low	86.1	Confident	97 Å²	97	41.3 Å²	41.3	63%	0.63	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-21	-176.3	-23.5	34.8	0	0	0	115.9	F561 R566	F561-P563 HydrophobicContact CE1-CG 4.36Å; P563-R566 WeakPolarHBondContact O-CG 3.46Å
564	V	69.6	Low	86	Confident	114 Å²	114	41.5 Å²	41.5	69%	0.691	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-45.1	175.1	-172.1	0	0	0	0	109.5	D562 M651	D562-V564 VanDerWaalsContact C-N 3.29Å; D562-V564 PolarHBondContact O-N 3.06Å; D562-V564 VanDerWaalsContact OD1-CA 3.3Å; D562-V564 WeakPolarHBondContact OD1-CA 3.5Å; D562-V564 VanDerWaalsContact OD1-CB 3.27Å; D562-V564 WeakPolarHBondContact OD1-CB 3.37Å; D562-V564 PolarHBondContact OD1-N 2.92Å; V564-M651 HydrophobicContact CB-CE 4.24Å; V564-M651 HydrophobicContact CG1-CE 4.38Å
565	R	80.3	Confident	85.6	Confident	7 Å²	7	45.1 Å²	45.1	3%	0.026	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-37.1	178.2	-151.7	175.6	54.6	141.3	-5.2	112.6	L559 N560 D562 R567 S589 M651 E658	L559-R565 PolarHBondContact O-NH2 3.17Å; N560-R565 PolarHBondContact O-NH2 3.45Å; D562-R565 HydrophobicContact CB-CB 3.78Å; D562-R565 PolarHBondContact O-N 3.3Å; D562-R565 WeakPolarHBondContact OD1-CB 3.14Å; D562-R565 PolarHBondContact OD1-N 3.21Å; R565-R567 VanDerWaalsContact C-N 3.27Å; R565-R567 HydrophobicContact CG-CG 3.91Å; R565-R567 PolarHBondContact NE-O 3.46Å; R565-R567 PolarHBondContact NH2-O 3.42Å; R565-R567 PolarHBondContact O-N 2.86Å; R565-S589 WeakPolarHBondContact O-CB 3.21Å; R565-S589 PolarHBondContact O-OG 3.17Å; R565-M651 HydrophobicContact CB-CE 3.84Å; R565-M651 HydrophobicContact CB-SD 3.94Å; R565-M651 HydrophobicContact CG-CE 4.15Å; R565-M651 HydrophobicContact CG-SD 4.05Å; R565-E658 IonicContact CZ-OE1 2.73Å; R565-E658 IonicContact CZ-OE2 3.62Å; R565-E658 IonicContact NH1-OE1 3.48Å; R565-E658 PolarHBondContact NH1-OE1 2.83Å; R565-E658 IonicContact NH1-OE2 3.54Å; R565-E658 PolarHBondContact NH1-OE2 2.71Å
566	R	82.3	Confident	85.3	Confident	94 Å²	94	48.7 Å²	48.7	36%	0.355	25%	0.248	S	C	.	.			trans	56.1	32.6	-178.5	-51.8	175.3	-173.5	150.2	5.6	115	D562 P563 G585 A586	D562-R566 WeakPolarHBondContact O-CA 3.01Å; D562-R566 PolarHBondContact O-N 3.49Å; P563-R566 WeakPolarHBondContact O-CG 3.46Å; R566-G585 WeakPolarHBondContact O-CA 3.34Å; R566-A586 HydrophobicContact CB-CB 4.15Å; R566-A586 PolarHBondContact O-N 2.93Å
567	R	88.8	Confident	85	Confident	9 Å²	9	49.9 Å²	49.9	3%	0.034	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	160	173.6	61.1	-174.9	-170.1	-106.2	-13.5	110.4	R565 K584 S589 I590 N655 E658	R565-R567 VanDerWaalsContact C-N 3.27Å; R565-R567 HydrophobicContact CG-CG 3.91Å; R565-R567 PolarHBondContact NE-O 3.46Å; R565-R567 PolarHBondContact NH2-O 3.42Å; R565-R567 PolarHBondContact O-N 2.86Å; R567-K584 CarbonylContact C-O 3.59Å; R567-K584 VanDerWaalsContact CA-O 3.23Å; R567-K584 WeakPolarHBondContact CA-O 3.49Å; R567-K584 VanDerWaalsContact CB-O 3.31Å; R567-K584 WeakPolarHBondContact CB-O 3.38Å; R567-S589 PolarHBondContact NH1-O 2.73Å; R567-I590 HydrophobicContact CB-CD1 4.03Å; R567-N655 PolarHBondContact NH2-OD1 3.34Å; R567-E658 IonicContact CZ-OE2 2.85Å; R567-E658 VanDerWaalsContact CZ-OE2 3.22Å; R567-E658 IonicContact NE-OE2 3.81Å; R567-E658 PolarHBondContact NE-OE2 3.27Å; R567-E658 IonicContact NH2-OE2 2.96Å; R567-E658 PolarHBondContact NH2-OE2 3.45Å
568	M	90.8	Very high	85	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.02	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144.2	175.1	178.8	-172.6	175.9	0	0	107.8	T467 V558 F561 V570 C583 K584	T467-M568 HydrophobicContact CG2-CE 3.62Å; T467-M568 HydrophobicContact CG2-SD 4.33Å; V558-M568 HydrophobicContact CG1-CE 3.51Å; F561-M568 HydrophobicContact CB-CB 4.15Å; M568-V570 HydrophobicContact CE-CG2 4Å; M568-C583 WeakPolarHBondContact O-CA 3.42Å; M568-K584 PolarHBondContact N-O 3.05Å; M568-K584 PolarHBondContact O-N 2.9Å
569	S	93.8	Very high	85.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	156	176.1	-54.5	0	0	0	0	112	L559 F582 C583 E658	L559-S569 WeakPolarHBondContact CA-O 3.28Å; L559-S569 WeakPolarHBondContact CB-O 3.44Å; L559-S569 PolarHBondContact N-O 3.47Å; L559-S569 PolarHBondContact O-N 2.89Å; L559-S569 VanDerWaalsContact O-N 3.1Å; S569-F582 CarbonylContact C-O 3.33Å; S569-F582 WeakPolarHBondContact CA-O 3.47Å; S569-F582 VanDerWaalsContact CB-O 3.24Å; S569-F582 WeakPolarHBondContact CB-O 3.35Å; S569-C583 VanDerWaalsContact OG-CB 3.28Å; S569-C583 WeakPolarHBondContact OG-CB 3.32Å; S569-C583 PolarHBondContact OG-SG 2.91Å; S569-E658 WeakPolarHBondContact CB-OE1 3.02Å; S569-E658 PolarHBondContact OG-OE1 2.93Å
570	V	93.6	Very high	85.5	Confident	1 Å²	1	51 Å²	51	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	129.3	178.4	-177	0	0	0	0	109.2	L555 V558 M568 V572 F582	L555-V570 HydrophobicContact CD1-CG1 3.33Å; V558-V570 HydrophobicContact CG1-CG2 4.42Å; M568-V570 HydrophobicContact CE-CG2 4Å; V570-V572 HydrophobicContact CG1-CG1 3.93Å; V570-F582 PolarHBondContact N-O 3.42Å; V570-F582 PolarHBondContact O-N 2.82Å
571	M	94.3	Very high	86.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.2	170.5	-68.4	179.8	-177.3	0	0	109.8	L556 H557 L559 L580 L581 L624 Y629 A632 V657	L556-M571 HydrophobicContact CB-CB 4.07Å; L556-M571 PolarHBondContact N-O 2.95Å; H557-M571 HydrophobicContact CB-CB 4.36Å; H557-M571 HydrophobicContact CB-SD 4.24Å; H557-M571 PolarHBondContact N-O 3.48Å; H557-M571 PolarHBondContact O-N 2.95Å; L559-M571 HydrophobicContact CD1-CE 4.31Å; M571-L580 WeakPolarHBondContact CA-O 3.4Å; M571-L581 HydrophobicContact CE-CD1 4.32Å; M571-L581 HydrophobicContact CG-CD1 3.72Å; M571-L624 HydrophobicContact CE-CD1 3.98Å; M571-L624 HydrophobicContact CG-CD1 4.3Å; M571-L624 HydrophobicContact SD-CD1 4.27Å; M571-Y629 HydrophobicContact SD-CD2 3.9Å; M571-Y629 HydrophobicContact SD-CE2 3.87Å; M571-A632 HydrophobicContact CE-CB 4.02Å; M571-V657 HydrophobicContact CE-CB 4.5Å; M571-V657 HydrophobicContact CE-CG1 3.46Å; M571-V657 VanDerWaalsContact CE-CG1 3.46Å; M571-V657 HydrophobicContact CE-CG2 4.2Å
572	V	93.6	Very high	86.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	152.2	174.6	-60	0	0	0	0	111.8	L464 Y553 E554 L555 V570 I579 L580 F582	L464-V572 HydrophobicContact CD1-CG2 4.35Å; L464-V572 HydrophobicContact CD2-CG1 4.49Å; Y553-V572 HydrophobicContact CD1-CB 4.37Å; Y553-V572 HydrophobicContact CD1-CG2 3.91Å; Y553-V572 HydrophobicContact CG-CG2 4.49Å; E554-V572 CarbonylContact O-C 3.44Å; E554-V572 VanDerWaalsContact O-CA 3.24Å; E554-V572 WeakPolarHBondContact O-CA 3.22Å; L555-V572 HydrophobicContact CD1-CG1 4.44Å; V570-V572 HydrophobicContact CG1-CG1 3.93Å; V572-I579 WeakPolarHBondContact O-CA 3.46Å; V572-L580 HydrophobicContact CG2-CB 4.02Å; V572-L580 PolarHBondContact N-O 2.96Å; V572-L580 PolarHBondContact O-N 3.4Å; V572-F582 HydrophobicContact CG2-CD2 4.19Å; V572-F582 HydrophobicContact CG2-CE2 3.96Å
573	R	93.4	Very high	88	Confident	73 Å²	73	39.5 Å²	39.5	28%	0.275	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.9	165.4	-168.9	-178.1	-65.9	128.6	3.9	109.8	Y553 E554 L556 D578 I579	Y553-R573 WeakPolarHBondContact CA-O 3.15Å; E554-R573 HydrophobicContact CB-CB 4.19Å; E554-R573 PolarHBondContact N-O 3.34Å; E554-R573 PolarHBondContact O-N 2.87Å; E554-R573 IonicContact OE1-CZ 2.73Å; E554-R573 IonicContact OE1-NH1 2.66Å; E554-R573 PolarHBondContact OE1-NH1 3.24Å; E554-R573 IonicContact OE2-CZ 2.83Å; E554-R573 IonicContact OE2-NE 2.8Å; E554-R573 IonicContact OE2-NH1 2.66Å; E554-R573 PolarHBondContact OE2-NH1 2.99Å; L556-R573 HydrophobicContact CD1-CB 4.19Å; L556-R573 HydrophobicContact CD2-CB 4.3Å; L556-R573 HydrophobicContact CG-CB 4.41Å; R573-D578 CarbonylContact C-O 3.53Å; R573-D578 WeakPolarHBondContact CA-O 3.46Å; R573-I579 HydrophobicContact CG-CG1 4.37Å
574	S	89.3	Confident	89.4	Confident	21 Å²	21	35.7 Å²	35.7	15%	0.147	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	156.5	172.2	179.5	0	0	0	0	111.4	T576 G577 D578	S574-T576 VanDerWaalsContact CB-OG1 3.24Å; S574-T576 WeakPolarHBondContact CB-OG1 3.45Å; S574-T576 PolarHBondContact O-N 3.02Å; S574-T576 VanDerWaalsContact O-N 3.11Å; S574-T576 PolarHBondContact OG-N 2.85Å; S574-T576 PolarHBondContact OG-OG1 3.47Å; S574-G577 PolarHBondContact O-N 2.97Å; S574-D578 PolarHBondContact N-O 3.5Å
575	K	85	Confident	90.4	Very high	152 Å²	152	30.4 Å²	30.4	66%	0.661	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-26	164.6	-95.6	168.5	160.2	145.8	0	113.4	T552 G577	T552-K575 WeakPolarHBondContact OG1-CD 2.94Å; T552-K575 WeakPolarHBondContact OG1-CE 3.24Å; T552-K575 PolarHBondContact OG1-NZ 3.15Å; K575-G577 VanDerWaalsContact C-N 3.29Å
576	T	82.9	Confident	90.7	Very high	106 Å²	106	30.5 Å²	30.5	65%	0.65	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.8	175.7	49.6	0	0	0	0	114	S574 D578	S574-T576 VanDerWaalsContact CB-OG1 3.24Å; S574-T576 WeakPolarHBondContact CB-OG1 3.45Å; S574-T576 PolarHBondContact O-N 3.02Å; S574-T576 VanDerWaalsContact O-N 3.11Å; S574-T576 PolarHBondContact OG-N 2.85Å; S574-T576 PolarHBondContact OG-OG1 3.47Å; T576-D578 VanDerWaalsContact CB-OD2 3.25Å; T576-D578 WeakPolarHBondContact CB-OD2 3.44Å; T576-D578 PolarHBondContact OG1-OD2 2.83Å
577	G	84	Confident	90.8	Very high	45 Å²	45	27.5 Å²	27.5	46%	0.464	15%	0.151	S	C	.	.	S	Bend	trans	94.1	-15.7	-176.1	0	0	0	0	0	114.5	S574 K575	S574-G577 PolarHBondContact O-N 2.97Å; K575-G577 VanDerWaalsContact C-N 3.29Å
578	D	89.3	Confident	90.5	Very high	78 Å²	78	29.7 Å²	29.7	42%	0.417	17%	0.167	S	C	.	.			trans	-60	134.9	178.6	-60.1	-73.5	0	0	0	112.2	R573 S574 T576	R573-D578 CarbonylContact C-O 3.53Å; R573-D578 WeakPolarHBondContact CA-O 3.46Å; S574-D578 PolarHBondContact N-O 3.5Å; T576-D578 VanDerWaalsContact CB-OD2 3.25Å; T576-D578 WeakPolarHBondContact CB-OD2 3.44Å; T576-D578 PolarHBondContact OG1-OD2 2.83Å
579	I	93.5	Very high	90.3	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.072	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.9	173.9	-55.4	178.2	0	0	0	108.7	L556 V572 R573 L624 Y629	L556-I579 HydrophobicContact CD1-CD1 4.45Å; L556-I579 HydrophobicContact CD1-CG1 4.44Å; L556-I579 HydrophobicContact CD1-CG2 3.85Å; V572-I579 WeakPolarHBondContact O-CA 3.46Å; R573-I579 HydrophobicContact CG-CG1 4.37Å; I579-L624 HydrophobicContact CB-CB 4.34Å; I579-L624 HydrophobicContact CG2-CB 4.06Å; I579-L624 HydrophobicContact CG2-CD1 4.33Å; I579-L624 PolarHBondContact O-N 2.81Å; I579-Y629 HydrophobicContact CD1-CD1 4.07Å; I579-Y629 HydrophobicContact CD1-CD2 4.33Å; I579-Y629 HydrophobicContact CD1-CG 3.74Å; I579-Y629 HydrophobicContact CG2-CD2 4.13Å; I579-Y629 HydrophobicContact CG2-CG 4.47Å
580	L	93.8	Very high	90.1	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.073	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127	-178.2	-63.8	171.9	0	0	0	109.7	M571 V572 F582 Y621	M571-L580 WeakPolarHBondContact CA-O 3.4Å; V572-L580 HydrophobicContact CG2-CB 4.02Å; V572-L580 PolarHBondContact N-O 2.96Å; V572-L580 PolarHBondContact O-N 3.4Å; L580-F582 HydrophobicContact CB-CD2 4.34Å; L580-F582 HydrophobicContact CB-CE2 3.84Å; L580-F582 HydrophobicContact CB-CZ 4.28Å; L580-F582 HydrophobicContact CD1-CE2 3.97Å; L580-F582 HydrophobicContact CD1-CZ 3.88Å; L580-Y621 HydrophobicContact CD2-CD2 4.46Å
581	L	94.9	Very high	90	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	115.6	162.8	179.1	73.1	0	0	0	107.7	L559 M571 Y621 K622 L624 V657 E658 M661	L559-L581 HydrophobicContact CD1-CD1 3.99Å; M571-L581 HydrophobicContact CE-CD1 4.32Å; M571-L581 HydrophobicContact CG-CD1 3.72Å; L581-Y621 CarbonylContact O-C 3.57Å; L581-Y621 WeakPolarHBondContact O-CA 3.25Å; L581-Y621 WeakPolarHBondContact O-CB 3.35Å; L581-K622 HydrophobicContact CB-CB 4.32Å; L581-K622 HydrophobicContact CD2-CB 4.38Å; L581-K622 PolarHBondContact N-O 2.9Å; L581-K622 PolarHBondContact O-N 3.02Å; L581-L624 HydrophobicContact CB-CD1 4.01Å; L581-L624 HydrophobicContact CB-CG 4.21Å; L581-V657 HydrophobicContact CD1-CG1 4.18Å; L581-V657 HydrophobicContact CD2-CG1 3.77Å; L581-E658 HydrophobicContact CD2-CG 4.42Å; L581-M661 HydrophobicContact CD2-SD 4.46Å
582	F	95.8	Very high	89.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	142	165.5	-67.1	-75.2	0	0	0	109.5	L457 A461 L464 C465 S569 V570 V572 L580	L457-F582 HydrophobicContact CD1-CE1 3.88Å; L457-F582 HydrophobicContact CD1-CZ 4.02Å; L457-F582 HydrophobicContact CG-CE1 4.49Å; A461-F582 HydrophobicContact CB-CD1 3.38Å; A461-F582 HydrophobicContact CB-CE1 3.68Å; A461-F582 HydrophobicContact CB-CG 4.19Å; L464-F582 HydrophobicContact CB-CD2 4.13Å; L464-F582 HydrophobicContact CB-CE2 4.36Å; L464-F582 HydrophobicContact CD1-CD2 4.11Å; L464-F582 HydrophobicContact CD1-CE2 3.5Å; L464-F582 HydrophobicContact CD1-CZ 4.15Å; C465-F582 HydrophobicContact CB-CB 3.84Å; S569-F582 CarbonylContact C-O 3.33Å; S569-F582 WeakPolarHBondContact CA-O 3.47Å; S569-F582 VanDerWaalsContact CB-O 3.24Å; S569-F582 WeakPolarHBondContact CB-O 3.35Å; V570-F582 PolarHBondContact N-O 3.42Å; V570-F582 PolarHBondContact O-N 2.82Å; V572-F582 HydrophobicContact CG2-CD2 4.19Å; V572-F582 HydrophobicContact CG2-CE2 3.96Å; L580-F582 HydrophobicContact CB-CD2 4.34Å; L580-F582 HydrophobicContact CB-CE2 3.84Å; L580-F582 HydrophobicContact CB-CZ 4.28Å; L580-F582 HydrophobicContact CD1-CE2 3.97Å; L580-F582 HydrophobicContact CD1-CZ 3.88Å
583	C	94.7	Very high	89.5	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	136.1	178.8	-178.3	0	0	0	0	110.4	M568 S569 I590 V619 A620 M661	M568-C583 WeakPolarHBondContact O-CA 3.42Å; S569-C583 VanDerWaalsContact OG-CB 3.28Å; S569-C583 WeakPolarHBondContact OG-CB 3.32Å; S569-C583 PolarHBondContact OG-SG 2.91Å; C583-I590 WeakPolarHBondContact SG-CD1 3.2Å; C583-V619 WeakPolarHBondContact O-CA 3.29Å; C583-A620 PolarHBondContact N-O 2.99Å; C583-A620 PolarHBondContact O-N 3.34Å; C583-A620 VanDerWaalsContact O-O 3.13Å; C583-M661 HydrophobicContact CB-CE 4Å; C583-M661 HydrophobicContact CB-SD 3.48Å; C583-M661 WeakPolarHBondContact CB-SD 3.31Å
584	K	93.6	Very high	89.4	Confident	18 Å²	18	35.3 Å²	35.3	8%	0.078	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.1	171	74.8	-176.3	-176.9	-166.2	0	110.9	C465 E519 L522 R567 M568 C618 V619	C465-K584 VanDerWaalsContact O-CD 3.29Å; C465-K584 WeakPolarHBondContact O-CD 3.39Å; C465-K584 WeakPolarHBondContact O-CE 3.24Å; C465-K584 PolarHBondContact O-NZ 2.8Å; E519-K584 WeakPolarHBondContact OE1-CE 3.36Å; E519-K584 IonicContact OE1-NZ 3.78Å; E519-K584 PolarHBondContact OE1-NZ 3.46Å; L522-K584 HydrophobicContact CD1-CD 4.16Å; R567-K584 CarbonylContact C-O 3.59Å; R567-K584 VanDerWaalsContact CA-O 3.23Å; R567-K584 WeakPolarHBondContact CA-O 3.49Å; R567-K584 VanDerWaalsContact CB-O 3.31Å; R567-K584 WeakPolarHBondContact CB-O 3.38Å; M568-K584 PolarHBondContact N-O 3.05Å; M568-K584 PolarHBondContact O-N 2.9Å; K584-C618 WeakPolarHBondContact CA-O 3.1Å; K584-V619 HydrophobicContact CB-CG2 4.41Å
585	G	90.4	Very high	89.4	Confident	3 Å²	3	41.1 Å²	41.1	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.5	-169.4	177	0	0	0	0	0	114.4	R566 L617 C618	R566-G585 WeakPolarHBondContact O-CA 3.34Å; G585-L617 CarbonylContact O-C 3.49Å; G585-L617 WeakPolarHBondContact O-CA 3.35Å; G585-C618 PolarHBondContact N-O 3.25Å; G585-C618 PolarHBondContact O-N 3.38Å
586	A	86.1	Confident	89.4	Confident	8 Å²	8	39.8 Å²	39.8	7%	0.066	22%	0.222	C	C	.	.			trans	-62.4	138.7	175.6	0	0	0	0	0	111.3	R566 S588 S589 I590	R566-A586 HydrophobicContact CB-CB 4.15Å; R566-A586 PolarHBondContact O-N 2.93Å; A586-S588 PolarHBondContact O-N 2.85Å; A586-S588 VanDerWaalsContact O-N 3.17Å; A586-S589 CarbonylContact O-C 3.58Å; A586-S589 WeakPolarHBondContact O-CA 3.41Å; A586-S589 PolarHBondContact O-N 2.84Å; A586-I590 WeakPolarHBondContact O-CG1 3.34Å; A586-I590 PolarHBondContact O-N 3.43Å
587	D	85.9	Confident	89.5	Confident	32 Å²	32	42.1 Å²	42.1	17%	0.171	23%	0.225	C	C	.	.	H	α-helix	trans	-30.6	-55.4	160.9	63	-49.3	0	0	0	113.3	S589 I590 F591 V606 K698	D587-S589 PolarHBondContact O-N 3.18Å; D587-S589 VanDerWaalsContact O-N 3.1Å; D587-I590 PolarHBondContact O-N 2.86Å; D587-F591 HydrophobicContact CB-CD2 4.25Å; D587-F591 HydrophobicContact CB-CE2 3.86Å; D587-F591 HydrophobicContact CB-CZ 4.11Å; D587-F591 WeakPolarHBondContact O-CB 3.15Å; D587-F591 VanDerWaalsContact O-CG 3.24Å; D587-F591 WeakPolarHBondContact O-CG 3.43Å; D587-F591 PolarHBondContact O-N 2.71Å; D587-V606 HydrophobicContact CB-CG1 3.92Å; D587-K698 IonicContact OD1-NZ 3.61Å; D587-K698 PolarHBondContact OD1-NZ 2.7Å
588	S	82.3	Confident	89.6	Confident	54 Å²	54	40.3 Å²	40.3	38%	0.378	21%	0.205	S	C	.	.	H	α-helix	trans	-64.2	-17.4	-177.9	68.2	0	0	0	0	115	A586 P592	A586-S588 PolarHBondContact O-N 2.85Å; A586-S588 VanDerWaalsContact O-N 3.17Å; S588-P592 WeakPolarHBondContact O-CD 3.37Å; S588-P592 WeakPolarHBondContact O-CG 3.22Å
589	S	85.9	Confident	89.5	Confident	16 Å²	16	36.7 Å²	36.7	11%	0.112	19%	0.185	C	C	.	.	H	α-helix	trans	-109.9	-14.7	-176.6	-69.3	0	0	0	0	113.7	R565 R567 A586 D587	R565-S589 WeakPolarHBondContact O-CB 3.21Å; R565-S589 PolarHBondContact O-OG 3.17Å; R567-S589 PolarHBondContact NH1-O 2.73Å; A586-S589 CarbonylContact O-C 3.58Å; A586-S589 WeakPolarHBondContact O-CA 3.41Å; A586-S589 PolarHBondContact O-N 2.84Å; D587-S589 PolarHBondContact O-N 3.18Å; D587-S589 VanDerWaalsContact O-N 3.1Å
590	I	90.1	Very high	89.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-100.4	-44.4	176.2	-59.3	-61.9	0	0	0	110.8	R567 C583 A586 D587 P592 Q593 V594 C618 A620 M661 L663	R567-I590 HydrophobicContact CB-CD1 4.03Å; C583-I590 WeakPolarHBondContact SG-CD1 3.2Å; A586-I590 WeakPolarHBondContact O-CG1 3.34Å; A586-I590 PolarHBondContact O-N 3.43Å; D587-I590 PolarHBondContact O-N 2.86Å; I590-P592 VanDerWaalsContact C-CD 3.46Å; I590-P592 VanDerWaalsContact C-N 3.33Å; I590-Q593 WeakPolarHBondContact O-CA 3.42Å; I590-Q593 PolarHBondContact O-N 2.83Å; I590-V594 HydrophobicContact CG2-CG1 4.02Å; I590-V594 PolarHBondContact O-N 3.04Å; I590-C618 HydrophobicContact CB-CB 3.93Å; I590-C618 HydrophobicContact CG1-CB 4.05Å; I590-C618 HydrophobicContact CG2-CB 3.94Å; I590-A620 HydrophobicContact CG2-CB 4.07Å; I590-M661 HydrophobicContact CD1-CE 4.27Å; I590-L663 HydrophobicContact CG2-CD1 4.06Å
591	F	90.8	Very high	88.7	Confident	28 Å²	28	44.9 Å²	44.9	12%	0.123	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-54.9	-37.2	-179.1	-66.2	-15.9	0	0	0	114.3	D587 Q593 V599 V606 C618 L663	D587-F591 HydrophobicContact CB-CD2 4.25Å; D587-F591 HydrophobicContact CB-CE2 3.86Å; D587-F591 HydrophobicContact CB-CZ 4.11Å; D587-F591 WeakPolarHBondContact O-CB 3.15Å; D587-F591 VanDerWaalsContact O-CG 3.24Å; D587-F591 WeakPolarHBondContact O-CG 3.43Å; D587-F591 PolarHBondContact O-N 2.71Å; F591-Q593 PolarHBondContact O-N 3.48Å; F591-V599 HydrophobicContact CB-CG1 4.18Å; F591-V599 HydrophobicContact CB-CG2 4.04Å; F591-V599 HydrophobicContact CD1-CB 4.37Å; F591-V599 HydrophobicContact CD1-CG1 3.84Å; F591-V599 HydrophobicContact CD1-CG2 3.9Å; F591-V599 HydrophobicContact CD2-CG1 3.78Å; F591-V599 HydrophobicContact CE1-CG1 4.09Å; F591-V599 HydrophobicContact CE2-CG1 4.03Å; F591-V599 HydrophobicContact CG-CG1 3.68Å; F591-V599 HydrophobicContact CG-CG2 4.08Å; F591-V599 HydrophobicContact CZ-CG1 4.18Å; F591-V606 HydrophobicContact CZ-CB 4.49Å; F591-V606 HydrophobicContact CZ-CG1 4.46Å; F591-V606 HydrophobicContact CZ-CG2 4.3Å; F591-C618 VanDerWaalsContact CE1-SG 3.52Å; F591-L663 HydrophobicContact CD1-CD2 4.4Å; F591-L663 HydrophobicContact CE1-CD2 4.09Å
592	P	89.4	Confident	88.3	Confident	91 Å²	91	45 Å²	45	59%	0.591	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-72.4	-2.1	174.9	-18.8	33.6	0	0	0	115.4	S588 I590	S588-P592 WeakPolarHBondContact O-CD 3.37Å; S588-P592 WeakPolarHBondContact O-CG 3.22Å; I590-P592 VanDerWaalsContact C-CD 3.46Å; I590-P592 VanDerWaalsContact C-N 3.33Å
593	Q	88.8	Confident	87.9	Confident	44 Å²	44	47.9 Å²	47.9	21%	0.206	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-118.4	5.3	-175.4	-55.4	-60.1	-40	0	0	112.9	I590 F591 E658 D660 M661	I590-Q593 WeakPolarHBondContact O-CA 3.42Å; I590-Q593 PolarHBondContact O-N 2.83Å; F591-Q593 PolarHBondContact O-N 3.48Å; Q593-E658 PolarHBondContact OE1-O 2.96Å; Q593-D660 PolarHBondContact O-N 3.34Å; Q593-M661 HydrophobicContact CB-CE 3.84Å; Q593-M661 PolarHBondContact O-N 3.22Å
594	V	91.4	Very high	87.5	Confident	18 Å²	18	54.7 Å²	54.7	11%	0.109	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-130.9	169.7	-177.3	-59.1	0	0	0	0	110.6	I590 V599 A620 M661 L663	I590-V594 HydrophobicContact CG2-CG1 4.02Å; I590-V594 PolarHBondContact O-N 3.04Å; V594-V599 HydrophobicContact CG2-CG2 3.55Å; V594-A620 HydrophobicContact CG1-CB 4.11Å; V594-M661 WeakPolarHBondContact CA-O 3.32Å; V594-M661 HydrophobicContact CG1-CB 3.96Å; V594-M661 WeakPolarHBondContact CG1-O 3.04Å; V594-L663 HydrophobicContact CB-CB 4.18Å; V594-L663 HydrophobicContact CG1-CB 4.15Å; V594-L663 HydrophobicContact CG2-CB 4.17Å; V594-L663 HydrophobicContact CG2-CD2 4.49Å
595	R	88.1	Confident	87.1	Confident	143 Å²	143	55.8 Å²	55.8	54%	0.54	27%	0.269	S	S	.	.			trans	-74.2	134.5	-177.8	-64	-175.4	-70	-155	-2.7	111.9	E597 E598 V599	R595-E597 PolarHBondContact O-N 3.41Å; R595-E597 VanDerWaalsContact O-N 3.16Å; R595-E598 HydrophobicContact CB-CG 4.28Å; R595-E598 IonicContact CZ-OE1 2.86Å; R595-E598 IonicContact NE-OE1 2.86Å; R595-E598 PolarHBondContact NE-OE1 3.05Å; R595-E598 IonicContact NH2-OE1 2.62Å; R595-E598 PolarHBondContact NH2-OE1 3.26Å; R595-E598 WeakPolarHBondContact O-CB 3.28Å; R595-E598 PolarHBondContact O-N 3.21Å; R595-V599 PolarHBondContact O-N 3.27Å
596	Q	85.9	Confident	86.8	Confident	123 Å²	123	55.9 Å²	55.9	58%	0.575	27%	0.269	S	S	*	.	H	α-helix	trans	-55.5	-35.9	-177.3	-166.6	73.5	4.7	0	0	113.5	E598 V599 E600	Q596-E598 PolarHBondContact O-N 2.94Å; Q596-V599 PolarHBondContact O-N 3.44Å; Q596-E600 PolarHBondContact O-N 2.74Å
597	E	85.3	Confident	86.6	Confident	155 Å²	155	60.1 Å²	60.1	72%	0.724	29%	0.287	S	S	*	.	H	α-helix	trans	-64.7	-18.3	176.4	-61.3	178.7	-177.9	0	0	114.4	R595 R601	R595-E597 PolarHBondContact O-N 3.41Å; R595-E597 VanDerWaalsContact O-N 3.16Å; E597-R601 PolarHBondContact O-NE 3.09Å; E597-R601 PolarHBondContact O-NH2 3.15Å
598	E	85.7	Confident	86.5	Confident	8 Å²	8	62.2 Å²	62.2	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-93.1	-38.4	175.6	-58.3	169.3	-178	0	0	110.1	R595 Q596 E600 R601 I662 L663	R595-E598 HydrophobicContact CB-CG 4.28Å; R595-E598 IonicContact CZ-OE1 2.86Å; R595-E598 IonicContact NE-OE1 2.86Å; R595-E598 PolarHBondContact NE-OE1 3.05Å; R595-E598 IonicContact NH2-OE1 2.62Å; R595-E598 PolarHBondContact NH2-OE1 3.26Å; R595-E598 WeakPolarHBondContact O-CB 3.28Å; R595-E598 PolarHBondContact O-N 3.21Å; Q596-E598 PolarHBondContact O-N 2.94Å; E598-E600 PolarHBondContact O-N 2.87Å; E598-R601 PolarHBondContact O-N 3.23Å; E598-I662 WeakPolarHBondContact OE2-CA 3.46Å; E598-L663 HydrophobicContact CB-CB 3.99Å; E598-L663 PolarHBondContact OE2-N 2.98Å
599	V	87.4	Confident	86.5	Confident	1 Å²	1	60 Å²	60	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-55.6	-49.9	172.9	179.3	0	0	0	0	110.7	F591 V594 R595 Q596 R601 I602 R603	F591-V599 HydrophobicContact CB-CG1 4.18Å; F591-V599 HydrophobicContact CB-CG2 4.04Å; F591-V599 HydrophobicContact CD1-CB 4.37Å; F591-V599 HydrophobicContact CD1-CG1 3.84Å; F591-V599 HydrophobicContact CD1-CG2 3.9Å; F591-V599 HydrophobicContact CD2-CG1 3.78Å; F591-V599 HydrophobicContact CE1-CG1 4.09Å; F591-V599 HydrophobicContact CE2-CG1 4.03Å; F591-V599 HydrophobicContact CG-CG1 3.68Å; F591-V599 HydrophobicContact CG-CG2 4.08Å; F591-V599 HydrophobicContact CZ-CG1 4.18Å; V594-V599 HydrophobicContact CG2-CG2 3.55Å; R595-V599 PolarHBondContact O-N 3.27Å; Q596-V599 PolarHBondContact O-N 3.44Å; V599-R601 VanDerWaalsContact C-N 3.25Å; V599-R601 PolarHBondContact O-N 3.46Å; V599-I602 PolarHBondContact O-N 2.9Å; V599-R603 WeakPolarHBondContact O-CB 3.29Å; V599-R603 PolarHBondContact O-N 3.07Å
600	E	85.6	Confident	86	Confident	99 Å²	99	59.8 Å²	59.8	46%	0.463	28%	0.276	S	S	.	.	H	α-helix	trans	-66.5	-25.8	-170.6	-145.9	59.2	-145.6	0	0	113.5	Q596 E598 I602 R603	Q596-E600 PolarHBondContact O-N 2.74Å; E598-E600 PolarHBondContact O-N 2.87Å; E600-I602 VanDerWaalsContact C-N 3.33Å; E600-R603 WeakPolarHBondContact OE1-CD 3.34Å; E600-R603 IonicContact OE1-CZ 2.97Å; E600-R603 IonicContact OE1-NE 3.4Å; E600-R603 PolarHBondContact OE1-NE 2.81Å; E600-R603 IonicContact OE1-NH2 3.82Å; E600-R603 IonicContact OE2-CZ 2.7Å; E600-R603 VanDerWaalsContact OE2-CZ 3.29Å; E600-R603 IonicContact OE2-NE 3.72Å; E600-R603 PolarHBondContact OE2-NE 2.88Å; E600-R603 IonicContact OE2-NH2 3.15Å; E600-R603 PolarHBondContact OE2-NH2 3.45Å
601	R	84	Confident	85	Confident	102 Å²	102	65 Å²	65	39%	0.385	31%	0.308	S	S	.	.	H	α-helix	trans	-68.6	-29.1	172.1	-85	175.6	-85.3	178.9	-17.3	113.6	D420 E597 E598 V599	D420-R601 IonicContact OD1-CZ 2.7Å; D420-R601 IonicContact OD1-NH1 3.52Å; D420-R601 PolarHBondContact OD1-NH1 3.25Å; E597-R601 PolarHBondContact O-NE 3.09Å; E597-R601 PolarHBondContact O-NH2 3.15Å; E598-R601 PolarHBondContact O-N 3.23Å; V599-R601 VanDerWaalsContact C-N 3.25Å; V599-R601 PolarHBondContact O-N 3.46Å
602	I	88	Confident	84.1	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-108.9	-23.1	-171.1	-71.4	160	0	0	0	111.7	V599 E600 M604 H605 V606 L663 A666	V599-I602 PolarHBondContact O-N 2.9Å; E600-I602 VanDerWaalsContact C-N 3.33Å; I602-M604 PolarHBondContact O-N 3.29Å; I602-H605 PolarHBondContact O-N 3.14Å; I602-H605 VanDerWaalsContact O-N 3.13Å; I602-V606 HydrophobicContact CG2-CG2 3.77Å; I602-V606 PolarHBondContact O-N 3Å; I602-L663 HydrophobicContact CB-CD2 4.23Å; I602-L663 HydrophobicContact CD1-CD2 3.64Å; I602-L663 HydrophobicContact CD1-CG 3.79Å; I602-L663 HydrophobicContact CG2-CD2 4.45Å; I602-A666 HydrophobicContact CG2-CB 3.86Å
603	R	87.1	Confident	83.3	Confident	61 Å²	61	64.2 Å²	64.2	23%	0.23	30%	0.302	C	S	.	.	H	α-helix	trans	-45.4	-58.6	-179.8	-178.7	-163.8	-62	-74	-4.3	112.6	V599 E600 H605 V606 E607	V599-R603 WeakPolarHBondContact O-CB 3.29Å; V599-R603 PolarHBondContact O-N 3.07Å; E600-R603 WeakPolarHBondContact OE1-CD 3.34Å; E600-R603 IonicContact OE1-CZ 2.97Å; E600-R603 IonicContact OE1-NE 3.4Å; E600-R603 PolarHBondContact OE1-NE 2.81Å; E600-R603 IonicContact OE1-NH2 3.82Å; E600-R603 IonicContact OE2-CZ 2.7Å; E600-R603 VanDerWaalsContact OE2-CZ 3.29Å; E600-R603 IonicContact OE2-NE 3.72Å; E600-R603 PolarHBondContact OE2-NE 2.88Å; E600-R603 IonicContact OE2-NH2 3.15Å; E600-R603 PolarHBondContact OE2-NH2 3.45Å; R603-H605 VanDerWaalsContact C-N 3.26Å; R603-H605 PolarHBondContact O-N 2.68Å; R603-V606 PolarHBondContact O-N 3.25Å; R603-E607 WeakPolarHBondContact CD-OE1 3.37Å; R603-E607 VanDerWaalsContact CG-CD 3.47Å; R603-E607 HydrophobicContact CG-CG 4.25Å; R603-E607 WeakPolarHBondContact CG-OE1 3.46Å; R603-E607 IonicContact NH1-OE1 2.64Å; R603-E607 PolarHBondContact O-N 3.31Å
604	M	85.1	Confident	82.9	Confident	143 Å²	143	64 Å²	64	70%	0.704	30%	0.3	S	S	*	.	H	α-helix	trans	-61.7	-33.5	-174.5	-67.1	-155.5	-57.7	0	0	112.9	I602 R608	I602-M604 PolarHBondContact O-N 3.29Å; M604-R608 VanDerWaalsContact O-CB 3.24Å; M604-R608 WeakPolarHBondContact O-CB 3.44Å; M604-R608 PolarHBondContact O-N 3.34Å
605	H	85.3	Confident	82.5	Confident	40 Å²	40	65.1 Å²	65.1	19%	0.185	30%	0.302	C	S	.	.	H	α-helix	trans	-69.3	-41.8	174.1	-71.9	-80.7	0	0	0	111.6	C418 I602 R603 N609	C418-H605 HydrophobicContact CB-CB 4.01Å; I602-H605 PolarHBondContact O-N 3.14Å; I602-H605 VanDerWaalsContact O-N 3.13Å; R603-H605 VanDerWaalsContact C-N 3.26Å; R603-H605 PolarHBondContact O-N 2.68Å; H605-N609 WeakPolarHBondContact O-CB 3.06Å; H605-N609 PolarHBondContact O-N 3.26Å; H605-N609 PolarHBondContact O-OD1 3.03Å; H605-N609 VanDerWaalsContact O-OD1 3.11Å
606	V	85.1	Confident	82.5	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-64.2	-42.5	176	171.5	0	0	0	0	111.5	D587 F591 I602 R603 A610 T616 A666	D587-V606 HydrophobicContact CB-CG1 3.92Å; F591-V606 HydrophobicContact CZ-CB 4.49Å; F591-V606 HydrophobicContact CZ-CG1 4.46Å; F591-V606 HydrophobicContact CZ-CG2 4.3Å; I602-V606 HydrophobicContact CG2-CG2 3.77Å; I602-V606 PolarHBondContact O-N 3Å; R603-V606 PolarHBondContact O-N 3.25Å; V606-A610 VanDerWaalsContact O-CB 3.28Å; V606-A610 WeakPolarHBondContact O-CB 3.39Å; V606-A610 PolarHBondContact O-N 2.87Å; V606-T616 HydrophobicContact CG1-CG2 4.32Å; V606-A666 HydrophobicContact CG2-CB 3.59Å
607	E	81.2	Confident	82.7	Confident	98 Å²	98	54.6 Å²	54.6	46%	0.458	26%	0.26	S	S	.	.	H	α-helix	trans	-70.2	-41	179.4	-71.5	173.2	-175.9	0	0	111.9	R603 T611	R603-E607 WeakPolarHBondContact CD-OE1 3.37Å; R603-E607 VanDerWaalsContact CG-CD 3.47Å; R603-E607 HydrophobicContact CG-CG 4.25Å; R603-E607 WeakPolarHBondContact CG-OE1 3.46Å; R603-E607 IonicContact NH1-OE1 2.64Å; R603-E607 PolarHBondContact O-N 3.31Å; E607-T611 WeakPolarHBondContact O-CB 3.45Å; E607-T611 PolarHBondContact O-N 3.37Å; E607-T611 PolarHBondContact O-OG1 3.17Å
608	R	83.9	Confident	83.1	Confident	76 Å²	76	47.2 Å²	47.2	29%	0.287	23%	0.226	S	C	.	.	H	α-helix	trans	-61.2	-50.2	172	-175.2	-160.7	63.7	-166.9	-5.1	110.9	E416 Q423 M604 A610 T611 E612	E416-R608 IonicContact OE1-NH2 3.56Å; E416-R608 PolarHBondContact OE1-NH2 3.02Å; E416-R608 IonicContact OE2-NH2 3.24Å; Q423-R608 VanDerWaalsContact CD-NH2 3.26Å; M604-R608 VanDerWaalsContact O-CB 3.24Å; M604-R608 WeakPolarHBondContact O-CB 3.44Å; M604-R608 PolarHBondContact O-N 3.34Å; R608-A610 VanDerWaalsContact C-N 3.32Å; R608-A610 PolarHBondContact O-N 2.98Å; R608-T611 CarbonylContact O-C 3.49Å; R608-T611 WeakPolarHBondContact O-CA 3.42Å; R608-T611 VanDerWaalsContact O-CB 3.3Å; R608-T611 WeakPolarHBondContact O-CB 3.31Å; R608-T611 PolarHBondContact O-N 2.97Å; R608-E612 VanDerWaalsContact CD-OE1 3.24Å; R608-E612 WeakPolarHBondContact CD-OE1 3.26Å; R608-E612 VanDerWaalsContact CG-OE1 3.28Å; R608-E612 WeakPolarHBondContact CG-OE1 3.4Å; R608-E612 IonicContact NE-OE1 2.73Å; R608-E612 PolarHBondContact NE-OE1 3.43Å; R608-E612 PolarHBondContact O-N 3.2Å
609	N	82.8	Confident	83.5	Confident	6 Å²	6	47 Å²	47	3%	0.032	23%	0.225	C	C	.	.	H	α-helix	trans	-67.1	-34.4	-175.1	-67	8.1	0	0	0	112	E416 H605 T611 E612 G613 Y614 T616 A668	E416-N609 PolarHBondContact OE1-ND2 2.82Å; E416-N609 PolarHBondContact OE1-OD1 3.46Å; H605-N609 WeakPolarHBondContact O-CB 3.06Å; H605-N609 PolarHBondContact O-N 3.26Å; H605-N609 PolarHBondContact O-OD1 3.03Å; H605-N609 VanDerWaalsContact O-OD1 3.11Å; N609-T611 VanDerWaalsContact C-N 3.3Å; N609-E612 PolarHBondContact O-N 3.37Å; N609-G613 PolarHBondContact O-N 2.98Å; N609-Y614 HydrophobicContact CB-CD2 4.17Å; N609-Y614 PolarHBondContact O-N 2.76Å; N609-T616 HydrophobicContact CB-CG2 3.81Å; N609-A668 HydrophobicContact CB-CB 4.24Å
610	A	74.3	Confident	83.9	Confident	13 Å²	13	46.9 Å²	46.9	11%	0.107	22%	0.224	C	C	.	.	H	α-helix	trans	-68	-28.6	170.6	0	0	0	0	0	113.1	V606 R608 G613 T616 E700	V606-A610 VanDerWaalsContact O-CB 3.28Å; V606-A610 WeakPolarHBondContact O-CB 3.39Å; V606-A610 PolarHBondContact O-N 2.87Å; R608-A610 VanDerWaalsContact C-N 3.32Å; R608-A610 PolarHBondContact O-N 2.98Å; A610-G613 PolarHBondContact O-N 3.33Å; A610-T616 HydrophobicContact CB-CG2 4.45Å; A610-E700 HydrophobicContact CB-CB 4.48Å
611	T	70.6	Confident	84.3	Confident	110 Å²	110	44.1 Å²	44.1	68%	0.675	21%	0.21	S	C	*	.	H	α-helix	trans	-75.7	-39.4	174.3	-56.9	0	0	0	0	111.7	E607 R608 N609 G613 S704	E607-T611 WeakPolarHBondContact O-CB 3.45Å; E607-T611 PolarHBondContact O-N 3.37Å; E607-T611 PolarHBondContact O-OG1 3.17Å; R608-T611 CarbonylContact O-C 3.49Å; R608-T611 WeakPolarHBondContact O-CA 3.42Å; R608-T611 VanDerWaalsContact O-CB 3.3Å; R608-T611 WeakPolarHBondContact O-CB 3.31Å; R608-T611 PolarHBondContact O-N 2.97Å; N609-T611 VanDerWaalsContact C-N 3.3Å; T611-G613 PolarHBondContact O-N 3.48Å; T611-S704 PolarHBondContact O-OG 2.99Å
612	E	72.3	Confident	84.8	Confident	84 Å²	84	40.6 Å²	40.6	39%	0.393	20%	0.197	S	C	.	.	H	α-helix	trans	-63.9	-27.8	170.4	-71.1	172.2	-161.6	0	0	111	R608 N609 Y614 S704	R608-E612 VanDerWaalsContact CD-OE1 3.24Å; R608-E612 WeakPolarHBondContact CD-OE1 3.26Å; R608-E612 VanDerWaalsContact CG-OE1 3.28Å; R608-E612 WeakPolarHBondContact CG-OE1 3.4Å; R608-E612 IonicContact NE-OE1 2.73Å; R608-E612 PolarHBondContact NE-OE1 3.43Å; R608-E612 PolarHBondContact O-N 3.2Å; N609-E612 PolarHBondContact O-N 3.37Å; E612-Y614 HydrophobicContact CB-CD2 4.09Å; E612-Y614 HydrophobicContact CB-CE2 3.89Å; E612-Y614 WeakPolarHBondContact OE2-CE2 3.48Å; E612-S704 PolarHBondContact O-OG 3.44Å
613	G	71	Confident	85	Confident	18 Å²	18	45.6 Å²	45.6	19%	0.186	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	117.7	-1.4	167.9	0	0	0	0	0	114.8	N609 A610 T611 S704	N609-G613 PolarHBondContact O-N 2.98Å; A610-G613 PolarHBondContact O-N 3.33Å; T611-G613 PolarHBondContact O-N 3.48Å; G613-S704 VanDerWaalsContact CA-OG 3.24Å; G613-S704 WeakPolarHBondContact CA-OG 3.43Å
614	Y	82.1	Confident	85.3	Confident	40 Å²	40	43.4 Å²	43.4	16%	0.157	21%	0.213	C	C	.	.			trans	-66.7	143.7	178.8	-51.9	-50.8	0	0	0	111.8	I415 N609 E612 T616 A668 V669 E670	I415-Y614 HydrophobicContact CB-CE1 4.48Å; I415-Y614 HydrophobicContact CG1-CD1 4.44Å; I415-Y614 HydrophobicContact CG1-CE1 4.1Å; I415-Y614 HydrophobicContact CG2-CE1 4.42Å; N609-Y614 HydrophobicContact CB-CD2 4.17Å; N609-Y614 PolarHBondContact O-N 2.76Å; E612-Y614 HydrophobicContact CB-CD2 4.09Å; E612-Y614 HydrophobicContact CB-CE2 3.89Å; E612-Y614 WeakPolarHBondContact OE2-CE2 3.48Å; Y614-T616 PolarHBondContact O-N 2.91Å; Y614-A668 HydrophobicContact CD2-CB 4.03Å; Y614-A668 HydrophobicContact CG-CB 4.09Å; Y614-V669 CarbonylContact C-O 3.58Å; Y614-V669 WeakPolarHBondContact CA-O 3.17Å; Y614-E670 HydrophobicContact CD1-CB 3.76Å; Y614-E670 HydrophobicContact CD1-CG 4.14Å; Y614-E670 HydrophobicContact CE1-CB 3.94Å; Y614-E670 HydrophobicContact CE1-CG 4.09Å
615	R	82.4	Confident	85.6	Confident	41 Å²	41	39.2 Å²	39.2	16%	0.155	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	115.2	167.5	-62.2	178.5	174.1	-150.2	-0.2	108.3	M412 D518 V669 D671	M412-R615 VanDerWaalsContact SD-CZ 3.59Å; D518-R615 VanDerWaalsContact OD1-CD 3.3Å; D518-R615 WeakPolarHBondContact OD1-CD 3.4Å; D518-R615 IonicContact OD1-CZ 3.71Å; D518-R615 IonicContact OD1-NE 3.97Å; D518-R615 IonicContact OD1-NH1 3.1Å; D518-R615 PolarHBondContact OD1-NH1 3.18Å; D518-R615 IonicContact OD2-NH1 2.73Å; D518-R615 PolarHBondContact OD2-NH1 3.31Å; R615-V669 HydrophobicContact CB-CB 4.34Å; R615-V669 WeakPolarHBondContact CB-O 3.41Å; R615-V669 PolarHBondContact N-O 2.74Å; R615-V669 PolarHBondContact O-N 2.97Å; R615-D671 IonicContact CZ-OD2 2.74Å; R615-D671 IonicContact NE-OD2 3.73Å; R615-D671 PolarHBondContact NE-OD2 3.33Å; R615-D671 IonicContact NH2-OD2 3.67Å; R615-D671 PolarHBondContact NH2-OD2 2.95Å
616	T	86.8	Confident	85.8	Confident	8 Å²	8	41 Å²	41	5%	0.049	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128.4	179.2	50.2	0	0	0	0	112.1	V606 N609 A610 Y614 T667	V606-T616 HydrophobicContact CG1-CG2 4.32Å; N609-T616 HydrophobicContact CB-CG2 3.81Å; A610-T616 HydrophobicContact CB-CG2 4.45Å; Y614-T616 PolarHBondContact O-N 2.91Å; T616-T667 WeakPolarHBondContact CA-O 3.48Å
617	L	91.1	Very high	86	Confident	37 Å²	37	47.3 Å²	47.3	19%	0.194	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.5	174	-66	171.7	0	0	0	109.5	L522 G585 A666 T667	L522-L617 HydrophobicContact CD1-CD1 4.12Å; G585-L617 CarbonylContact O-C 3.49Å; G585-L617 WeakPolarHBondContact O-CA 3.35Å; L617-A666 CarbonylContact O-C 3.52Å; L617-A666 VanDerWaalsContact O-CA 3.23Å; L617-A666 WeakPolarHBondContact O-CA 3.45Å; L617-T667 PolarHBondContact N-O 3.44Å; L617-T667 VanDerWaalsContact N-O 3.14Å; L617-T667 PolarHBondContact O-N 2.9Å; L617-T667 PolarHBondContact O-OG1 2.95Å
618	C	93.4	Very high	86.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	143.3	174.1	-66.4	0	0	0	0	109.8	K584 G585 I590 F591 L663	K584-C618 WeakPolarHBondContact CA-O 3.1Å; G585-C618 PolarHBondContact N-O 3.25Å; G585-C618 PolarHBondContact O-N 3.38Å; I590-C618 HydrophobicContact CB-CB 3.93Å; I590-C618 HydrophobicContact CG1-CB 4.05Å; I590-C618 HydrophobicContact CG2-CB 3.94Å; F591-C618 VanDerWaalsContact CE1-SG 3.52Å; C618-L663 HydrophobicContact CB-CD1 4.02Å
619	V	94.9	Very high	86.8	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.6	-178.4	-173.5	0	0	0	0	109.4	F458 A461 L462 C583 K584 I664 G665	F458-V619 HydrophobicContact CD2-CB 4.35Å; F458-V619 HydrophobicContact CE2-CB 3.98Å; F458-V619 HydrophobicContact CE2-CG2 4.07Å; A461-V619 HydrophobicContact CB-CG1 3.63Å; L462-V619 HydrophobicContact CD2-CG2 4Å; C583-V619 WeakPolarHBondContact O-CA 3.29Å; K584-V619 HydrophobicContact CB-CG2 4.41Å; V619-I664 HydrophobicContact CG1-CD1 4.48Å; V619-I664 PolarHBondContact O-N 3.39Å; V619-G665 PolarHBondContact N-O 3.42Å; V619-G665 PolarHBondContact O-N 2.88Å
620	A	94.9	Very high	87.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	163.3	-177	0	0	0	0	0	111	C583 I590 V594 M661 I662	C583-A620 PolarHBondContact N-O 2.99Å; C583-A620 PolarHBondContact O-N 3.34Å; C583-A620 VanDerWaalsContact O-O 3.13Å; I590-A620 HydrophobicContact CG2-CB 4.07Å; V594-A620 HydrophobicContact CG1-CB 4.11Å; A620-M661 HydrophobicContact CB-CB 4.09Å; A620-M661 HydrophobicContact CB-CE 4.32Å; A620-M661 HydrophobicContact CB-SD 4.44Å; A620-I662 CarbonylContact C-O 3.56Å; A620-I662 WeakPolarHBondContact CA-O 3.46Å; A620-I662 WeakPolarHBondContact CB-O 3.3Å
621	Y	94.7	Very high	88	Confident	40 Å²	40	53.7 Å²	53.7	16%	0.157	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	164.1	174.5	81.4	-60.2	0	0	0	112.5	L457 L580 L581 H623 I662 I664	L457-Y621 HydrophobicContact CD2-CD1 4.06Å; L457-Y621 HydrophobicContact CD2-CD2 4.04Å; L457-Y621 HydrophobicContact CD2-CE1 3.72Å; L457-Y621 HydrophobicContact CD2-CE2 3.71Å; L457-Y621 HydrophobicContact CD2-CG 4.21Å; L580-Y621 HydrophobicContact CD2-CD2 4.46Å; L581-Y621 CarbonylContact O-C 3.57Å; L581-Y621 WeakPolarHBondContact O-CA 3.25Å; L581-Y621 WeakPolarHBondContact O-CB 3.35Å; Y621-H623 AromaticContact CE2-CD2 3.63Å; Y621-H623 AromaticContact CE2-NE2 3.64Å; Y621-I662 HydrophobicContact CD1-CB 4Å; Y621-I662 HydrophobicContact CD1-CG2 4.36Å; Y621-I662 HydrophobicContact CE1-CB 3.65Å; Y621-I662 HydrophobicContact CE1-CD1 4.27Å; Y621-I662 HydrophobicContact CE1-CG2 3.69Å; Y621-I662 PolarHBondContact N-O 3.21Å; Y621-I662 PolarHBondContact O-N 3.27Å; Y621-I664 HydrophobicContact CD1-CD1 3.71Å; Y621-I664 HydrophobicContact CD1-CG1 3.5Å; Y621-I664 VanDerWaalsContact CD1-CG1 3.5Å; Y621-I664 HydrophobicContact CE1-CD1 4.49Å; Y621-I664 HydrophobicContact CE1-CG1 4.06Å; Y621-I664 HydrophobicContact CG-CD1 4.11Å; Y621-I664 HydrophobicContact CG-CG1 4.38Å
622	K	94.3	Very high	88.8	Confident	29 Å²	29	48.6 Å²	48.6	13%	0.126	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	132.3	175	180	173.4	-179.3	179.1	0	109.3	L581 L624 V657 T659 M661	L581-K622 HydrophobicContact CB-CB 4.32Å; L581-K622 HydrophobicContact CD2-CB 4.38Å; L581-K622 PolarHBondContact N-O 2.9Å; L581-K622 PolarHBondContact O-N 3.02Å; K622-L624 HydrophobicContact CD-CD2 4.19Å; K622-L624 HydrophobicContact CG-CD2 4.25Å; K622-V657 PolarHBondContact NZ-O 2.87Å; K622-T659 WeakPolarHBondContact CD-O 3.4Å; K622-T659 WeakPolarHBondContact CE-O 3.49Å; K622-T659 PolarHBondContact NZ-O 3.17Å; K622-M661 HydrophobicContact CB-CG 4.19Å; K622-M661 HydrophobicContact CD-CG 4.41Å
623	H	92.7	Very high	89.6	Confident	106 Å²	106	46.1 Å²	46.1	49%	0.491	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	132.8	164.4	-75	-103	0	0	0	108.4	Y621	Y621-H623 AromaticContact CE2-CD2 3.63Å; Y621-H623 AromaticContact CE2-NE2 3.64Å
624	L	91.8	Very high	90.5	Very high	16 Å²	16	47 Å²	47	8%	0.084	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	130.7	174.2	-64.9	176.7	0	0	0	109.5	M571 I579 L581 K622	M571-L624 HydrophobicContact CE-CD1 3.98Å; M571-L624 HydrophobicContact CG-CD1 4.3Å; M571-L624 HydrophobicContact SD-CD1 4.27Å; I579-L624 HydrophobicContact CB-CB 4.34Å; I579-L624 HydrophobicContact CG2-CB 4.06Å; I579-L624 HydrophobicContact CG2-CD1 4.33Å; I579-L624 PolarHBondContact O-N 2.81Å; L581-L624 HydrophobicContact CB-CD1 4.01Å; L581-L624 HydrophobicContact CB-CG 4.21Å; K622-L624 HydrophobicContact CD-CD2 4.19Å; K622-L624 HydrophobicContact CG-CD2 4.25Å
625	S	92.2	Very high	90.8	Very high	55 Å²	55	47 Å²	47	39%	0.385	25%	0.247	S	C	.	.			trans	-68	156	167	69.3	0	0	0	0	110.7	Q627 E628 Y629	S625-Q627 PolarHBondContact O-N 3.35Å; S625-Q627 VanDerWaalsContact O-N 3.13Å; S625-E628 WeakPolarHBondContact CB-OE2 3.47Å; S625-E628 PolarHBondContact N-OE2 3.11Å; S625-E628 PolarHBondContact O-N 3.43Å; S625-E628 VanDerWaalsContact O-N 3.13Å; S625-E628 WeakPolarHBondContact OG-CG 3.49Å; S625-E628 PolarHBondContact OG-N 3.14Å; S625-E628 PolarHBondContact OG-OE2 3.18Å; S625-Y629 PolarHBondContact O-N 3.04Å
626	A	88.6	Confident	90.8	Very high	76 Å²	76	45.1 Å²	45.1	63%	0.628	24%	0.24	S	C	*	.	H	α-helix	trans	-57.7	-27.9	176.1	0	0	0	0	0	113.1	A630	A626-A630 VanDerWaalsContact O-CB 3.28Å; A626-A630 WeakPolarHBondContact O-CB 3.23Å; A626-A630 PolarHBondContact O-N 3.29Å
627	Q	90.4	Very high	90.5	Very high	138 Å²	138	50.6 Å²	50.6	65%	0.645	26%	0.26	S	S	*	.	H	α-helix	trans	-75.6	-40.9	176.5	-62.6	-171.7	13.5	0	0	112.5	S625 A630 R631	S625-Q627 PolarHBondContact O-N 3.35Å; S625-Q627 VanDerWaalsContact O-N 3.13Å; Q627-A630 PolarHBondContact O-N 3.01Å; Q627-R631 WeakPolarHBondContact O-CG 2.86Å; Q627-R631 PolarHBondContact O-N 3.35Å; Q627-R631 VanDerWaalsContact O-N 3.13Å
628	E	89.4	Confident	90.1	Very high	84 Å²	84	55.7 Å²	55.7	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-65.6	-42.9	174.1	-70.7	162.2	113.4	0	0	111	S625 R631 A632	S625-E628 WeakPolarHBondContact CB-OE2 3.47Å; S625-E628 PolarHBondContact N-OE2 3.11Å; S625-E628 PolarHBondContact O-N 3.43Å; S625-E628 VanDerWaalsContact O-N 3.13Å; S625-E628 WeakPolarHBondContact OG-CG 3.49Å; S625-E628 PolarHBondContact OG-N 3.14Å; S625-E628 PolarHBondContact OG-OE2 3.18Å; E628-R631 PolarHBondContact O-N 3.27Å; E628-A632 WeakPolarHBondContact O-CB 3.39Å; E628-A632 PolarHBondContact O-N 3.15Å
629	Y	91.4	Very high	89.4	Confident	31 Å²	31	56 Å²	56	12%	0.122	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-48.1	173.9	175.3	-94.2	0	0	0	111.8	L556 M571 I579 S625 R631 A632 D633	L556-Y629 HydrophobicContact CB-CE2 3.81Å; L556-Y629 HydrophobicContact CD1-CD2 3.91Å; L556-Y629 HydrophobicContact CD1-CE2 3.47Å; L556-Y629 VanDerWaalsContact CD1-CE2 3.47Å; L556-Y629 HydrophobicContact CG-CE2 4.22Å; M571-Y629 HydrophobicContact SD-CD2 3.9Å; M571-Y629 HydrophobicContact SD-CE2 3.87Å; I579-Y629 HydrophobicContact CD1-CD1 4.07Å; I579-Y629 HydrophobicContact CD1-CD2 4.33Å; I579-Y629 HydrophobicContact CD1-CG 3.74Å; I579-Y629 HydrophobicContact CG2-CD2 4.13Å; I579-Y629 HydrophobicContact CG2-CG 4.47Å; S625-Y629 PolarHBondContact O-N 3.04Å; Y629-R631 VanDerWaalsContact C-N 3.29Å; Y629-R631 PolarHBondContact O-N 3.24Å; Y629-A632 PolarHBondContact O-N 3.45Å; Y629-A632 VanDerWaalsContact O-N 3.11Å; Y629-D633 HydrophobicContact CE1-CB 4.14Å; Y629-D633 PolarHBondContact O-N 2.86Å
630	A	91.1	Very high	88.3	Confident	54 Å²	54	60 Å²	60	45%	0.446	30%	0.3	S	S	.	.	H	α-helix	trans	-61.8	-35.9	-179.4	0	0	0	0	0	112.9	A626 Q627 A634	A626-A630 VanDerWaalsContact O-CB 3.28Å; A626-A630 WeakPolarHBondContact O-CB 3.23Å; A626-A630 PolarHBondContact O-N 3.29Å; Q627-A630 PolarHBondContact O-N 3.01Å; A630-A634 WeakPolarHBondContact O-CB 3.48Å; A630-A634 PolarHBondContact O-N 3.25Å; A630-A634 VanDerWaalsContact O-N 3.14Å
631	R	92	Very high	87.1	Confident	158 Å²	158	66.3 Å²	66.3	60%	0.596	33%	0.333	S	S	*	.	H	α-helix	trans	-69.4	-43.3	171.8	-69	173.5	-174.4	170.6	4.6	111.7	Q627 E628 Y629 A634 D635	Q627-R631 WeakPolarHBondContact O-CG 2.86Å; Q627-R631 PolarHBondContact O-N 3.35Å; Q627-R631 VanDerWaalsContact O-N 3.13Å; E628-R631 PolarHBondContact O-N 3.27Å; Y629-R631 VanDerWaalsContact C-N 3.29Å; Y629-R631 PolarHBondContact O-N 3.24Å; R631-A634 PolarHBondContact O-N 2.88Å; R631-D635 WeakPolarHBondContact O-CB 3.35Å; R631-D635 PolarHBondContact O-N 3.05Å
632	A	87.9	Confident	86	Confident	3 Å²	3	65.2 Å²	65.2	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-62.5	-45.1	177.9	0	0	0	0	0	112.1	M571 E628 Y629 D635 L636 V657	M571-A632 HydrophobicContact CE-CB 4.02Å; E628-A632 WeakPolarHBondContact O-CB 3.39Å; E628-A632 PolarHBondContact O-N 3.15Å; Y629-A632 PolarHBondContact O-N 3.45Å; Y629-A632 VanDerWaalsContact O-N 3.11Å; A632-D635 PolarHBondContact O-N 3.36Å; A632-L636 WeakPolarHBondContact O-CB 3.4Å; A632-L636 WeakPolarHBondContact O-CD1 3.44Å; A632-L636 WeakPolarHBondContact O-CG 3.44Å; A632-L636 PolarHBondContact O-N 2.87Å; A632-V657 HydrophobicContact CB-CG2 3.79Å
633	D	89.1	Confident	84	Confident	33 Å²	33	70.1 Å²	70.1	18%	0.176	36%	0.36	C	S	.	.	H	α-helix	trans	-63.3	-41	175.8	174.1	51.5	0	0	0	111.8	H557 Y629 R637	H557-D633 IonicContact NE2-OD1 3.24Å; H557-D633 PolarHBondContact NE2-OD1 3.31Å; Y629-D633 HydrophobicContact CE1-CB 4.14Å; Y629-D633 PolarHBondContact O-N 2.86Å; D633-R637 VanDerWaalsContact CG-NH2 3.33Å; D633-R637 VanDerWaalsContact O-CB 3.31Å; D633-R637 WeakPolarHBondContact O-CB 3.21Å; D633-R637 PolarHBondContact O-N 2.86Å; D633-R637 IonicContact OD1-NH2 2.84Å; D633-R637 IonicContact OD2-CZ 3.19Å; D633-R637 IonicContact OD2-NH2 2.81Å; D633-R637 PolarHBondContact OD2-NH2 3Å
634	A	88.6	Confident	82.7	Confident	35 Å²	35	72 Å²	72	29%	0.289	37%	0.369	S	S	.	.	H	α-helix	trans	-60	-53.3	174.3	0	0	0	0	0	112.4	A630 R631 L636 R637 E638	A630-A634 WeakPolarHBondContact O-CB 3.48Å; A630-A634 PolarHBondContact O-N 3.25Å; A630-A634 VanDerWaalsContact O-N 3.14Å; R631-A634 PolarHBondContact O-N 2.88Å; A634-L636 PolarHBondContact O-N 3.43Å; A634-R637 WeakPolarHBondContact O-CB 3.35Å; A634-R637 PolarHBondContact O-N 3.03Å; A634-R637 VanDerWaalsContact O-N 3.11Å; A634-E638 PolarHBondContact O-N 3.49Å
635	D	88.3	Confident	81.8	Confident	42 Å²	42	76 Å²	76	23%	0.225	39%	0.39	C	S	.	.	H	α-helix	trans	-70	-33.7	-175.6	-59.1	2.6	0	0	0	111.8	R631 A632 R637 E638 A639 V653 R656	R631-D635 WeakPolarHBondContact O-CB 3.35Å; R631-D635 PolarHBondContact O-N 3.05Å; A632-D635 PolarHBondContact O-N 3.36Å; D635-R637 VanDerWaalsContact C-N 3.32Å; D635-E638 PolarHBondContact O-N 3.42Å; D635-A639 VanDerWaalsContact O-CB 3.24Å; D635-A639 WeakPolarHBondContact O-CB 3.47Å; D635-A639 PolarHBondContact O-N 2.91Å; D635-V653 HydrophobicContact CB-CG1 4.08Å; D635-V653 HydrophobicContact CB-CG2 3.98Å; D635-R656 IonicContact OD2-CZ 2.68Å; D635-R656 IonicContact OD2-NH1 3.23Å; D635-R656 PolarHBondContact OD2-NH1 2.99Å; D635-R656 IonicContact OD2-NH2 3.32Å; D635-R656 PolarHBondContact OD2-NH2 3.11Å
636	L	83.7	Confident	80.9	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-63.6	-37.5	170.7	-77	170	0	0	0	111.5	L559 A632 A634 R640 V653 Y654	L559-L636 HydrophobicContact CD2-CD1 4.18Å; L559-L636 HydrophobicContact CD2-CD2 3.83Å; A632-L636 WeakPolarHBondContact O-CB 3.4Å; A632-L636 WeakPolarHBondContact O-CD1 3.44Å; A632-L636 WeakPolarHBondContact O-CG 3.44Å; A632-L636 PolarHBondContact O-N 2.87Å; A634-L636 PolarHBondContact O-N 3.43Å; L636-R640 WeakPolarHBondContact O-CB 3.32Å; L636-R640 WeakPolarHBondContact O-CG 3.32Å; L636-R640 PolarHBondContact O-N 3.43Å; L636-V653 HydrophobicContact CD2-CG1 3.73Å; L636-V653 HydrophobicContact CG-CG1 3.8Å; L636-Y654 HydrophobicContact CD2-CD1 3.81Å; L636-Y654 HydrophobicContact CD2-CE1 3.56Å
637	R	79.3	Confident	80.2	Confident	123 Å²	123	78.8 Å²	78.8	46%	0.464	38%	0.382	S	S	.	.	H	α-helix	trans	-69.4	-43.7	177.8	-151.3	-177.4	-41.9	104.8	0.1	111	D633 A634 D635 R640 L641	D633-R637 VanDerWaalsContact CG-NH2 3.33Å; D633-R637 VanDerWaalsContact O-CB 3.31Å; D633-R637 WeakPolarHBondContact O-CB 3.21Å; D633-R637 PolarHBondContact O-N 2.86Å; D633-R637 IonicContact OD1-NH2 2.84Å; D633-R637 IonicContact OD2-CZ 3.19Å; D633-R637 IonicContact OD2-NH2 2.81Å; D633-R637 PolarHBondContact OD2-NH2 3Å; A634-R637 WeakPolarHBondContact O-CB 3.35Å; A634-R637 PolarHBondContact O-N 3.03Å; A634-R637 VanDerWaalsContact O-N 3.11Å; D635-R637 VanDerWaalsContact C-N 3.32Å; R637-R640 PolarHBondContact O-N 3.03Å; R637-L641 WeakPolarHBondContact O-CD1 3.45Å; R637-L641 VanDerWaalsContact O-CG 3.26Å; R637-L641 WeakPolarHBondContact O-CG 3.42Å; R637-L641 PolarHBondContact O-N 3.38Å
638	E	83	Confident	79.7	Confident	145 Å²	145	79.1 Å²	79.1	68%	0.678	38%	0.384	S	S	*	.	H	α-helix	trans	-61.6	-49.7	174	-171.3	-177.4	155.3	0	0	111.5	A634 D635 R640 L641 A642	A634-E638 PolarHBondContact O-N 3.49Å; D635-E638 PolarHBondContact O-N 3.42Å; E638-R640 VanDerWaalsContact C-N 3.32Å; E638-R640 PolarHBondContact O-N 2.94Å; E638-L641 PolarHBondContact O-N 3.03Å; E638-A642 PolarHBondContact O-N 2.87Å; E638-A642 VanDerWaalsContact O-N 3.15Å
639	A	79.6	Confident	79.4	Confident	6 Å²	6	79.4 Å²	79.4	5%	0.05	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-35.1	179.6	0	0	0	0	0	113	D635 L641 A642 R646 K649 L650 V653	D635-A639 VanDerWaalsContact O-CB 3.24Å; D635-A639 WeakPolarHBondContact O-CB 3.47Å; D635-A639 PolarHBondContact O-N 2.91Å; A639-L641 VanDerWaalsContact C-N 3.33Å; A639-A642 PolarHBondContact O-N 2.66Å; A639-R646 VanDerWaalsContact O-CG 3.28Å; A639-R646 WeakPolarHBondContact O-CG 3.19Å; A639-K649 HydrophobicContact CB-CB 4.18Å; A639-L650 HydrophobicContact CB-CD2 3.73Å; A639-L650 HydrophobicContact CB-CG 4.05Å; A639-V653 HydrophobicContact CB-CG2 4.17Å
640	R	72.1	Confident	79	Confident	85 Å²	85	78.7 Å²	78.7	32%	0.321	38%	0.382	S	S	.	.	H	α-helix	trans	-67.2	-30.8	173	-76.8	173.3	-179.5	140.3	1.6	113.1	H557 L636 R637 E638 L650	H557-R640 PolarHBondContact ND1-NH1 3.21Å; H557-R640 PolarHBondContact NE2-NH1 2.93Å; L636-R640 WeakPolarHBondContact O-CB 3.32Å; L636-R640 WeakPolarHBondContact O-CG 3.32Å; L636-R640 PolarHBondContact O-N 3.43Å; R637-R640 PolarHBondContact O-N 3.03Å; E638-R640 VanDerWaalsContact C-N 3.32Å; E638-R640 PolarHBondContact O-N 2.94Å; R640-L650 HydrophobicContact CG-CD2 3.9Å
641	L	69.4	Low	78.7	Confident	133 Å²	133	77.9 Å²	77.9	70%	0.696	37%	0.369	S	S	*	.	H	α-helix	trans	-84.8	-9.7	179.5	-69.5	168.7	0	0	0	113.7	R637 E638 A639 L643	R637-L641 WeakPolarHBondContact O-CD1 3.45Å; R637-L641 VanDerWaalsContact O-CG 3.26Å; R637-L641 WeakPolarHBondContact O-CG 3.42Å; R637-L641 PolarHBondContact O-N 3.38Å; E638-L641 PolarHBondContact O-N 3.03Å; A639-L641 VanDerWaalsContact C-N 3.33Å; L641-L643 PolarHBondContact O-N 3.36Å
642	A	71.1	Confident	78.5	Confident	18 Å²	18	73.3 Å²	73.3	15%	0.149	37%	0.365	C	S	.	.			trans	-66	124.6	-177.9	0	0	0	0	0	112.9	E638 A639 R646 K649	E638-A642 PolarHBondContact O-N 2.87Å; E638-A642 VanDerWaalsContact O-N 3.15Å; A639-A642 PolarHBondContact O-N 2.66Å; A642-R646 WeakPolarHBondContact O-CB 3.37Å; A642-R646 WeakPolarHBondContact O-CG 3.14Å; A642-K649 HydrophobicContact CB-CD 3.79Å
643	L	52.1	Low	78.6	Confident	132 Å²	132	74 Å²	74	69%	0.691	37%	0.368	S	S	*	.	S	Bend	trans	-80.8	-18.1	178.6	-62.7	177.7	0	0	0	114.2	L641	L641-L643 PolarHBondContact O-N 3.36Å
644	Q	65.6	Low	78.7	Confident	145 Å²	145	73.5 Å²	73.5	68%	0.678	36%	0.364	S	S	*	.	S	Bend	trans	-127.6	139.8	177.7	-71.4	176.9	-17.7	0	0	108.8	R646 K649	Q644-R646 PolarHBondContact O-N 2.93Å; Q644-R646 VanDerWaalsContact O-N 3.17Å; Q644-K649 PolarHBondContact O-NZ 3.24Å
645	D	73.3	Confident	78.7	Confident	100 Å²	100	74.7 Å²	74.7	54%	0.535	37%	0.366	S	S	.	.	S	Bend	trans	54.5	34.2	175.8	-38.5	-47.2	0	0	0	113.6	E647 E648 K649	D645-E647 VanDerWaalsContact C-N 3.31Å; D645-E647 PolarHBondContact O-N 3.26Å; D645-E648 HydrophobicContact CB-CB 4.46Å; D645-E648 PolarHBondContact O-N 2.89Å; D645-K649 WeakPolarHBondContact O-CB 3.39Å; D645-K649 WeakPolarHBondContact O-CG 3.27Å; D645-K649 PolarHBondContact O-N 3.47Å
646	R	73.4	Confident	78.8	Confident	49 Å²	49	78.9 Å²	78.9	19%	0.185	38%	0.379	C	S	.	.	H	α-helix	trans	-54.5	-45.4	-176.1	-163	-173.9	70.4	147.1	2.6	112.1	E237 A639 A642 Q644 L650	E237-R646 IonicContact OE1-CZ 3.49Å; E237-R646 IonicContact OE1-NH1 2.67Å; E237-R646 PolarHBondContact OE1-NH1 3.1Å; E237-R646 IonicContact OE1-NH2 3.75Å; E237-R646 IonicContact OE2-CZ 3.73Å; E237-R646 IonicContact OE2-NH1 2.72Å; E237-R646 PolarHBondContact OE2-NH1 2.73Å; E237-R646 IonicContact OE2-NH2 4Å; E237-R646 PolarHBondContact OE2-NH2 3.01Å; A639-R646 VanDerWaalsContact O-CG 3.28Å; A639-R646 WeakPolarHBondContact O-CG 3.19Å; A642-R646 WeakPolarHBondContact O-CB 3.37Å; A642-R646 WeakPolarHBondContact O-CG 3.14Å; Q644-R646 PolarHBondContact O-N 2.93Å; Q644-R646 VanDerWaalsContact O-N 3.17Å; R646-L650 HydrophobicContact CG-CD1 4.13Å; R646-L650 WeakPolarHBondContact O-CB 3.28Å; R646-L650 WeakPolarHBondContact O-CD1 3.47Å; R646-L650 WeakPolarHBondContact O-CG 3.31Å; R646-L650 PolarHBondContact O-N 3.05Å
647	E	72.4	Confident	79.1	Confident	140 Å²	140	79.4 Å²	79.4	65%	0.654	38%	0.382	S	S	*	.	H	α-helix	trans	-67.5	-41.6	-178.6	-66.7	173.2	178.6	0	0	111.9	D645 L650 M651	D645-E647 VanDerWaalsContact C-N 3.31Å; D645-E647 PolarHBondContact O-N 3.26Å; E647-L650 PolarHBondContact O-N 3.3Å; E647-M651 WeakPolarHBondContact O-CB 3.19Å; E647-M651 VanDerWaalsContact O-CG 3.32Å; E647-M651 WeakPolarHBondContact O-CG 3.49Å; E647-M651 PolarHBondContact O-N 3.19Å
648	E	81.3	Confident	79.7	Confident	146 Å²	146	73.5 Å²	73.5	68%	0.682	36%	0.36	S	S	*	.	H	α-helix	trans	-67.9	-41.3	177	-172.1	169.7	-157.3	0	0	111.7	D645 M651 A652	D645-E648 HydrophobicContact CB-CB 4.46Å; D645-E648 PolarHBondContact O-N 2.89Å; E648-M651 PolarHBondContact O-N 2.86Å; E648-A652 WeakPolarHBondContact O-CB 3.49Å; E648-A652 PolarHBondContact O-N 2.86Å
649	K	83.3	Confident	80.1	Confident	90 Å²	90	68.8 Å²	68.8	39%	0.391	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-44.2	174.5	-72.5	165.2	-175.5	161.8	0	112	A639 A642 Q644 D645 A652 V653	A639-K649 HydrophobicContact CB-CB 4.18Å; A642-K649 HydrophobicContact CB-CD 3.79Å; Q644-K649 PolarHBondContact O-NZ 3.24Å; D645-K649 WeakPolarHBondContact O-CB 3.39Å; D645-K649 WeakPolarHBondContact O-CG 3.27Å; D645-K649 PolarHBondContact O-N 3.47Å; K649-A652 PolarHBondContact O-N 3.33Å; K649-V653 WeakPolarHBondContact O-CG2 3.42Å; K649-V653 PolarHBondContact O-N 3.4Å
650	L	82.9	Confident	80.5	Confident	16 Å²	16	74.6 Å²	74.6	8%	0.084	37%	0.371	C	S	.	.	H	α-helix	trans	-60.1	-47.5	173	-74.9	167.4	0	0	0	110.9	A639 R640 R646 E647 A652 V653 Y654	A639-L650 HydrophobicContact CB-CD2 3.73Å; A639-L650 HydrophobicContact CB-CG 4.05Å; R640-L650 HydrophobicContact CG-CD2 3.9Å; R646-L650 HydrophobicContact CG-CD1 4.13Å; R646-L650 WeakPolarHBondContact O-CB 3.28Å; R646-L650 WeakPolarHBondContact O-CD1 3.47Å; R646-L650 WeakPolarHBondContact O-CG 3.31Å; R646-L650 PolarHBondContact O-N 3.05Å; E647-L650 PolarHBondContact O-N 3.3Å; L650-A652 VanDerWaalsContact C-N 3.32Å; L650-A652 PolarHBondContact O-N 3.3Å; L650-V653 PolarHBondContact O-N 3.41Å; L650-Y654 HydrophobicContact CB-CE1 4.17Å; L650-Y654 HydrophobicContact CB-CE2 4.45Å; L650-Y654 HydrophobicContact CD2-CE1 4Å; L650-Y654 WeakPolarHBondContact O-CB 3.46Å; L650-Y654 WeakPolarHBondContact O-CD1 3.43Å; L650-Y654 PolarHBondContact O-N 2.92Å
651	M	84.3	Confident	81.6	Confident	37 Å²	37	70.6 Å²	70.6	18%	0.182	36%	0.356	C	S	.	.	H	α-helix	trans	-60.4	-37.2	176.6	-80.5	-73.9	-83.3	0	0	113.1	D562 V564 R565 E647 E648 Y654 N655	D562-M651 HydrophobicContact CB-SD 4.43Å; V564-M651 HydrophobicContact CB-CE 4.24Å; V564-M651 HydrophobicContact CG1-CE 4.38Å; R565-M651 HydrophobicContact CB-CE 3.84Å; R565-M651 HydrophobicContact CB-SD 3.94Å; R565-M651 HydrophobicContact CG-CE 4.15Å; R565-M651 HydrophobicContact CG-SD 4.05Å; E647-M651 WeakPolarHBondContact O-CB 3.19Å; E647-M651 VanDerWaalsContact O-CG 3.32Å; E647-M651 WeakPolarHBondContact O-CG 3.49Å; E647-M651 PolarHBondContact O-N 3.19Å; E648-M651 PolarHBondContact O-N 2.86Å; M651-Y654 HydrophobicContact SD-CD2 4.38Å; M651-N655 WeakPolarHBondContact O-CB 3.46Å; M651-N655 PolarHBondContact O-N 3.3Å; M651-N655 PolarHBondContact O-ND2 3.44Å
652	A	88.4	Confident	82.7	Confident	61 Å²	61	66.5 Å²	66.5	50%	0.504	33%	0.334	S	S	.	.	H	α-helix	trans	-63.6	-46.9	174	0	0	0	0	0	111.9	E648 K649 L650 R656	E648-A652 WeakPolarHBondContact O-CB 3.49Å; E648-A652 PolarHBondContact O-N 2.86Å; K649-A652 PolarHBondContact O-N 3.33Å; L650-A652 VanDerWaalsContact C-N 3.32Å; L650-A652 PolarHBondContact O-N 3.3Å; A652-R656 PolarHBondContact O-N 2.81Å; A652-R656 VanDerWaalsContact O-N 3.08Å
653	V	90.3	Very high	83.8	Confident	17 Å²	17	65.8 Å²	65.8	10%	0.103	33%	0.328	C	S	.	.	H	α-helix	trans	-64.3	-43.5	176.2	177	0	0	0	0	111.2	D635 L636 A639 K649 L650 R656 V657	D635-V653 HydrophobicContact CB-CG1 4.08Å; D635-V653 HydrophobicContact CB-CG2 3.98Å; L636-V653 HydrophobicContact CD2-CG1 3.73Å; L636-V653 HydrophobicContact CG-CG1 3.8Å; A639-V653 HydrophobicContact CB-CG2 4.17Å; K649-V653 WeakPolarHBondContact O-CG2 3.42Å; K649-V653 PolarHBondContact O-N 3.4Å; L650-V653 PolarHBondContact O-N 3.41Å; V653-R656 PolarHBondContact O-N 2.97Å; V653-V657 WeakPolarHBondContact O-CG2 3.38Å; V653-V657 PolarHBondContact O-N 3.43Å
654	Y	90.8	Very high	85.7	Confident	23 Å²	23	59.6 Å²	59.6	9%	0.09	30%	0.295	C	S	.	.	H	α-helix	trans	-58.5	-50.2	177.5	-68.7	3.7	0	0	0	111.1	L559 L636 L650 M651 R656 V657 E658	L559-Y654 HydrophobicContact CD2-CD1 3.5Å; L559-Y654 VanDerWaalsContact CD2-CD1 3.5Å; L559-Y654 HydrophobicContact CD2-CE1 3.47Å; L559-Y654 VanDerWaalsContact CD2-CE1 3.47Å; L559-Y654 HydrophobicContact CD2-CG 4.27Å; L636-Y654 HydrophobicContact CD2-CD1 3.81Å; L636-Y654 HydrophobicContact CD2-CE1 3.56Å; L650-Y654 HydrophobicContact CB-CE1 4.17Å; L650-Y654 HydrophobicContact CB-CE2 4.45Å; L650-Y654 HydrophobicContact CD2-CE1 4Å; L650-Y654 WeakPolarHBondContact O-CB 3.46Å; L650-Y654 WeakPolarHBondContact O-CD1 3.43Å; L650-Y654 PolarHBondContact O-N 2.92Å; M651-Y654 HydrophobicContact SD-CD2 4.38Å; Y654-R656 VanDerWaalsContact C-N 3.32Å; Y654-R656 PolarHBondContact O-N 3.37Å; Y654-V657 PolarHBondContact O-N 3.22Å; Y654-E658 WeakPolarHBondContact O-CB 3.39Å; Y654-E658 WeakPolarHBondContact O-CG 3.4Å; Y654-E658 PolarHBondContact O-N 2.81Å; Y654-E658 VanDerWaalsContact O-N 3.15Å
655	N	89	Confident	87	Confident	61 Å²	61	52.7 Å²	52.7	33%	0.326	26%	0.263	S	S	.	.	H	α-helix	trans	-60.5	-39.6	177.3	-76.6	-50.1	0	0	0	112.2	R567 M651 V657 E658 T659	R567-N655 PolarHBondContact NH2-OD1 3.34Å; M651-N655 WeakPolarHBondContact O-CB 3.46Å; M651-N655 PolarHBondContact O-N 3.3Å; M651-N655 PolarHBondContact O-ND2 3.44Å; N655-V657 PolarHBondContact O-N 2.86Å; N655-E658 PolarHBondContact O-N 2.85Å; N655-T659 WeakPolarHBondContact O-CG2 3.38Å
656	R	89.4	Confident	87.9	Confident	130 Å²	130	48.2 Å²	48.2	49%	0.491	24%	0.24	S	C	.	.	H	α-helix	trans	-70.4	-28.7	179.6	-158.2	-163.8	73.1	-158	-3.7	113.6	D635 A652 V653 Y654	D635-R656 IonicContact OD2-CZ 2.68Å; D635-R656 IonicContact OD2-NH1 3.23Å; D635-R656 PolarHBondContact OD2-NH1 2.99Å; D635-R656 IonicContact OD2-NH2 3.32Å; D635-R656 PolarHBondContact OD2-NH2 3.11Å; A652-R656 PolarHBondContact O-N 2.81Å; A652-R656 VanDerWaalsContact O-N 3.08Å; V653-R656 PolarHBondContact O-N 2.97Å; Y654-R656 VanDerWaalsContact C-N 3.32Å; Y654-R656 PolarHBondContact O-N 3.37Å
657	V	91.1	Very high	88.8	Confident	10 Å²	10	46 Å²	46	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-72.3	-37.8	174	164.2	0	0	0	0	111.2	L559 M571 L581 K622 A632 V653 Y654 N655	L559-V657 HydrophobicContact CD1-CG1 4.22Å; M571-V657 HydrophobicContact CE-CB 4.5Å; M571-V657 HydrophobicContact CE-CG1 3.46Å; M571-V657 VanDerWaalsContact CE-CG1 3.46Å; M571-V657 HydrophobicContact CE-CG2 4.2Å; L581-V657 HydrophobicContact CD1-CG1 4.18Å; L581-V657 HydrophobicContact CD2-CG1 3.77Å; K622-V657 PolarHBondContact NZ-O 2.87Å; A632-V657 HydrophobicContact CB-CG2 3.79Å; V653-V657 WeakPolarHBondContact O-CG2 3.38Å; V653-V657 PolarHBondContact O-N 3.43Å; Y654-V657 PolarHBondContact O-N 3.22Å; N655-V657 PolarHBondContact O-N 2.86Å
658	E	91.7	Very high	89.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-91.9	9.7	-167.2	-66.3	173.9	153.4	0	0	114.9	R565 R567 S569 L581 Q593 Y654 N655 M661	R565-E658 IonicContact CZ-OE1 2.73Å; R565-E658 IonicContact CZ-OE2 3.62Å; R565-E658 IonicContact NH1-OE1 3.48Å; R565-E658 PolarHBondContact NH1-OE1 2.83Å; R565-E658 IonicContact NH1-OE2 3.54Å; R565-E658 PolarHBondContact NH1-OE2 2.71Å; R567-E658 IonicContact CZ-OE2 2.85Å; R567-E658 VanDerWaalsContact CZ-OE2 3.22Å; R567-E658 IonicContact NE-OE2 3.81Å; R567-E658 PolarHBondContact NE-OE2 3.27Å; R567-E658 IonicContact NH2-OE2 2.96Å; R567-E658 PolarHBondContact NH2-OE2 3.45Å; S569-E658 WeakPolarHBondContact CB-OE1 3.02Å; S569-E658 PolarHBondContact OG-OE1 2.93Å; L581-E658 HydrophobicContact CD2-CG 4.42Å; Q593-E658 PolarHBondContact OE1-O 2.96Å; Y654-E658 WeakPolarHBondContact O-CB 3.39Å; Y654-E658 WeakPolarHBondContact O-CG 3.4Å; Y654-E658 PolarHBondContact O-N 2.81Å; Y654-E658 VanDerWaalsContact O-N 3.15Å; N655-E658 PolarHBondContact O-N 2.85Å; E658-M661 HydrophobicContact CB-SD 4.44Å; E658-M661 WeakPolarHBondContact O-CE 3.47Å; E658-M661 WeakPolarHBondContact O-CG 3.42Å
659	T	89.9	Confident	90	Very high	46 Å²	46	32.4 Å²	32.4	28%	0.282	17%	0.168	S	C	.	.	S	Bend	trans	-72.6	160.7	170.6	73.3	0	0	0	0	111.5	K622 N655 M661	K622-T659 WeakPolarHBondContact CD-O 3.4Å; K622-T659 WeakPolarHBondContact CE-O 3.49Å; K622-T659 PolarHBondContact NZ-O 3.17Å; N655-T659 WeakPolarHBondContact O-CG2 3.38Å; T659-M661 VanDerWaalsContact C-N 3.33Å; T659-M661 PolarHBondContact O-N 3.47Å
660	D	89.9	Confident	90	Very high	127 Å²	127	31.6 Å²	31.6	68%	0.679	17%	0.166	S	C	*	.	S	Bend	trans	55.1	43.8	166.4	-46	-67.2	0	0	0	114	Q593	Q593-D660 PolarHBondContact O-N 3.34Å
661	M	93.5	Very high	90	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-84.5	161.5	174.4	-59.8	-172.9	-64.9	0	0	111.3	L581 C583 I590 Q593 V594 A620 K622 E658 T659	L581-M661 HydrophobicContact CD2-SD 4.46Å; C583-M661 HydrophobicContact CB-CE 4Å; C583-M661 HydrophobicContact CB-SD 3.48Å; C583-M661 WeakPolarHBondContact CB-SD 3.31Å; I590-M661 HydrophobicContact CD1-CE 4.27Å; Q593-M661 HydrophobicContact CB-CE 3.84Å; Q593-M661 PolarHBondContact O-N 3.22Å; V594-M661 WeakPolarHBondContact CA-O 3.32Å; V594-M661 HydrophobicContact CG1-CB 3.96Å; V594-M661 WeakPolarHBondContact CG1-O 3.04Å; A620-M661 HydrophobicContact CB-CB 4.09Å; A620-M661 HydrophobicContact CB-CE 4.32Å; A620-M661 HydrophobicContact CB-SD 4.44Å; K622-M661 HydrophobicContact CB-CG 4.19Å; K622-M661 HydrophobicContact CD-CG 4.41Å; E658-M661 HydrophobicContact CB-SD 4.44Å; E658-M661 WeakPolarHBondContact O-CE 3.47Å; E658-M661 WeakPolarHBondContact O-CG 3.42Å; T659-M661 VanDerWaalsContact C-N 3.33Å; T659-M661 PolarHBondContact O-N 3.47Å
662	I	93.4	Very high	90	Very high	47 Å²	47	32.6 Å²	32.6	24%	0.241	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.2	173.9	-58.9	172.3	0	0	0	108.2	E598 A620 Y621	E598-I662 WeakPolarHBondContact OE2-CA 3.46Å; A620-I662 CarbonylContact C-O 3.56Å; A620-I662 WeakPolarHBondContact CA-O 3.46Å; A620-I662 WeakPolarHBondContact CB-O 3.3Å; Y621-I662 HydrophobicContact CD1-CB 4Å; Y621-I662 HydrophobicContact CD1-CG2 4.36Å; Y621-I662 HydrophobicContact CE1-CB 3.65Å; Y621-I662 HydrophobicContact CE1-CD1 4.27Å; Y621-I662 HydrophobicContact CE1-CG2 3.69Å; Y621-I662 PolarHBondContact N-O 3.21Å; Y621-I662 PolarHBondContact O-N 3.27Å
663	L	93.8	Very high	89.9	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123.6	178.2	-176.3	65.4	0	0	0	110.2	I590 F591 V594 E598 I602 C618	I590-L663 HydrophobicContact CG2-CD1 4.06Å; F591-L663 HydrophobicContact CD1-CD2 4.4Å; F591-L663 HydrophobicContact CE1-CD2 4.09Å; V594-L663 HydrophobicContact CB-CB 4.18Å; V594-L663 HydrophobicContact CG1-CB 4.15Å; V594-L663 HydrophobicContact CG2-CB 4.17Å; V594-L663 HydrophobicContact CG2-CD2 4.49Å; E598-L663 HydrophobicContact CB-CB 3.99Å; E598-L663 PolarHBondContact OE2-N 2.98Å; I602-L663 HydrophobicContact CB-CD2 4.23Å; I602-L663 HydrophobicContact CD1-CD2 3.64Å; I602-L663 HydrophobicContact CD1-CG 3.79Å; I602-L663 HydrophobicContact CG2-CD2 4.45Å; C618-L663 HydrophobicContact CB-CD1 4.02Å
664	I	92.4	Very high	89.9	Confident	3 Å²	3	32.1 Å²	32.1	2%	0.015	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-43.7	178.3	-45.2	173.8	0	0	0	110.4	I419 D420 L457 F458 A461 V619 Y621	I419-I664 HydrophobicContact CG2-CG2 4.45Å; D420-I664 PolarHBondContact N-O 2.67Å; L457-I664 HydrophobicContact CD2-CD1 4.2Å; L457-I664 HydrophobicContact CG-CD1 4.09Å; F458-I664 HydrophobicContact CB-CG2 3.78Å; F458-I664 HydrophobicContact CD2-CB 4.11Å; F458-I664 HydrophobicContact CD2-CG2 3.84Å; F458-I664 HydrophobicContact CG-CG2 4.3Å; A461-I664 HydrophobicContact CB-CD1 4.16Å; V619-I664 HydrophobicContact CG1-CD1 4.48Å; V619-I664 PolarHBondContact O-N 3.39Å; Y621-I664 HydrophobicContact CD1-CD1 3.71Å; Y621-I664 HydrophobicContact CD1-CG1 3.5Å; Y621-I664 VanDerWaalsContact CD1-CG1 3.5Å; Y621-I664 HydrophobicContact CE1-CD1 4.49Å; Y621-I664 HydrophobicContact CE1-CG1 4.06Å; Y621-I664 HydrophobicContact CG-CD1 4.11Å; Y621-I664 HydrophobicContact CG-CG1 4.38Å
665	G	92.9	Very high	89.8	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.7	-170.5	-171.2	0	0	0	0	0	113.7	C418 V619	C418-G665 CarbonylContact O-C 3.48Å; C418-G665 WeakPolarHBondContact O-CA 3.43Å; V619-G665 PolarHBondContact N-O 3.42Å; V619-G665 PolarHBondContact O-N 2.88Å
666	A	92.8	Very high	89.9	Confident	6 Å²	6	35.5 Å²	35.5	5%	0.05	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	152.2	173.6	0	0	0	0	0	111.5	C417 C418 I602 V606 L617	C417-A666 CarbonylContact C-O 3.54Å; C417-A666 VanDerWaalsContact CA-O 3.29Å; C417-A666 WeakPolarHBondContact CA-O 3.43Å; C417-A666 VanDerWaalsContact CB-O 3.31Å; C417-A666 WeakPolarHBondContact CB-O 3.25Å; C418-A666 PolarHBondContact N-O 3.32Å; C418-A666 PolarHBondContact O-N 3.49Å; I602-A666 HydrophobicContact CG2-CB 3.86Å; V606-A666 HydrophobicContact CG2-CB 3.59Å; L617-A666 CarbonylContact O-C 3.52Å; L617-A666 VanDerWaalsContact O-CA 3.23Å; L617-A666 WeakPolarHBondContact O-CA 3.45Å
667	T	92.3	Very high	90	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.3	177.5	56.9	0	0	0	0	111.1	F414 C417 F458 L462 L522 T616 L617	F414-T667 HydrophobicContact CE2-CG2 3.7Å; F414-T667 HydrophobicContact CZ-CG2 4.07Å; C417-T667 HydrophobicContact CB-CG2 4.2Å; F458-T667 HydrophobicContact CE1-CG2 4.16Å; F458-T667 HydrophobicContact CZ-CG2 3.57Å; L462-T667 HydrophobicContact CD1-CG2 4.28Å; L462-T667 HydrophobicContact CD2-CG2 4.07Å; L522-T667 HydrophobicContact CD2-CG2 3.76Å; L522-T667 WeakPolarHBondContact CD2-OG1 3.47Å; T616-T667 WeakPolarHBondContact CA-O 3.48Å; L617-T667 PolarHBondContact N-O 3.44Å; L617-T667 VanDerWaalsContact N-O 3.14Å; L617-T667 PolarHBondContact O-N 2.9Å; L617-T667 PolarHBondContact O-OG1 2.95Å
668	A	89.8	Confident	90	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.6	172.6	0	0	0	0	0	110.4	I415 E416 N609 Y614	I415-A668 PolarHBondContact N-O 2.64Å; E416-A668 HydrophobicContact CG-CB 3.72Å; E416-A668 PolarHBondContact O-N 3.3Å; N609-A668 HydrophobicContact CB-CB 4.24Å; Y614-A668 HydrophobicContact CD2-CB 4.03Å; Y614-A668 HydrophobicContact CG-CB 4.09Å
669	V	87.4	Confident	90	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	127.8	179.8	176.3	0	0	0	0	109.2	M412 E413 A521 L522 Y614 R615	M412-V669 HydrophobicContact CB-CG1 3.74Å; M412-V669 HydrophobicContact CG-CG1 4.35Å; M412-V669 HydrophobicContact SD-CG1 4.25Å; E413-V669 CarbonylContact O-C 3.6Å; E413-V669 VanDerWaalsContact O-CA 3.27Å; E413-V669 WeakPolarHBondContact O-CA 3.28Å; A521-V669 HydrophobicContact CB-CG1 3.93Å; A521-V669 HydrophobicContact CB-CG2 4.45Å; L522-V669 HydrophobicContact CD2-CG2 4.25Å; Y614-V669 CarbonylContact C-O 3.58Å; Y614-V669 WeakPolarHBondContact CA-O 3.17Å; R615-V669 HydrophobicContact CB-CB 4.34Å; R615-V669 WeakPolarHBondContact CB-O 3.41Å; R615-V669 PolarHBondContact N-O 2.74Å; R615-V669 PolarHBondContact O-N 2.97Å
670	E	84.8	Confident	90.2	Very high	73 Å²	73	33.9 Å²	33.9	34%	0.341	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	144.5	176.4	-171.9	165.5	-171.7	0	0	111.7	M412 E413 I415 Y614	M412-E670 WeakPolarHBondContact CA-O 3.45Å; E413-E670 PolarHBondContact N-O 3.07Å; E413-E670 PolarHBondContact O-N 3.34Å; I415-E670 HydrophobicContact CD1-CB 4.12Å; I415-E670 HydrophobicContact CG1-CB 3.64Å; Y614-E670 HydrophobicContact CD1-CB 3.76Å; Y614-E670 HydrophobicContact CD1-CG 4.14Å; Y614-E670 HydrophobicContact CE1-CB 3.94Å; Y614-E670 HydrophobicContact CE1-CG 4.09Å
671	D	81.6	Confident	90.4	Very high	19 Å²	19	27.9 Å²	27.9	10%	0.102	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	84.6	179.4	-178.4	3.8	0	0	0	107.3	K403 T408 M412 R615	K403-D671 IonicContact NZ-OD2 2.75Å; K403-D671 PolarHBondContact NZ-OD2 2.9Å; T408-D671 WeakPolarHBondContact CB-OD1 3.49Å; T408-D671 HydrophobicContact CG2-CB 4.49Å; T408-D671 WeakPolarHBondContact CG2-O 3.32Å; T408-D671 PolarHBondContact OG1-OD1 3.47Å; M412-D671 HydrophobicContact CE-CB 4.07Å; M412-D671 WeakPolarHBondContact CE-OD1 3.42Å; M412-D671 HydrophobicContact SD-CB 3.88Å; R615-D671 IonicContact CZ-OD2 2.74Å; R615-D671 IonicContact NE-OD2 3.73Å; R615-D671 PolarHBondContact NE-OD2 3.33Å; R615-D671 IonicContact NH2-OD2 3.67Å; R615-D671 PolarHBondContact NH2-OD2 2.95Å
672	Q	84	Confident	90.2	Very high	56 Å²	56	32.7 Å²	32.7	26%	0.262	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	140	-164	-71.6	169	-13.1	0	0	113.1	T408 Q409 N411 E413	T408-Q672 CarbonylContact C-O 3.56Å; T408-Q672 WeakPolarHBondContact CA-O 3.35Å; T408-Q672 VanDerWaalsContact CB-O 3.27Å; T408-Q672 WeakPolarHBondContact CB-O 3.37Å; Q409-Q672 PolarHBondContact N-O 3.39Å; N411-Q672 PolarHBondContact ND2-OE1 3.4Å; N411-Q672 PolarHBondContact O-N 2.83Å; E413-Q672 PolarHBondContact OE1-NE2 3.13Å
673	L	87.9	Confident	90.2	Very high	54 Å²	54	31.2 Å²	31.2	28%	0.283	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	151.7	173.7	-67.5	-174.5	0	0	0	112.6	L407 T408 Q409 A677 T705 A708 C709	L407-L673 WeakPolarHBondContact O-CA 3.23Å; T408-L673 HydrophobicContact CG2-CD2 4.36Å; Q409-L673 WeakPolarHBondContact CG-O 3.27Å; Q409-L673 PolarHBondContact NE2-O 2.83Å; L673-A677 HydrophobicContact CB-CB 4.4Å; L673-T705 HydrophobicContact CD2-CG2 3.78Å; L673-A708 HydrophobicContact CD1-CB 3.92Å; L673-C709 VanDerWaalsContact CD2-SG 3.59Å
674	Q	89.3	Confident	90.1	Very high	14 Å²	14	31.1 Å²	31.1	7%	0.065	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-65.5	148.2	166.3	-53.2	-149.5	-3.9	0	0	111.2	G405 T406 L407 T408 Q409 E676 A677 L875	G405-Q674 PolarHBondContact O-NE2 3.03Å; T406-Q674 PolarHBondContact O-NE2 2.9Å; L407-Q674 PolarHBondContact O-N 2.79Å; T408-Q674 WeakPolarHBondContact O-CG 3.32Å; T408-Q674 PolarHBondContact O-NE2 3.35Å; T408-Q674 VanDerWaalsContact O-NE2 3.12Å; Q409-Q674 HydrophobicContact CG-CB 4.5Å; Q409-Q674 HydrophobicContact CG-CG 4.2Å; Q674-E676 PolarHBondContact O-N 3.35Å; Q674-A677 HydrophobicContact CB-CB 4.35Å; Q674-A677 WeakPolarHBondContact O-CB 3.33Å; Q674-A677 PolarHBondContact O-N 3.05Å; Q674-L875 HydrophobicContact CB-CB 4.27Å; Q674-L875 HydrophobicContact CG-CB 4.44Å
675	D	88.9	Confident	90	Very high	63 Å²	63	31.8 Å²	31.8	34%	0.337	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	135	175.3	-4.5	-47.5	0	0	0	110.8	Q409 A677 K876	Q409-D675 PolarHBondContact NE2-OD1 3.11Å; Q409-D675 VanDerWaalsContact NE2-OD1 3.11Å; D675-A677 PolarHBondContact O-N 3.03Å; D675-K876 HydrophobicContact CB-CD 4.32Å; D675-K876 IonicContact OD2-NZ 2.73Å; D675-K876 PolarHBondContact OD2-NZ 3.36Å
676	E	91.1	Very high	89.7	Confident	91 Å²	91	33.1 Å²	33.1	43%	0.425	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	15.6	-176.6	-60.3	173.7	-137.1	0	0	115.8	Q674 A678 Q679 T680 K876	Q674-E676 PolarHBondContact O-N 3.35Å; E676-A678 PolarHBondContact O-N 3.32Å; E676-Q679 HydrophobicContact CB-CB 4.41Å; E676-Q679 PolarHBondContact O-N 2.7Å; E676-T680 VanDerWaalsContact O-CB 3.28Å; E676-T680 WeakPolarHBondContact O-CB 3.36Å; E676-T680 PolarHBondContact O-N 2.68Å; E676-T680 PolarHBondContact O-OG1 2.68Å; E676-K876 HydrophobicContact CB-CB 3.95Å
677	A	91.3	Very high	89.6	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-54.4	-49.1	179.8	0	0	0	0	0	112.5	L673 Q674 D675 T680 M681 L875	L673-A677 HydrophobicContact CB-CB 4.4Å; Q674-A677 HydrophobicContact CB-CB 4.35Å; Q674-A677 WeakPolarHBondContact O-CB 3.33Å; Q674-A677 PolarHBondContact O-N 3.05Å; D675-A677 PolarHBondContact O-N 3.03Å; A677-T680 PolarHBondContact O-N 2.93Å; A677-M681 WeakPolarHBondContact O-CG 3.4Å; A677-M681 PolarHBondContact O-N 3.4Å; A677-L875 HydrophobicContact CB-CD2 3.79Å
678	A	90.3	Very high	89.3	Confident	34 Å²	34	34.4 Å²	34.4	28%	0.281	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-46.3	177.7	0	0	0	0	0	112.6	E676 T680 M681 E682 A708	E676-A678 PolarHBondContact O-N 3.32Å; A678-T680 VanDerWaalsContact C-N 3.27Å; A678-T680 PolarHBondContact O-N 2.68Å; A678-M681 PolarHBondContact O-N 3.02Å; A678-E682 PolarHBondContact O-N 2.6Å; A678-A708 WeakPolarHBondContact CB-O 3.21Å
679	Q	92.3	Very high	89.3	Confident	118 Å²	118	34.5 Å²	34.5	55%	0.551	19%	0.191	S	C	*	.	H	α-helix	trans	-63.2	-35.2	178.1	-59.4	-173.3	20.8	0	0	112.1	E676 A683	E676-Q679 HydrophobicContact CB-CB 4.41Å; E676-Q679 PolarHBondContact O-N 2.7Å; Q679-A683 WeakPolarHBondContact O-CB 3.47Å; Q679-A683 PolarHBondContact O-N 3.4Å
680	T	94.5	Very high	89.5	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.3	-47.3	175.6	-64.4	0	0	0	0	110.6	E676 A677 A678 A683 L684 L878 K879	E676-T680 VanDerWaalsContact O-CB 3.28Å; E676-T680 WeakPolarHBondContact O-CB 3.36Å; E676-T680 PolarHBondContact O-N 2.68Å; E676-T680 PolarHBondContact O-OG1 2.68Å; A677-T680 PolarHBondContact O-N 2.93Å; A678-T680 VanDerWaalsContact C-N 3.27Å; A678-T680 PolarHBondContact O-N 2.68Å; T680-A683 PolarHBondContact O-N 3.16Å; T680-L684 HydrophobicContact CG2-CD1 3.82Å; T680-L684 WeakPolarHBondContact O-CB 3.11Å; T680-L684 WeakPolarHBondContact O-CD1 3.36Å; T680-L684 WeakPolarHBondContact O-CG 3.38Å; T680-L684 PolarHBondContact O-N 2.88Å; T680-L878 HydrophobicContact CG2-CB 4.37Å; T680-K879 HydrophobicContact CG2-CB 4.19Å
681	M	93.2	Very high	89.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.1	-41.9	179.6	-71.1	-59.4	149.2	0	0	112.7	L407 A677 A678 L684 Q685 V691 L711 L875	L407-M681 HydrophobicContact CD2-CE 3.79Å; L407-M681 HydrophobicContact CD2-CG 4.37Å; A677-M681 WeakPolarHBondContact O-CG 3.4Å; A677-M681 PolarHBondContact O-N 3.4Å; A678-M681 PolarHBondContact O-N 3.02Å; M681-L684 PolarHBondContact O-N 3.14Å; M681-L684 HydrophobicContact SD-CD1 4.48Å; M681-Q685 WeakPolarHBondContact O-CG 3.33Å; M681-Q685 PolarHBondContact O-N 2.93Å; M681-V691 HydrophobicContact SD-CB 4.36Å; M681-V691 HydrophobicContact SD-CG1 3.74Å; M681-V691 HydrophobicContact SD-CG2 3.84Å; M681-L711 HydrophobicContact CB-CD2 3.8Å; M681-L711 HydrophobicContact CB-CG 4.2Å; M681-L711 HydrophobicContact CG-CD2 4.21Å; M681-L711 HydrophobicContact CG-CG 4.42Å; M681-L711 HydrophobicContact SD-CD2 4.28Å; M681-L875 HydrophobicContact CE-CD1 3.81Å; M681-L875 HydrophobicContact CE-CD2 3.85Å; M681-L875 HydrophobicContact CE-CG 4.24Å
682	E	90.9	Very high	90.6	Very high	103 Å²	103	31.7 Å²	31.7	48%	0.481	18%	0.176	S	C	.	.	H	α-helix	trans	-65.7	-40	173.8	-177.3	158.6	-124.7	0	0	112.1	A678 L684 Q685 G686 K713	A678-E682 PolarHBondContact O-N 2.6Å; E682-L684 VanDerWaalsContact C-N 3.33Å; E682-L684 PolarHBondContact O-N 3.23Å; E682-Q685 PolarHBondContact O-N 2.98Å; E682-G686 PolarHBondContact O-N 3.46Å; E682-K713 IonicContact OE1-NZ 2.68Å; E682-K713 PolarHBondContact OE1-NZ 2.88Å
683	A	92.1	Very high	91.1	Very high	16 Å²	16	29 Å²	29	13%	0.132	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-40.4	175.6	0	0	0	0	0	112.4	Q679 T680 G686 A687 K879 L883 S962	Q679-A683 WeakPolarHBondContact O-CB 3.47Å; Q679-A683 PolarHBondContact O-N 3.4Å; T680-A683 PolarHBondContact O-N 3.16Å; A683-G686 PolarHBondContact O-N 3.5Å; A683-A687 PolarHBondContact O-N 3.13Å; A683-K879 HydrophobicContact CB-CD 4.21Å; A683-K879 HydrophobicContact CB-CG 4.29Å; A683-L883 HydrophobicContact CB-CD1 4.37Å; A683-S962 VanDerWaalsContact O-CB 3.23Å; A683-S962 WeakPolarHBondContact O-CB 3.29Å; A683-S962 PolarHBondContact O-OG 2.84Å
684	L	93.1	Very high	91.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.3	-37.6	178	-66.4	167	0	0	0	112.3	I399 T680 M681 E682 A687 M689 L878 L882 L883	I399-L684 HydrophobicContact CD1-CB 4.48Å; I399-L684 HydrophobicContact CD1-CD1 3.94Å; I399-L684 HydrophobicContact CD1-CD2 4.21Å; I399-L684 HydrophobicContact CD1-CG 4.44Å; T680-L684 HydrophobicContact CG2-CD1 3.82Å; T680-L684 WeakPolarHBondContact O-CB 3.11Å; T680-L684 WeakPolarHBondContact O-CD1 3.36Å; T680-L684 WeakPolarHBondContact O-CG 3.38Å; T680-L684 PolarHBondContact O-N 2.88Å; M681-L684 PolarHBondContact O-N 3.14Å; M681-L684 HydrophobicContact SD-CD1 4.48Å; E682-L684 VanDerWaalsContact C-N 3.33Å; E682-L684 PolarHBondContact O-N 3.23Å; L684-A687 WeakPolarHBondContact O-CB 3.45Å; L684-A687 PolarHBondContact O-N 3.44Å; L684-M689 HydrophobicContact CB-SD 4.25Å; L684-M689 HydrophobicContact CD2-CE 4.07Å; L684-M689 HydrophobicContact CD2-SD 3.64Å; L684-M689 WeakPolarHBondContact O-CB 3.11Å; L684-M689 PolarHBondContact O-N 3.35Å; L684-L878 HydrophobicContact CD1-CD2 3.8Å; L684-L878 HydrophobicContact CD1-CG 4.12Å; L684-L882 HydrophobicContact CD2-CB 4.38Å; L684-L882 HydrophobicContact CD2-CD1 3.81Å; L684-L883 HydrophobicContact CD2-CD2 4.49Å
685	Q	89.8	Confident	91.2	Very high	18 Å²	18	25.8 Å²	25.8	8%	0.084	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-47.4	168.3	-74.9	-170.9	-14.7	0	0	111	M681 E682 A687 G688 L711 W763	M681-Q685 WeakPolarHBondContact O-CG 3.33Å; M681-Q685 PolarHBondContact O-N 2.93Å; E682-Q685 PolarHBondContact O-N 2.98Å; Q685-A687 PolarHBondContact O-N 3.06Å; Q685-G688 PolarHBondContact O-N 3.1Å; Q685-L711 HydrophobicContact CG-CD2 4.42Å; Q685-L711 PolarHBondContact NE2-O 3.23Å; Q685-W763 WeakPolarHBondContact O-CZ3 3.46Å
686	G	86.9	Confident	90.7	Very high	28 Å²	28	24.9 Å²	24.9	29%	0.289	15%	0.152	S	C	.	.	H	α-helix	trans	-57.5	-31.5	175.5	0	0	0	0	0	113.8	E682 A683 G688	E682-G686 PolarHBondContact O-N 3.46Å; A683-G686 PolarHBondContact O-N 3.5Å; G686-G688 PolarHBondContact O-N 2.66Å
687	A	89.3	Confident	89.9	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.008	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-1.2	173.1	0	0	0	0	0	114.7	A683 L684 Q685 M689 L883 S962 Y965 R966	A683-A687 PolarHBondContact O-N 3.13Å; L684-A687 WeakPolarHBondContact O-CB 3.45Å; L684-A687 PolarHBondContact O-N 3.44Å; Q685-A687 PolarHBondContact O-N 3.06Å; A687-M689 HydrophobicContact CB-CE 4.3Å; A687-M689 HydrophobicContact CB-CG 4.47Å; A687-L883 HydrophobicContact CB-CD2 3.48Å; A687-L883 VanDerWaalsContact CB-CD2 3.48Å; A687-S962 WeakPolarHBondContact CA-O 3.32Å; A687-S962 WeakPolarHBondContact CB-O 3.3Å; A687-S962 PolarHBondContact N-OG 3.33Å; A687-Y965 HydrophobicContact CB-CD1 4.3Å; A687-Y965 HydrophobicContact CB-CG 4.35Å; A687-Y965 WeakPolarHBondContact O-CD1 3.2Å; A687-R966 WeakPolarHBondContact O-CG 3.5Å
688	G	86.6	Confident	88.9	Confident	33 Å²	33	24.6 Å²	24.6	34%	0.34	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	3.9	179.8	0	0	0	0	0	114.9	Q685 G686	Q685-G688 PolarHBondContact O-N 3.1Å; G686-G688 PolarHBondContact O-N 2.66Å
689	M	90.4	Very high	88.5	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	14%	0.143	C	C	.	.			trans	-81.9	155.7	178	-53.4	173.6	-173.2	0	0	110.8	E397 I399 L684 A687 L882 L883 Y965	E397-M689 WeakPolarHBondContact O-CA 3.25Å; I399-M689 HydrophobicContact CD1-SD 3.62Å; I399-M689 HydrophobicContact CG1-SD 4.36Å; L684-M689 HydrophobicContact CB-SD 4.25Å; L684-M689 HydrophobicContact CD2-CE 4.07Å; L684-M689 HydrophobicContact CD2-SD 3.64Å; L684-M689 WeakPolarHBondContact O-CB 3.11Å; L684-M689 PolarHBondContact O-N 3.35Å; A687-M689 HydrophobicContact CB-CE 4.3Å; A687-M689 HydrophobicContact CB-CG 4.47Å; M689-L882 HydrophobicContact CE-CB 4.03Å; M689-L882 HydrophobicContact CE-CD1 4.08Å; M689-L882 HydrophobicContact SD-CD1 4.11Å; M689-L883 HydrophobicContact CE-CD2 4.19Å; M689-Y965 HydrophobicContact CE-CD1 3.84Å; M689-Y965 HydrophobicContact CE-CD2 4.05Å; M689-Y965 HydrophobicContact CE-CE1 3.43Å; M689-Y965 VanDerWaalsContact CE-CE1 3.43Å; M689-Y965 HydrophobicContact CE-CE2 3.65Å; M689-Y965 HydrophobicContact CE-CG 4.14Å; M689-Y965 HydrophobicContact CG-CE1 4.26Å
690	K	91.2	Very high	87.8	Confident	33 Å²	33	20.5 Å²	20.5	14%	0.143	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.2	170.2	-64	-179.7	-169.2	170.5	0	110.2	E397 Y398 I399 Q803	E397-K690 PolarHBondContact O-N 3.26Å; Y398-K690 WeakPolarHBondContact CA-O 3.49Å; Y398-K690 HydrophobicContact CD1-CB 4.05Å; Y398-K690 HydrophobicContact CD1-CD 4.32Å; Y398-K690 HydrophobicContact CE1-CB 4.2Å; Y398-K690 HydrophobicContact CE1-CD 3.64Å; Y398-K690 PolarHBondContact OH-NZ 3.4Å; I399-K690 PolarHBondContact N-O 3.07Å; K690-Q803 PolarHBondContact NZ-O 3.38Å
691	V	93.6	Very high	87	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128	173.5	-176.1	0	0	0	0	108.4	I399 T401 M681 L711	I399-V691 HydrophobicContact CB-CG2 4.46Å; I399-V691 CarbonylContact O-C 3.57Å; I399-V691 WeakPolarHBondContact O-CA 3.39Å; T401-V691 HydrophobicContact CG2-CG1 3.91Å; M681-V691 HydrophobicContact SD-CB 4.36Å; M681-V691 HydrophobicContact SD-CG1 3.74Å; M681-V691 HydrophobicContact SD-CG2 3.84Å; V691-L711 HydrophobicContact CB-CD2 3.72Å; V691-L711 HydrophobicContact CG1-CD1 4.07Å; V691-L711 HydrophobicContact CG1-CD2 3.92Å; V691-L711 HydrophobicContact CG2-CD2 4.1Å
692	W	95.2	Very high	86.6	Confident	1 Å²	1	21 Å²	21	0%	0.004	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	126.2	174.3	-71.1	27.5	0	0	0	108	Y398 I399 F400 T401 C802 V808 I821 V825	Y398-W692 AromaticContact CD1-CE2 3.9Å; Y398-W692 HydrophobicContact CD1-CZ2 4.13Å; Y398-W692 AromaticContact CD1-NE1 3.72Å; Y398-W692 AromaticContact CE1-CE2 3.99Å; Y398-W692 AromaticContact CE1-CZ2 3.85Å; Y398-W692 HydrophobicContact CE1-CZ2 3.85Å; Y398-W692 AromaticContact CE1-NE1 3.85Å; I399-W692 PolarHBondContact O-N 3.49Å; F400-W692 WeakPolarHBondContact CA-O 3.35Å; F400-W692 HydrophobicContact CD1-CB 3.74Å; F400-W692 HydrophobicContact CD1-CD2 4.45Å; F400-W692 HydrophobicContact CD1-CE3 4.3Å; F400-W692 HydrophobicContact CD1-CG 4.31Å; F400-W692 HydrophobicContact CE1-CB 4.01Å; F400-W692 AromaticContact CE1-CD2 3.82Å; F400-W692 HydrophobicContact CE1-CD2 3.82Å; F400-W692 AromaticContact CE1-CE3 3.56Å; F400-W692 HydrophobicContact CE1-CE3 3.56Å; F400-W692 HydrophobicContact CE1-CG 4.08Å; F400-W692 HydrophobicContact CE1-CZ3 4.21Å; T401-W692 PolarHBondContact N-O 3.12Å; W692-C802 HydrophobicContact CH2-CB 3.36Å; W692-C802 HydrophobicContact CZ2-CB 3.52Å; W692-C802 WeakPolarHBondContact CZ2-O 3.36Å; W692-C802 HydrophobicContact CZ3-CB 4.24Å; W692-V808 CarbonylContact C-O 3.57Å; W692-V808 VanDerWaalsContact CA-O 3.23Å; W692-V808 WeakPolarHBondContact CA-O 3.33Å; W692-V808 HydrophobicContact CB-CB 4.35Å; W692-V808 HydrophobicContact CD2-CB 3.66Å; W692-V808 HydrophobicContact CD2-CG1 4.14Å; W692-V808 HydrophobicContact CD2-CG2 3.88Å; W692-V808 HydrophobicContact CE3-CB 4.07Å; W692-V808 HydrophobicContact CE3-CG1 4.01Å; W692-V808 HydrophobicContact CE3-CG2 4.45Å; W692-V808 HydrophobicContact CG-CB 3.74Å; W692-V808 HydrophobicContact CG-CG2 4.2Å; W692-V808 HydrophobicContact CZ2-CG2 4.04Å; W692-V808 HydrophobicContact CZ3-CG1 4.44Å; W692-I821 HydrophobicContact CE3-CG2 3.99Å; W692-I821 HydrophobicContact CZ3-CG2 3.93Å; W692-V825 HydrophobicContact CH2-CG2 3.46Å; W692-V825 VanDerWaalsContact CH2-CG2 3.46Å; W692-V825 HydrophobicContact CZ2-CG2 4.22Å; W692-V825 HydrophobicContact CZ3-CG2 3.67Å
693	V	94.8	Very high	86.4	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118.2	179.5	-175.2	0	0	0	0	108.6	T401 K403 L407 L711 V808 L809 C810	T401-V693 HydrophobicContact CG2-CB 4.36Å; T401-V693 HydrophobicContact CG2-CG2 3.87Å; T401-V693 CarbonylContact O-C 3.59Å; T401-V693 WeakPolarHBondContact O-CA 3.46Å; K403-V693 HydrophobicContact CB-CG1 4.14Å; L407-V693 HydrophobicContact CD1-CG1 4.36Å; L407-V693 HydrophobicContact CD1-CG2 4.25Å; V693-L711 HydrophobicContact CG2-CD1 3.67Å; V693-V808 PolarHBondContact N-O 3.24Å; V693-L809 HydrophobicContact CB-CD1 3.89Å; V693-L809 HydrophobicContact CG1-CD1 3.93Å; V693-C810 PolarHBondContact O-N 3.29Å
694	L	92.7	Very high	86	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	95.2	-177.5	-55.5	-169.7	0	0	0	109.6	F400 T401 C810 M813 K818 I821 M846	F400-L694 HydrophobicContact CB-CD1 4.06Å; F400-L694 HydrophobicContact CB-CG 4.42Å; F400-L694 HydrophobicContact CD1-CD1 3.64Å; F400-L694 HydrophobicContact CD1-CD2 4.43Å; F400-L694 HydrophobicContact CD1-CG 4.06Å; F400-L694 HydrophobicContact CE1-CD1 4.47Å; F400-L694 HydrophobicContact CG-CD1 4.13Å; T401-L694 PolarHBondContact O-N 2.91Å; L694-C810 HydrophobicContact CD2-CB 3.63Å; L694-C810 VanDerWaalsContact CD2-SG 3.54Å; L694-M813 HydrophobicContact CB-SD 3.86Å; L694-M813 HydrophobicContact CD2-SD 3.93Å; L694-M813 HydrophobicContact CG-SD 4.32Å; L694-K818 HydrophobicContact CB-CD 4.27Å; L694-K818 HydrophobicContact CB-CG 4.27Å; L694-K818 HydrophobicContact CD1-CB 4.34Å; L694-K818 WeakPolarHBondContact O-CE 3.24Å; L694-K818 PolarHBondContact O-NZ 2.99Å; L694-I821 HydrophobicContact CD1-CB 4.1Å; L694-I821 HydrophobicContact CD1-CG2 3.79Å; L694-I821 HydrophobicContact CD2-CG2 4.03Å; L694-M846 HydrophobicContact CB-SD 4.34Å; L694-M846 HydrophobicContact CD1-SD 3.85Å; L694-M846 HydrophobicContact CG-SD 4.49Å
695	T	87.1	Confident	85.6	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.122	C	C	.	.			trans	-128.8	154	-168.2	-164.9	0	0	0	0	114.5	D402 K403 D697 A702 L809 C810 C811 R812 M813	D402-T695 VanDerWaalsContact OD1-CA 3.25Å; D402-T695 WeakPolarHBondContact OD1-CA 3.38Å; D402-T695 WeakPolarHBondContact OD1-CB 3.39Å; D402-T695 PolarHBondContact OD1-OG1 3.41Å; K403-T695 HydrophobicContact CB-CG2 4.32Å; T695-D697 VanDerWaalsContact C-N 3.32Å; T695-D697 HydrophobicContact CG2-CB 4.05Å; T695-A702 HydrophobicContact CG2-CB 3.81Å; T695-L809 HydrophobicContact CG2-CD1 4.23Å; T695-C810 PolarHBondContact N-O 3.4Å; T695-C811 CarbonylContact O-C 3.48Å; T695-C811 WeakPolarHBondContact O-CA 3.48Å; T695-R812 PolarHBondContact O-N 2.89Å; T695-M813 WeakPolarHBondContact O-CB 3.48Å; T695-M813 PolarHBondContact O-N 2.97Å
696	G	78	Confident	85.6	Confident	43 Å²	43	18.7 Å²	18.7	44%	0.443	12%	0.118	S	C	.	.	S	Bend	trans	-78.2	-14	172.9	0	0	0	0	0	114.2	R812	G696-R812 WeakPolarHBondContact O-CA 3.34Å
697	D	73.8	Confident	85.5	Confident	37 Å²	37	21.5 Å²	21.5	20%	0.198	12%	0.121	C	C	.	.	S	Bend	trans	-68.3	170.1	-171.4	-81.7	24.5	0	0	0	115	K403 T695 R812	K403-D697 WeakPolarHBondContact CE-OD2 3.43Å; K403-D697 IonicContact NZ-OD2 3.13Å; K403-D697 PolarHBondContact NZ-OD2 3.13Å; T695-D697 VanDerWaalsContact C-N 3.32Å; T695-D697 HydrophobicContact CG2-CB 4.05Å; D697-R812 WeakPolarHBondContact O-CG 3.5Å; D697-R812 PolarHBondContact O-N 3.27Å; D697-R812 VanDerWaalsContact O-N 3.07Å
698	K	71.8	Confident	85.3	Confident	49 Å²	49	24.1 Å²	24.1	21%	0.213	14%	0.143	C	C	.	.			trans	-57.1	148.3	166.1	-69.2	-171.5	-167.7	174.8	0	110.8	D587 E700 A702	D587-K698 IonicContact OD1-NZ 3.61Å; D587-K698 PolarHBondContact OD1-NZ 2.7Å; K698-E700 VanDerWaalsContact C-N 3.3Å; K698-E700 PolarHBondContact O-N 3.02Å; K698-A702 WeakPolarHBondContact O-CB 3.32Å; K698-A702 PolarHBondContact O-N 3.37Å
699	M	81	Confident	85.3	Confident	20 Å²	20	22.6 Å²	22.6	10%	0.099	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-43.6	177.8	-175.6	-176.4	76.4	0	0	111.4	A702 K703 T722 I773 C811	M699-A702 PolarHBondContact O-N 3.49Å; M699-K703 WeakPolarHBondContact O-CB 3.33Å; M699-K703 PolarHBondContact O-N 2.93Å; M699-T722 HydrophobicContact SD-CG2 3.65Å; M699-I773 HydrophobicContact CG-CG2 3.72Å; M699-I773 HydrophobicContact SD-CG2 3.8Å; M699-C811 HydrophobicContact CB-CB 4.43Å
700	E	78.6	Confident	85	Confident	47 Å²	47	23.5 Å²	23.5	22%	0.22	14%	0.136	C	C	.	.	H	α-helix	trans	-63.3	-53.7	-172.8	-60.6	84.6	169.5	0	0	111.2	A610 K698 A702 K703 S704 R724	A610-E700 HydrophobicContact CB-CB 4.48Å; K698-E700 VanDerWaalsContact C-N 3.3Å; K698-E700 PolarHBondContact O-N 3.02Å; E700-A702 PolarHBondContact O-N 2.76Å; E700-K703 PolarHBondContact O-N 3.18Å; E700-S704 PolarHBondContact O-N 3.09Å; E700-R724 IonicContact OE1-CZ 3.44Å; E700-R724 IonicContact OE1-NH1 3.74Å; E700-R724 PolarHBondContact OE1-NH1 3.35Å; E700-R724 IonicContact OE1-NH2 2.7Å; E700-R724 PolarHBondContact OE1-NH2 3Å
701	T	77.9	Confident	84.8	Confident	10 Å²	10	22 Å²	22	6%	0.061	13%	0.13	C	C	.	.	H	α-helix	trans	-57.4	-50.5	174.9	-51.8	0	0	0	0	111.4	K703 S704 T705	T701-K703 VanDerWaalsContact C-N 3.32Å; T701-K703 PolarHBondContact O-N 2.85Å; T701-S704 PolarHBondContact O-N 3.17Å; T701-T705 PolarHBondContact O-N 3.38Å; T701-T705 PolarHBondContact O-OG1 3.42Å
702	A	84.7	Confident	84.5	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67.5	-30.4	-178.1	0	0	0	0	0	113.2	T695 K698 M699 E700 T705 C706 L809	T695-A702 HydrophobicContact CG2-CB 3.81Å; K698-A702 WeakPolarHBondContact O-CB 3.32Å; K698-A702 PolarHBondContact O-N 3.37Å; M699-A702 PolarHBondContact O-N 3.49Å; E700-A702 PolarHBondContact O-N 2.76Å; A702-T705 PolarHBondContact O-N 2.77Å; A702-C706 PolarHBondContact O-N 2.89Å; A702-C706 PolarHBondContact O-SG 3.04Å; A702-L809 HydrophobicContact CB-CD1 3.77Å; A702-L809 HydrophobicContact CB-CD2 4.01Å; A702-L809 HydrophobicContact CB-CG 4.49Å
703	K	85.6	Confident	83.9	Confident	55 Å²	55	25.8 Å²	25.8	24%	0.239	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-43.5	172.5	175.3	173.1	172.7	170.1	0	110.9	M699 E700 T701 C706 Y707 L718 E720 I773 L809	M699-K703 WeakPolarHBondContact O-CB 3.33Å; M699-K703 PolarHBondContact O-N 2.93Å; E700-K703 PolarHBondContact O-N 3.18Å; T701-K703 VanDerWaalsContact C-N 3.32Å; T701-K703 PolarHBondContact O-N 2.85Å; K703-C706 PolarHBondContact O-N 2.97Å; K703-Y707 HydrophobicContact CG-CD2 4.35Å; K703-Y707 HydrophobicContact CG-CE2 3.91Å; K703-Y707 WeakPolarHBondContact O-CD2 3.5Å; K703-Y707 PolarHBondContact O-N 3.02Å; K703-Y707 VanDerWaalsContact O-N 3.16Å; K703-L718 HydrophobicContact CD-CD1 4.21Å; K703-L718 VanDerWaalsContact CE-CD1 3.42Å; K703-E720 IonicContact NZ-OE1 3.94Å; K703-E720 PolarHBondContact NZ-OE1 3.33Å; K703-I773 HydrophobicContact CD-CD1 4.01Å; K703-I773 HydrophobicContact CG-CD1 4.3Å; K703-L809 HydrophobicContact CB-CD2 4.24Å
704	S	83.2	Confident	83	Confident	17 Å²	17	36.1 Å²	36.1	12%	0.119	19%	0.191	C	C	.	.	H	α-helix	trans	-64.5	-44.2	171.9	-175.1	0	0	0	0	112.1	T611 E612 G613 E700 T701 C706 Y707 A708	T611-S704 PolarHBondContact O-OG 2.99Å; E612-S704 PolarHBondContact O-OG 3.44Å; G613-S704 VanDerWaalsContact CA-OG 3.24Å; G613-S704 WeakPolarHBondContact CA-OG 3.43Å; E700-S704 PolarHBondContact O-N 3.09Å; T701-S704 PolarHBondContact O-N 3.17Å; S704-C706 PolarHBondContact O-N 3.14Å; S704-Y707 WeakPolarHBondContact O-CA 3.35Å; S704-Y707 WeakPolarHBondContact O-CB 3.35Å; S704-Y707 PolarHBondContact O-N 2.98Å; S704-A708 PolarHBondContact O-N 3.15Å
705	T	85.9	Confident	82.4	Confident	15 Å²	15	41.2 Å²	41.2	9%	0.092	22%	0.219	C	C	.	.	H	α-helix	trans	-58.1	-35.9	174.8	-40.8	0	0	0	0	112.2	K403 L407 T408 L673 T701 A702 A708 C709	K403-T705 HydrophobicContact CD-CG2 4.23Å; K403-T705 HydrophobicContact CG-CG2 3.74Å; L407-T705 HydrophobicContact CB-CG2 4.44Å; L407-T705 HydrophobicContact CD1-CG2 4.39Å; T408-T705 HydrophobicContact CG2-CG2 4.36Å; L673-T705 HydrophobicContact CD2-CG2 3.78Å; T701-T705 PolarHBondContact O-N 3.38Å; T701-T705 PolarHBondContact O-OG1 3.42Å; A702-T705 PolarHBondContact O-N 2.77Å; T705-A708 PolarHBondContact O-N 3.2Å; T705-C709 VanDerWaalsContact O-CB 3.31Å; T705-C709 WeakPolarHBondContact O-CB 3.32Å; T705-C709 PolarHBondContact O-N 3.39Å; T705-C709 PolarHBondContact O-SG 3.42Å
706	C	88.8	Confident	82.2	Confident	1 Å²	1	42 Å²	42	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-67.2	-32.6	173.7	-69.7	0	0	0	0	113.4	A702 K703 S704 G710 L711 F712	A702-C706 PolarHBondContact O-N 2.89Å; A702-C706 PolarHBondContact O-SG 3.04Å; K703-C706 PolarHBondContact O-N 2.97Å; S704-C706 PolarHBondContact O-N 3.14Å; C706-G710 PolarHBondContact O-N 3.01Å; C706-L711 HydrophobicContact CB-CB 4.3Å; C706-L711 WeakPolarHBondContact O-CA 3.44Å; C706-L711 WeakPolarHBondContact O-CB 3.29Å; C706-L711 PolarHBondContact O-N 3.21Å; C706-F712 HydrophobicContact CB-CD2 3.35Å; C706-F712 HydrophobicContact CB-CE2 3.59Å; C706-F712 HydrophobicContact CB-CG 3.97Å; C706-F712 HydrophobicContact CB-CZ 4.38Å; C706-F712 PolarHBondContact O-N 2.92Å
707	Y	85.9	Confident	82.6	Confident	88 Å²	88	43.5 Å²	43.5	35%	0.345	22%	0.218	S	C	.	.	H	α-helix	trans	-70.8	-44.9	170.6	-75.4	-66	0	0	0	111.8	K703 S704 C709 G710 F712 L718	K703-Y707 HydrophobicContact CG-CD2 4.35Å; K703-Y707 HydrophobicContact CG-CE2 3.91Å; K703-Y707 WeakPolarHBondContact O-CD2 3.5Å; K703-Y707 PolarHBondContact O-N 3.02Å; K703-Y707 VanDerWaalsContact O-N 3.16Å; S704-Y707 WeakPolarHBondContact O-CA 3.35Å; S704-Y707 WeakPolarHBondContact O-CB 3.35Å; S704-Y707 PolarHBondContact O-N 2.98Å; Y707-C709 VanDerWaalsContact C-N 3.34Å; Y707-C709 PolarHBondContact O-N 2.85Å; Y707-G710 PolarHBondContact O-N 3.45Å; Y707-F712 HydrophobicContact CD1-CB 3.66Å; Y707-F712 WeakPolarHBondContact CD1-O 3.48Å; Y707-F712 HydrophobicContact CE1-CB 3.59Å; Y707-F712 HydrophobicContact CG-CB 4.25Å; Y707-L718 WeakPolarHBondContact OH-CD1 3.47Å
708	A	85.1	Confident	83.3	Confident	56 Å²	56	43.4 Å²	43.4	46%	0.463	22%	0.218	S	C	.	.	H	α-helix	trans	-63.9	-36.5	179.4	0	0	0	0	0	112.5	L673 A678 S704 T705 G710	L673-A708 HydrophobicContact CD1-CB 3.92Å; A678-A708 WeakPolarHBondContact CB-O 3.21Å; S704-A708 PolarHBondContact O-N 3.15Å; T705-A708 PolarHBondContact O-N 3.2Å; A708-G710 PolarHBondContact O-N 2.98Å
709	C	86.3	Confident	84.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	3.6	171.5	-71.9	0	0	0	0	114.4	L673 T705 Y707 L711	L673-C709 VanDerWaalsContact CD2-SG 3.59Å; T705-C709 VanDerWaalsContact O-CB 3.31Å; T705-C709 WeakPolarHBondContact O-CB 3.32Å; T705-C709 PolarHBondContact O-N 3.39Å; T705-C709 PolarHBondContact O-SG 3.42Å; Y707-C709 VanDerWaalsContact C-N 3.34Å; Y707-C709 PolarHBondContact O-N 2.85Å; C709-L711 HydrophobicContact CB-CD1 4.26Å; C709-L711 HydrophobicContact CB-CG 4.14Å; C709-L711 PolarHBondContact O-N 3.36Å; C709-L711 VanDerWaalsContact O-N 3.15Å
710	G	83.1	Confident	84.6	Confident	20 Å²	20	42.3 Å²	42.3	21%	0.206	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	5.3	-178.8	0	0	0	0	0	115.7	C706 Y707 A708	C706-G710 PolarHBondContact O-N 3.01Å; Y707-G710 PolarHBondContact O-N 3.45Å; A708-G710 PolarHBondContact O-N 2.98Å
711	L	87.4	Confident	85	Confident	3 Å²	3	40 Å²	40	2%	0.016	20%	0.203	C	C	.	.	S	Bend	trans	-70.1	-32.2	-178.4	-69	176.3	0	0	0	112.7	M681 Q685 V691 V693 C706 C709 S807	M681-L711 HydrophobicContact CB-CD2 3.8Å; M681-L711 HydrophobicContact CB-CG 4.2Å; M681-L711 HydrophobicContact CG-CD2 4.21Å; M681-L711 HydrophobicContact CG-CG 4.42Å; M681-L711 HydrophobicContact SD-CD2 4.28Å; Q685-L711 HydrophobicContact CG-CD2 4.42Å; Q685-L711 PolarHBondContact NE2-O 3.23Å; V691-L711 HydrophobicContact CB-CD2 3.72Å; V691-L711 HydrophobicContact CG1-CD1 4.07Å; V691-L711 HydrophobicContact CG1-CD2 3.92Å; V691-L711 HydrophobicContact CG2-CD2 4.1Å; V693-L711 HydrophobicContact CG2-CD1 3.67Å; C706-L711 HydrophobicContact CB-CB 4.3Å; C706-L711 WeakPolarHBondContact O-CA 3.44Å; C706-L711 WeakPolarHBondContact O-CB 3.29Å; C706-L711 PolarHBondContact O-N 3.21Å; C709-L711 HydrophobicContact CB-CD1 4.26Å; C709-L711 HydrophobicContact CB-CG 4.14Å; C709-L711 PolarHBondContact O-N 3.36Å; C709-L711 VanDerWaalsContact O-N 3.15Å; L711-S807 WeakPolarHBondContact O-CB 3.48Å
712	F	87.9	Confident	85.3	Confident	3 Å²	3	40 Å²	40	1%	0.013	20%	0.203	C	C	.	.	S	Bend	trans	-111	141.3	164.3	-63.2	-33.4	0	0	0	109.2	C706 Y707 T716 L718 I773 L809	C706-F712 HydrophobicContact CB-CD2 3.35Å; C706-F712 HydrophobicContact CB-CE2 3.59Å; C706-F712 HydrophobicContact CB-CG 3.97Å; C706-F712 HydrophobicContact CB-CZ 4.38Å; C706-F712 PolarHBondContact O-N 2.92Å; Y707-F712 HydrophobicContact CD1-CB 3.66Å; Y707-F712 WeakPolarHBondContact CD1-O 3.48Å; Y707-F712 HydrophobicContact CE1-CB 3.59Å; Y707-F712 HydrophobicContact CG-CB 4.25Å; F712-T716 HydrophobicContact CD1-CG2 4.37Å; F712-L718 HydrophobicContact CD1-CD2 4.03Å; F712-L718 HydrophobicContact CD2-CD2 4.11Å; F712-L718 HydrophobicContact CE1-CD2 3.97Å; F712-L718 HydrophobicContact CE2-CD2 4.06Å; F712-L718 HydrophobicContact CG-CD2 4.11Å; F712-L718 HydrophobicContact CZ-CD2 3.99Å; F712-I773 HydrophobicContact CE2-CD1 4.04Å; F712-I773 HydrophobicContact CE2-CG1 4.35Å; F712-I773 HydrophobicContact CZ-CD1 4.33Å; F712-I773 HydrophobicContact CZ-CG1 4.13Å; F712-L809 HydrophobicContact CE2-CB 4.34Å; F712-L809 HydrophobicContact CE2-CD2 4.25Å; F712-L809 HydrophobicContact CZ-CB 3.96Å
713	K	82.5	Confident	84.9	Confident	77 Å²	77	42.7 Å²	42.7	34%	0.335	22%	0.217	S	C	.	.			trans	-112.3	158.9	178.8	-59.3	-170.4	175.1	-163.1	0	109.4	E682 N715 T716	E682-K713 IonicContact OE1-NZ 2.68Å; E682-K713 PolarHBondContact OE1-NZ 2.88Å; K713-N715 VanDerWaalsContact CB-OD1 3.28Å; K713-N715 WeakPolarHBondContact CB-OD1 3.13Å; K713-N715 PolarHBondContact O-N 2.91Å; K713-T716 PolarHBondContact N-OG1 3Å; K713-T716 VanDerWaalsContact O-CB 3.3Å; K713-T716 WeakPolarHBondContact O-CB 3.33Å; K713-T716 PolarHBondContact O-N 3.28Å; K713-T716 PolarHBondContact O-OG1 3.48Å
714	K	76.8	Confident	84.3	Confident	217 Å²	217	47.1 Å²	47.1	94%	0.943	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.4	-176.4	-66.1	-170.7	179.4	-175.3	0	113.9
715	N	79	Confident	83.8	Confident	108 Å²	108	48 Å²	48	58%	0.578	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	7.3	175.8	67.7	-54.4	0	0	0	114.1	K713	K713-N715 VanDerWaalsContact CB-OD1 3.28Å; K713-N715 WeakPolarHBondContact CB-OD1 3.13Å; K713-N715 PolarHBondContact O-N 2.91Å
716	T	82.7	Confident	83.1	Confident	15 Å²	15	47.3 Å²	47.3	9%	0.092	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-80.7	122.7	177.4	-57.5	0	0	0	0	110.3	F712 K713 L718 D769	F712-T716 HydrophobicContact CD1-CG2 4.37Å; K713-T716 PolarHBondContact N-OG1 3Å; K713-T716 VanDerWaalsContact O-CB 3.3Å; K713-T716 WeakPolarHBondContact O-CB 3.33Å; K713-T716 PolarHBondContact O-N 3.28Å; K713-T716 PolarHBondContact O-OG1 3.48Å; T716-L718 HydrophobicContact CG2-CD2 4.16Å; T716-D769 CarbonylContact C-O 3.58Å; T716-D769 VanDerWaalsContact CA-O 3.29Å; T716-D769 WeakPolarHBondContact CA-O 3.24Å; T716-D769 WeakPolarHBondContact CG2-O 3.44Å
717	E	86.3	Confident	82.1	Confident	75 Å²	75	52.1 Å²	52.1	35%	0.35	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	129.7	171.5	-172.7	-179	152.3	0	0	109.1	K747 D769 Y770 G771	E717-K747 IonicContact OE1-NZ 3.25Å; E717-D769 PolarHBondContact N-O 3.23Å; E717-Y770 HydrophobicContact CB-CD1 3.93Å; E717-Y770 HydrophobicContact CB-CE1 4.07Å; E717-Y770 HydrophobicContact CG-CD1 4.34Å; E717-Y770 HydrophobicContact CG-CE1 4.28Å; E717-Y770 WeakPolarHBondContact O-CA 3.24Å; E717-Y770 WeakPolarHBondContact OE2-CE1 3.45Å; E717-G771 PolarHBondContact O-N 3.03Å
718	L	88.4	Confident	80.7	Confident	36 Å²	36	53 Å²	53	19%	0.188	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.6	-177	-64.5	178.7	0	0	0	111.2	K703 Y707 F712 T716 E720 I773	K703-L718 HydrophobicContact CD-CD1 4.21Å; K703-L718 VanDerWaalsContact CE-CD1 3.42Å; Y707-L718 WeakPolarHBondContact OH-CD1 3.47Å; F712-L718 HydrophobicContact CD1-CD2 4.03Å; F712-L718 HydrophobicContact CD2-CD2 4.11Å; F712-L718 HydrophobicContact CE1-CD2 3.97Å; F712-L718 HydrophobicContact CE2-CD2 4.06Å; F712-L718 HydrophobicContact CG-CD2 4.11Å; F712-L718 HydrophobicContact CZ-CD2 3.99Å; T716-L718 HydrophobicContact CG2-CD2 4.16Å; L718-E720 HydrophobicContact CB-CG 4.24Å; L718-I773 HydrophobicContact CD1-CD1 4.05Å; L718-I773 HydrophobicContact CD2-CD1 4.33Å
719	L	90.4	Very high	79.4	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	105.1	176.1	-56.1	177.2	0	0	0	108.4	Y744 K747 A748 Y770 G771 F772 I773 I801	L719-Y744 HydrophobicContact CB-CD1 4.45Å; L719-Y744 HydrophobicContact CB-CD2 4.26Å; L719-Y744 HydrophobicContact CB-CE2 4.34Å; L719-Y744 HydrophobicContact CB-CG 4.3Å; L719-Y744 HydrophobicContact CD1-CG 4.42Å; L719-Y744 HydrophobicContact CD2-CD1 3.9Å; L719-Y744 HydrophobicContact CD2-CE1 4.14Å; L719-Y744 HydrophobicContact CD2-CG 4.42Å; L719-K747 HydrophobicContact CD2-CD 4.36Å; L719-A748 HydrophobicContact CD1-CB 4.36Å; L719-Y770 HydrophobicContact CD1-CD1 4.28Å; L719-Y770 HydrophobicContact CG-CD1 4.42Å; L719-G771 PolarHBondContact N-O 2.77Å; L719-F772 HydrophobicContact CB-CD2 3.81Å; L719-F772 HydrophobicContact CB-CE2 4.32Å; L719-F772 HydrophobicContact CD1-CD2 4.48Å; L719-I773 PolarHBondContact O-N 3.22Å; L719-I801 HydrophobicContact CD1-CG2 4.49Å
720	E	89.8	Confident	78.1	Confident	43 Å²	43	57.5 Å²	57.5	20%	0.201	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	103.7	-167.8	-55.8	-165.6	168.2	0	0	112.9	K703 L718 T725 Y744 I773	K703-E720 IonicContact NZ-OE1 3.94Å; K703-E720 PolarHBondContact NZ-OE1 3.33Å; L718-E720 HydrophobicContact CB-CG 4.24Å; E720-T725 PolarHBondContact O-OG1 2.99Å; E720-Y744 PolarHBondContact O-OH 2.85Å; E720-I773 HydrophobicContact CG-CB 4.21Å; E720-I773 HydrophobicContact CG-CD1 4.25Å; E720-I773 HydrophobicContact CG-CG1 4.45Å
721	L	88.1	Confident	77.2	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	92.6	178.6	-173.7	63.9	0	0	0	111.3	L726 L737 L740 L741 Y744 F772 I773 I774 D775	L721-L726 HydrophobicContact CD1-CD1 4.48Å; L721-L726 HydrophobicContact CD1-CD2 4.08Å; L721-L726 HydrophobicContact CD1-CG 4.33Å; L721-L737 HydrophobicContact CD1-CD1 3.88Å; L721-L737 HydrophobicContact CD2-CD1 3.83Å; L721-L737 HydrophobicContact CG-CD1 4.34Å; L721-L740 HydrophobicContact CD1-CB 4.47Å; L721-L740 HydrophobicContact CD1-CD1 4.21Å; L721-L741 HydrophobicContact CD2-CD2 4.15Å; L721-Y744 HydrophobicContact CB-CE2 4.42Å; L721-F772 HydrophobicContact CB-CZ 4.03Å; L721-F772 HydrophobicContact CD2-CZ 4.15Å; L721-I773 PolarHBondContact N-O 2.8Å; L721-I774 HydrophobicContact CB-CG1 4.4Å; L721-I774 HydrophobicContact CD2-CD1 3.96Å; L721-I774 HydrophobicContact CD2-CG1 4.41Å; L721-I774 WeakPolarHBondContact O-CA 3.5Å; L721-D775 PolarHBondContact O-N 2.92Å
722	T	82.8	Confident	76.4	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.055	35%	0.353	C	S	.	.	S	Bend	trans	-131.7	167.6	-174.3	64.9	0	0	0	0	111.2	M699 R724 T725 L726 D775	M699-T722 HydrophobicContact SD-CG2 3.65Å; T722-R724 PolarHBondContact O-N 2.89Å; T722-R724 PolarHBondContact OG1-N 3.18Å; T722-T725 PolarHBondContact N-OG1 3.34Å; T722-T725 CarbonylContact O-C 3.5Å; T722-T725 PolarHBondContact O-N 2.87Å; T722-T725 PolarHBondContact O-OG1 2.81Å; T722-T725 PolarHBondContact OG1-N 3.33Å; T722-T725 PolarHBondContact OG1-OG1 3.18Å; T722-L726 WeakPolarHBondContact O-CG 3.34Å; T722-L726 PolarHBondContact O-N 3.47Å; T722-D775 VanDerWaalsContact CA-OD2 3.25Å; T722-D775 WeakPolarHBondContact CA-OD2 3.23Å; T722-D775 WeakPolarHBondContact CB-OD2 3.26Å
723	L	75.9	Confident	75.8	Confident	57 Å²	57	72.5 Å²	72.5	30%	0.298	38%	0.375	S	S	.	.	H	α-helix	trans	-55.5	-39.8	171.7	-70.7	176.1	0	0	0	112.3	T725 L726 E727 D775 A777 M781	L723-T725 PolarHBondContact O-N 3.49Å; L723-L726 CarbonylContact O-C 3.52Å; L723-L726 PolarHBondContact O-N 3.19Å; L723-E727 WeakPolarHBondContact O-CG 3.4Å; L723-E727 PolarHBondContact O-N 3.33Å; L723-D775 PolarHBondContact N-OD2 3.32Å; L723-A777 HydrophobicContact CD1-CB 3.7Å; L723-A777 HydrophobicContact CD2-CB 3.98Å; L723-A777 HydrophobicContact CG-CB 3.85Å; L723-M781 HydrophobicContact CD2-CE 4.1Å
724	R	73.9	Confident	75.5	Confident	148 Å²	148	75.6 Å²	75.6	56%	0.558	39%	0.39	S	S	*	.	H	α-helix	trans	-56.8	-50.7	175.2	-67.7	-176.9	-179.1	137.5	-4.7	111	E700 T722 L726 E727	E700-R724 IonicContact OE1-CZ 3.44Å; E700-R724 IonicContact OE1-NH1 3.74Å; E700-R724 PolarHBondContact OE1-NH1 3.35Å; E700-R724 IonicContact OE1-NH2 2.7Å; E700-R724 PolarHBondContact OE1-NH2 3Å; T722-R724 PolarHBondContact O-N 2.89Å; T722-R724 PolarHBondContact OG1-N 3.18Å; R724-L726 PolarHBondContact O-N 3.27Å; R724-E727 PolarHBondContact O-N 3.43Å
725	T	73.4	Confident	75.5	Confident	35 Å²	35	70.1 Å²	70.1	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-74.6	-2.5	178.8	55	0	0	0	0	114	E720 T722 L723 R736 L740	E720-T725 PolarHBondContact O-OG1 2.99Å; T722-T725 PolarHBondContact N-OG1 3.34Å; T722-T725 CarbonylContact O-C 3.5Å; T722-T725 PolarHBondContact O-N 2.87Å; T722-T725 PolarHBondContact O-OG1 2.81Å; T722-T725 PolarHBondContact OG1-N 3.33Å; T722-T725 PolarHBondContact OG1-OG1 3.18Å; L723-T725 PolarHBondContact O-N 3.49Å; T725-R736 WeakPolarHBondContact O-CD 3.45Å; T725-R736 PolarHBondContact O-NH1 3.5Å; T725-L740 WeakPolarHBondContact O-CD1 3.34Å
726	L	70.8	Confident	75.7	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-102.5	-13.6	171.8	-70.7	176.3	0	0	0	114.3	L721 T722 L723 R724 R736 L737 L740 S778 M781	L721-L726 HydrophobicContact CD1-CD1 4.48Å; L721-L726 HydrophobicContact CD1-CD2 4.08Å; L721-L726 HydrophobicContact CD1-CG 4.33Å; T722-L726 WeakPolarHBondContact O-CG 3.34Å; T722-L726 PolarHBondContact O-N 3.47Å; L723-L726 CarbonylContact O-C 3.52Å; L723-L726 PolarHBondContact O-N 3.19Å; R724-L726 PolarHBondContact O-N 3.27Å; L726-R736 HydrophobicContact CD2-CB 4.24Å; L726-R736 WeakPolarHBondContact O-CD 3.41Å; L726-L737 HydrophobicContact CD2-CB 3.89Å; L726-L737 HydrophobicContact CD2-CD1 4.47Å; L726-L740 HydrophobicContact CD2-CD1 4.08Å; L726-S778 WeakPolarHBondContact CD1-OG 3.39Å; L726-M781 HydrophobicContact CD1-CE 3.48Å; L726-M781 VanDerWaalsContact CD1-CE 3.48Å
727	E	66.7	Low	75.7	Confident	102 Å²	102	67.6 Å²	67.6	48%	0.477	35%	0.349	S	S	.	.	H	α-helix	trans	-99.8	-21.3	-176.9	-72.8	176.4	156.8	0	0	114.1	L723 R724 G729 R733	L723-E727 WeakPolarHBondContact O-CG 3.4Å; L723-E727 PolarHBondContact O-N 3.33Å; R724-E727 PolarHBondContact O-N 3.43Å; E727-G729 PolarHBondContact O-N 3.48Å; E727-R733 IonicContact OE1-CZ 2.8Å; E727-R733 IonicContact OE1-NE 3.22Å; E727-R733 PolarHBondContact OE1-NE 3.01Å; E727-R733 IonicContact OE1-NH2 2.62Å; E727-R733 PolarHBondContact OE1-NH2 3.43Å
728	D	57.6	Low	75.6	Confident	106 Å²	106	66 Å²	66	57%	0.567	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	127.3	179	-94.4	-37.8	0	0	0	113.7	R736	D728-R736 PolarHBondContact O-NE 2.9Å; D728-R736 PolarHBondContact O-NH2 3.49Å
729	G	56.8	Low	75.4	Confident	72 Å²	72	68.1 Å²	68.1	74%	0.742	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	19.4	166.2	0	0	0	0	0	116.7	E727 R731	E727-G729 PolarHBondContact O-N 3.48Å; G729-R731 PolarHBondContact O-N 3.3Å
730	G	58.9	Low	75.2	Confident	79 Å²	79	68.9 Å²	68.9	81%	0.814	36%	0.357	S	S	*	.	S	Bend	trans	71.1	15.5	154.4	0	0	0	0	0	118.2
731	R	64.3	Low	75	Confident	167 Å²	167	66.8 Å²	66.8	63%	0.63	35%	0.348	S	S	*	.	S	Bend	trans	-87.3	173.9	168.2	-64.7	-170.5	-174.8	171.7	1	111.5	G729 D739	G729-R731 PolarHBondContact O-N 3.3Å; R731-D739 IonicContact NH1-OD2 2.78Å; R731-D739 PolarHBondContact NH1-OD2 2.91Å
732	S	72.3	Confident	74.9	Confident	49 Å²	49	69.8 Å²	69.8	34%	0.343	36%	0.363	S	S	.	.			trans	-64.6	142.7	169.1	82.1	0	0	0	0	110.8	E734 E735 R736	S732-E734 PolarHBondContact O-N 3.33Å; S732-E735 VanDerWaalsContact CB-OE1 3.3Å; S732-E735 WeakPolarHBondContact CB-OE1 3.3Å; S732-E735 PolarHBondContact O-N 2.92Å; S732-E735 WeakPolarHBondContact OG-CB 3.23Å; S732-E735 VanDerWaalsContact OG-CG 3.29Å; S732-E735 WeakPolarHBondContact OG-CG 3.29Å; S732-E735 PolarHBondContact OG-N 3.04Å; S732-E735 PolarHBondContact OG-OE1 3.41Å; S732-R736 PolarHBondContact O-N 2.97Å
733	R	75.1	Confident	75.1	Confident	124 Å²	124	73.2 Å²	73.2	47%	0.468	38%	0.379	S	S	.	.	H	α-helix	trans	-60	-28.9	179.3	-67.6	-176.9	-178.6	135.6	-6.1	112.1	E727 L737	E727-R733 IonicContact OE1-CZ 2.8Å; E727-R733 IonicContact OE1-NE 3.22Å; E727-R733 PolarHBondContact OE1-NE 3.01Å; E727-R733 IonicContact OE1-NH2 2.62Å; E727-R733 PolarHBondContact OE1-NH2 3.43Å; R733-L737 VanDerWaalsContact O-CB 3.26Å; R733-L737 WeakPolarHBondContact O-CB 3.38Å; R733-L737 PolarHBondContact O-N 3.13Å
734	E	75.1	Confident	75.6	Confident	142 Å²	142	71.5 Å²	71.5	66%	0.664	37%	0.368	S	S	*	.	H	α-helix	trans	-78.2	-38.1	-176.7	-60.8	-174.5	166.2	0	0	112.8	S732 H738	S732-E734 PolarHBondContact O-N 3.33Å; E734-H738 PolarHBondContact O-N 3.17Å
735	E	78.2	Confident	76.2	Confident	103 Å²	103	65.4 Å²	65.4	48%	0.481	35%	0.346	S	S	.	.	H	α-helix	trans	-63.1	-46.9	169.6	-74.4	157.6	-115.7	0	0	110.9	S732 L737 H738 D739	S732-E735 VanDerWaalsContact CB-OE1 3.3Å; S732-E735 WeakPolarHBondContact CB-OE1 3.3Å; S732-E735 PolarHBondContact O-N 2.92Å; S732-E735 WeakPolarHBondContact OG-CB 3.23Å; S732-E735 VanDerWaalsContact OG-CG 3.29Å; S732-E735 WeakPolarHBondContact OG-CG 3.29Å; S732-E735 PolarHBondContact OG-N 3.04Å; S732-E735 PolarHBondContact OG-OE1 3.41Å; E735-L737 VanDerWaalsContact C-N 3.29Å; E735-L737 PolarHBondContact O-N 3.36Å; E735-H738 WeakPolarHBondContact O-CA 3.39Å; E735-H738 VanDerWaalsContact O-CB 3.3Å; E735-H738 WeakPolarHBondContact O-CB 3.28Å; E735-H738 PolarHBondContact O-N 3.45Å; E735-D739 PolarHBondContact O-N 3.26Å
736	R	82.1	Confident	76.7	Confident	65 Å²	65	68.5 Å²	68.5	25%	0.245	36%	0.356	C	S	.	.	H	α-helix	trans	-63.8	-36.2	179.9	-148.3	-172.8	-149.7	-85.2	-1.4	111.9	T725 L726 D728 S732 L740	T725-R736 WeakPolarHBondContact O-CD 3.45Å; T725-R736 PolarHBondContact O-NH1 3.5Å; L726-R736 HydrophobicContact CD2-CB 4.24Å; L726-R736 WeakPolarHBondContact O-CD 3.41Å; D728-R736 PolarHBondContact O-NE 2.9Å; D728-R736 PolarHBondContact O-NH2 3.49Å; S732-R736 PolarHBondContact O-N 2.97Å; R736-L740 HydrophobicContact CG-CD1 4.39Å; R736-L740 WeakPolarHBondContact O-CB 3.44Å; R736-L740 VanDerWaalsContact O-CG 3.28Å; R736-L740 WeakPolarHBondContact O-CG 3.19Å; R736-L740 PolarHBondContact O-N 2.92Å
737	L	83.3	Confident	77.2	Confident	4 Å²	4	71.5 Å²	71.5	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-63.7	-38.8	171.5	178.1	61.7	0	0	0	112	L721 L726 R733 E735 L741 M781 V782	L721-L737 HydrophobicContact CD1-CD1 3.88Å; L721-L737 HydrophobicContact CD2-CD1 3.83Å; L721-L737 HydrophobicContact CG-CD1 4.34Å; L726-L737 HydrophobicContact CD2-CB 3.89Å; L726-L737 HydrophobicContact CD2-CD1 4.47Å; R733-L737 VanDerWaalsContact O-CB 3.26Å; R733-L737 WeakPolarHBondContact O-CB 3.38Å; R733-L737 PolarHBondContact O-N 3.13Å; E735-L737 VanDerWaalsContact C-N 3.29Å; E735-L737 PolarHBondContact O-N 3.36Å; L737-L741 HydrophobicContact CD1-CD1 3.81Å; L737-L741 HydrophobicContact CD1-CG 4.07Å; L737-L741 HydrophobicContact CG-CD1 4.04Å; L737-L741 VanDerWaalsContact O-CB 3.28Å; L737-L741 WeakPolarHBondContact O-CB 3.22Å; L737-L741 WeakPolarHBondContact O-CG 3.12Å; L737-L741 PolarHBondContact O-N 2.94Å; L737-L741 VanDerWaalsContact O-N 3.07Å; L737-M781 HydrophobicContact CD2-CB 3.95Å; L737-V782 HydrophobicContact CD1-CG2 4.09Å; L737-V782 HydrophobicContact CD2-CG2 4.35Å
738	H	83.8	Confident	77.6	Confident	43 Å²	43	66.8 Å²	66.8	20%	0.199	35%	0.348	C	S	.	.	H	α-helix	trans	-64.2	-51.4	175.1	-164.1	114.9	0	0	0	111.5	E734 E735 L741 L742 Y794	E734-H738 PolarHBondContact O-N 3.17Å; E735-H738 WeakPolarHBondContact O-CA 3.39Å; E735-H738 VanDerWaalsContact O-CB 3.3Å; E735-H738 WeakPolarHBondContact O-CB 3.28Å; E735-H738 PolarHBondContact O-N 3.45Å; H738-L741 PolarHBondContact O-N 3.17Å; H738-L742 WeakPolarHBondContact O-CG 3.42Å; H738-L742 PolarHBondContact O-N 2.91Å; H738-Y794 HydrophobicContact CB-CE1 4.4Å; H738-Y794 AromaticContact ND1-CE1 3.39Å; H738-Y794 WeakPolarHBondContact ND1-CE1 3.39Å; H738-Y794 AromaticContact ND1-CZ 3.59Å; H738-Y794 PolarHBondContact ND1-OH 3Å
739	D	84.9	Confident	78.2	Confident	80 Å²	80	63.9 Å²	63.9	43%	0.428	33%	0.334	S	S	.	.	H	α-helix	trans	-60.4	-49.6	-178.5	-75.6	-12.5	0	0	0	111	R731 E735 L741 L742 E743	R731-D739 IonicContact NH1-OD2 2.78Å; R731-D739 PolarHBondContact NH1-OD2 2.91Å; E735-D739 PolarHBondContact O-N 3.26Å; D739-L741 PolarHBondContact O-N 2.84Å; D739-L742 PolarHBondContact O-N 3.31Å; D739-E743 PolarHBondContact O-N 2.85Å
740	L	85.6	Confident	78.6	Confident	17 Å²	17	66.3 Å²	66.3	9%	0.089	33%	0.326	C	S	.	.	H	α-helix	trans	-64.3	-40.4	178.7	-70.7	172.3	0	0	0	112.6	L721 T725 L726 R736 L742 E743 Y744	L721-L740 HydrophobicContact CD1-CB 4.47Å; L721-L740 HydrophobicContact CD1-CD1 4.21Å; T725-L740 WeakPolarHBondContact O-CD1 3.34Å; L726-L740 HydrophobicContact CD2-CD1 4.08Å; R736-L740 HydrophobicContact CG-CD1 4.39Å; R736-L740 WeakPolarHBondContact O-CB 3.44Å; R736-L740 VanDerWaalsContact O-CG 3.28Å; R736-L740 WeakPolarHBondContact O-CG 3.19Å; R736-L740 PolarHBondContact O-N 2.92Å; L740-L742 VanDerWaalsContact C-N 3.29Å; L740-L742 PolarHBondContact O-N 3.27Å; L740-E743 PolarHBondContact O-N 3.12Å; L740-Y744 HydrophobicContact CB-CE2 4.3Å; L740-Y744 HydrophobicContact CD2-CE1 4.24Å; L740-Y744 VanDerWaalsContact O-CB 3.29Å; L740-Y744 WeakPolarHBondContact O-CB 3.38Å; L740-Y744 WeakPolarHBondContact O-CD2 3.38Å; L740-Y744 PolarHBondContact O-N 2.86Å
741	L	85.4	Confident	78.7	Confident	0 Å²	0	67 Å²	67	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.7	-31.3	175.4	-75.9	173.8	0	0	0	112.4	L721 L737 H738 D739 H745 V782 Y794 I801	L721-L741 HydrophobicContact CD2-CD2 4.15Å; L737-L741 HydrophobicContact CD1-CD1 3.81Å; L737-L741 HydrophobicContact CD1-CG 4.07Å; L737-L741 HydrophobicContact CG-CD1 4.04Å; L737-L741 VanDerWaalsContact O-CB 3.28Å; L737-L741 WeakPolarHBondContact O-CB 3.22Å; L737-L741 WeakPolarHBondContact O-CG 3.12Å; L737-L741 PolarHBondContact O-N 2.94Å; L737-L741 VanDerWaalsContact O-N 3.07Å; H738-L741 PolarHBondContact O-N 3.17Å; D739-L741 PolarHBondContact O-N 2.84Å; L741-H745 WeakPolarHBondContact O-CB 3.39Å; L741-H745 PolarHBondContact O-N 2.83Å; L741-H745 VanDerWaalsContact O-N 3.08Å; L741-V782 HydrophobicContact CD1-CG2 4.39Å; L741-Y794 HydrophobicContact CD1-CD1 4.25Å; L741-Y794 HydrophobicContact CD1-CG 4.32Å; L741-I801 HydrophobicContact CD2-CD1 3.89Å
742	L	86	Confident	78.3	Confident	62 Å²	62	60.6 Å²	60.6	33%	0.325	29%	0.294	S	S	.	.	H	α-helix	trans	-74.6	-41.1	172.4	-70.4	-175.3	0	0	0	112.3	H738 D739 L740 H745 K746 L797	H738-L742 WeakPolarHBondContact O-CG 3.42Å; H738-L742 PolarHBondContact O-N 2.91Å; D739-L742 PolarHBondContact O-N 3.31Å; L740-L742 VanDerWaalsContact C-N 3.29Å; L740-L742 PolarHBondContact O-N 3.27Å; L742-H745 PolarHBondContact O-N 3.49Å; L742-K746 WeakPolarHBondContact O-CB 3.33Å; L742-K746 PolarHBondContact O-N 3.07Å; L742-L797 HydrophobicContact CD2-CD1 3.99Å; L742-L797 HydrophobicContact CD2-CD2 4.41Å
743	E	86.9	Confident	77.1	Confident	82 Å²	82	63.6 Å²	63.6	38%	0.383	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-50	176.5	-167.9	-156.2	128.5	0	0	111.3	D739 L740 H745 K746 K747	D739-E743 PolarHBondContact O-N 2.85Å; L740-E743 PolarHBondContact O-N 3.12Å; E743-H745 VanDerWaalsContact C-N 3.33Å; E743-H745 PolarHBondContact O-N 3.3Å; E743-K746 WeakPolarHBondContact O-CB 3.06Å; E743-K746 PolarHBondContact O-N 3.41Å; E743-K746 VanDerWaalsContact O-N 3.09Å; E743-K747 PolarHBondContact O-N 3.33Å; E743-K747 WeakPolarHBondContact OE1-CE 3.12Å; E743-K747 IonicContact OE1-NZ 3.55Å; E743-K747 PolarHBondContact OE1-NZ 2.98Å
744	Y	86.9	Confident	75.5	Confident	21 Å²	21	63.6 Å²	63.6	8%	0.082	33%	0.328	C	S	.	.	H	α-helix	trans	-66.5	-35.6	179.1	-63.5	-12	0	0	0	111.7	L719 E720 L721 L740 A748 F772	L719-Y744 HydrophobicContact CB-CD1 4.45Å; L719-Y744 HydrophobicContact CB-CD2 4.26Å; L719-Y744 HydrophobicContact CB-CE2 4.34Å; L719-Y744 HydrophobicContact CB-CG 4.3Å; L719-Y744 HydrophobicContact CD1-CG 4.42Å; L719-Y744 HydrophobicContact CD2-CD1 3.9Å; L719-Y744 HydrophobicContact CD2-CE1 4.14Å; L719-Y744 HydrophobicContact CD2-CG 4.42Å; E720-Y744 PolarHBondContact O-OH 2.85Å; L721-Y744 HydrophobicContact CB-CE2 4.42Å; L740-Y744 HydrophobicContact CB-CE2 4.3Å; L740-Y744 HydrophobicContact CD2-CE1 4.24Å; L740-Y744 VanDerWaalsContact O-CB 3.29Å; L740-Y744 WeakPolarHBondContact O-CB 3.38Å; L740-Y744 WeakPolarHBondContact O-CD2 3.38Å; L740-Y744 PolarHBondContact O-N 2.86Å; Y744-A748 VanDerWaalsContact O-CB 3.23Å; Y744-A748 WeakPolarHBondContact O-CB 3.4Å; Y744-A748 PolarHBondContact O-N 3.46Å; Y744-F772 AromaticContact CD2-CE2 3.97Å; Y744-F772 HydrophobicContact CD2-CE2 3.97Å
745	H	85.4	Confident	74	Confident	20 Å²	20	62.8 Å²	62.8	9%	0.093	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-40.5	169.9	177	89.2	0	0	0	111.7	L741 L742 E743 V749 Q750 L797 Q800 I801	L741-H745 WeakPolarHBondContact O-CB 3.39Å; L741-H745 PolarHBondContact O-N 2.83Å; L741-H745 VanDerWaalsContact O-N 3.08Å; L742-H745 PolarHBondContact O-N 3.49Å; E743-H745 VanDerWaalsContact C-N 3.33Å; E743-H745 PolarHBondContact O-N 3.3Å; H745-V749 WeakPolarHBondContact O-CA 3.36Å; H745-V749 WeakPolarHBondContact O-CB 3.49Å; H745-V749 WeakPolarHBondContact O-CG2 3.35Å; H745-V749 PolarHBondContact O-N 3.23Å; H745-Q750 PolarHBondContact CD2-NE2 3.36Å; H745-Q750 PolarHBondContact NE2-NE2 3.09Å; H745-Q750 VanDerWaalsContact NE2-NE2 3.19Å; H745-L797 HydrophobicContact CB-CD2 4.07Å; H745-Q800 PolarHBondContact CE1-OE1 3.5Å; H745-Q800 VanDerWaalsContact CE1-OE1 3.26Å; H745-I801 HydrophobicContact CB-CD1 4.23Å; H745-I801 HydrophobicContact CB-CG1 4.08Å
746	K	84.6	Confident	71.8	Confident	99 Å²	99	66 Å²	66	43%	0.43	35%	0.345	S	S	.	.	I	π-helix	trans	-62.1	-54.8	176.4	-165.4	-170	176.7	-96.6	0	110.8	L742 E743 A748 Q750 D751	L742-K746 WeakPolarHBondContact O-CB 3.33Å; L742-K746 PolarHBondContact O-N 3.07Å; E743-K746 WeakPolarHBondContact O-CB 3.06Å; E743-K746 PolarHBondContact O-N 3.41Å; E743-K746 VanDerWaalsContact O-N 3.09Å; K746-A748 PolarHBondContact O-N 2.82Å; K746-Q750 HydrophobicContact CG-CB 4.16Å; K746-Q750 WeakPolarHBondContact O-CA 3.45Å; K746-Q750 WeakPolarHBondContact O-CB 3.43Å; K746-Q750 PolarHBondContact O-N 2.94Å; K746-D751 WeakPolarHBondContact CG-OD2 3.13Å; K746-D751 IonicContact NZ-OD1 2.74Å; K746-D751 PolarHBondContact NZ-OD1 3.16Å; K746-D751 IonicContact NZ-OD2 2.66Å; K746-D751 PolarHBondContact NZ-OD2 2.98Å; K746-D751 PolarHBondContact O-N 2.85Å
747	K	80.9	Confident	69.4	Low	64 Å²	64	71.7 Å²	71.7	28%	0.278	38%	0.379	S	S	.	.	I	π-helix	trans	-54.8	-54.4	177.7	-75.3	176	166.6	174.4	0	112.4	E717 L719 E743	E717-K747 IonicContact OE1-NZ 3.25Å; L719-K747 HydrophobicContact CD2-CD 4.36Å; E743-K747 PolarHBondContact O-N 3.33Å; E743-K747 WeakPolarHBondContact OE1-CE 3.12Å; E743-K747 IonicContact OE1-NZ 3.55Å; E743-K747 PolarHBondContact OE1-NZ 2.98Å
748	A	75.5	Confident	67.3	Low	3 Å²	3	75.3 Å²	75.3	3%	0.025	42%	0.417	C	S	.	.	I	π-helix	trans	-81.9	-17.9	-172.3	0	0	0	0	0	114.6	L719 Y744 K746 I801 N804	L719-A748 HydrophobicContact CD1-CB 4.36Å; Y744-A748 VanDerWaalsContact O-CB 3.23Å; Y744-A748 WeakPolarHBondContact O-CB 3.4Å; Y744-A748 PolarHBondContact O-N 3.46Å; K746-A748 PolarHBondContact O-N 2.82Å; A748-I801 HydrophobicContact CB-CG2 4.46Å; A748-N804 WeakPolarHBondContact O-CB 3.37Å; A748-N804 PolarHBondContact O-ND2 3.41Å
749	V	71.3	Confident	65	Low	46 Å²	46	79.2 Å²	79.2	28%	0.279	44%	0.438	S	S	.	.	I	π-helix	trans	-126.8	-32.1	-170.5	-164.1	0	0	0	0	114.4	H745 Q800	H745-V749 WeakPolarHBondContact O-CA 3.36Å; H745-V749 WeakPolarHBondContact O-CB 3.49Å; H745-V749 WeakPolarHBondContact O-CG2 3.35Å; H745-V749 PolarHBondContact O-N 3.23Å; V749-Q800 HydrophobicContact CG2-CB 4.45Å
750	Q	65.2	Low	62.6	Low	123 Å²	123	81.3 Å²	81.3	58%	0.575	45%	0.454	S	S	*	.	I	π-helix	trans	-104.5	-43.1	-174.1	-56.6	-174.7	4.3	0	0	113	H745 K746 A752	H745-Q750 PolarHBondContact CD2-NE2 3.36Å; H745-Q750 PolarHBondContact NE2-NE2 3.09Å; H745-Q750 VanDerWaalsContact NE2-NE2 3.19Å; K746-Q750 HydrophobicContact CG-CB 4.16Å; K746-Q750 WeakPolarHBondContact O-CA 3.45Å; K746-Q750 WeakPolarHBondContact O-CB 3.43Å; K746-Q750 PolarHBondContact O-N 2.94Å; Q750-A752 VanDerWaalsContact C-N 3.26Å
751	D	60.7	Low	60.5	Low	94 Å²	94	87 Å²	87	50%	0.503	48%	0.475	S	S	.	.	S	Bend	trans	-81.1	-9.3	176.5	-61.9	-34.5	0	0	0	111.7	K746	K746-D751 WeakPolarHBondContact CG-OD2 3.13Å; K746-D751 IonicContact NZ-OD1 2.74Å; K746-D751 PolarHBondContact NZ-OD1 3.16Å; K746-D751 IonicContact NZ-OD2 2.66Å; K746-D751 PolarHBondContact NZ-OD2 2.98Å; K746-D751 PolarHBondContact O-N 2.85Å
752	A	55	Low	58	Low	32 Å²	32	90.6 Å²	90.6	26%	0.264	50%	0.5	S	S	.	.	S	Bend	trans	-70.5	137	172.4	0	0	0	0	0	111.7	Q750	Q750-A752 VanDerWaalsContact C-N 3.26Å
753	P	48.3	Very low	56	Low	111 Å²	111	92.2 Å²	92.2	72%	0.721	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-62.3	136.1	-170.3	22.6	-33.5	0	0	0	113.1	V755	P753-V755 PolarHBondContact O-N 2.93Å
754	P	41.4	Very low	53.4	Low	125 Å²	125	92.9 Å²	92.9	81%	0.812	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-66.6	132.1	-167.9	24.5	-34.4	0	0	0	113	K756	P754-K756 PolarHBondContact O-N 3.01Å; P754-K756 VanDerWaalsContact O-N 3.07Å
755	V	42.6	Very low	50.9	Low	124 Å²	124	97.3 Å²	97.3	75%	0.752	54%	0.544	S	S	*	.			trans	-66.2	106.8	-177.9	-179.2	0	0	0	0	110.6	P753 L757	P753-V755 PolarHBondContact O-N 2.93Å; V755-L757 PolarHBondContact O-N 3.42Å
756	K	33	Very low	48.6	Very low	172 Å²	172	101.7 Å²	101.7	75%	0.748	58%	0.584	S	S	*	*			trans	-63.4	116.1	169.9	-75.5	-172.9	177.2	179	0	110	P754 G758 I759	P754-K756 PolarHBondContact O-N 3.01Å; P754-K756 VanDerWaalsContact O-N 3.07Å; K756-G758 PolarHBondContact O-N 2.99Å; K756-I759 PolarHBondContact O-N 3.23Å
757	L	31.2	Very low	46.7	Very low	184 Å²	184	99.2 Å²	99.2	96%	0.963	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	99.7	-175.1	-167.9	76.9	0	0	0	111.2	V755	V755-L757 PolarHBondContact O-N 3.42Å
758	G	39	Very low	45.6	Very low	79 Å²	79	103.1 Å²	103.1	81%	0.814	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	140	-18.4	178.2	0	0	0	0	0	115	K756	K756-G758 PolarHBondContact O-N 2.99Å
759	I	34.2	Very low	45.6	Very low	125 Å²	125	105 Å²	105	64%	0.641	62%	0.615	S	S	*	*			trans	-108.8	112.3	177.2	-58.6	174.6	0	0	0	109.1	K756	K756-I759 PolarHBondContact O-N 3.23Å
760	T	36	Very low	46.3	Very low	125 Å²	125	104.8 Å²	104.8	77%	0.767	61%	0.609	S	S	*	*			trans	-64.8	139	167.6	33.6	0	0	0	0	109.7	S762	T760-S762 PolarHBondContact O-N 3.42Å
761	R	41.1	Very low	47.5	Very low	136 Å²	136	98.9 Å²	98.9	51%	0.513	58%	0.582	S	S	.	*			trans	-43.6	104	-175.8	-82.2	-173.1	175.4	179.9	-2	111.6	W763 R966	R761-W763 PolarHBondContact O-N 3.19Å; R761-R966 PolarHBondContact O-NH1 2.86Å; R761-R966 VanDerWaalsContact O-NH1 3.13Å; R761-R966 PolarHBondContact O-NH2 2.94Å
762	S	32.2	Very low	49	Very low	75 Å²	75	94.4 Å²	94.4	52%	0.524	56%	0.558	S	S	.	*			trans	-72.8	112.4	162.1	-162.6	0	0	0	0	106.1	T760 S764	T760-S762 PolarHBondContact O-N 3.42Å; S762-S764 PolarHBondContact O-N 2.88Å; S762-S764 PolarHBondContact OG-OG 2.83Å
763	W	45.3	Very low	50.8	Low	97 Å²	97	92.9 Å²	92.9	37%	0.367	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	30.5	-168.1	-146.2	-31	0	0	0	112.2	Q685 R761 T806	Q685-W763 WeakPolarHBondContact O-CZ3 3.46Å; R761-W763 PolarHBondContact O-N 3.19Å; W763-T806 HydrophobicContact CZ2-CG2 3.78Å
764	S	32.3	Very low	53	Low	95 Å²	95	87.6 Å²	87.6	66%	0.664	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.6	18.5	-165.5	68.8	0	0	0	0	112.6	S762	S762-S764 PolarHBondContact O-N 2.88Å; S762-S764 PolarHBondContact OG-OG 2.83Å
765	V	33.8	Very low	55.2	Low	115 Å²	115	82.2 Å²	82.2	70%	0.697	48%	0.476	S	S	*	.	S	Bend	trans	-130.1	86.1	179	-174	0	0	0	0	109.5	G767	V765-G767 PolarHBondContact O-N 3.44Å
766	A	36.9	Very low	57	Low	112 Å²	112	76.6 Å²	76.6	93%	0.926	44%	0.442	S	S	*	.			trans	25.8	62.8	154.2	0	0	0	0	0	117.1
767	G	45.8	Very low	59.4	Low	47 Å²	47	70.2 Å²	70.2	49%	0.485	42%	0.422	S	S	.	.			trans	-112.9	153	163.4	0	0	0	0	0	109.6	V765 D769	V765-G767 PolarHBondContact O-N 3.44Å; G767-D769 PolarHBondContact O-N 2.72Å
768	H	56.6	Low	61.9	Low	146 Å²	146	61.5 Å²	61.5	68%	0.676	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-67.7	120.3	172.9	-67.3	-96.8	0	0	0	109.4	Y770	H768-Y770 HydrophobicContact CB-CE2 4.16Å
769	D	74.9	Confident	64.2	Low	41 Å²	41	57.8 Å²	57.8	22%	0.219	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-78.4	121.2	171.9	-77.4	-42.1	0	0	0	108.8	T716 E717 G767 T806	T716-D769 CarbonylContact C-O 3.58Å; T716-D769 VanDerWaalsContact CA-O 3.29Å; T716-D769 WeakPolarHBondContact CA-O 3.24Å; T716-D769 WeakPolarHBondContact CG2-O 3.44Å; E717-D769 PolarHBondContact N-O 3.23Å; G767-D769 PolarHBondContact O-N 2.72Å; D769-T806 HydrophobicContact CB-CG2 4.26Å; D769-T806 VanDerWaalsContact OD1-CG2 3.27Å; D769-T806 WeakPolarHBondContact OD1-CG2 3.46Å
770	Y	87.3	Confident	66.5	Low	42 Å²	42	54.2 Å²	54.2	17%	0.165	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.1	176.1	-64.9	-76.4	0	0	0	111	E717 L719 H768 C805 T806	E717-Y770 HydrophobicContact CB-CD1 3.93Å; E717-Y770 HydrophobicContact CB-CE1 4.07Å; E717-Y770 HydrophobicContact CG-CD1 4.34Å; E717-Y770 HydrophobicContact CG-CE1 4.28Å; E717-Y770 WeakPolarHBondContact O-CA 3.24Å; E717-Y770 WeakPolarHBondContact OE2-CE1 3.45Å; L719-Y770 HydrophobicContact CD1-CD1 4.28Å; L719-Y770 HydrophobicContact CG-CD1 4.42Å; H768-Y770 HydrophobicContact CB-CE2 4.16Å; Y770-C805 VanDerWaalsContact O-CA 3.23Å; Y770-C805 WeakPolarHBondContact O-CA 3.5Å; Y770-C805 WeakPolarHBondContact O-CB 3.45Å; Y770-T806 PolarHBondContact O-N 2.75Å; Y770-T806 PolarHBondContact O-OG1 3.28Å
771	G	89.9	Confident	68.8	Low	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	146.1	164.7	0	0	0	0	0	110.6	E717 L719 S807	E717-G771 PolarHBondContact O-N 3.03Å; L719-G771 PolarHBondContact N-O 2.77Å; G771-S807 WeakPolarHBondContact CA-O 3.41Å
772	F	92.9	Very high	70.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	134.2	176.8	-167.3	-98.7	0	0	0	110.6	L719 L721 Y744 I774 F798 I801 C805 S807 V808 L809	L719-F772 HydrophobicContact CB-CD2 3.81Å; L719-F772 HydrophobicContact CB-CE2 4.32Å; L719-F772 HydrophobicContact CD1-CD2 4.48Å; L721-F772 HydrophobicContact CB-CZ 4.03Å; L721-F772 HydrophobicContact CD2-CZ 4.15Å; Y744-F772 AromaticContact CD2-CE2 3.97Å; Y744-F772 HydrophobicContact CD2-CE2 3.97Å; F772-I774 HydrophobicContact CD1-CB 4.38Å; F772-I774 HydrophobicContact CD1-CG2 4.41Å; F772-I774 HydrophobicContact CE1-CB 3.8Å; F772-I774 HydrophobicContact CE1-CD1 4.27Å; F772-I774 HydrophobicContact CE1-CG2 4.12Å; F772-F798 HydrophobicContact CE1-CD2 4.18Å; F772-F798 AromaticContact CE1-CE2 3.84Å; F772-F798 HydrophobicContact CE1-CE2 3.84Å; F772-F798 HydrophobicContact CZ-CD2 4.45Å; F772-I801 HydrophobicContact CD2-CG2 3.56Å; F772-I801 HydrophobicContact CE2-CG2 3.75Å; F772-I801 HydrophobicContact CG-CG2 4.36Å; F772-C805 HydrophobicContact CB-CB 4.4Å; F772-S807 PolarHBondContact N-O 3.22Å; F772-S807 VanDerWaalsContact N-O 3.17Å; F772-V808 HydrophobicContact CB-CG1 4.33Å; F772-V808 HydrophobicContact CB-CG2 4.23Å; F772-V808 HydrophobicContact CD1-CG1 4.18Å; F772-V808 CarbonylContact O-C 3.41Å; F772-V808 WeakPolarHBondContact O-CA 3.44Å; F772-L809 PolarHBondContact O-N 3.5Å
773	I	93.3	Very high	73	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.8	177.8	-53.7	-172.6	0	0	0	109.1	M699 K703 F712 L718 L719 E720 L721 L809	M699-I773 HydrophobicContact CG-CG2 3.72Å; M699-I773 HydrophobicContact SD-CG2 3.8Å; K703-I773 HydrophobicContact CD-CD1 4.01Å; K703-I773 HydrophobicContact CG-CD1 4.3Å; F712-I773 HydrophobicContact CE2-CD1 4.04Å; F712-I773 HydrophobicContact CE2-CG1 4.35Å; F712-I773 HydrophobicContact CZ-CD1 4.33Å; F712-I773 HydrophobicContact CZ-CG1 4.13Å; L718-I773 HydrophobicContact CD1-CD1 4.05Å; L718-I773 HydrophobicContact CD2-CD1 4.33Å; L719-I773 PolarHBondContact O-N 3.22Å; E720-I773 HydrophobicContact CG-CB 4.21Å; E720-I773 HydrophobicContact CG-CD1 4.25Å; E720-I773 HydrophobicContact CG-CG1 4.45Å; L721-I773 PolarHBondContact N-O 2.8Å; I773-L809 VanDerWaalsContact CA-O 3.32Å; I773-L809 WeakPolarHBondContact CA-O 3.49Å; I773-L809 HydrophobicContact CD1-CD2 4.33Å; I773-L809 HydrophobicContact CG1-CB 4.33Å; I773-L809 HydrophobicContact CG1-CD2 4.5Å; I773-L809 HydrophobicContact CG2-CD2 4.34Å; I773-L809 HydrophobicContact CG2-CG 4.41Å
774	I	92.8	Very high	74	Confident	0 Å²	0	41 Å²	41	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	142.5	177.9	-171	170.4	0	0	0	111.7	L721 F772 L779 F798 L809 C810 C811	L721-I774 HydrophobicContact CB-CG1 4.4Å; L721-I774 HydrophobicContact CD2-CD1 3.96Å; L721-I774 HydrophobicContact CD2-CG1 4.41Å; L721-I774 WeakPolarHBondContact O-CA 3.5Å; F772-I774 HydrophobicContact CD1-CB 4.38Å; F772-I774 HydrophobicContact CD1-CG2 4.41Å; F772-I774 HydrophobicContact CE1-CB 3.8Å; F772-I774 HydrophobicContact CE1-CD1 4.27Å; F772-I774 HydrophobicContact CE1-CG2 4.12Å; I774-L779 HydrophobicContact CD1-CB 3.87Å; I774-L779 HydrophobicContact CD1-CD1 4.12Å; I774-L779 HydrophobicContact CG1-CB 4.2Å; I774-F798 HydrophobicContact CD1-CD2 4.22Å; I774-F798 HydrophobicContact CD1-CE2 3.67Å; I774-F798 HydrophobicContact CG2-CE2 4.5Å; I774-L809 PolarHBondContact N-O 3.31Å; I774-C810 HydrophobicContact CG2-CB 4.08Å; I774-C810 WeakPolarHBondContact CG2-SG 3.02Å; I774-C810 CarbonylContact O-C 3.58Å; I774-C810 WeakPolarHBondContact O-CA 3.45Å; I774-C811 PolarHBondContact O-N 2.89Å; I774-C811 PolarHBondContact O-SG 3.03Å
775	D	88.1	Confident	74.9	Confident	12 Å²	12	38 Å²	38	6%	0.064	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	156.8	171.9	76.7	33.5	0	0	0	112.9	L721 T722 L723 A777 S778 L779 C811	L721-D775 PolarHBondContact O-N 2.92Å; T722-D775 VanDerWaalsContact CA-OD2 3.25Å; T722-D775 WeakPolarHBondContact CA-OD2 3.23Å; T722-D775 WeakPolarHBondContact CB-OD2 3.26Å; L723-D775 PolarHBondContact N-OD2 3.32Å; D775-A777 PolarHBondContact O-N 3.36Å; D775-A777 VanDerWaalsContact O-N 3.11Å; D775-A777 WeakPolarHBondContact OD1-CB 3.24Å; D775-A777 PolarHBondContact OD1-N 2.97Å; D775-S778 PolarHBondContact O-N 2.6Å; D775-S778 PolarHBondContact OD1-N 3.39Å; D775-S778 PolarHBondContact OD1-OG 3.11Å; D775-L779 WeakPolarHBondContact O-CB 3.44Å; D775-L779 PolarHBondContact O-N 2.72Å; D775-C811 CarbonylContact C-O 3.54Å; D775-C811 WeakPolarHBondContact CA-O 3.48Å
776	G	81.1	Confident	75.6	Confident	5 Å²	5	36.4 Å²	36.4	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-59.7	-19	-179.1	0	0	0	0	0	115	S780 C811 Q817	G776-S780 WeakPolarHBondContact O-CB 3.49Å; G776-S780 PolarHBondContact O-N 2.89Å; G776-S780 VanDerWaalsContact O-N 3.14Å; G776-S780 PolarHBondContact O-OG 3.44Å; G776-C811 PolarHBondContact N-O 3.21Å; G776-Q817 PolarHBondContact O-NE2 3.02Å
777	A	81.9	Confident	76.1	Confident	39 Å²	39	37 Å²	37	32%	0.322	24%	0.236	S	C	.	.	H	α-helix	trans	-85.1	-46.7	178	0	0	0	0	0	111.5	L723 D775 L779 S780 M781	L723-A777 HydrophobicContact CD1-CB 3.7Å; L723-A777 HydrophobicContact CD2-CB 3.98Å; L723-A777 HydrophobicContact CG-CB 3.85Å; D775-A777 PolarHBondContact O-N 3.36Å; D775-A777 VanDerWaalsContact O-N 3.11Å; D775-A777 WeakPolarHBondContact OD1-CB 3.24Å; D775-A777 PolarHBondContact OD1-N 2.97Å; A777-L779 VanDerWaalsContact C-N 3.3Å; A777-L779 PolarHBondContact O-N 2.92Å; A777-S780 WeakPolarHBondContact O-CB 3.49Å; A777-S780 PolarHBondContact O-N 2.95Å; A777-S780 VanDerWaalsContact O-N 3.13Å; A777-M781 PolarHBondContact O-N 3.1Å; A777-M781 VanDerWaalsContact O-N 3.1Å
778	S	85.5	Confident	76.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.7	-40.5	171.1	-67.2	0	0	0	0	111.4	L726 D775 S780 M781 V782	L726-S778 WeakPolarHBondContact CD1-OG 3.39Å; D775-S778 PolarHBondContact O-N 2.6Å; D775-S778 PolarHBondContact OD1-N 3.39Å; D775-S778 PolarHBondContact OD1-OG 3.11Å; S778-S780 PolarHBondContact O-N 3.38Å; S778-M781 PolarHBondContact O-N 3.33Å; S778-V782 WeakPolarHBondContact O-CG2 3.45Å; S778-V782 PolarHBondContact O-N 2.74Å; S778-V782 VanDerWaalsContact O-N 3.12Å
779	L	85.9	Confident	76.5	Confident	1 Å²	1	38 Å²	38	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-42.3	172.4	-179.2	65.4	0	0	0	111.9	I774 D775 A777 M781 V782 L783 F798 M813 I821	I774-L779 HydrophobicContact CD1-CB 3.87Å; I774-L779 HydrophobicContact CD1-CD1 4.12Å; I774-L779 HydrophobicContact CG1-CB 4.2Å; D775-L779 WeakPolarHBondContact O-CB 3.44Å; D775-L779 PolarHBondContact O-N 2.72Å; A777-L779 VanDerWaalsContact C-N 3.3Å; A777-L779 PolarHBondContact O-N 2.92Å; L779-M781 VanDerWaalsContact C-N 3.28Å; L779-M781 PolarHBondContact O-N 3.43Å; L779-V782 PolarHBondContact O-N 2.55Å; L779-V782 VanDerWaalsContact O-N 3.14Å; L779-L783 HydrophobicContact CD1-CD1 3.83Å; L779-L783 HydrophobicContact CD1-CD2 4.4Å; L779-L783 HydrophobicContact CD1-CG 3.83Å; L779-L783 HydrophobicContact CD2-CD1 4.07Å; L779-L783 HydrophobicContact CG-CD1 3.7Å; L779-L783 HydrophobicContact CG-CG 4.04Å; L779-L783 WeakPolarHBondContact O-CB 3.47Å; L779-L783 WeakPolarHBondContact O-CG 3.39Å; L779-L783 PolarHBondContact O-N 2.91Å; L779-F798 HydrophobicContact CD1-CE1 4.3Å; L779-F798 HydrophobicContact CD1-CE2 4.28Å; L779-F798 HydrophobicContact CD1-CZ 3.87Å; L779-M813 HydrophobicContact CD2-CE 3.37Å; L779-I821 HydrophobicContact CD1-CD1 3.62Å; L779-I821 HydrophobicContact CD2-CD1 3.71Å; L779-I821 HydrophobicContact CD2-CG1 3.76Å; L779-I821 HydrophobicContact CG-CD1 4.3Å
780	S	84.1	Confident	75.9	Confident	51 Å²	51	39.4 Å²	39.4	36%	0.357	25%	0.245	S	C	.	.	H	α-helix	trans	-56.4	-41.7	174.2	-88.6	0	0	0	0	111.9	G776 A777 S778 V782 L783 S784 Q817	G776-S780 WeakPolarHBondContact O-CB 3.49Å; G776-S780 PolarHBondContact O-N 2.89Å; G776-S780 VanDerWaalsContact O-N 3.14Å; G776-S780 PolarHBondContact O-OG 3.44Å; A777-S780 WeakPolarHBondContact O-CB 3.49Å; A777-S780 PolarHBondContact O-N 2.95Å; A777-S780 VanDerWaalsContact O-N 3.13Å; S778-S780 PolarHBondContact O-N 3.38Å; S780-V782 PolarHBondContact O-N 3.37Å; S780-L783 PolarHBondContact O-N 3.46Å; S780-S784 WeakPolarHBondContact O-CB 3.18Å; S780-S784 PolarHBondContact O-N 3.47Å; S780-S784 PolarHBondContact O-OG 3.02Å; S780-Q817 PolarHBondContact OG-NE2 3.35Å
781	M	82.3	Confident	74.7	Confident	49 Å²	49	37.5 Å²	37.5	24%	0.241	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-37.3	176.4	-66.1	-176.1	-74.2	0	0	112.8	L723 L726 L737 A777 S778 L779 L783 S785	L723-M781 HydrophobicContact CD2-CE 4.1Å; L726-M781 HydrophobicContact CD1-CE 3.48Å; L726-M781 VanDerWaalsContact CD1-CE 3.48Å; L737-M781 HydrophobicContact CD2-CB 3.95Å; A777-M781 PolarHBondContact O-N 3.1Å; A777-M781 VanDerWaalsContact O-N 3.1Å; S778-M781 PolarHBondContact O-N 3.33Å; L779-M781 VanDerWaalsContact C-N 3.28Å; L779-M781 PolarHBondContact O-N 3.43Å; M781-L783 VanDerWaalsContact C-N 3.33Å; M781-L783 PolarHBondContact O-N 3.4Å; M781-S785 PolarHBondContact O-OG 3.31Å
782	V	84	Confident	73.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-31.5	172.8	174.9	0	0	0	0	112.2	L737 L741 S778 L779 S780 K795 F798	L737-V782 HydrophobicContact CD1-CG2 4.09Å; L737-V782 HydrophobicContact CD2-CG2 4.35Å; L741-V782 HydrophobicContact CD1-CG2 4.39Å; S778-V782 WeakPolarHBondContact O-CG2 3.45Å; S778-V782 PolarHBondContact O-N 2.74Å; S778-V782 VanDerWaalsContact O-N 3.12Å; L779-V782 PolarHBondContact O-N 2.55Å; L779-V782 VanDerWaalsContact O-N 3.14Å; S780-V782 PolarHBondContact O-N 3.37Å; V782-K795 VanDerWaalsContact O-CE 3.3Å; V782-K795 WeakPolarHBondContact O-CE 3.5Å; V782-K795 WeakPolarHBondContact O-CG 3.32Å; V782-F798 HydrophobicContact CG1-CB 3.86Å; V782-F798 HydrophobicContact CG1-CD1 4.37Å; V782-F798 HydrophobicContact CG1-CD2 4.37Å; V782-F798 HydrophobicContact CG1-CG 3.95Å
783	L	78.9	Confident	73	Confident	19 Å²	19	52.1 Å²	52.1	10%	0.099	29%	0.293	C	S	.	.	H	α-helix	trans	-96.4	-33.8	-174.7	-66.4	-175.3	0	0	0	115.4	L779 S780 M781 S786 K795 Q820 L824	L779-L783 HydrophobicContact CD1-CD1 3.83Å; L779-L783 HydrophobicContact CD1-CD2 4.4Å; L779-L783 HydrophobicContact CD1-CG 3.83Å; L779-L783 HydrophobicContact CD2-CD1 4.07Å; L779-L783 HydrophobicContact CG-CD1 3.7Å; L779-L783 HydrophobicContact CG-CG 4.04Å; L779-L783 WeakPolarHBondContact O-CB 3.47Å; L779-L783 WeakPolarHBondContact O-CG 3.39Å; L779-L783 PolarHBondContact O-N 2.91Å; S780-L783 PolarHBondContact O-N 3.46Å; M781-L783 VanDerWaalsContact C-N 3.33Å; M781-L783 PolarHBondContact O-N 3.4Å; L783-S786 PolarHBondContact O-OG 3.13Å; L783-K795 WeakPolarHBondContact O-CE 3.16Å; L783-K795 PolarHBondContact O-NZ 2.83Å; L783-Q820 HydrophobicContact CD1-CB 4.08Å; L783-L824 HydrophobicContact CD2-CD2 4.1Å
784	S	65.8	Low	72.6	Confident	87 Å²	87	53.6 Å²	53.6	61%	0.608	30%	0.299	S	S	*	.	H	α-helix	trans	-74.5	-31.8	-165	64.7	0	0	0	0	114.5	S780 S786	S780-S784 WeakPolarHBondContact O-CB 3.18Å; S780-S784 PolarHBondContact O-N 3.47Å; S780-S784 PolarHBondContact O-OG 3.02Å; S784-S786 PolarHBondContact O-N 3.35Å
785	S	52.1	Low	72.2	Confident	32 Å²	32	55.2 Å²	55.2	22%	0.224	31%	0.306	C	S	.	.			trans	-66.9	24.6	-168	43.2	0	0	0	0	116.4	M781 S787 E788 S791	M781-S785 PolarHBondContact O-OG 3.31Å; S785-S787 PolarHBondContact O-N 3.12Å; S785-E788 PolarHBondContact O-N 3.27Å; S785-S791 VanDerWaalsContact C-CB 3.44Å; S785-S791 VanDerWaalsContact C-OG 3.25Å; S785-S791 WeakPolarHBondContact CB-OG 3.47Å; S785-S791 WeakPolarHBondContact O-CB 3.23Å; S785-S791 PolarHBondContact O-OG 3.48Å; S785-S791 WeakPolarHBondContact OG-CB 3.22Å; S785-S791 PolarHBondContact OG-OG 3.1Å
786	S	48.1	Very low	72	Confident	82 Å²	82	58.9 Å²	58.9	57%	0.573	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-15.1	-164.4	-58.8	0	0	0	0	117	L783 S784 K795	L783-S786 PolarHBondContact O-OG 3.13Å; S784-S786 PolarHBondContact O-N 3.35Å; S786-K795 PolarHBondContact OG-NZ 3.18Å
787	S	47.1	Very low	72.2	Confident	123 Å²	123	59.3 Å²	59.3	86%	0.86	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-22	174.3	37.2	0	0	0	0	114	S785	S785-S787 PolarHBondContact O-N 3.12Å
788	E	53.1	Low	72.6	Confident	108 Å²	108	57.5 Å²	57.5	51%	0.505	31%	0.311	S	S	.	.	S	Bend	trans	-98.9	149.2	-174.5	-74.8	-152.2	172.8	0	0	115	S785 N790 S791	S785-E788 PolarHBondContact O-N 3.27Å; E788-N790 VanDerWaalsContact C-N 3.25Å; E788-N790 PolarHBondContact O-N 3.4Å; E788-S791 WeakPolarHBondContact O-CB 3.39Å; E788-S791 PolarHBondContact O-N 3.13Å
789	P	58.3	Low	72.6	Confident	108 Å²	108	58.2 Å²	58.2	70%	0.701	32%	0.315	S	S	*	.	H	α-helix	trans	-61.3	-32.5	172.8	26	-34	0	0	0	112.7	S791 R792	P789-S791 VanDerWaalsContact C-N 3.33Å; P789-S791 PolarHBondContact O-N 2.88Å; P789-R792 PolarHBondContact O-N 3.27Å
790	N	61.1	Low	72.6	Confident	69 Å²	69	62.1 Å²	62.1	37%	0.369	33%	0.333	S	S	.	.	H	α-helix	trans	-64	-34.2	178.5	-71.4	-35.8	0	0	0	112.9	E788 R792 R793 Y794	E788-N790 VanDerWaalsContact C-N 3.25Å; E788-N790 PolarHBondContact O-N 3.4Å; N790-R792 VanDerWaalsContact C-N 3.29Å; N790-R792 PolarHBondContact O-N 2.76Å; N790-R793 WeakPolarHBondContact O-CA 3.38Å; N790-R793 VanDerWaalsContact O-CB 3.25Å; N790-R793 WeakPolarHBondContact O-CB 3.42Å; N790-R793 PolarHBondContact O-N 3.12Å; N790-Y794 PolarHBondContact O-N 3.49Å
791	S	62.6	Low	72.8	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.014	32%	0.316	C	S	.	.	H	α-helix	trans	-61.3	-36.9	179.7	-169.7	0	0	0	0	113	S785 E788 P789 R793 Y794 K795	S785-S791 VanDerWaalsContact C-CB 3.44Å; S785-S791 VanDerWaalsContact C-OG 3.25Å; S785-S791 WeakPolarHBondContact CB-OG 3.47Å; S785-S791 WeakPolarHBondContact O-CB 3.23Å; S785-S791 PolarHBondContact O-OG 3.48Å; S785-S791 WeakPolarHBondContact OG-CB 3.22Å; S785-S791 PolarHBondContact OG-OG 3.1Å; E788-S791 WeakPolarHBondContact O-CB 3.39Å; E788-S791 PolarHBondContact O-N 3.13Å; P789-S791 VanDerWaalsContact C-N 3.33Å; P789-S791 PolarHBondContact O-N 2.88Å; S791-R793 PolarHBondContact O-N 3.47Å; S791-Y794 PolarHBondContact O-N 3.21Å; S791-K795 WeakPolarHBondContact O-CB 3.14Å; S791-K795 WeakPolarHBondContact O-CD 3.34Å; S791-K795 WeakPolarHBondContact O-CG 3.49Å; S791-K795 PolarHBondContact O-N 3.26Å; S791-K795 WeakPolarHBondContact OG-CE 3.24Å; S791-K795 PolarHBondContact OG-NZ 3.04Å
792	R	70.4	Confident	73	Confident	185 Å²	185	57.3 Å²	57.3	70%	0.698	31%	0.305	S	S	*	.	H	α-helix	trans	-65.7	-30	174.2	-63.7	-176.1	-177.6	-179.3	1.8	111.6	P789 N790 N796	P789-R792 PolarHBondContact O-N 3.27Å; N790-R792 VanDerWaalsContact C-N 3.29Å; N790-R792 PolarHBondContact O-N 2.76Å; R792-N796 WeakPolarHBondContact O-CB 3.31Å; R792-N796 VanDerWaalsContact O-CG 3.24Å; R792-N796 PolarHBondContact O-N 3.12Å; R792-N796 PolarHBondContact O-ND2 3.33Å
793	R	77.6	Confident	73	Confident	122 Å²	122	59.8 Å²	59.8	46%	0.46	32%	0.316	S	S	.	.	H	α-helix	trans	-71.2	-47.8	173.4	-170.2	177.4	174.5	-170.9	-6.3	110.8	N790 S791 N796 L797	N790-R793 WeakPolarHBondContact O-CA 3.38Å; N790-R793 VanDerWaalsContact O-CB 3.25Å; N790-R793 WeakPolarHBondContact O-CB 3.42Å; N790-R793 PolarHBondContact O-N 3.12Å; S791-R793 PolarHBondContact O-N 3.47Å; R793-N796 PolarHBondContact O-N 3.28Å; R793-L797 HydrophobicContact CG-CD1 4.1Å; R793-L797 WeakPolarHBondContact O-CG 3.49Å; R793-L797 PolarHBondContact O-N 3.21Å
794	Y	83.7	Confident	73.2	Confident	32 Å²	32	61.3 Å²	61.3	13%	0.125	32%	0.324	C	S	.	.	H	α-helix	trans	-62.4	-45.8	178.5	-60.2	-22.3	0	0	0	112.8	H738 L741 N790 S791 N796 L797 F798	H738-Y794 HydrophobicContact CB-CE1 4.4Å; H738-Y794 AromaticContact ND1-CE1 3.39Å; H738-Y794 WeakPolarHBondContact ND1-CE1 3.39Å; H738-Y794 AromaticContact ND1-CZ 3.59Å; H738-Y794 PolarHBondContact ND1-OH 3Å; L741-Y794 HydrophobicContact CD1-CD1 4.25Å; L741-Y794 HydrophobicContact CD1-CG 4.32Å; N790-Y794 PolarHBondContact O-N 3.49Å; S791-Y794 PolarHBondContact O-N 3.21Å; Y794-N796 VanDerWaalsContact C-N 3.28Å; Y794-N796 PolarHBondContact O-N 2.9Å; Y794-L797 PolarHBondContact O-N 3.01Å; Y794-F798 VanDerWaalsContact O-CB 3.29Å; Y794-F798 WeakPolarHBondContact O-CB 3.34Å; Y794-F798 PolarHBondContact O-N 3.41Å
795	K	83.7	Confident	74.1	Confident	34 Å²	34	57.2 Å²	57.2	15%	0.148	30%	0.296	C	S	.	.	H	α-helix	trans	-58.8	-37.7	175.3	-73.2	162.1	177.8	153.9	0	112.6	V782 L783 S786 S791 L799	V782-K795 VanDerWaalsContact O-CE 3.3Å; V782-K795 WeakPolarHBondContact O-CE 3.5Å; V782-K795 WeakPolarHBondContact O-CG 3.32Å; L783-K795 WeakPolarHBondContact O-CE 3.16Å; L783-K795 PolarHBondContact O-NZ 2.83Å; S786-K795 PolarHBondContact OG-NZ 3.18Å; S791-K795 WeakPolarHBondContact O-CB 3.14Å; S791-K795 WeakPolarHBondContact O-CD 3.34Å; S791-K795 WeakPolarHBondContact O-CG 3.49Å; S791-K795 PolarHBondContact O-N 3.26Å; S791-K795 WeakPolarHBondContact OG-CE 3.24Å; S791-K795 PolarHBondContact OG-NZ 3.04Å; K795-L799 WeakPolarHBondContact O-CB 3.38Å; K795-L799 WeakPolarHBondContact O-CG 3.47Å; K795-L799 PolarHBondContact O-N 2.86Å; K795-L799 VanDerWaalsContact O-N 3.11Å
796	N	83.9	Confident	75.5	Confident	89 Å²	89	56.2 Å²	56.2	48%	0.476	29%	0.288	S	S	.	.	H	α-helix	trans	-73	-41.8	175.9	-77.7	-37.8	0	0	0	112.8	R792 R793 Y794 L799 Q800	R792-N796 WeakPolarHBondContact O-CB 3.31Å; R792-N796 VanDerWaalsContact O-CG 3.24Å; R792-N796 PolarHBondContact O-N 3.12Å; R792-N796 PolarHBondContact O-ND2 3.33Å; R793-N796 PolarHBondContact O-N 3.28Å; Y794-N796 VanDerWaalsContact C-N 3.28Å; Y794-N796 PolarHBondContact O-N 2.9Å; N796-L799 PolarHBondContact O-N 2.75Å; N796-Q800 WeakPolarHBondContact O-CB 3.33Å; N796-Q800 VanDerWaalsContact O-CG 3.29Å; N796-Q800 WeakPolarHBondContact O-CG 3.31Å; N796-Q800 PolarHBondContact O-N 3.39Å
797	L	86.2	Confident	77.4	Confident	14 Å²	14	52.3 Å²	52.3	7%	0.073	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-49.5	176.5	-73.9	169.3	0	0	0	111.2	L742 H745 R793 Y794 L799 Q800 I801	L742-L797 HydrophobicContact CD2-CD1 3.99Å; L742-L797 HydrophobicContact CD2-CD2 4.41Å; H745-L797 HydrophobicContact CB-CD2 4.07Å; R793-L797 HydrophobicContact CG-CD1 4.1Å; R793-L797 WeakPolarHBondContact O-CG 3.49Å; R793-L797 PolarHBondContact O-N 3.21Å; Y794-L797 PolarHBondContact O-N 3.01Å; L797-L799 VanDerWaalsContact C-N 3.35Å; L797-L799 PolarHBondContact O-N 2.73Å; L797-Q800 PolarHBondContact O-N 3.36Å; L797-Q800 VanDerWaalsContact O-N 3.09Å; L797-I801 WeakPolarHBondContact O-CG1 3.44Å; L797-I801 PolarHBondContact O-N 2.98Å
798	F	89.5	Confident	79.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-54.5	-48.3	174.2	170.2	-98.5	0	0	0	111.8	F772 I774 L779 V782 Y794 Q800 I801 C802 I821 L824	F772-F798 HydrophobicContact CE1-CD2 4.18Å; F772-F798 AromaticContact CE1-CE2 3.84Å; F772-F798 HydrophobicContact CE1-CE2 3.84Å; F772-F798 HydrophobicContact CZ-CD2 4.45Å; I774-F798 HydrophobicContact CD1-CD2 4.22Å; I774-F798 HydrophobicContact CD1-CE2 3.67Å; I774-F798 HydrophobicContact CG2-CE2 4.5Å; L779-F798 HydrophobicContact CD1-CE1 4.3Å; L779-F798 HydrophobicContact CD1-CE2 4.28Å; L779-F798 HydrophobicContact CD1-CZ 3.87Å; V782-F798 HydrophobicContact CG1-CB 3.86Å; V782-F798 HydrophobicContact CG1-CD1 4.37Å; V782-F798 HydrophobicContact CG1-CD2 4.37Å; V782-F798 HydrophobicContact CG1-CG 3.95Å; Y794-F798 VanDerWaalsContact O-CB 3.29Å; Y794-F798 WeakPolarHBondContact O-CB 3.34Å; Y794-F798 PolarHBondContact O-N 3.41Å; F798-Q800 VanDerWaalsContact C-N 3.34Å; F798-Q800 PolarHBondContact O-N 3.06Å; F798-I801 PolarHBondContact O-N 2.94Å; F798-C802 WeakPolarHBondContact O-CB 3.31Å; F798-C802 PolarHBondContact O-N 3.03Å; F798-C802 PolarHBondContact O-SG 3.43Å; F798-I821 HydrophobicContact CE1-CD1 3.96Å; F798-I821 HydrophobicContact CZ-CD1 3.87Å; F798-L824 HydrophobicContact CD1-CD2 3.83Å; F798-L824 HydrophobicContact CE1-CD2 3.79Å
799	L	86.8	Confident	81.6	Confident	15 Å²	15	41.3 Å²	41.3	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-58.5	-43.2	174.6	-90	173.5	0	0	0	112.3	K795 N796 L797 Q803 L824 V825	K795-L799 WeakPolarHBondContact O-CB 3.38Å; K795-L799 WeakPolarHBondContact O-CG 3.47Å; K795-L799 PolarHBondContact O-N 2.86Å; K795-L799 VanDerWaalsContact O-N 3.11Å; N796-L799 PolarHBondContact O-N 2.75Å; L797-L799 VanDerWaalsContact C-N 3.35Å; L797-L799 PolarHBondContact O-N 2.73Å; L799-Q803 WeakPolarHBondContact O-CB 3.22Å; L799-Q803 WeakPolarHBondContact O-CG 3.23Å; L799-Q803 PolarHBondContact O-N 3.31Å; L799-L824 HydrophobicContact CD1-CD1 3.99Å; L799-L824 HydrophobicContact CD1-CG 3.94Å; L799-L824 HydrophobicContact CD2-CD2 4.3Å; L799-L824 HydrophobicContact CD2-CG 4.02Å; L799-L824 HydrophobicContact CG-CD1 4.44Å; L799-L824 HydrophobicContact CG-CD2 4.08Å; L799-L824 HydrophobicContact CG-CG 3.94Å; L799-V825 HydrophobicContact CD2-CG2 4.23Å
800	Q	85.6	Confident	83.2	Confident	83 Å²	83	36.2 Å²	36.2	39%	0.388	16%	0.163	S	C	.	.	H	α-helix	trans	-66.9	-39.4	-179.3	-75.5	172.3	-31.7	0	0	112.9	H745 V749 N796 L797 F798 Q803 N804	H745-Q800 PolarHBondContact CE1-OE1 3.5Å; H745-Q800 VanDerWaalsContact CE1-OE1 3.26Å; V749-Q800 HydrophobicContact CG2-CB 4.45Å; N796-Q800 WeakPolarHBondContact O-CB 3.33Å; N796-Q800 VanDerWaalsContact O-CG 3.29Å; N796-Q800 WeakPolarHBondContact O-CG 3.31Å; N796-Q800 PolarHBondContact O-N 3.39Å; L797-Q800 PolarHBondContact O-N 3.36Å; L797-Q800 VanDerWaalsContact O-N 3.09Å; F798-Q800 VanDerWaalsContact C-N 3.34Å; F798-Q800 PolarHBondContact O-N 3.06Å; Q800-Q803 PolarHBondContact O-N 3.06Å; Q800-N804 PolarHBondContact O-N 3.17Å
801	I	87.5	Confident	84.5	Confident	0 Å²	0	33 Å²	33	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-55.7	174.1	-63.9	158.4	0	0	0	109.5	L719 L741 H745 A748 F772 L797 F798 Q803 N804 C805	L719-I801 HydrophobicContact CD1-CG2 4.49Å; L741-I801 HydrophobicContact CD2-CD1 3.89Å; H745-I801 HydrophobicContact CB-CD1 4.23Å; H745-I801 HydrophobicContact CB-CG1 4.08Å; A748-I801 HydrophobicContact CB-CG2 4.46Å; F772-I801 HydrophobicContact CD2-CG2 3.56Å; F772-I801 HydrophobicContact CE2-CG2 3.75Å; F772-I801 HydrophobicContact CG-CG2 4.36Å; L797-I801 WeakPolarHBondContact O-CG1 3.44Å; L797-I801 PolarHBondContact O-N 2.98Å; F798-I801 PolarHBondContact O-N 2.94Å; I801-Q803 PolarHBondContact O-N 3.46Å; I801-N804 PolarHBondContact O-N 3.24Å; I801-C805 PolarHBondContact O-N 3.06Å; I801-C805 VanDerWaalsContact O-N 3.1Å; I801-C805 PolarHBondContact O-SG 2.94Å; I801-C805 VanDerWaalsContact O-SG 3.37Å
802	C	87.4	Confident	85.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.4	-22.8	-178.6	-57.5	0	0	0	0	113.2	W692 F798 V808	W692-C802 HydrophobicContact CH2-CB 3.36Å; W692-C802 HydrophobicContact CZ2-CB 3.52Å; W692-C802 WeakPolarHBondContact CZ2-O 3.36Å; W692-C802 HydrophobicContact CZ3-CB 4.24Å; F798-C802 WeakPolarHBondContact O-CB 3.31Å; F798-C802 PolarHBondContact O-N 3.03Å; F798-C802 PolarHBondContact O-SG 3.43Å; C802-V808 HydrophobicContact CB-CG2 4.12Å
803	Q	83.4	Confident	85.7	Confident	52 Å²	52	29.2 Å²	29.2	24%	0.243	13%	0.132	C	C	.	.	H	α-helix	trans	-77.6	-14.7	171.2	-79.4	-178.4	-6.8	0	0	113.9	K690 L799 Q800 I801 S828	K690-Q803 PolarHBondContact NZ-O 3.38Å; L799-Q803 WeakPolarHBondContact O-CB 3.22Å; L799-Q803 WeakPolarHBondContact O-CG 3.23Å; L799-Q803 PolarHBondContact O-N 3.31Å; Q800-Q803 PolarHBondContact O-N 3.06Å; I801-Q803 PolarHBondContact O-N 3.46Å; Q803-S828 PolarHBondContact NE2-OG 2.91Å; Q803-S828 VanDerWaalsContact NE2-OG 3.12Å
804	N	83.9	Confident	85.5	Confident	50 Å²	50	25.6 Å²	25.6	27%	0.267	13%	0.128	S	C	.	.	H	α-helix	trans	-101.6	-32.6	176.6	-84.7	12.7	0	0	0	113.8	A748 Q800 I801	A748-N804 WeakPolarHBondContact O-CB 3.37Å; A748-N804 PolarHBondContact O-ND2 3.41Å; Q800-N804 PolarHBondContact O-N 3.17Å; I801-N804 PolarHBondContact O-N 3.24Å
805	C	84.7	Confident	85	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.007	14%	0.136	C	C	.	.	S	Bend	trans	-56.8	155.5	170.7	-63.8	0	0	0	0	112.9	Y770 F772 I801 V808	Y770-C805 VanDerWaalsContact O-CA 3.23Å; Y770-C805 WeakPolarHBondContact O-CA 3.5Å; Y770-C805 WeakPolarHBondContact O-CB 3.45Å; F772-C805 HydrophobicContact CB-CB 4.4Å; I801-C805 PolarHBondContact O-N 3.06Å; I801-C805 VanDerWaalsContact O-N 3.1Å; I801-C805 PolarHBondContact O-SG 2.94Å; I801-C805 VanDerWaalsContact O-SG 3.37Å; C805-V808 HydrophobicContact CB-CG2 4.36Å
806	T	81.3	Confident	84.6	Confident	11 Å²	11	30.8 Å²	30.8	7%	0.067	16%	0.161	C	C	.	.	S	Bend	trans	-85.4	-45.7	179.9	50.6	0	0	0	0	112.3	W763 D769 Y770	W763-T806 HydrophobicContact CZ2-CG2 3.78Å; D769-T806 HydrophobicContact CB-CG2 4.26Å; D769-T806 VanDerWaalsContact OD1-CG2 3.27Å; D769-T806 WeakPolarHBondContact OD1-CG2 3.46Å; Y770-T806 PolarHBondContact O-N 2.75Å; Y770-T806 PolarHBondContact O-OG1 3.28Å
807	S	88.2	Confident	84.4	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.3	177.1	178.9	0	0	0	0	109.8	L711 G771 F772	L711-S807 WeakPolarHBondContact O-CB 3.48Å; G771-S807 WeakPolarHBondContact CA-O 3.41Å; F772-S807 PolarHBondContact N-O 3.22Å; F772-S807 VanDerWaalsContact N-O 3.17Å
808	V	93.8	Very high	84.4	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	128.3	178.7	-179	0	0	0	0	109	W692 V693 F772 C802 C805	W692-V808 CarbonylContact C-O 3.57Å; W692-V808 VanDerWaalsContact CA-O 3.23Å; W692-V808 WeakPolarHBondContact CA-O 3.33Å; W692-V808 HydrophobicContact CB-CB 4.35Å; W692-V808 HydrophobicContact CD2-CB 3.66Å; W692-V808 HydrophobicContact CD2-CG1 4.14Å; W692-V808 HydrophobicContact CD2-CG2 3.88Å; W692-V808 HydrophobicContact CE3-CB 4.07Å; W692-V808 HydrophobicContact CE3-CG1 4.01Å; W692-V808 HydrophobicContact CE3-CG2 4.45Å; W692-V808 HydrophobicContact CG-CB 3.74Å; W692-V808 HydrophobicContact CG-CG2 4.2Å; W692-V808 HydrophobicContact CZ2-CG2 4.04Å; W692-V808 HydrophobicContact CZ3-CG1 4.44Å; V693-V808 PolarHBondContact N-O 3.24Å; F772-V808 HydrophobicContact CB-CG1 4.33Å; F772-V808 HydrophobicContact CB-CG2 4.23Å; F772-V808 HydrophobicContact CD1-CG1 4.18Å; F772-V808 CarbonylContact O-C 3.41Å; F772-V808 WeakPolarHBondContact O-CA 3.44Å; C802-V808 HydrophobicContact CB-CG2 4.12Å; C805-V808 HydrophobicContact CB-CG2 4.36Å
809	L	94.4	Very high	84.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118	175.8	169.5	59.8	0	0	0	109.5	V693 T695 A702 K703 F712 F772 I773 I774	V693-L809 HydrophobicContact CB-CD1 3.89Å; V693-L809 HydrophobicContact CG1-CD1 3.93Å; T695-L809 HydrophobicContact CG2-CD1 4.23Å; A702-L809 HydrophobicContact CB-CD1 3.77Å; A702-L809 HydrophobicContact CB-CD2 4.01Å; A702-L809 HydrophobicContact CB-CG 4.49Å; K703-L809 HydrophobicContact CB-CD2 4.24Å; F712-L809 HydrophobicContact CE2-CB 4.34Å; F712-L809 HydrophobicContact CE2-CD2 4.25Å; F712-L809 HydrophobicContact CZ-CB 3.96Å; F772-L809 PolarHBondContact O-N 3.5Å; I773-L809 VanDerWaalsContact CA-O 3.32Å; I773-L809 WeakPolarHBondContact CA-O 3.49Å; I773-L809 HydrophobicContact CD1-CD2 4.33Å; I773-L809 HydrophobicContact CG1-CB 4.33Å; I773-L809 HydrophobicContact CG1-CD2 4.5Å; I773-L809 HydrophobicContact CG2-CD2 4.34Å; I773-L809 HydrophobicContact CG2-CG 4.41Å; I774-L809 PolarHBondContact N-O 3.31Å
810	C	92.4	Very high	84.4	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.9	168.7	-55.5	0	0	0	0	108.8	V693 L694 T695 I774 M813	V693-C810 PolarHBondContact O-N 3.29Å; L694-C810 HydrophobicContact CD2-CB 3.63Å; L694-C810 VanDerWaalsContact CD2-SG 3.54Å; T695-C810 PolarHBondContact N-O 3.4Å; I774-C810 HydrophobicContact CG2-CB 4.08Å; I774-C810 WeakPolarHBondContact CG2-SG 3.02Å; I774-C810 CarbonylContact O-C 3.58Å; I774-C810 WeakPolarHBondContact O-CA 3.45Å; C810-M813 HydrophobicContact CB-CE 4.45Å; C810-M813 HydrophobicContact CB-CG 3.75Å; C810-M813 HydrophobicContact CB-SD 3.27Å; C810-M813 WeakPolarHBondContact CB-SD 3.47Å
811	C	87.4	Confident	84.6	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.014	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	161.3	-177	66.7	0	0	0	0	111.9	T695 M699 I774 D775 G776 M813	T695-C811 CarbonylContact O-C 3.48Å; T695-C811 WeakPolarHBondContact O-CA 3.48Å; M699-C811 HydrophobicContact CB-CB 4.43Å; I774-C811 PolarHBondContact O-N 2.89Å; I774-C811 PolarHBondContact O-SG 3.03Å; D775-C811 CarbonylContact C-O 3.54Å; D775-C811 WeakPolarHBondContact CA-O 3.48Å; G776-C811 PolarHBondContact N-O 3.21Å; C811-M813 PolarHBondContact O-N 3.26Å
812	R	80.6	Confident	84.9	Confident	98 Å²	98	27.7 Å²	27.7	37%	0.37	15%	0.146	S	C	.	.	S	Bend	trans	50.2	38	-174.8	-57.7	-176.1	179.9	167.7	4.3	113.7	T695 G696 D697	T695-R812 PolarHBondContact O-N 2.89Å; G696-R812 WeakPolarHBondContact O-CA 3.34Å; D697-R812 WeakPolarHBondContact O-CG 3.5Å; D697-R812 PolarHBondContact O-N 3.27Å; D697-R812 VanDerWaalsContact O-N 3.07Å
813	M	77.9	Confident	85	Confident	10 Å²	10	32.6 Å²	32.6	5%	0.049	17%	0.167	C	C	.	.			trans	-79.3	130.3	-179.8	-65.6	-140.4	71.6	0	0	112.8	L694 T695 L779 C810 C811 Q817 K818 I821	L694-M813 HydrophobicContact CB-SD 3.86Å; L694-M813 HydrophobicContact CD2-SD 3.93Å; L694-M813 HydrophobicContact CG-SD 4.32Å; T695-M813 WeakPolarHBondContact O-CB 3.48Å; T695-M813 PolarHBondContact O-N 2.97Å; L779-M813 HydrophobicContact CD2-CE 3.37Å; C810-M813 HydrophobicContact CB-CE 4.45Å; C810-M813 HydrophobicContact CB-CG 3.75Å; C810-M813 HydrophobicContact CB-SD 3.27Å; C810-M813 WeakPolarHBondContact CB-SD 3.47Å; C811-M813 PolarHBondContact O-N 3.26Å; M813-Q817 VanDerWaalsContact CE-C 3.46Å; M813-Q817 HydrophobicContact CE-CB 3.43Å; M813-Q817 VanDerWaalsContact CE-CB 3.43Å; M813-K818 HydrophobicContact CB-CG 4.05Å; M813-K818 HydrophobicContact SD-CG 4.25Å; M813-I821 HydrophobicContact CE-CG1 4Å
814	A	74.1	Confident	85.3	Confident	45 Å²	45	31.9 Å²	31.9	37%	0.372	17%	0.165	S	C	.	.			trans	-76.9	150.1	163.5	0	0	0	0	0	111.2	L816 Q817 K818	A814-L816 VanDerWaalsContact C-N 3.34Å; A814-L816 PolarHBondContact O-N 3.05Å; A814-Q817 HydrophobicContact CB-CG 4.2Å; A814-Q817 WeakPolarHBondContact O-CA 3.46Å; A814-Q817 WeakPolarHBondContact O-CB 3.46Å; A814-Q817 PolarHBondContact O-N 2.96Å; A814-K818 PolarHBondContact O-N 3.31Å; A814-K818 VanDerWaalsContact O-N 3.15Å
815	P	71.6	Confident	85.7	Confident	46 Å²	46	29.5 Å²	29.5	30%	0.299	15%	0.152	S	C	.	.	H	α-helix	trans	-49.3	-47.6	-179.6	-32.9	38.1	0	0	0	114.5	Q817 K818 A819 N842 S845	P815-Q817 VanDerWaalsContact C-N 3.25Å; P815-Q817 PolarHBondContact O-N 3.2Å; P815-K818 WeakPolarHBondContact O-CB 3.27Å; P815-K818 PolarHBondContact O-N 3.25Å; P815-K818 VanDerWaalsContact O-N 3.09Å; P815-A819 PolarHBondContact O-N 3.24Å; P815-N842 WeakPolarHBondContact CB-O 3.14Å; P815-N842 HydrophobicContact CG-CB 4.11Å; P815-N842 WeakPolarHBondContact CG-OD1 3.13Å; P815-S845 PolarHBondContact O-OG 2.82Å
816	L	75	Confident	86	Confident	130 Å²	130	31.7 Å²	31.7	68%	0.681	16%	0.162	S	C	*	.	H	α-helix	trans	-61	-32.3	177.7	-68.7	173.5	0	0	0	113	A814 Q820	A814-L816 VanDerWaalsContact C-N 3.34Å; A814-L816 PolarHBondContact O-N 3.05Å; L816-Q820 VanDerWaalsContact O-CG 3.29Å; L816-Q820 WeakPolarHBondContact O-CG 3.26Å; L816-Q820 PolarHBondContact O-N 2.83Å; L816-Q820 VanDerWaalsContact O-N 3.07Å
817	Q	81.2	Confident	86.3	Confident	23 Å²	23	36.3 Å²	36.3	11%	0.107	19%	0.186	C	C	.	.	H	α-helix	trans	-72.9	-35.8	176.1	-61.5	177.1	-46.8	0	0	111.7	G776 S780 M813 A814 P815 A819 Q820 I821	G776-Q817 PolarHBondContact O-NE2 3.02Å; S780-Q817 PolarHBondContact OG-NE2 3.35Å; M813-Q817 VanDerWaalsContact CE-C 3.46Å; M813-Q817 HydrophobicContact CE-CB 3.43Å; M813-Q817 VanDerWaalsContact CE-CB 3.43Å; A814-Q817 HydrophobicContact CB-CG 4.2Å; A814-Q817 WeakPolarHBondContact O-CA 3.46Å; A814-Q817 WeakPolarHBondContact O-CB 3.46Å; A814-Q817 PolarHBondContact O-N 2.96Å; P815-Q817 VanDerWaalsContact C-N 3.25Å; P815-Q817 PolarHBondContact O-N 3.2Å; Q817-A819 VanDerWaalsContact C-N 3.32Å; Q817-A819 PolarHBondContact O-N 3.21Å; Q817-Q820 WeakPolarHBondContact O-CB 3.45Å; Q817-Q820 PolarHBondContact O-N 3.35Å; Q817-Q820 VanDerWaalsContact O-N 3.16Å; Q817-I821 PolarHBondContact O-N 2.88Å
818	K	86.6	Confident	86.2	Confident	3 Å²	3	36.6 Å²	36.6	1%	0.013	19%	0.188	C	C	.	.	H	α-helix	trans	-56.5	-49.5	172.9	-57.5	-164.6	-173.1	-160.7	0	110.2	D402 L694 M813 A814 P815 Q820 I821 V822 D843 M846	D402-K818 IonicContact OD1-NZ 2.68Å; D402-K818 IonicContact OD2-NZ 2.68Å; D402-K818 PolarHBondContact OD2-NZ 3.11Å; L694-K818 HydrophobicContact CB-CD 4.27Å; L694-K818 HydrophobicContact CB-CG 4.27Å; L694-K818 HydrophobicContact CD1-CB 4.34Å; L694-K818 WeakPolarHBondContact O-CE 3.24Å; L694-K818 PolarHBondContact O-NZ 2.99Å; M813-K818 HydrophobicContact CB-CG 4.05Å; M813-K818 HydrophobicContact SD-CG 4.25Å; A814-K818 PolarHBondContact O-N 3.31Å; A814-K818 VanDerWaalsContact O-N 3.15Å; P815-K818 WeakPolarHBondContact O-CB 3.27Å; P815-K818 PolarHBondContact O-N 3.25Å; P815-K818 VanDerWaalsContact O-N 3.09Å; K818-Q820 VanDerWaalsContact C-N 3.33Å; K818-Q820 PolarHBondContact O-N 3.33Å; K818-I821 PolarHBondContact O-N 2.7Å; K818-V822 PolarHBondContact O-N 3.05Å; K818-V822 VanDerWaalsContact O-N 3.13Å; K818-D843 WeakPolarHBondContact CD-OD1 3.43Å; K818-D843 IonicContact NZ-OD1 3.43Å; K818-D843 PolarHBondContact NZ-OD1 2.87Å; K818-M846 HydrophobicContact CB-CB 4.25Å; K818-M846 HydrophobicContact CB-CG 4.35Å; K818-M846 HydrophobicContact CB-SD 4.24Å; K818-M846 HydrophobicContact CD-SD 4.22Å
819	A	86.3	Confident	85.4	Confident	16 Å²	16	46 Å²	46	13%	0.132	23%	0.228	C	C	.	.	H	α-helix	trans	-60.9	-38.3	176.1	0	0	0	0	0	112.8	P815 Q817 V822 K823 S845	P815-A819 PolarHBondContact O-N 3.24Å; Q817-A819 VanDerWaalsContact C-N 3.32Å; Q817-A819 PolarHBondContact O-N 3.21Å; A819-V822 PolarHBondContact O-N 3.45Å; A819-K823 VanDerWaalsContact O-CB 3.32Å; A819-K823 WeakPolarHBondContact O-CB 3.09Å; A819-K823 PolarHBondContact O-N 3.01Å; A819-S845 WeakPolarHBondContact CB-O 3.5Å
820	Q	88.3	Confident	84.4	Confident	94 Å²	94	49.5 Å²	49.5	44%	0.439	27%	0.265	S	S	.	.	H	α-helix	trans	-63.5	-39.7	175.1	-73.4	171.2	10.9	0	0	112.9	L783 L816 Q817 K818 K823 L824	L783-Q820 HydrophobicContact CD1-CB 4.08Å; L816-Q820 VanDerWaalsContact O-CG 3.29Å; L816-Q820 WeakPolarHBondContact O-CG 3.26Å; L816-Q820 PolarHBondContact O-N 2.83Å; L816-Q820 VanDerWaalsContact O-N 3.07Å; Q817-Q820 WeakPolarHBondContact O-CB 3.45Å; Q817-Q820 PolarHBondContact O-N 3.35Å; Q817-Q820 VanDerWaalsContact O-N 3.16Å; K818-Q820 VanDerWaalsContact C-N 3.33Å; K818-Q820 PolarHBondContact O-N 3.33Å; Q820-K823 PolarHBondContact O-N 3.37Å; Q820-L824 WeakPolarHBondContact O-CB 3.35Å; Q820-L824 PolarHBondContact O-N 2.99Å
821	I	91.3	Very high	84	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-50.6	173	-73.1	-65.5	0	0	0	111.1	F400 W692 L694 L779 F798 M813 Q817 K818 K823 L824 V825	F400-I821 HydrophobicContact CD1-CG2 4.24Å; F400-I821 HydrophobicContact CE1-CG2 3.76Å; W692-I821 HydrophobicContact CE3-CG2 3.99Å; W692-I821 HydrophobicContact CZ3-CG2 3.93Å; L694-I821 HydrophobicContact CD1-CB 4.1Å; L694-I821 HydrophobicContact CD1-CG2 3.79Å; L694-I821 HydrophobicContact CD2-CG2 4.03Å; L779-I821 HydrophobicContact CD1-CD1 3.62Å; L779-I821 HydrophobicContact CD2-CD1 3.71Å; L779-I821 HydrophobicContact CD2-CG1 3.76Å; L779-I821 HydrophobicContact CG-CD1 4.3Å; F798-I821 HydrophobicContact CE1-CD1 3.96Å; F798-I821 HydrophobicContact CZ-CD1 3.87Å; M813-I821 HydrophobicContact CE-CG1 4Å; Q817-I821 PolarHBondContact O-N 2.88Å; K818-I821 PolarHBondContact O-N 2.7Å; I821-K823 VanDerWaalsContact C-N 3.27Å; I821-K823 PolarHBondContact O-N 3.26Å; I821-L824 WeakPolarHBondContact O-CB 3.42Å; I821-L824 PolarHBondContact O-N 3.45Å; I821-L824 VanDerWaalsContact O-N 3.1Å; I821-V825 PolarHBondContact O-N 2.84Å
822	V	92.1	Very high	84.1	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-56.6	-45.4	178	177.5	0	0	0	0	110.5	F400 K818 A819 L824 V825 K826 M846 E849 A850	F400-V822 HydrophobicContact CB-CG2 4.3Å; F400-V822 HydrophobicContact CD1-CG2 4.35Å; F400-V822 HydrophobicContact CD2-CB 4.42Å; F400-V822 HydrophobicContact CD2-CG1 4.34Å; F400-V822 HydrophobicContact CD2-CG2 3.63Å; F400-V822 HydrophobicContact CE2-CB 4.35Å; F400-V822 HydrophobicContact CE2-CG1 4.24Å; F400-V822 HydrophobicContact CE2-CG2 3.99Å; F400-V822 HydrophobicContact CG-CG2 3.83Å; F400-V822 HydrophobicContact CZ-CG2 4.49Å; K818-V822 PolarHBondContact O-N 3.05Å; K818-V822 VanDerWaalsContact O-N 3.13Å; A819-V822 PolarHBondContact O-N 3.45Å; V822-L824 PolarHBondContact O-N 3.25Å; V822-V825 PolarHBondContact O-N 2.89Å; V822-K826 WeakPolarHBondContact O-CB 3.38Å; V822-K826 PolarHBondContact O-N 2.8Å; V822-M846 HydrophobicContact CG2-CG 3.51Å; V822-M846 HydrophobicContact CG2-SD 4.44Å; V822-E849 HydrophobicContact CB-CG 4.5Å; V822-E849 HydrophobicContact CG1-CG 4.3Å; V822-A850 HydrophobicContact CG1-CB 3.91Å
823	K	90.7	Very high	84.7	Confident	103 Å²	103	51 Å²	51	45%	0.448	28%	0.28	S	S	.	.	H	α-helix	trans	-62.1	-39.8	177.3	-161.3	179.5	-161.3	111.5	0	112.6	A819 Q820 I821 N827 E849	A819-K823 VanDerWaalsContact O-CB 3.32Å; A819-K823 WeakPolarHBondContact O-CB 3.09Å; A819-K823 PolarHBondContact O-N 3.01Å; Q820-K823 PolarHBondContact O-N 3.37Å; I821-K823 VanDerWaalsContact C-N 3.27Å; I821-K823 PolarHBondContact O-N 3.26Å; K823-N827 WeakPolarHBondContact O-CB 3.3Å; K823-N827 PolarHBondContact O-N 3.35Å; K823-N827 VanDerWaalsContact O-N 3.13Å; K823-N827 PolarHBondContact O-ND2 3.1Å; K823-E849 HydrophobicContact CB-CG 3.87Å; K823-E849 WeakPolarHBondContact CD-OE2 3.37Å; K823-E849 WeakPolarHBondContact CE-OE2 3.42Å; K823-E849 HydrophobicContact CG-CG 4.29Å; K823-E849 IonicContact NZ-OE2 2.86Å; K823-E849 PolarHBondContact NZ-OE2 2.85Å
824	L	90.5	Very high	85.5	Confident	36 Å²	36	50.5 Å²	50.5	19%	0.188	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-45.3	179.7	-174	69.7	0	0	0	111.5	L783 F798 L799 Q820 I821 V822 S828	L783-L824 HydrophobicContact CD2-CD2 4.1Å; F798-L824 HydrophobicContact CD1-CD2 3.83Å; F798-L824 HydrophobicContact CE1-CD2 3.79Å; L799-L824 HydrophobicContact CD1-CD1 3.99Å; L799-L824 HydrophobicContact CD1-CG 3.94Å; L799-L824 HydrophobicContact CD2-CD2 4.3Å; L799-L824 HydrophobicContact CD2-CG 4.02Å; L799-L824 HydrophobicContact CG-CD1 4.44Å; L799-L824 HydrophobicContact CG-CD2 4.08Å; L799-L824 HydrophobicContact CG-CG 3.94Å; Q820-L824 WeakPolarHBondContact O-CB 3.35Å; Q820-L824 PolarHBondContact O-N 2.99Å; I821-L824 WeakPolarHBondContact O-CB 3.42Å; I821-L824 PolarHBondContact O-N 3.45Å; I821-L824 VanDerWaalsContact O-N 3.1Å; V822-L824 PolarHBondContact O-N 3.25Å; L824-S828 PolarHBondContact O-N 3.17Å
825	V	91.3	Very high	86.5	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-70.4	-43.8	177.7	177.8	0	0	0	0	111.4	Y398 F400 W692 L799 I821 V822 N827 S828 P832 T834	Y398-V825 HydrophobicContact CD1-CG1 3.97Å; Y398-V825 HydrophobicContact CD2-CG1 4.14Å; Y398-V825 HydrophobicContact CE1-CG1 4.18Å; Y398-V825 HydrophobicContact CE2-CG1 4.37Å; Y398-V825 HydrophobicContact CG-CG1 3.97Å; F400-V825 HydrophobicContact CE1-CG2 4.37Å; F400-V825 HydrophobicContact CZ-CB 3.85Å; F400-V825 HydrophobicContact CZ-CG1 4.05Å; F400-V825 HydrophobicContact CZ-CG2 3.92Å; W692-V825 HydrophobicContact CH2-CG2 3.46Å; W692-V825 VanDerWaalsContact CH2-CG2 3.46Å; W692-V825 HydrophobicContact CZ2-CG2 4.22Å; W692-V825 HydrophobicContact CZ3-CG2 3.67Å; L799-V825 HydrophobicContact CD2-CG2 4.23Å; I821-V825 PolarHBondContact O-N 2.84Å; V822-V825 PolarHBondContact O-N 2.89Å; V825-N827 VanDerWaalsContact C-N 3.28Å; V825-N827 PolarHBondContact O-N 2.88Å; V825-S828 VanDerWaalsContact O-CB 3.23Å; V825-S828 WeakPolarHBondContact O-CB 3.2Å; V825-S828 PolarHBondContact O-N 3.43Å; V825-S828 PolarHBondContact O-OG 3.2Å; V825-P832 HydrophobicContact CG1-CG 4.14Å; V825-P832 WeakPolarHBondContact O-CG 3.47Å; V825-T834 HydrophobicContact CG1-CG2 4.18Å
826	K	90.4	Very high	87.7	Confident	47 Å²	47	46.2 Å²	46.2	20%	0.204	25%	0.246	C	C	.	.	H	α-helix	trans	-54.7	-39.2	176.5	170.7	174.6	177.3	-171.9	0	113.4	V822 T834 E849	V822-K826 WeakPolarHBondContact O-CB 3.38Å; V822-K826 PolarHBondContact O-N 2.8Å; K826-T834 HydrophobicContact CB-CG2 4.22Å; K826-E849 WeakPolarHBondContact CD-O 3.43Å; K826-E849 WeakPolarHBondContact CE-O 3.38Å; K826-E849 PolarHBondContact NZ-O 2.69Å; K826-E849 IonicContact NZ-OE1 3.66Å; K826-E849 PolarHBondContact NZ-OE1 3.46Å
827	N	88.5	Confident	88.7	Confident	108 Å²	108	40 Å²	40	58%	0.578	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	10.7	178.7	-62.8	-69.9	0	0	0	113.3	K823 V825	K823-N827 WeakPolarHBondContact O-CB 3.3Å; K823-N827 PolarHBondContact O-N 3.35Å; K823-N827 VanDerWaalsContact O-N 3.13Å; K823-N827 PolarHBondContact O-ND2 3.1Å; V825-N827 VanDerWaalsContact C-N 3.28Å; V825-N827 PolarHBondContact O-N 2.88Å
828	S	86.8	Confident	89.1	Confident	5 Å²	5	38.9 Å²	38.9	4%	0.035	21%	0.209	C	C	.	.	S	Bend	trans	-75.4	162.3	177.3	74.2	0	0	0	0	112.1	Q803 L824 V825 G830 N831	Q803-S828 PolarHBondContact NE2-OG 2.91Å; Q803-S828 VanDerWaalsContact NE2-OG 3.12Å; L824-S828 PolarHBondContact O-N 3.17Å; V825-S828 VanDerWaalsContact O-CB 3.23Å; V825-S828 WeakPolarHBondContact O-CB 3.2Å; V825-S828 PolarHBondContact O-N 3.43Å; V825-S828 PolarHBondContact O-OG 3.2Å; S828-G830 PolarHBondContact O-N 3.21Å; S828-N831 PolarHBondContact O-N 3.33Å
829	K	75.5	Confident	89	Confident	197 Å²	197	39 Å²	39	86%	0.857	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	116.4	-177.4	-71.2	-175.4	179	179.5	0	111.2
830	G	73.4	Confident	88.4	Confident	74 Å²	74	38.7 Å²	38.7	76%	0.763	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	113.1	-14.3	-176.8	0	0	0	0	0	114.1	S828	S828-G830 PolarHBondContact O-N 3.21Å
831	N	84	Confident	87.4	Confident	110 Å²	110	35.3 Å²	35.3	59%	0.588	20%	0.196	S	C	*	.			trans	50.4	55.7	-177.1	-56.4	-26.1	0	0	0	112.7	S828	S828-N831 PolarHBondContact O-N 3.33Å
832	P	89.6	Confident	86.5	Confident	9 Å²	9	39 Å²	39	6%	0.058	22%	0.215	C	C	.	.			trans	-62	145	-176.2	29	-36	0	0	0	111.3	E397 Y398 V825 T834 H851	E397-P832 HydrophobicContact CB-CB 4.4Å; Y398-P832 HydrophobicContact CD2-CB 3.78Å; Y398-P832 HydrophobicContact CD2-CG 4.2Å; Y398-P832 HydrophobicContact CE2-CB 3.68Å; Y398-P832 HydrophobicContact CE2-CG 4Å; V825-P832 HydrophobicContact CG1-CG 4.14Å; V825-P832 WeakPolarHBondContact O-CG 3.47Å; P832-T834 PolarHBondContact O-N 2.86Å; P832-H851 PolarHBondContact O-CE1 2.94Å
833	I	92.8	Very high	85.9	Confident	14 Å²	14	39 Å²	39	7%	0.072	22%	0.216	C	C	.	.			trans	-76.4	127.2	178.4	-52.7	-49.5	0	0	0	109.1	A278 E392 Q395 V396 E397 Y398 H851	A278-I833 HydrophobicContact CB-CD1 4.12Å; E392-I833 HydrophobicContact CG-CG2 3.86Å; Q395-I833 HydrophobicContact CB-CG1 4.09Å; Q395-I833 WeakPolarHBondContact O-CB 3.15Å; V396-I833 HydrophobicContact CG2-CG2 4.48Å; E397-I833 PolarHBondContact N-O 3.42Å; Y398-I833 PolarHBondContact N-O 3.32Å; I833-H851 HydrophobicContact CG2-CB 4.05Å
834	T	94.9	Very high	85.4	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.6	-172.3	50.6	0	0	0	0	110.1	F400 V825 K826 P832 H851 V852	F400-T834 HydrophobicContact CE2-CG2 3.74Å; F400-T834 HydrophobicContact CZ-CG2 4.43Å; V825-T834 HydrophobicContact CG1-CG2 4.18Å; K826-T834 HydrophobicContact CB-CG2 4.22Å; P832-T834 PolarHBondContact O-N 2.86Å; T834-H851 PolarHBondContact N-ND1 3.16Å; T834-H851 WeakPolarHBondContact O-CA 3.46Å; T834-H851 WeakPolarHBondContact O-CB 3.23Å; T834-H851 PolarHBondContact O-N 3.29Å; T834-H851 PolarHBondContact OG1-N 3.01Å; T834-H851 PolarHBondContact OG1-ND1 2.68Å; T834-V852 PolarHBondContact O-N 3.32Å; T834-V852 VanDerWaalsContact O-N 3.07Å
835	L	96.5	Very high	85	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	145.7	167.7	-176.3	149.5	0	0	0	108.8	V396 Y398 I399 F400 I837 V852 I854 L882	V396-L835 HydrophobicContact CB-CB 4.42Å; V396-L835 HydrophobicContact CG1-CB 3.54Å; V396-L835 HydrophobicContact CG1-CD1 4.36Å; V396-L835 HydrophobicContact CG2-CB 3.92Å; V396-L835 HydrophobicContact CG2-CD1 3.85Å; Y398-L835 PolarHBondContact O-N 3.07Å; I399-L835 CarbonylContact C-O 3.54Å; I399-L835 WeakPolarHBondContact CA-O 3.39Å; I399-L835 HydrophobicContact CB-CD2 4.48Å; I399-L835 HydrophobicContact CG1-CB 4.35Å; I399-L835 HydrophobicContact CG1-CD2 4.18Å; I399-L835 HydrophobicContact CG2-CD2 3.98Å; F400-L835 WeakPolarHBondContact CD2-O 3.49Å; F400-L835 PolarHBondContact N-O 3.48Å; L835-I837 HydrophobicContact CD2-CB 4.36Å; L835-V852 CarbonylContact C-O 3.57Å; L835-V852 WeakPolarHBondContact CA-O 3.46Å; L835-V852 HydrophobicContact CB-CB 4.49Å; L835-V852 HydrophobicContact CD1-CB 4.44Å; L835-V852 HydrophobicContact CD1-CG1 4.19Å; L835-V852 HydrophobicContact CG-CB 4.36Å; L835-V852 HydrophobicContact CG-CG1 4.38Å; L835-I854 HydrophobicContact CD1-CD1 3.72Å; L835-I854 HydrophobicContact CD1-CG1 4.31Å; L835-I854 HydrophobicContact CD2-CD1 4.24Å; L835-I854 HydrophobicContact CD2-CG1 4.49Å; L835-I854 HydrophobicContact CG-CD1 4.27Å; L835-I854 HydrophobicContact CG-CG1 4.42Å; L835-L882 HydrophobicContact CD1-CD1 4.1Å; L835-L882 HydrophobicContact CD1-CD2 3.71Å; L835-L882 HydrophobicContact CD1-CG 4.46Å
836	S	95.6	Very high	84.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141.9	167.6	56.7	0	0	0	0	111.1	F400 M846 I847 A850 V852 I854	F400-S836 CarbonylContact O-C 3.59Å; F400-S836 WeakPolarHBondContact O-CA 3.21Å; S836-M846 PolarHBondContact OG-O 3.18Å; S836-I847 VanDerWaalsContact OG-CA 3.31Å; S836-I847 WeakPolarHBondContact OG-CA 3.19Å; S836-A850 WeakPolarHBondContact OG-CB 3.41Å; S836-V852 PolarHBondContact N-O 3.32Å; S836-I854 PolarHBondContact O-N 3.15Å
837	I	95.4	Very high	84.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.6	-178.9	-172	167	0	0	0	110.5	I399 F400 D402 T406 L835 M846 I854 I856 I872 L875 L878	I399-I837 HydrophobicContact CG2-CG2 4.33Å; F400-I837 PolarHBondContact O-N 3.17Å; D402-I837 PolarHBondContact N-O 2.62Å; T406-I837 HydrophobicContact CG2-CG1 4.23Å; T406-I837 HydrophobicContact CG2-CG2 4.14Å; L835-I837 HydrophobicContact CD2-CB 4.36Å; I837-M846 WeakPolarHBondContact O-CE 3.48Å; I837-I854 WeakPolarHBondContact CA-O 3.36Å; I837-I854 HydrophobicContact CB-CB 4.25Å; I837-I854 HydrophobicContact CD1-CB 4.36Å; I837-I854 HydrophobicContact CD1-CG2 3.87Å; I837-I854 HydrophobicContact CG1-CB 4.1Å; I837-I854 HydrophobicContact CG1-CG2 3.97Å; I837-I856 HydrophobicContact CD1-CD1 3.83Å; I837-I856 HydrophobicContact CD1-CG1 3.88Å; I837-I856 HydrophobicContact CG1-CD1 4.08Å; I837-I856 HydrophobicContact CG1-CG1 4.01Å; I837-I872 HydrophobicContact CD1-CD1 4.13Å; I837-L875 HydrophobicContact CD1-CD1 3.99Å; I837-L878 HydrophobicContact CD1-CD1 4.37Å; I837-L878 HydrophobicContact CD1-CD2 4.04Å
838	G	90.1	Very high	84.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	169.1	-179.1	0	0	0	0	0	110.9	T406 D843 I854 G855 I856 A864	T406-G838 WeakPolarHBondContact OG1-CA 3.26Å; G838-D843 WeakPolarHBondContact CA-OD2 3.26Å; G838-I854 PolarHBondContact N-O 3.19Å; G838-G855 CarbonylContact O-C 3.59Å; G838-G855 VanDerWaalsContact O-CA 3.29Å; G838-G855 WeakPolarHBondContact O-CA 3.03Å; G838-I856 PolarHBondContact O-N 2.66Å; G838-A864 VanDerWaalsContact O-CB 3.29Å; G838-A864 WeakPolarHBondContact O-CB 3.22Å
839	D	84.5	Confident	84.7	Confident	6 Å²	6	31.9 Å²	31.9	3%	0.032	19%	0.186	C	C	.	.	S	Bend	trans	-120.4	-45.9	178.7	58.8	-36.3	0	0	0	112.9	G405 T406 I856 A864	G405-D839 VanDerWaalsContact CA-OD2 3.25Å; G405-D839 WeakPolarHBondContact CA-OD2 3.18Å; T406-D839 PolarHBondContact OG1-OD1 2.9Å; D839-I856 HydrophobicContact CB-CB 4.07Å; D839-I856 HydrophobicContact CB-CG2 4.39Å; D839-A864 WeakPolarHBondContact O-CB 3.45Å; D839-A864 PolarHBondContact O-N 3.04Å
840	G	74	Confident	85.5	Confident	9 Å²	9	22.6 Å²	22.6	9%	0.093	15%	0.146	C	C	.	.	S	Bend	trans	-73	169.7	179.2	0	0	0	0	0	115.3	N842 D843	G840-N842 VanDerWaalsContact C-N 3.26Å; G840-N842 PolarHBondContact O-N 3.28Å; G840-D843 PolarHBondContact O-N 3.19Å
841	A	67.1	Low	86.5	Confident	23 Å²	23	20.3 Å²	20.3	19%	0.19	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-67.8	-25.1	177	0	0	0	0	0	113.4	D179 D843 V844 Q863	D179-A841 HydrophobicContact CB-CB 4.48Å; D179-A841 WeakPolarHBondContact O-CB 3.29Å; D179-A841 PolarHBondContact O-N 3.21Å; A841-D843 PolarHBondContact O-N 2.85Å; A841-D843 VanDerWaalsContact O-N 3.1Å; A841-V844 WeakPolarHBondContact O-CB 3.2Å; A841-V844 PolarHBondContact O-N 3.34Å; A841-Q863 HydrophobicContact CB-CB 3.99Å; A841-Q863 HydrophobicContact CB-CG 3.97Å
842	N	72.4	Confident	87	Confident	77 Å²	77	15 Å²	15	41%	0.412	9%	0.087	S	C	.	.	G	3₁₀ helix	trans	-53.7	-30.3	174.7	-69.8	-45.1	0	0	0	112.3	P815 G840 S845	P815-N842 WeakPolarHBondContact CB-O 3.14Å; P815-N842 HydrophobicContact CG-CB 4.11Å; P815-N842 WeakPolarHBondContact CG-OD1 3.13Å; G840-N842 VanDerWaalsContact C-N 3.26Å; G840-N842 PolarHBondContact O-N 3.28Å; N842-S845 PolarHBondContact O-OG 3.46Å
843	D	80.4	Confident	87.2	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.005	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-91.7	-10	178.7	-66.3	-41.9	0	0	0	114.8	D402 K818 G838 G840 A841 S845 M846 I847	D402-D843 WeakPolarHBondContact CB-OD2 3.38Å; K818-D843 WeakPolarHBondContact CD-OD1 3.43Å; K818-D843 IonicContact NZ-OD1 3.43Å; K818-D843 PolarHBondContact NZ-OD1 2.87Å; G838-D843 WeakPolarHBondContact CA-OD2 3.26Å; G840-D843 PolarHBondContact O-N 3.19Å; A841-D843 PolarHBondContact O-N 2.85Å; A841-D843 VanDerWaalsContact O-N 3.1Å; D843-S845 PolarHBondContact O-N 3.02Å; D843-M846 HydrophobicContact CB-CE 3.96Å; D843-M846 WeakPolarHBondContact O-CA 3.46Å; D843-M846 VanDerWaalsContact O-CB 3.29Å; D843-M846 WeakPolarHBondContact O-CB 3.27Å; D843-M846 PolarHBondContact O-N 3.39Å; D843-M846 VanDerWaalsContact OD1-CE 3.27Å; D843-M846 WeakPolarHBondContact OD1-CE 3.38Å; D843-I847 HydrophobicContact CB-CD1 3.98Å; D843-I847 HydrophobicContact CB-CG1 4.42Å; D843-I847 WeakPolarHBondContact O-CB 3.22Å; D843-I847 VanDerWaalsContact O-CG1 3.29Å; D843-I847 WeakPolarHBondContact O-CG1 3.23Å; D843-I847 PolarHBondContact O-N 2.96Å
844	V	79.6	Confident	87.3	Confident	18 Å²	18	14 Å²	14	11%	0.109	8%	0.081	C	C	.	.	H	α-helix	trans	-57.1	-37.5	179.5	168.2	0	0	0	0	111.1	A841 M846 I847 L848 Q863 N867	A841-V844 WeakPolarHBondContact O-CB 3.2Å; A841-V844 PolarHBondContact O-N 3.34Å; V844-M846 PolarHBondContact O-N 3.42Å; V844-I847 PolarHBondContact O-N 2.77Å; V844-L848 HydrophobicContact CG1-CD1 3.72Å; V844-L848 HydrophobicContact CG1-CG 4.27Å; V844-L848 WeakPolarHBondContact O-CB 3.3Å; V844-L848 WeakPolarHBondContact O-CG 3.08Å; V844-L848 PolarHBondContact O-N 2.86Å; V844-Q863 HydrophobicContact CG2-CB 4.31Å; V844-N867 HydrophobicContact CG1-CB 3.84Å; V844-N867 WeakPolarHBondContact CG1-ND2 3.5Å; V844-N867 HydrophobicContact CG2-CB 4.16Å
845	S	81.9	Confident	87.1	Confident	32 Å²	32	14 Å²	14	22%	0.224	8%	0.081	C	C	.	.	H	α-helix	trans	-61.5	-39.4	174	66.1	0	0	0	0	113.4	P815 A819 N842 D843 E849	P815-S845 PolarHBondContact O-OG 2.82Å; A819-S845 WeakPolarHBondContact CB-O 3.5Å; N842-S845 PolarHBondContact O-OG 3.46Å; D843-S845 PolarHBondContact O-N 3.02Å; S845-E849 PolarHBondContact O-N 3.28Å
846	M	87.8	Confident	86.8	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-70.9	-48.3	177.8	-168.6	178.3	57.3	0	0	110.8	F400 L694 K818 V822 S836 I837 D843 V844 L848 E849 A850	F400-M846 HydrophobicContact CB-SD 3.81Å; L694-M846 HydrophobicContact CB-SD 4.34Å; L694-M846 HydrophobicContact CD1-SD 3.85Å; L694-M846 HydrophobicContact CG-SD 4.49Å; K818-M846 HydrophobicContact CB-CB 4.25Å; K818-M846 HydrophobicContact CB-CG 4.35Å; K818-M846 HydrophobicContact CB-SD 4.24Å; K818-M846 HydrophobicContact CD-SD 4.22Å; V822-M846 HydrophobicContact CG2-CG 3.51Å; V822-M846 HydrophobicContact CG2-SD 4.44Å; S836-M846 PolarHBondContact OG-O 3.18Å; I837-M846 WeakPolarHBondContact O-CE 3.48Å; D843-M846 HydrophobicContact CB-CE 3.96Å; D843-M846 WeakPolarHBondContact O-CA 3.46Å; D843-M846 VanDerWaalsContact O-CB 3.29Å; D843-M846 WeakPolarHBondContact O-CB 3.27Å; D843-M846 PolarHBondContact O-N 3.39Å; D843-M846 VanDerWaalsContact OD1-CE 3.27Å; D843-M846 WeakPolarHBondContact OD1-CE 3.38Å; V844-M846 PolarHBondContact O-N 3.42Å; M846-L848 VanDerWaalsContact C-N 3.35Å; M846-L848 PolarHBondContact O-N 3.12Å; M846-E849 PolarHBondContact O-N 3.36Å; M846-A850 PolarHBondContact O-N 3.07Å
847	I	89.2	Confident	86.2	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61	-36.5	-179.9	-72.6	171.8	0	0	0	112.7	K275 S836 D843 V844 I854 A864 S868	K275-I847 PolarHBondContact NZ-O 3.09Å; S836-I847 VanDerWaalsContact OG-CA 3.31Å; S836-I847 WeakPolarHBondContact OG-CA 3.19Å; D843-I847 HydrophobicContact CB-CD1 3.98Å; D843-I847 HydrophobicContact CB-CG1 4.42Å; D843-I847 WeakPolarHBondContact O-CB 3.22Å; D843-I847 VanDerWaalsContact O-CG1 3.29Å; D843-I847 WeakPolarHBondContact O-CG1 3.23Å; D843-I847 PolarHBondContact O-N 2.96Å; V844-I847 PolarHBondContact O-N 2.77Å; I847-I854 WeakPolarHBondContact CD1-O 3.33Å; I847-A864 HydrophobicContact CD1-CB 3.56Å; I847-S868 VanDerWaalsContact CG2-CA 3.49Å
848	L	85.8	Confident	84.9	Confident	60 Å²	60	15.6 Å²	15.6	31%	0.314	10%	0.095	S	C	.	.	H	α-helix	trans	-77.6	-31.8	177.7	-70.2	172.6	0	0	0	113.2	K272 V844 M846	K272-L848 HydrophobicContact CG-CD2 4.26Å; V844-L848 HydrophobicContact CG1-CD1 3.72Å; V844-L848 HydrophobicContact CG1-CG 4.27Å; V844-L848 WeakPolarHBondContact O-CB 3.3Å; V844-L848 WeakPolarHBondContact O-CG 3.08Å; V844-L848 PolarHBondContact O-N 2.86Å; M846-L848 VanDerWaalsContact C-N 3.35Å; M846-L848 PolarHBondContact O-N 3.12Å
849	E	88.9	Confident	83.4	Confident	40 Å²	40	22.8 Å²	22.8	19%	0.187	13%	0.126	C	C	.	.	H	α-helix	trans	-84	-25.7	178.9	-178.2	65.3	-103.2	0	0	113.1	V822 K823 K826 S845 M846	V822-E849 HydrophobicContact CB-CG 4.5Å; V822-E849 HydrophobicContact CG1-CG 4.3Å; K823-E849 HydrophobicContact CB-CG 3.87Å; K823-E849 WeakPolarHBondContact CD-OE2 3.37Å; K823-E849 WeakPolarHBondContact CE-OE2 3.42Å; K823-E849 HydrophobicContact CG-CG 4.29Å; K823-E849 IonicContact NZ-OE2 2.86Å; K823-E849 PolarHBondContact NZ-OE2 2.85Å; K826-E849 WeakPolarHBondContact CD-O 3.43Å; K826-E849 WeakPolarHBondContact CE-O 3.38Å; K826-E849 PolarHBondContact NZ-O 2.69Å; K826-E849 IonicContact NZ-OE1 3.66Å; K826-E849 PolarHBondContact NZ-OE1 3.46Å; S845-E849 PolarHBondContact O-N 3.28Å; M846-E849 PolarHBondContact O-N 3.36Å
850	A	92.4	Very high	81.8	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.008	13%	0.13	C	C	.	.	S	Bend	trans	-65.6	156	176.1	0	0	0	0	0	113.9	K275 V822 S836 M846 V852	K275-A850 VanDerWaalsContact CE-O 3.26Å; K275-A850 WeakPolarHBondContact CE-O 3.43Å; K275-A850 PolarHBondContact NZ-O 2.94Å; V822-A850 HydrophobicContact CG1-CB 3.91Å; S836-A850 WeakPolarHBondContact OG-CB 3.41Å; M846-A850 PolarHBondContact O-N 3.07Å; A850-V852 VanDerWaalsContact C-N 3.28Å; A850-V852 WeakPolarHBondContact CB-O 3.36Å; A850-V852 PolarHBondContact O-N 2.9Å
851	H	93.1	Very high	81.1	Confident	26 Å²	26	23.8 Å²	23.8	12%	0.12	13%	0.131	C	C	.	.	S	Bend	trans	-63.4	-35.6	172.7	-72.4	99.6	0	0	0	112	K275 P832 I833 T834	K275-H851 WeakPolarHBondContact CD-O 3.35Å; P832-H851 PolarHBondContact O-CE1 2.94Å; I833-H851 HydrophobicContact CG2-CB 4.05Å; T834-H851 PolarHBondContact N-ND1 3.16Å; T834-H851 WeakPolarHBondContact O-CA 3.46Å; T834-H851 WeakPolarHBondContact O-CB 3.23Å; T834-H851 PolarHBondContact O-N 3.29Å; T834-H851 PolarHBondContact OG1-N 3.01Å; T834-H851 PolarHBondContact OG1-ND1 2.68Å
852	V	94.6	Very high	81.2	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.1	170.7	178.3	0	0	0	0	109	E392 L393 T834 L835 S836 A850 I854 Y870	E392-V852 HydrophobicContact CB-CG2 3.9Å; E392-V852 HydrophobicContact CG-CG2 3.95Å; L393-V852 HydrophobicContact CD2-CG1 3.97Å; T834-V852 PolarHBondContact O-N 3.32Å; T834-V852 VanDerWaalsContact O-N 3.07Å; L835-V852 CarbonylContact C-O 3.57Å; L835-V852 WeakPolarHBondContact CA-O 3.46Å; L835-V852 HydrophobicContact CB-CB 4.49Å; L835-V852 HydrophobicContact CD1-CB 4.44Å; L835-V852 HydrophobicContact CD1-CG1 4.19Å; L835-V852 HydrophobicContact CG-CB 4.36Å; L835-V852 HydrophobicContact CG-CG1 4.38Å; S836-V852 PolarHBondContact N-O 3.32Å; A850-V852 VanDerWaalsContact C-N 3.28Å; A850-V852 WeakPolarHBondContact CB-O 3.36Å; A850-V852 PolarHBondContact O-N 2.9Å; V852-I854 HydrophobicContact CG1-CG1 4.24Å; V852-Y870 HydrophobicContact CG1-CD2 3.81Å; V852-Y870 HydrophobicContact CG1-CE2 3.73Å
853	G	93.9	Very high	80.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.3	172	0	0	0	0	0	111.1	S868 D869 Y870	G853-S868 WeakPolarHBondContact O-CB 3.4Å; G853-D869 PolarHBondContact N-OD2 3.3Å; G853-D869 WeakPolarHBondContact O-CB 3.23Å; G853-D869 PolarHBondContact O-N 3.48Å; G853-Y870 PolarHBondContact O-N 3.47Å
854	I	94.9	Very high	80.6	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131	173.5	-60	-171.2	0	0	0	109.2	L835 S836 I837 G838 I847 V852 Y870 I872 L878 L881	L835-I854 HydrophobicContact CD1-CD1 3.72Å; L835-I854 HydrophobicContact CD1-CG1 4.31Å; L835-I854 HydrophobicContact CD2-CD1 4.24Å; L835-I854 HydrophobicContact CD2-CG1 4.49Å; L835-I854 HydrophobicContact CG-CD1 4.27Å; L835-I854 HydrophobicContact CG-CG1 4.42Å; S836-I854 PolarHBondContact O-N 3.15Å; I837-I854 WeakPolarHBondContact CA-O 3.36Å; I837-I854 HydrophobicContact CB-CB 4.25Å; I837-I854 HydrophobicContact CD1-CB 4.36Å; I837-I854 HydrophobicContact CD1-CG2 3.87Å; I837-I854 HydrophobicContact CG1-CB 4.1Å; I837-I854 HydrophobicContact CG1-CG2 3.97Å; G838-I854 PolarHBondContact N-O 3.19Å; I847-I854 WeakPolarHBondContact CD1-O 3.33Å; V852-I854 HydrophobicContact CG1-CG1 4.24Å; I854-Y870 CarbonylContact C-O 3.46Å; I854-Y870 WeakPolarHBondContact CA-O 3.28Å; I854-Y870 HydrophobicContact CG1-CD2 4.43Å; I854-I872 HydrophobicContact CG2-CD1 3.98Å; I854-I872 HydrophobicContact CG2-CG1 3.9Å; I854-L878 HydrophobicContact CD1-CD1 3.58Å; I854-L881 HydrophobicContact CD1-CD2 3.74Å
855	G	92	Very high	80.6	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.2	169.1	0	0	0	0	0	110.8	G838 S868 Y870 A871 I872	G838-G855 CarbonylContact O-C 3.59Å; G838-G855 VanDerWaalsContact O-CA 3.29Å; G838-G855 WeakPolarHBondContact O-CA 3.03Å; G855-S868 PolarHBondContact N-OG 2.96Å; G855-Y870 PolarHBondContact N-O 3.44Å; G855-A871 CarbonylContact O-C 3.56Å; G855-A871 WeakPolarHBondContact O-CA 3.4Å; G855-I872 PolarHBondContact O-N 3.23Å
856	I	89.9	Confident	80.2	Confident	1 Å²	1	28 Å²	28	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	136.5	163.6	-72.8	176	0	0	0	108.9	T406 I837 G838 D839 G858 V865 I872 L875	T406-I856 HydrophobicContact CG2-CD1 3.83Å; I837-I856 HydrophobicContact CD1-CD1 3.83Å; I837-I856 HydrophobicContact CD1-CG1 3.88Å; I837-I856 HydrophobicContact CG1-CD1 4.08Å; I837-I856 HydrophobicContact CG1-CG1 4.01Å; G838-I856 PolarHBondContact O-N 2.66Å; D839-I856 HydrophobicContact CB-CB 4.07Å; D839-I856 HydrophobicContact CB-CG2 4.39Å; I856-G858 PolarHBondContact O-N 3.29Å; I856-V865 VanDerWaalsContact O-CG2 3.27Å; I856-V865 WeakPolarHBondContact O-CG2 3.29Å; I856-I872 CarbonylContact C-O 3.47Å; I856-I872 VanDerWaalsContact CA-O 3.25Å; I856-I872 WeakPolarHBondContact CA-O 3.33Å; I856-I872 HydrophobicContact CG1-CG1 4.22Å; I856-L875 HydrophobicContact CD1-CB 4.22Å; I856-L875 HydrophobicContact CD1-CD1 4.36Å
857	K	83.1	Confident	79.7	Confident	11 Å²	11	29 Å²	29	5%	0.048	14%	0.139	C	C	.	.			trans	-80.9	64.4	172.6	-52.3	-179.6	170.7	-172.6	0	109.9	I378 E380 G381 V865 A871 I872 P873	I378-K857 VanDerWaalsContact CD1-O 3.28Å; I378-K857 WeakPolarHBondContact CD1-O 3.14Å; E380-K857 HydrophobicContact CB-CD 4.34Å; E380-K857 WeakPolarHBondContact OE2-CE 3.47Å; E380-K857 IonicContact OE2-NZ 3.01Å; E380-K857 PolarHBondContact OE2-NZ 3.12Å; G381-K857 WeakPolarHBondContact O-CE 3.17Å; G381-K857 PolarHBondContact O-NZ 3.02Å; K857-V865 HydrophobicContact CB-CG2 4.2Å; K857-V865 HydrophobicContact CG-CG1 4.31Å; K857-V865 HydrophobicContact CG-CG2 3.84Å; K857-A871 HydrophobicContact CG-CB 4.24Å; K857-I872 PolarHBondContact N-O 3Å; K857-P873 HydrophobicContact CB-CB 4.41Å; K857-P873 HydrophobicContact CD-CB 4.49Å
858	G	67.8	Low	79.6	Confident	23 Å²	23	29 Å²	29	24%	0.237	14%	0.139	C	C	.	.			trans	-65.6	172.1	179.8	0	0	0	0	0	113	I856 E860	I856-G858 PolarHBondContact O-N 3.29Å; G858-E860 PolarHBondContact O-N 3.44Å
859	K	57.6	Low	79.8	Confident	150 Å²	150	26.3 Å²	26.3	65%	0.652	13%	0.125	S	C	*	.	S	Bend	trans	-64.9	-24.4	160.6	-65.7	169.9	-175.6	166.9	0	110.4	G861	K859-G861 PolarHBondContact O-N 3.11Å
860	E	51.6	Low	80	Confident	26 Å²	26	24.5 Å²	24.5	12%	0.121	12%	0.116	C	C	.	.	S	Bend	trans	-73.6	56.8	173.1	-60.9	-99.7	96.1	0	0	112.4	G180 S182 N410 G858	G180-E860 WeakPolarHBondContact CA-O 3.47Å; G180-E860 CarbonylContact O-C 3.52Å; G180-E860 WeakPolarHBondContact O-CA 2.8Å; G180-E860 WeakPolarHBondContact O-CB 3.17Å; S182-E860 PolarHBondContact N-OE1 2.68Å; S182-E860 PolarHBondContact OG-OE1 3.29Å; N410-E860 VanDerWaalsContact ND2-CD 3.3Å; N410-E860 PolarHBondContact ND2-OE1 3.24Å; N410-E860 PolarHBondContact ND2-OE2 3.02Å; G858-E860 PolarHBondContact O-N 3.44Å
861	G	59.3	Low	80	Confident	11 Å²	11	24.4 Å²	24.4	11%	0.113	12%	0.116	C	C	.	.			trans	72.2	-156.7	165.5	0	0	0	0	0	116.1	A176 G180 K859	A176-G861 WeakPolarHBondContact O-CA 3.36Å; G180-G861 PolarHBondContact O-N 3.43Å; K859-G861 PolarHBondContact O-N 3.11Å
862	R	68.3	Low	80	Confident	113 Å²	113	23.2 Å²	23.2	43%	0.426	11%	0.11	S	C	.	.	S	Bend	trans	-138.7	25.4	-173.1	-61.5	-172.2	179.6	-141.8	-4	113.6	E380 V865 K866	E380-R862 IonicContact OE1-CZ 2.68Å; E380-R862 IonicContact OE1-NH1 2.92Å; E380-R862 PolarHBondContact OE1-NH1 2.88Å; E380-R862 IonicContact OE1-NH2 2.74Å; E380-R862 PolarHBondContact OE1-NH2 3.07Å; E380-R862 IonicContact OE2-NH1 2.67Å; R862-V865 HydrophobicContact CB-CB 4.29Å; R862-K866 WeakPolarHBondContact O-CB 3.47Å; R862-K866 WeakPolarHBondContact O-CD 3.29Å; R862-K866 VanDerWaalsContact O-CG 3.26Å; R862-K866 WeakPolarHBondContact O-CG 3.34Å; R862-K866 PolarHBondContact O-N 3.42Å; R862-K866 VanDerWaalsContact O-N 3.11Å
863	Q	67.2	Low	79.9	Confident	25 Å²	25	23.3 Å²	23.3	12%	0.117	11%	0.111	C	C	.	.	H	α-helix	trans	-71.4	-58.6	-177.7	-87	-76.4	-31.5	0	0	112.6	S177 L178 A841 V844 V865 K866 N867	S177-Q863 PolarHBondContact O-NE2 3.49Å; L178-Q863 WeakPolarHBondContact O-CG 3.4Å; L178-Q863 PolarHBondContact O-NE2 3Å; L178-Q863 VanDerWaalsContact O-NE2 3.12Å; A841-Q863 HydrophobicContact CB-CB 3.99Å; A841-Q863 HydrophobicContact CB-CG 3.97Å; V844-Q863 HydrophobicContact CG2-CB 4.31Å; Q863-V865 VanDerWaalsContact C-N 3.28Å; Q863-V865 PolarHBondContact O-N 3.18Å; Q863-K866 PolarHBondContact O-N 3.38Å; Q863-N867 PolarHBondContact O-N 3.3Å; Q863-N867 PolarHBondContact O-ND2 3.39Å
864	A	73.6	Confident	79.7	Confident	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.1	-40.6	173.4	0	0	0	0	0	111.5	G838 D839 I847 K866 N867 S868	G838-A864 VanDerWaalsContact O-CB 3.29Å; G838-A864 WeakPolarHBondContact O-CB 3.22Å; D839-A864 WeakPolarHBondContact O-CB 3.45Å; D839-A864 PolarHBondContact O-N 3.04Å; I847-A864 HydrophobicContact CD1-CB 3.56Å; A864-K866 VanDerWaalsContact C-N 3.34Å; A864-K866 PolarHBondContact O-N 3Å; A864-N867 PolarHBondContact O-N 2.75Å; A864-N867 VanDerWaalsContact O-N 3.17Å; A864-S868 WeakPolarHBondContact O-CB 3.46Å; A864-S868 PolarHBondContact O-N 3.17Å; A864-S868 PolarHBondContact O-OG 3.12Å
865	V	79.5	Confident	79.7	Confident	10 Å²	10	24 Å²	24	6%	0.061	11%	0.114	C	C	.	.	H	α-helix	trans	-55	-42.1	177.5	175.7	0	0	0	0	113.1	N385 I856 K857 R862 Q863 S868 A871	N385-V865 PolarHBondContact ND2-O 2.94Å; I856-V865 VanDerWaalsContact O-CG2 3.27Å; I856-V865 WeakPolarHBondContact O-CG2 3.29Å; K857-V865 HydrophobicContact CB-CG2 4.2Å; K857-V865 HydrophobicContact CG-CG1 4.31Å; K857-V865 HydrophobicContact CG-CG2 3.84Å; R862-V865 HydrophobicContact CB-CB 4.29Å; Q863-V865 VanDerWaalsContact C-N 3.28Å; Q863-V865 PolarHBondContact O-N 3.18Å; V865-S868 PolarHBondContact O-OG 3.01Å; V865-A871 HydrophobicContact CB-CB 4.35Å; V865-A871 HydrophobicContact CG1-CB 3.81Å; V865-A871 HydrophobicContact CG2-CB 4.39Å
866	K	74.6	Confident	79.7	Confident	92 Å²	92	26.4 Å²	26.4	40%	0.4	12%	0.124	S	C	.	.	H	α-helix	trans	-75.4	-35.9	177.5	-73.4	169.3	-175.5	174.9	0	112.4	K272 R862 Q863 A864	K272-K866 WeakPolarHBondContact CE-O 3.32Å; K272-K866 PolarHBondContact NZ-O 3.17Å; R862-K866 WeakPolarHBondContact O-CB 3.47Å; R862-K866 WeakPolarHBondContact O-CD 3.29Å; R862-K866 VanDerWaalsContact O-CG 3.26Å; R862-K866 WeakPolarHBondContact O-CG 3.34Å; R862-K866 PolarHBondContact O-N 3.42Å; R862-K866 VanDerWaalsContact O-N 3.11Å; Q863-K866 PolarHBondContact O-N 3.38Å; A864-K866 VanDerWaalsContact C-N 3.34Å; A864-K866 PolarHBondContact O-N 3Å
867	N	77.3	Confident	80	Confident	19 Å²	19	27.1 Å²	27.1	10%	0.102	13%	0.127	C	C	.	.	H	α-helix	trans	-89.5	-23.6	-171.7	-73	-46	0	0	0	114.8	K272 V844 Q863 A864	K272-N867 WeakPolarHBondContact CE-O 3.37Å; K272-N867 VanDerWaalsContact NZ-C 3.29Å; K272-N867 PolarHBondContact NZ-O 3.35Å; V844-N867 HydrophobicContact CG1-CB 3.84Å; V844-N867 WeakPolarHBondContact CG1-ND2 3.5Å; V844-N867 HydrophobicContact CG2-CB 4.16Å; Q863-N867 PolarHBondContact O-N 3.3Å; Q863-N867 PolarHBondContact O-ND2 3.39Å; A864-N867 PolarHBondContact O-N 2.75Å; A864-N867 VanDerWaalsContact O-N 3.17Å
868	S	86.7	Confident	80.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-64.8	170.8	174.7	56.7	0	0	0	0	114.9	K272 N385 I847 G853 G855 A864 V865 Y870	K272-S868 PolarHBondContact NZ-O 3.09Å; N385-S868 WeakPolarHBondContact CB-O 3.38Å; N385-S868 PolarHBondContact ND2-O 3.39Å; I847-S868 VanDerWaalsContact CG2-CA 3.49Å; G853-S868 WeakPolarHBondContact O-CB 3.4Å; G855-S868 PolarHBondContact N-OG 2.96Å; A864-S868 WeakPolarHBondContact O-CB 3.46Å; A864-S868 PolarHBondContact O-N 3.17Å; A864-S868 PolarHBondContact O-OG 3.12Å; V865-S868 PolarHBondContact O-OG 3.01Å; S868-Y870 WeakPolarHBondContact CB-O 3.28Å; S868-Y870 PolarHBondContact OG-O 3.13Å; S868-Y870 VanDerWaalsContact OG-O 3.05Å
869	D	90.1	Very high	81.9	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.021	12%	0.124	C	C	.	.	S	Bend	trans	-89.3	-32.7	172.7	-60.6	-64.1	0	0	0	111.8	K275 N385 T386 L389 G853	K275-D869 WeakPolarHBondContact CD-OD2 3.34Å; K275-D869 WeakPolarHBondContact CE-OD2 3.29Å; K275-D869 IonicContact NZ-OD2 2.77Å; K275-D869 PolarHBondContact NZ-OD2 2.91Å; N385-D869 WeakPolarHBondContact CA-O 3.31Å; N385-D869 WeakPolarHBondContact CB-O 3.14Å; N385-D869 PolarHBondContact N-O 3.3Å; T386-D869 WeakPolarHBondContact CB-OD1 3.34Å; T386-D869 PolarHBondContact N-O 3.1Å; T386-D869 PolarHBondContact OG1-OD1 3.1Å; L389-D869 HydrophobicContact CD1-CB 4.08Å; G853-D869 PolarHBondContact N-OD2 3.3Å; G853-D869 WeakPolarHBondContact O-CB 3.23Å; G853-D869 PolarHBondContact O-N 3.48Å
870	Y	93	Very high	83.7	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.008	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148.5	173.6	-52.9	-88	0	0	0	109.7	I367 L383 V384 L389 N390 L393 V852 G853 I854 G855 S868	I367-Y870 HydrophobicContact CD1-CE1 4.03Å; L383-Y870 CarbonylContact O-C 3.58Å; L383-Y870 WeakPolarHBondContact O-CA 3.22Å; V384-Y870 HydrophobicContact CB-CD1 4.38Å; V384-Y870 HydrophobicContact CG1-CD1 3.95Å; V384-Y870 HydrophobicContact CG1-CE1 3.77Å; V384-Y870 HydrophobicContact CG2-CD1 4.05Å; V384-Y870 HydrophobicContact CG2-CE1 4.28Å; L389-Y870 PolarHBondContact O-OH 2.82Å; N390-Y870 VanDerWaalsContact CA-OH 3.22Å; N390-Y870 WeakPolarHBondContact CA-OH 3.35Å; N390-Y870 PolarHBondContact N-OH 3.3Å; N390-Y870 VanDerWaalsContact N-OH 3.15Å; N390-Y870 PolarHBondContact OD1-OH 3.25Å; L393-Y870 HydrophobicContact CD1-CE1 3.96Å; L393-Y870 HydrophobicContact CD1-CE2 4.07Å; L393-Y870 HydrophobicContact CD2-CD2 4.15Å; L393-Y870 HydrophobicContact CD2-CE2 3.8Å; L393-Y870 HydrophobicContact CG-CE2 3.98Å; V852-Y870 HydrophobicContact CG1-CD2 3.81Å; V852-Y870 HydrophobicContact CG1-CE2 3.73Å; G853-Y870 PolarHBondContact O-N 3.47Å; I854-Y870 CarbonylContact C-O 3.46Å; I854-Y870 WeakPolarHBondContact CA-O 3.28Å; I854-Y870 HydrophobicContact CG1-CD2 4.43Å; G855-Y870 PolarHBondContact N-O 3.44Å; S868-Y870 WeakPolarHBondContact CB-O 3.28Å; S868-Y870 PolarHBondContact OG-O 3.13Å; S868-Y870 VanDerWaalsContact OG-O 3.05Å
871	A	91.6	Very high	85.8	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.6	168.7	0	0	0	0	0	111.8	A382 L383 G855 K857 V865	A382-A871 CarbonylContact C-O 3.59Å; A382-A871 VanDerWaalsContact CA-O 3.28Å; A382-A871 WeakPolarHBondContact CA-O 3.3Å; L383-A871 HydrophobicContact CB-CB 4.41Å; L383-A871 PolarHBondContact N-O 2.94Å; L383-A871 PolarHBondContact O-N 3.32Å; G855-A871 CarbonylContact O-C 3.56Å; G855-A871 WeakPolarHBondContact O-CA 3.4Å; K857-A871 HydrophobicContact CG-CB 4.24Å; V865-A871 HydrophobicContact CB-CB 4.35Å; V865-A871 HydrophobicContact CG1-CB 3.81Å; V865-A871 HydrophobicContact CG2-CB 4.39Å
872	I	94.1	Very high	87.5	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.005	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146	179.4	60.5	178.8	0	0	0	109.8	A382 I837 I854 G855 I856 K857 H877 L878 L881	A382-I872 HydrophobicContact CB-CG2 4.41Å; I837-I872 HydrophobicContact CD1-CD1 4.13Å; I854-I872 HydrophobicContact CG2-CD1 3.98Å; I854-I872 HydrophobicContact CG2-CG1 3.9Å; G855-I872 PolarHBondContact O-N 3.23Å; I856-I872 CarbonylContact C-O 3.47Å; I856-I872 VanDerWaalsContact CA-O 3.25Å; I856-I872 WeakPolarHBondContact CA-O 3.33Å; I856-I872 HydrophobicContact CG1-CG1 4.22Å; K857-I872 PolarHBondContact N-O 3Å; I872-H877 HydrophobicContact CB-CB 4.18Å; I872-H877 HydrophobicContact CD1-CB 4.26Å; I872-H877 HydrophobicContact CG2-CB 4.45Å; I872-L878 HydrophobicContact CD1-CB 4.13Å; I872-L881 HydrophobicContact CG2-CD2 4Å
873	P	91.1	Very high	88.8	Confident	2 Å²	2	14.6 Å²	14.6	1%	0.013	7%	0.066	C	C	.	.	S	Bend	trans	-79	-27.3	-174.3	24.1	-30.4	0	0	0	116.2	F373 D375 I378 K857	F373-P873 WeakPolarHBondContact O-CD 3.27Å; F373-P873 WeakPolarHBondContact O-CG 3.46Å; D375-P873 HydrophobicContact CB-CB 3.52Å; D375-P873 HydrophobicContact CB-CG 3.57Å; I378-P873 HydrophobicContact CD1-CB 3.73Å; K857-P873 HydrophobicContact CB-CB 4.41Å; K857-P873 HydrophobicContact CD-CB 4.49Å
874	K	91.5	Very high	90.1	Very high	14 Å²	14	13.4 Å²	13.4	6%	0.061	6%	0.061	C	C	.	.	S	Bend	trans	-139.2	154.7	180	-60	-81.4	-175.4	158.6	0	109.9	D375 E377 K876 H877	D375-K874 WeakPolarHBondContact OD1-CE 3.3Å; D375-K874 WeakPolarHBondContact OD1-CG 3.26Å; E377-K874 IonicContact OE1-NZ 3.66Å; E377-K874 IonicContact OE2-NZ 3.58Å; E377-K874 PolarHBondContact OE2-NZ 3.34Å; K874-K876 VanDerWaalsContact C-N 3.34Å; K874-K876 HydrophobicContact CB-CG 4.2Å; K874-K876 PolarHBondContact O-N 3.02Å; K874-H877 WeakPolarHBondContact O-CB 3.45Å; K874-H877 PolarHBondContact O-N 3.27Å
875	L	93.1	Very high	91.1	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-38.7	-178.1	179.3	63.7	0	0	0	113.5	T406 L407 Q674 A677 M681 I837 I856 H877 L878	T406-L875 WeakPolarHBondContact O-CD2 3.39Å; L407-L875 HydrophobicContact CD2-CD2 3.78Å; Q674-L875 HydrophobicContact CB-CB 4.27Å; Q674-L875 HydrophobicContact CG-CB 4.44Å; A677-L875 HydrophobicContact CB-CD2 3.79Å; M681-L875 HydrophobicContact CE-CD1 3.81Å; M681-L875 HydrophobicContact CE-CD2 3.85Å; M681-L875 HydrophobicContact CE-CG 4.24Å; I837-L875 HydrophobicContact CD1-CD1 3.99Å; I856-L875 HydrophobicContact CD1-CB 4.22Å; I856-L875 HydrophobicContact CD1-CD1 4.36Å; L875-H877 PolarHBondContact O-N 3.39Å; L875-L878 HydrophobicContact CD1-CB 4.48Å; L875-L878 HydrophobicContact CD1-CD2 4.05Å; L875-L878 WeakPolarHBondContact O-CB 3.35Å; L875-L878 PolarHBondContact O-N 3.03Å
876	K	93.1	Very high	91.8	Very high	50 Å²	50	13.7 Å²	13.7	22%	0.217	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-31.5	-178.9	65.1	-164.6	178.2	-170.1	0	114.2	D675 E676 K874 L878 K879	D675-K876 HydrophobicContact CB-CD 4.32Å; D675-K876 IonicContact OD2-NZ 2.73Å; D675-K876 PolarHBondContact OD2-NZ 3.36Å; E676-K876 HydrophobicContact CB-CB 3.95Å; K874-K876 VanDerWaalsContact C-N 3.34Å; K874-K876 HydrophobicContact CB-CG 4.2Å; K874-K876 PolarHBondContact O-N 3.02Å; K876-L878 PolarHBondContact O-N 3.44Å; K876-K879 WeakPolarHBondContact O-CB 3.41Å; K876-K879 PolarHBondContact O-N 3Å
877	H	95.3	Very high	92.7	Very high	16 Å²	16	9.5 Å²	9.5	7%	0.074	4%	0.043	C	C	.	.	H	α-helix	trans	-64.6	-21.2	177.8	-57.6	152.5	0	0	0	113.3	D372 F373 I872 K874 L875 K879 K880 L881	D372-H877 PolarHBondContact O-CD2 3.01Å; D372-H877 PolarHBondContact O-NE2 2.64Å; F373-H877 HydrophobicContact CD1-CB 3.6Å; F373-H877 AromaticContact CD1-CG 3.88Å; F373-H877 HydrophobicContact CE1-CB 3.93Å; F373-H877 WeakPolarHBondContact CE1-O 3.37Å; I872-H877 HydrophobicContact CB-CB 4.18Å; I872-H877 HydrophobicContact CD1-CB 4.26Å; I872-H877 HydrophobicContact CG2-CB 4.45Å; K874-H877 WeakPolarHBondContact O-CB 3.45Å; K874-H877 PolarHBondContact O-N 3.27Å; L875-H877 PolarHBondContact O-N 3.39Å; H877-K879 VanDerWaalsContact C-N 3.26Å; H877-K879 PolarHBondContact O-N 3.21Å; H877-K880 PolarHBondContact O-N 3.34Å; H877-L881 WeakPolarHBondContact O-CB 3.42Å; H877-L881 PolarHBondContact O-N 3.42Å
878	L	95.6	Very high	93.5	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-59.7	-35.6	174.3	-172.9	63	0	0	0	112.3	T680 L684 I837 I854 I872 L875 K876 L881 L882	T680-L878 HydrophobicContact CG2-CB 4.37Å; L684-L878 HydrophobicContact CD1-CD2 3.8Å; L684-L878 HydrophobicContact CD1-CG 4.12Å; I837-L878 HydrophobicContact CD1-CD1 4.37Å; I837-L878 HydrophobicContact CD1-CD2 4.04Å; I854-L878 HydrophobicContact CD1-CD1 3.58Å; I872-L878 HydrophobicContact CD1-CB 4.13Å; L875-L878 HydrophobicContact CD1-CB 4.48Å; L875-L878 HydrophobicContact CD1-CD2 4.05Å; L875-L878 WeakPolarHBondContact O-CB 3.35Å; L875-L878 PolarHBondContact O-N 3.03Å; K876-L878 PolarHBondContact O-N 3.44Å; L878-L881 PolarHBondContact O-N 3.27Å; L878-L882 HydrophobicContact CD1-CD1 3.73Å; L878-L882 HydrophobicContact CD1-CG 4.01Å; L878-L882 HydrophobicContact CG-CD1 3.99Å; L878-L882 PolarHBondContact O-N 3.5Å; L878-L882 VanDerWaalsContact O-N 3.09Å
879	K	95.1	Very high	93.9	Very high	47 Å²	47	8.8 Å²	8.8	20%	0.204	4%	0.039	C	C	.	.	H	α-helix	trans	-57	-52.2	176.1	-174.5	180	174.2	-177.1	0	110.8	T680 A683 K876 H877 L883	T680-K879 HydrophobicContact CG2-CB 4.19Å; A683-K879 HydrophobicContact CB-CD 4.21Å; A683-K879 HydrophobicContact CB-CG 4.29Å; K876-K879 WeakPolarHBondContact O-CB 3.41Å; K876-K879 PolarHBondContact O-N 3Å; H877-K879 VanDerWaalsContact C-N 3.26Å; H877-K879 PolarHBondContact O-N 3.21Å; K879-L883 HydrophobicContact CG-CD1 3.96Å; K879-L883 VanDerWaalsContact O-CB 3.28Å; K879-L883 WeakPolarHBondContact O-CB 3.03Å; K879-L883 VanDerWaalsContact O-CG 3.31Å; K879-L883 WeakPolarHBondContact O-CG 3.47Å; K879-L883 PolarHBondContact O-N 2.7Å
880	K	95.5	Very high	94.2	Very high	22 Å²	22	8.6 Å²	8.6	10%	0.096	4%	0.038	C	C	.	.	H	α-helix	trans	-72.8	-36.5	-179.6	-173.4	-179.5	-171.8	-174.5	0	112.8	D370 D372 F373 H877 L882 A884 H885 L959	D370-K880 IonicContact OD1-NZ 2.68Å; D370-K880 PolarHBondContact OD1-NZ 3.27Å; D370-K880 WeakPolarHBondContact OD2-CE 3.29Å; D370-K880 IonicContact OD2-NZ 2.68Å; D370-K880 PolarHBondContact OD2-NZ 3.39Å; D372-K880 HydrophobicContact CB-CD 3.9Å; D372-K880 IonicContact OD1-NZ 2.66Å; D372-K880 IonicContact OD2-NZ 2.74Å; D372-K880 PolarHBondContact OD2-NZ 3.16Å; F373-K880 HydrophobicContact CE1-CB 3.95Å; F373-K880 HydrophobicContact CE1-CD 4.25Å; F373-K880 HydrophobicContact CE1-CG 4.23Å; F373-K880 HydrophobicContact CZ-CB 4.31Å; F373-K880 HydrophobicContact CZ-CD 4.41Å; F373-K880 HydrophobicContact CZ-CG 4.24Å; H877-K880 PolarHBondContact O-N 3.34Å; K880-L882 PolarHBondContact O-N 3.22Å; K880-A884 HydrophobicContact CG-CB 4.22Å; K880-A884 WeakPolarHBondContact O-CB 3.3Å; K880-A884 PolarHBondContact O-N 3.3Å; K880-H885 PolarHBondContact O-N 3.4Å; K880-H885 VanDerWaalsContact O-N 3.15Å; K880-L959 HydrophobicContact CB-CD2 3.98Å; K880-L959 HydrophobicContact CG-CD1 4.35Å; K880-L959 HydrophobicContact CG-CD2 4.14Å
881	L	96.3	Very high	94.2	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.041	C	C	.	.	I	π-helix	trans	-62.5	-39.3	178.7	-176.7	61.2	0	0	0	112.7	I367 F373 L393 I854 I872 H877 L878 H885 G886	I367-L881 HydrophobicContact CD1-CD1 4.35Å; I367-L881 HydrophobicContact CG2-CD1 4.01Å; F373-L881 HydrophobicContact CE1-CB 4.39Å; F373-L881 HydrophobicContact CZ-CB 4.03Å; F373-L881 HydrophobicContact CZ-CD1 4.33Å; L393-L881 HydrophobicContact CD1-CD1 3.82Å; L393-L881 HydrophobicContact CD1-CG 4.16Å; L393-L881 HydrophobicContact CD2-CG 4.34Å; I854-L881 HydrophobicContact CD1-CD2 3.74Å; I872-L881 HydrophobicContact CG2-CD2 4Å; H877-L881 WeakPolarHBondContact O-CB 3.42Å; H877-L881 PolarHBondContact O-N 3.42Å; L878-L881 PolarHBondContact O-N 3.27Å; L881-H885 HydrophobicContact CD1-CB 4.47Å; L881-H885 WeakPolarHBondContact O-CB 3.35Å; L881-G886 PolarHBondContact O-N 3.41Å
882	L	95.6	Very high	94.3	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	4%	0.044	C	C	.	.	I	π-helix	trans	-87.9	-52.9	179.6	-61.9	177.7	0	0	0	112.8	L393 V396 I399 L684 M689 L835 L878 K880 G886 H887	L393-L882 HydrophobicContact CB-CD2 4.1Å; L393-L882 HydrophobicContact CD2-CD2 3.71Å; L393-L882 WeakPolarHBondContact O-CD2 3.49Å; V396-L882 HydrophobicContact CG2-CD2 4.16Å; I399-L882 HydrophobicContact CD1-CD1 3.79Å; L684-L882 HydrophobicContact CD2-CB 4.38Å; L684-L882 HydrophobicContact CD2-CD1 3.81Å; M689-L882 HydrophobicContact CE-CB 4.03Å; M689-L882 HydrophobicContact CE-CD1 4.08Å; M689-L882 HydrophobicContact SD-CD1 4.11Å; L835-L882 HydrophobicContact CD1-CD1 4.1Å; L835-L882 HydrophobicContact CD1-CD2 3.71Å; L835-L882 HydrophobicContact CD1-CG 4.46Å; L878-L882 HydrophobicContact CD1-CD1 3.73Å; L878-L882 HydrophobicContact CD1-CG 4.01Å; L878-L882 HydrophobicContact CG-CD1 3.99Å; L878-L882 PolarHBondContact O-N 3.5Å; L878-L882 VanDerWaalsContact O-N 3.09Å; K880-L882 PolarHBondContact O-N 3.22Å; L882-G886 WeakPolarHBondContact O-CA 3.49Å; L882-G886 PolarHBondContact O-N 2.94Å; L882-H887 PolarHBondContact O-N 2.58Å
883	L	94.8	Very high	94.3	Very high	3 Å²	3	9.8 Å²	9.8	2%	0.016	4%	0.044	C	C	.	.	I	π-helix	trans	-74.8	-33.7	-169.7	-55.9	-179.3	0	0	0	113.3	A683 L684 A687 M689 K879 H887 Y965	A683-L883 HydrophobicContact CB-CD1 4.37Å; L684-L883 HydrophobicContact CD2-CD2 4.49Å; A687-L883 HydrophobicContact CB-CD2 3.48Å; A687-L883 VanDerWaalsContact CB-CD2 3.48Å; M689-L883 HydrophobicContact CE-CD2 4.19Å; K879-L883 HydrophobicContact CG-CD1 3.96Å; K879-L883 VanDerWaalsContact O-CB 3.28Å; K879-L883 WeakPolarHBondContact O-CB 3.03Å; K879-L883 VanDerWaalsContact O-CG 3.31Å; K879-L883 WeakPolarHBondContact O-CG 3.47Å; K879-L883 PolarHBondContact O-N 2.7Å; L883-H887 WeakPolarHBondContact O-CB 3.48Å; L883-Y965 HydrophobicContact CD2-CD2 4.24Å; L883-Y965 HydrophobicContact CD2-CG 4.29Å
884	A	94.1	Very high	94.4	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	4%	0.043	C	C	.	.	I	π-helix	trans	-97.6	-63.7	176.7	0	0	0	0	0	112	K880 L888 I955 L959	K880-A884 HydrophobicContact CG-CB 4.22Å; K880-A884 WeakPolarHBondContact O-CB 3.3Å; K880-A884 PolarHBondContact O-N 3.3Å; A884-L888 WeakPolarHBondContact O-CB 3.4Å; A884-L888 VanDerWaalsContact O-CG 3.27Å; A884-L888 WeakPolarHBondContact O-CG 3.5Å; A884-L888 PolarHBondContact O-N 3.16Å; A884-I955 HydrophobicContact CB-CG1 4.42Å; A884-I955 HydrophobicContact CB-CG2 3.86Å; A884-L959 HydrophobicContact CB-CD2 4.07Å
885	H	95.2	Very high	94.5	Very high	15 Å²	15	10.2 Å²	10.2	7%	0.069	5%	0.046	C	C	.	.	I	π-helix	trans	-64.5	-55.6	-175.4	-81.7	-83.2	0	0	0	112	F366 D370 F373 K880 L881 H887 L888 Y889	F366-H885 PolarHBondContact O-CE1 2.93Å; D370-H885 IonicContact OD2-CD2 2.69Å; D370-H885 IonicContact OD2-CE1 2.73Å; D370-H885 IonicContact OD2-NE2 3.18Å; D370-H885 PolarHBondContact OD2-NE2 2.92Å; F373-H885 AromaticContact CE2-CD2 3.87Å; F373-H885 AromaticContact CE2-NE2 3.79Å; F373-H885 AromaticContact CZ-CD2 3.77Å; K880-H885 PolarHBondContact O-N 3.4Å; K880-H885 VanDerWaalsContact O-N 3.15Å; L881-H885 HydrophobicContact CD1-CB 4.47Å; L881-H885 WeakPolarHBondContact O-CB 3.35Å; H885-H887 PolarHBondContact O-N 2.96Å; H885-L888 PolarHBondContact O-N 2.99Å; H885-Y889 HydrophobicContact CB-CD2 4.19Å; H885-Y889 HydrophobicContact CB-CE2 3.9Å; H885-Y889 AromaticContact ND1-CE2 3.62Å; H885-Y889 WeakPolarHBondContact O-CD2 3.49Å; H885-Y889 PolarHBondContact O-N 3.33Å
886	G	94.3	Very high	94.6	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.046	C	C	.	.	I	π-helix	trans	-55.1	-47.5	179.2	0	0	0	0	0	113.1	G394 L881 L882 L888 Y889 Y890	G394-G886 VanDerWaalsContact CA-O 3.24Å; G394-G886 WeakPolarHBondContact CA-O 2.94Å; L881-G886 PolarHBondContact O-N 3.41Å; L882-G886 WeakPolarHBondContact O-CA 3.49Å; L882-G886 PolarHBondContact O-N 2.94Å; G886-L888 PolarHBondContact O-N 3.2Å; G886-Y889 PolarHBondContact O-N 2.99Å; G886-Y890 WeakPolarHBondContact O-CB 3.47Å; G886-Y890 PolarHBondContact O-N 3.25Å
887	H	94.3	Very high	94.7	Very high	4 Å²	4	7.9 Å²	7.9	2%	0.019	4%	0.036	C	C	.	.	H	α-helix	trans	-57.5	-47.6	176.1	-175.9	99.5	0	0	0	112.5	L882 L883 H885 V891 H952 I968	L882-H887 PolarHBondContact O-N 2.58Å; L883-H887 WeakPolarHBondContact O-CB 3.48Å; H885-H887 PolarHBondContact O-N 2.96Å; H887-V891 WeakPolarHBondContact O-CG2 3.3Å; H887-V891 PolarHBondContact O-N 3.42Å; H887-V891 VanDerWaalsContact O-N 3.17Å; H887-H952 AromaticContact CD2-CE1 3.51Å; H887-H952 AromaticContact CD2-NE2 3.85Å; H887-H952 AromaticContact NE2-CE1 3.34Å; H887-H952 PolarHBondContact NE2-CE1 2.9Å; H887-H952 VanDerWaalsContact NE2-CE1 3.34Å; H887-H952 AromaticContact NE2-NE2 3.18Å; H887-H952 PolarHBondContact NE2-NE2 3.2Å; H887-H952 VanDerWaalsContact NE2-NE2 3.18Å; H887-I968 HydrophobicContact CB-CD1 3.96Å; H887-I968 VanDerWaalsContact ND1-CD1 3.33Å; H887-I968 WeakPolarHBondContact ND1-CD1 3.29Å
888	L	94.2	Very high	94.6	Very high	3 Å²	3	7.2 Å²	7.2	2%	0.016	3%	0.033	C	C	.	.	H	α-helix	trans	-66.1	-45.4	178.4	-71.9	174.2	0	0	0	112.2	A884 H885 G886 Y890 V891 R892 Q951 I955 L958	A884-L888 WeakPolarHBondContact O-CB 3.4Å; A884-L888 VanDerWaalsContact O-CG 3.27Å; A884-L888 WeakPolarHBondContact O-CG 3.5Å; A884-L888 PolarHBondContact O-N 3.16Å; H885-L888 PolarHBondContact O-N 2.99Å; G886-L888 PolarHBondContact O-N 3.2Å; L888-Y890 PolarHBondContact O-N 2.93Å; L888-V891 PolarHBondContact O-N 2.88Å; L888-R892 VanDerWaalsContact O-CB 3.24Å; L888-R892 WeakPolarHBondContact O-CB 3.46Å; L888-R892 WeakPolarHBondContact O-CD 3.43Å; L888-R892 WeakPolarHBondContact O-CG 3.29Å; L888-R892 PolarHBondContact O-N 3.42Å; L888-Q951 HydrophobicContact CD1-CG 4.42Å; L888-I955 HydrophobicContact CD1-CD1 4.25Å; L888-I955 HydrophobicContact CD1-CG1 3.79Å; L888-L958 HydrophobicContact CD1-CD1 4.47Å; L888-L958 HydrophobicContact CD2-CD1 4.22Å; L888-L958 HydrophobicContact CG-CD1 4.04Å
889	Y	94.9	Very high	94.6	Very high	2 Å²	2	7.2 Å²	7.2	1%	0.008	3%	0.033	C	C	.	.	H	α-helix	trans	-61.6	-42.1	178.5	-73.4	-59.2	0	0	0	112.6	G363 F366 I367 N390 H885 G886 R892 I893	G363-Y889 PolarHBondContact O-OH 3.33Å; F366-Y889 WeakPolarHBondContact CB-OH 3.41Å; I367-Y889 HydrophobicContact CD1-CE2 3.84Å; I367-Y889 HydrophobicContact CG1-CE2 3.87Å; N390-Y889 HydrophobicContact CB-CD1 4.2Å; N390-Y889 HydrophobicContact CB-CD2 4.1Å; N390-Y889 HydrophobicContact CB-CG 3.93Å; N390-Y889 WeakPolarHBondContact O-CB 3.42Å; H885-Y889 HydrophobicContact CB-CD2 4.19Å; H885-Y889 HydrophobicContact CB-CE2 3.9Å; H885-Y889 AromaticContact ND1-CE2 3.62Å; H885-Y889 WeakPolarHBondContact O-CD2 3.49Å; H885-Y889 PolarHBondContact O-N 3.33Å; G886-Y889 PolarHBondContact O-N 2.99Å; Y889-R892 PolarHBondContact O-N 3.4Å; Y889-I893 WeakPolarHBondContact O-CG2 3.24Å; Y889-I893 PolarHBondContact O-N 3.19Å
890	Y	94.6	Very high	94.5	Very high	0 Å²	0	5 Å²	5	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-61.5	-48.4	176.2	174.9	-97.2	0	0	0	112.1	V279 Q395 G886 L888 R892 I893 A894 I968 N971 A972 M973	V279-Y890 HydrophobicContact CG2-CD2 4.28Å; V279-Y890 HydrophobicContact CG2-CE2 4.17Å; Q395-Y890 VanDerWaalsContact CD-CE2 3.49Å; Q395-Y890 HydrophobicContact CG-CD2 3.55Å; Q395-Y890 HydrophobicContact CG-CE2 3.81Å; Q395-Y890 HydrophobicContact CG-CG 4.26Å; G886-Y890 WeakPolarHBondContact O-CB 3.47Å; G886-Y890 PolarHBondContact O-N 3.25Å; L888-Y890 PolarHBondContact O-N 2.93Å; Y890-R892 PolarHBondContact O-N 3.02Å; Y890-I893 WeakPolarHBondContact O-CG2 3.28Å; Y890-A894 HydrophobicContact CE1-CB 4.42Å; Y890-A894 WeakPolarHBondContact O-CB 3.37Å; Y890-A894 PolarHBondContact O-N 3.05Å; Y890-I968 HydrophobicContact CD1-CB 3.67Å; Y890-I968 HydrophobicContact CD1-CD1 3.95Å; Y890-I968 HydrophobicContact CD1-CG1 4.38Å; Y890-I968 HydrophobicContact CD1-CG2 4.08Å; Y890-I968 HydrophobicContact CE1-CB 3.81Å; Y890-I968 HydrophobicContact CE1-CG2 4.28Å; Y890-I968 HydrophobicContact CG-CD1 4.39Å; Y890-N971 WeakPolarHBondContact CE2-OD1 3.23Å; Y890-N971 WeakPolarHBondContact OH-CA 3.31Å; Y890-N971 PolarHBondContact OH-O 3.25Å; Y890-N971 PolarHBondContact OH-OD1 3.46Å; Y890-A972 PolarHBondContact OH-N 2.98Å; Y890-M973 HydrophobicContact CE1-CB 4.09Å; Y890-M973 HydrophobicContact CE1-CG 4.18Å; Y890-M973 PolarHBondContact OH-N 3.46Å
891	V	93.1	Very high	94.4	Very high	9 Å²	9	4 Å²	4	6%	0.055	2%	0.019	C	C	.	.	H	α-helix	trans	-65.9	-41.2	179.8	175.1	0	0	0	0	111.6	H887 L888 A894 H895 I968 M973	H887-V891 WeakPolarHBondContact O-CG2 3.3Å; H887-V891 PolarHBondContact O-N 3.42Å; H887-V891 VanDerWaalsContact O-N 3.17Å; L888-V891 PolarHBondContact O-N 2.88Å; V891-A894 PolarHBondContact O-N 3.21Å; V891-H895 PolarHBondContact O-N 2.98Å; V891-I968 HydrophobicContact CG2-CG2 3.71Å; V891-M973 HydrophobicContact CB-CE 4.48Å; V891-M973 HydrophobicContact CB-SD 4.31Å; V891-M973 HydrophobicContact CG1-CE 4.02Å; V891-M973 HydrophobicContact CG1-SD 3.96Å; V891-M973 HydrophobicContact CG2-CE 3.76Å; V891-M973 HydrophobicContact CG2-SD 3.98Å
892	R	94.6	Very high	94.4	Very high	17 Å²	17	4 Å²	4	6%	0.064	2%	0.019	C	C	.	.	H	α-helix	trans	-58.2	-51	176.5	-77.2	164.8	-178.8	175.7	-4.2	112.3	L888 Y889 Y890 L896 S947 L948 E950	L888-R892 VanDerWaalsContact O-CB 3.24Å; L888-R892 WeakPolarHBondContact O-CB 3.46Å; L888-R892 WeakPolarHBondContact O-CD 3.43Å; L888-R892 WeakPolarHBondContact O-CG 3.29Å; L888-R892 PolarHBondContact O-N 3.42Å; Y889-R892 PolarHBondContact O-N 3.4Å; Y890-R892 PolarHBondContact O-N 3.02Å; R892-L896 WeakPolarHBondContact O-CB 3.48Å; R892-L896 PolarHBondContact O-N 3Å; R892-L896 VanDerWaalsContact O-N 3.16Å; R892-S947 VanDerWaalsContact C-OG 3.24Å; R892-S947 WeakPolarHBondContact CB-O 3.25Å; R892-S947 WeakPolarHBondContact CD-O 3.39Å; R892-S947 PolarHBondContact O-OG 3.16Å; R892-L948 PolarHBondContact NH1-O 3.44Å; R892-E950 VanDerWaalsContact CZ-O 3.29Å; R892-E950 PolarHBondContact NE-O 3.16Å; R892-E950 PolarHBondContact NH2-O 3.2Å
893	I	94.4	Very high	94.3	Very high	1 Å²	1	4 Å²	4	1%	0.005	2%	0.019	C	C	.	.	H	α-helix	trans	-72	-36.7	-179.4	-161.1	172.8	0	0	0	111.6	V279 V356 E391 Y889 Y890 L896 V897	V279-I893 HydrophobicContact CG1-CD1 4.08Å; V279-I893 HydrophobicContact CG1-CG1 4.34Å; V279-I893 HydrophobicContact CG1-CG2 4.22Å; V279-I893 HydrophobicContact CG2-CG2 4.36Å; V356-I893 HydrophobicContact CG1-CD1 3.93Å; E391-I893 HydrophobicContact CB-CD1 4.49Å; E391-I893 HydrophobicContact CB-CG2 3.57Å; E391-I893 HydrophobicContact CG-CD1 4.23Å; E391-I893 HydrophobicContact CG-CG2 3.97Å; Y889-I893 WeakPolarHBondContact O-CG2 3.24Å; Y889-I893 PolarHBondContact O-N 3.19Å; Y890-I893 WeakPolarHBondContact O-CG2 3.28Å; I893-L896 PolarHBondContact O-N 2.9Å; I893-V897 HydrophobicContact CG1-CG2 4.43Å; I893-V897 WeakPolarHBondContact O-CG2 3.34Å; I893-V897 PolarHBondContact O-N 2.96Å
894	A	93.4	Very high	94.2	Very high	1 Å²	1	3.9 Å²	3.9	1%	0.008	2%	0.018	C	C	.	.	H	α-helix	trans	-65.5	-44	-178.1	0	0	0	0	0	111.4	Y890 V891 Q898 M973 L974	Y890-A894 HydrophobicContact CE1-CB 4.42Å; Y890-A894 WeakPolarHBondContact O-CB 3.37Å; Y890-A894 PolarHBondContact O-N 3.05Å; V891-A894 PolarHBondContact O-N 3.21Å; A894-Q898 VanDerWaalsContact O-CG 3.23Å; A894-Q898 WeakPolarHBondContact O-CG 3.42Å; A894-Q898 PolarHBondContact O-N 2.94Å; A894-M973 HydrophobicContact CB-CB 3.72Å; A894-L974 HydrophobicContact CB-CD1 4.39Å; A894-L974 HydrophobicContact CB-CD2 4.05Å; A894-L974 HydrophobicContact CB-CG 3.99Å
895	H	93.8	Very high	94.3	Very high	25 Å²	25	4.1 Å²	4.1	12%	0.116	2%	0.019	C	C	.	.	H	α-helix	trans	-66.3	-43	174	-176.8	-72.6	0	0	0	111.7	V891 V897 Q898 Y899 Y946 W982 D1037	V891-H895 PolarHBondContact O-N 2.98Å; H895-V897 VanDerWaalsContact C-N 3.34Å; H895-V897 PolarHBondContact O-N 2.83Å; H895-Q898 PolarHBondContact O-N 2.7Å; H895-Y899 WeakPolarHBondContact O-CB 3.38Å; H895-Y899 PolarHBondContact O-N 3.32Å; H895-Y946 HydrophobicContact CB-CE1 3.97Å; H895-Y946 PolarHBondContact CD2-OH 3.45Å; H895-Y946 AromaticContact CE1-CE1 3.8Å; H895-Y946 AromaticContact CE1-CZ 3.98Å; H895-Y946 AromaticContact CG-CE1 3.63Å; H895-Y946 AromaticContact CG-CZ 3.9Å; H895-Y946 AromaticContact ND1-CE1 3.19Å; H895-Y946 WeakPolarHBondContact ND1-CE1 3.39Å; H895-Y946 AromaticContact ND1-CZ 3.72Å; H895-W982 AromaticContact CD2-CZ2 3.98Å; H895-W982 AromaticContact NE2-CH2 3.75Å; H895-W982 AromaticContact NE2-CZ2 3.77Å; H895-D1037 IonicContact CE1-OD2 2.78Å; H895-D1037 IonicContact NE2-OD2 2.76Å; H895-D1037 PolarHBondContact NE2-OD2 2.87Å
896	L	95	Very high	94.3	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.016	C	C	.	.	H	α-helix	trans	-53.7	-47.9	175.2	176.1	154.1	0	0	0	112.3	T355 V356 R892 I893 Y899 F900 I943 S947	T355-L896 HydrophobicContact CG2-CD1 4.07Å; V356-L896 HydrophobicContact CG2-CD2 3.55Å; R892-L896 WeakPolarHBondContact O-CB 3.48Å; R892-L896 PolarHBondContact O-N 3Å; R892-L896 VanDerWaalsContact O-N 3.16Å; I893-L896 PolarHBondContact O-N 2.9Å; L896-Y899 PolarHBondContact O-N 3.31Å; L896-F900 HydrophobicContact CD1-CE2 4.4Å; L896-F900 HydrophobicContact CD2-CD2 3.69Å; L896-F900 HydrophobicContact CD2-CE2 4.02Å; L896-F900 HydrophobicContact CG-CD2 3.83Å; L896-F900 HydrophobicContact CG-CE2 4Å; L896-F900 WeakPolarHBondContact O-CB 3.43Å; L896-F900 WeakPolarHBondContact O-CD2 3.36Å; L896-F900 PolarHBondContact O-N 3.13Å; L896-I943 HydrophobicContact CB-CD1 4.43Å; L896-I943 HydrophobicContact CB-CG1 4.22Å; L896-I943 HydrophobicContact CD1-CG1 4.24Å; L896-I943 HydrophobicContact CG-CG1 3.93Å; L896-S947 VanDerWaalsContact CD1-CB 3.41Å; L896-S947 WeakPolarHBondContact CD1-OG 3.45Å
897	V	93.6	Very high	94.2	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.016	C	C	.	.	H	α-helix	trans	-61.5	-47.3	179.2	168.5	0	0	0	0	111.2	I283 F286 I893 H895 F900 F901 L974	I283-V897 HydrophobicContact CD1-CG2 3.67Å; I283-V897 HydrophobicContact CG1-CB 4.49Å; I283-V897 HydrophobicContact CG1-CG1 3.83Å; I283-V897 HydrophobicContact CG1-CG2 3.75Å; F286-V897 HydrophobicContact CD2-CG1 4.24Å; F286-V897 HydrophobicContact CE2-CG1 4.46Å; I893-V897 HydrophobicContact CG1-CG2 4.43Å; I893-V897 WeakPolarHBondContact O-CG2 3.34Å; I893-V897 PolarHBondContact O-N 2.96Å; H895-V897 VanDerWaalsContact C-N 3.34Å; H895-V897 PolarHBondContact O-N 2.83Å; V897-F900 PolarHBondContact O-N 2.97Å; V897-F901 HydrophobicContact CG1-CD2 4.16Å; V897-F901 HydrophobicContact CG1-CE2 4.02Å; V897-F901 VanDerWaalsContact O-CD2 3.32Å; V897-F901 WeakPolarHBondContact O-CD2 3.22Å; V897-F901 PolarHBondContact O-N 3.48Å; V897-L974 HydrophobicContact CB-CD2 4.28Å; V897-L974 HydrophobicContact CG1-CD2 4.16Å
898	Q	93.9	Very high	94.3	Very high	3 Å²	3	3.2 Å²	3.2	1%	0.014	2%	0.015	C	C	.	.	H	α-helix	trans	-62.1	-45.8	179	-63.1	-73.8	16.8	0	0	111.4	A894 H895 F900 F901 Y902 M973 L974 W982	A894-Q898 VanDerWaalsContact O-CG 3.23Å; A894-Q898 WeakPolarHBondContact O-CG 3.42Å; A894-Q898 PolarHBondContact O-N 2.94Å; H895-Q898 PolarHBondContact O-N 2.7Å; Q898-F900 PolarHBondContact O-N 3.4Å; Q898-F901 PolarHBondContact O-N 3.28Å; Q898-Y902 WeakPolarHBondContact O-CB 3.32Å; Q898-Y902 PolarHBondContact O-N 3.37Å; Q898-M973 PolarHBondContact NE2-O 3.47Å; Q898-L974 HydrophobicContact CG-CD2 4.12Å; Q898-W982 HydrophobicContact CB-CD2 4.16Å; Q898-W982 HydrophobicContact CB-CG 3.94Å
899	Y	95.2	Very high	94.3	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-63.2	-37.9	177.8	179.3	-94.3	0	0	0	112.5	H895 L896 Y902 K903 I943 V1030 L1034	H895-Y899 WeakPolarHBondContact O-CB 3.38Å; H895-Y899 PolarHBondContact O-N 3.32Å; L896-Y899 PolarHBondContact O-N 3.31Å; Y899-Y902 AromaticContact CD2-CD1 3.88Å; Y899-Y902 HydrophobicContact CD2-CD1 3.88Å; Y899-Y902 HydrophobicContact CD2-CE1 4.15Å; Y899-Y902 HydrophobicContact CE2-CD1 4.2Å; Y899-Y902 HydrophobicContact CE2-CE1 4.07Å; Y899-Y902 PolarHBondContact O-N 2.79Å; Y899-K903 HydrophobicContact CD1-CD 3.85Å; Y899-K903 HydrophobicContact CE1-CB 4.39Å; Y899-K903 HydrophobicContact CE1-CD 3.45Å; Y899-K903 VanDerWaalsContact CE1-CD 3.45Å; Y899-K903 HydrophobicContact CE1-CG 4.49Å; Y899-K903 WeakPolarHBondContact O-CB 3.23Å; Y899-K903 PolarHBondContact O-N 3.39Å; Y899-I943 HydrophobicContact CD1-CB 3.87Å; Y899-I943 HydrophobicContact CD1-CD1 3.51Å; Y899-I943 HydrophobicContact CD1-CG1 3.56Å; Y899-I943 HydrophobicContact CD1-CG2 4.4Å; Y899-I943 HydrophobicContact CE1-CB 3.81Å; Y899-I943 HydrophobicContact CE1-CD1 4.1Å; Y899-I943 HydrophobicContact CE1-CG1 4.05Å; Y899-I943 HydrophobicContact CE1-CG2 4.26Å; Y899-I943 HydrophobicContact CG-CD1 3.83Å; Y899-I943 HydrophobicContact CG-CG1 4.34Å; Y899-V1030 PolarHBondContact OH-O 2.86Å; Y899-V1030 VanDerWaalsContact OH-O 3.07Å; Y899-L1034 HydrophobicContact CD2-CD1 4.46Å; Y899-L1034 HydrophobicContact CE1-CD2 4.49Å; Y899-L1034 HydrophobicContact CE2-CB 3.89Å; Y899-L1034 HydrophobicContact CE2-CD1 4.47Å
900	F	93.8	Very high	94.3	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-64.3	-39.9	177.9	-104.1	-79.8	0	0	0	113.3	P349 M352 T355 L896 V897 Q898 K903 N904 I943	P349-F900 HydrophobicContact CB-CD1 3.94Å; M352-F900 HydrophobicContact CB-CB 4.2Å; M352-F900 HydrophobicContact CB-CD1 3.75Å; M352-F900 HydrophobicContact CB-CE1 4.22Å; M352-F900 HydrophobicContact CB-CG 3.9Å; M352-F900 HydrophobicContact CG-CB 4Å; M352-F900 HydrophobicContact CG-CD1 4.38Å; M352-F900 HydrophobicContact CG-CD2 4.38Å; M352-F900 HydrophobicContact CG-CG 4.01Å; M352-F900 HydrophobicContact SD-CB 4.15Å; T355-F900 HydrophobicContact CG2-CE2 3.9Å; T355-F900 HydrophobicContact CG2-CZ 4.06Å; T355-F900 WeakPolarHBondContact OG1-CZ 3.23Å; L896-F900 HydrophobicContact CD1-CE2 4.4Å; L896-F900 HydrophobicContact CD2-CD2 3.69Å; L896-F900 HydrophobicContact CD2-CE2 4.02Å; L896-F900 HydrophobicContact CG-CD2 3.83Å; L896-F900 HydrophobicContact CG-CE2 4Å; L896-F900 WeakPolarHBondContact O-CB 3.43Å; L896-F900 WeakPolarHBondContact O-CD2 3.36Å; L896-F900 PolarHBondContact O-N 3.13Å; V897-F900 PolarHBondContact O-N 2.97Å; Q898-F900 PolarHBondContact O-N 3.4Å; F900-K903 VanDerWaalsContact CD1-CE 3.47Å; F900-K903 VanDerWaalsContact CE1-CE 3.49Å; F900-N904 PolarHBondContact O-ND2 3.49Å; F900-I943 HydrophobicContact CD2-CG1 4.45Å; F900-I943 HydrophobicContact CD2-CG2 4.31Å; F900-I943 HydrophobicContact CE2-CG1 4.31Å; F900-I943 HydrophobicContact CE2-CG2 3.53Å; F900-I943 HydrophobicContact CZ-CG2 3.93Å
901	F	93.7	Very high	94.3	Very high	2 Å²	2	3.6 Å²	3.6	1%	0.009	2%	0.017	C	C	.	.	H	α-helix	trans	-69.6	-48.2	173	-76.9	-66.8	0	0	0	111.3	F286 Y290 P349 M352 V897 Q898 K903 N904 L905 F979	F286-F901 HydrophobicContact CB-CD2 4.37Å; F286-F901 HydrophobicContact CB-CE2 3.68Å; F286-F901 HydrophobicContact CB-CZ 3.79Å; F286-F901 HydrophobicContact CD2-CD2 4.33Å; F286-F901 HydrophobicContact CD2-CE2 4.02Å; F286-F901 HydrophobicContact CG-CE2 4.38Å; Y290-F901 HydrophobicContact CD1-CD1 4.46Å; Y290-F901 AromaticContact CD2-CD1 3.26Å; Y290-F901 HydrophobicContact CD2-CD1 3.26Å; Y290-F901 AromaticContact CD2-CE1 3.55Å; Y290-F901 HydrophobicContact CD2-CE1 3.55Å; Y290-F901 HydrophobicContact CD2-CG 4.02Å; Y290-F901 HydrophobicContact CD2-CZ 4.49Å; Y290-F901 HydrophobicContact CE2-CB 3.73Å; Y290-F901 AromaticContact CE2-CD1 3.36Å; Y290-F901 HydrophobicContact CE2-CD1 3.36Å; Y290-F901 HydrophobicContact CE2-CE1 4.11Å; Y290-F901 AromaticContact CE2-CG 3.69Å; Y290-F901 HydrophobicContact CE2-CG 3.69Å; Y290-F901 AromaticContact CG-CD1 3.87Å; Y290-F901 HydrophobicContact CG-CD1 3.87Å; Y290-F901 HydrophobicContact CG-CE1 4.07Å; P349-F901 HydrophobicContact CG-CD1 4.32Å; P349-F901 HydrophobicContact CG-CE1 4.25Å; M352-F901 HydrophobicContact CE-CE2 4.34Å; M352-F901 HydrophobicContact CE-CZ 4.04Å; M352-F901 HydrophobicContact SD-CD2 4.43Å; M352-F901 HydrophobicContact SD-CE2 3.91Å; M352-F901 HydrophobicContact SD-CZ 4.14Å; V897-F901 HydrophobicContact CG1-CD2 4.16Å; V897-F901 HydrophobicContact CG1-CE2 4.02Å; V897-F901 VanDerWaalsContact O-CD2 3.32Å; V897-F901 WeakPolarHBondContact O-CD2 3.22Å; V897-F901 PolarHBondContact O-N 3.48Å; Q898-F901 PolarHBondContact O-N 3.28Å; F901-K903 PolarHBondContact O-N 3.37Å; F901-N904 PolarHBondContact O-N 2.91Å; F901-L905 PolarHBondContact O-N 3.43Å; F901-F979 HydrophobicContact CD2-CE2 4.38Å
902	Y	95.1	Very high	94.4	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-52.3	-53.1	176.6	155	-99.3	0	0	0	112.7	Q898 Y899 N904 L905 C906 W982 L985 H989 V1030 K1033	Q898-Y902 WeakPolarHBondContact O-CB 3.32Å; Q898-Y902 PolarHBondContact O-N 3.37Å; Y899-Y902 AromaticContact CD2-CD1 3.88Å; Y899-Y902 HydrophobicContact CD2-CD1 3.88Å; Y899-Y902 HydrophobicContact CD2-CE1 4.15Å; Y899-Y902 HydrophobicContact CE2-CD1 4.2Å; Y899-Y902 HydrophobicContact CE2-CE1 4.07Å; Y899-Y902 PolarHBondContact O-N 2.79Å; Y902-N904 VanDerWaalsContact C-N 3.25Å; Y902-N904 PolarHBondContact O-N 3.22Å; Y902-L905 PolarHBondContact O-N 3.02Å; Y902-C906 WeakPolarHBondContact CE2-SG 3.47Å; Y902-C906 PolarHBondContact O-N 3.29Å; Y902-C906 PolarHBondContact O-SG 3.12Å; Y902-C906 VanDerWaalsContact O-SG 3.35Å; Y902-W982 HydrophobicContact CD1-CE3 4.15Å; Y902-W982 AromaticContact CD1-CZ3 3.96Å; Y902-W982 HydrophobicContact CD1-CZ3 3.96Å; Y902-W982 HydrophobicContact CD2-CE3 4Å; Y902-W982 HydrophobicContact CD2-CZ3 4.41Å; Y902-W982 HydrophobicContact CE1-CZ3 4.4Å; Y902-W982 AromaticContact CG-CE3 3.69Å; Y902-W982 HydrophobicContact CG-CE3 3.69Å; Y902-W982 AromaticContact CG-CZ3 3.99Å; Y902-W982 HydrophobicContact CG-CZ3 3.99Å; Y902-L985 HydrophobicContact CD2-CD2 4.24Å; Y902-L985 HydrophobicContact CD2-CG 4.41Å; Y902-L985 HydrophobicContact CE2-CD2 3.87Å; Y902-L985 HydrophobicContact CE2-CG 3.96Å; Y902-H989 AromaticContact CE2-ND1 3.47Å; Y902-H989 WeakPolarHBondContact CE2-ND1 3.08Å; Y902-H989 AromaticContact CZ-ND1 3.6Å; Y902-H989 PolarHBondContact OH-CE1 3.5Å; Y902-H989 PolarHBondContact OH-ND1 2.97Å; Y902-V1030 HydrophobicContact CE1-CG1 4.26Å; Y902-K1033 HydrophobicContact CE1-CG 4.12Å
903	K	94.5	Very high	94.4	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-66.2	-26.4	-175.4	84.2	-169.9	-173.5	71.5	0	113.2	Y899 F900 F901 F907 Y934 N935 T939 V1030	Y899-K903 HydrophobicContact CD1-CD 3.85Å; Y899-K903 HydrophobicContact CE1-CB 4.39Å; Y899-K903 HydrophobicContact CE1-CD 3.45Å; Y899-K903 VanDerWaalsContact CE1-CD 3.45Å; Y899-K903 HydrophobicContact CE1-CG 4.49Å; Y899-K903 WeakPolarHBondContact O-CB 3.23Å; Y899-K903 PolarHBondContact O-N 3.39Å; F900-K903 VanDerWaalsContact CD1-CE 3.47Å; F900-K903 VanDerWaalsContact CE1-CE 3.49Å; F901-K903 PolarHBondContact O-N 3.37Å; K903-F907 WeakPolarHBondContact O-CB 3.4Å; K903-F907 PolarHBondContact O-N 3.11Å; K903-Y934 PolarHBondContact O-OH 3.09Å; K903-N935 PolarHBondContact NZ-OD1 2.96Å; K903-T939 PolarHBondContact NZ-OG1 3.23Å; K903-V1030 HydrophobicContact CB-CB 4.46Å; K903-V1030 HydrophobicContact CB-CG1 4.32Å
904	N	93.6	Very high	94.5	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-84.2	-34	177.6	-79.9	-79.9	0	0	0	112.2	F346 F900 F901 Y902 F907 I908 N935	F346-N904 PolarHBondContact O-OD1 3.43Å; F346-N904 VanDerWaalsContact O-OD1 3.09Å; F900-N904 PolarHBondContact O-ND2 3.49Å; F901-N904 PolarHBondContact O-N 2.91Å; Y902-N904 VanDerWaalsContact C-N 3.25Å; Y902-N904 PolarHBondContact O-N 3.22Å; N904-F907 PolarHBondContact O-N 2.86Å; N904-I908 WeakPolarHBondContact O-CG2 3.17Å; N904-I908 PolarHBondContact O-N 3.36Å; N904-N935 PolarHBondContact ND2-OD1 2.67Å; N904-N935 PolarHBondContact OD1-ND2 2.87Å; N904-N935 PolarHBondContact OD1-OD1 2.7Å; N904-N935 VanDerWaalsContact OD1-OD1 3.09Å
905	L	94.7	Very high	94.5	Very high	5 Å²	5	6.4 Å²	6.4	3%	0.026	3%	0.029	C	C	.	.	H	α-helix	trans	-64.6	-45.1	169.9	-177.7	54.6	0	0	0	111.9	Y290 I347 F901 Y902 F907 L909 T983 I987	Y290-L905 HydrophobicContact CE1-CB 4.25Å; Y290-L905 HydrophobicContact CE1-CD1 4.49Å; Y290-L905 HydrophobicContact CE1-CD2 4.29Å; Y290-L905 WeakPolarHBondContact OH-CD2 3.34Å; I347-L905 HydrophobicContact CD1-CD1 4.47Å; F901-L905 PolarHBondContact O-N 3.43Å; Y902-L905 PolarHBondContact O-N 3.02Å; L905-F907 VanDerWaalsContact C-N 3.26Å; L905-F907 PolarHBondContact O-N 3.41Å; L905-L909 VanDerWaalsContact O-CB 3.28Å; L905-L909 WeakPolarHBondContact O-CB 3.29Å; L905-L909 PolarHBondContact O-N 3.3Å; L905-T983 HydrophobicContact CD2-CG2 3.7Å; L905-T983 WeakPolarHBondContact CD2-O 3.49Å; L905-I987 HydrophobicContact CD2-CG1 4.11Å
906	C	94.9	Very high	94.5	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-53.6	-41.9	171.7	-76.1	0	0	0	0	112.8	Y902 P910 G986 F993 L1026 V1030	Y902-C906 WeakPolarHBondContact CE2-SG 3.47Å; Y902-C906 PolarHBondContact O-N 3.29Å; Y902-C906 PolarHBondContact O-SG 3.12Å; Y902-C906 VanDerWaalsContact O-SG 3.35Å; C906-P910 WeakPolarHBondContact O-CD 3.42Å; C906-G986 VanDerWaalsContact SG-CA 3.59Å; C906-F993 HydrophobicContact CB-CE2 4.16Å; C906-L1026 HydrophobicContact CB-CD1 3.73Å; C906-V1030 HydrophobicContact CB-CG1 4.3Å
907	F	93.9	Very high	94.3	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-71.1	-49.2	-176.4	168.6	-134.7	0	0	0	112.5	F346 K903 N904 L905 Y926 L931 Y934 F1023 L1026	F346-F907 HydrophobicContact CB-CD1 4.16Å; F346-F907 HydrophobicContact CB-CE1 3.71Å; F346-F907 HydrophobicContact CG-CE1 4.04Å; K903-F907 WeakPolarHBondContact O-CB 3.4Å; K903-F907 PolarHBondContact O-N 3.11Å; N904-F907 PolarHBondContact O-N 2.86Å; L905-F907 VanDerWaalsContact C-N 3.26Å; L905-F907 PolarHBondContact O-N 3.41Å; F907-Y926 HydrophobicContact CD2-CD2 4.09Å; F907-Y926 AromaticContact CD2-CE2 3.52Å; F907-Y926 HydrophobicContact CD2-CE2 3.52Å; F907-Y926 AromaticContact CD2-CZ 3.99Å; F907-Y926 AromaticContact CE2-CD2 3.44Å; F907-Y926 HydrophobicContact CE2-CD2 3.44Å; F907-Y926 VanDerWaalsContact CE2-CD2 3.44Å; F907-Y926 AromaticContact CE2-CE2 3.39Å; F907-Y926 HydrophobicContact CE2-CE2 3.39Å; F907-Y926 HydrophobicContact CE2-CG 4.22Å; F907-Y926 HydrophobicContact CZ-CD2 4.22Å; F907-Y926 HydrophobicContact CZ-CE2 4.4Å; F907-Y926 VanDerWaalsContact O-CE2 3.31Å; F907-Y926 WeakPolarHBondContact O-CE2 3.44Å; F907-Y926 PolarHBondContact O-OH 3.4Å; F907-L931 HydrophobicContact CE2-CD2 4.23Å; F907-L931 HydrophobicContact CZ-CD2 3.64Å; F907-Y934 HydrophobicContact CB-CD1 4.21Å; F907-Y934 HydrophobicContact CB-CE1 3.53Å; F907-Y934 AromaticContact CD1-CD1 3.55Å; F907-Y934 HydrophobicContact CD1-CD1 3.55Å; F907-Y934 AromaticContact CD1-CE1 3.68Å; F907-Y934 HydrophobicContact CD1-CE1 3.68Å; F907-Y934 HydrophobicContact CD1-CG 4.47Å; F907-Y934 HydrophobicContact CD2-CD1 4.15Å; F907-Y934 HydrophobicContact CD2-CE1 4.25Å; F907-Y934 HydrophobicContact CD2-CG 4.42Å; F907-Y934 AromaticContact CE1-CD1 3.8Å; F907-Y934 HydrophobicContact CE1-CD1 3.8Å; F907-Y934 HydrophobicContact CE1-CE1 4.4Å; F907-Y934 HydrophobicContact CE1-CG 4.47Å; F907-Y934 HydrophobicContact CE2-CD1 4.37Å; F907-Y934 HydrophobicContact CE2-CG 4.42Å; F907-Y934 AromaticContact CG-CD1 3.73Å; F907-Y934 HydrophobicContact CG-CD1 3.73Å; F907-Y934 AromaticContact CG-CE1 3.58Å; F907-Y934 HydrophobicContact CG-CE1 3.58Å; F907-Y934 HydrophobicContact CG-CG 4.44Å; F907-Y934 HydrophobicContact CZ-CD1 4.2Å; F907-Y934 HydrophobicContact CZ-CG 4.44Å; F907-F1023 HydrophobicContact CD2-CE2 4.34Å; F907-F1023 HydrophobicContact CE2-CD2 4.22Å; F907-F1023 AromaticContact CE2-CE2 3.85Å; F907-F1023 HydrophobicContact CE2-CE2 3.85Å; F907-L1026 HydrophobicContact CB-CD1 4.38Å; F907-L1026 HydrophobicContact CB-CD2 3.89Å; F907-L1026 HydrophobicContact CD2-CD2 3.54Å; F907-L1026 HydrophobicContact CG-CD2 4.14Å
908	I	94.6	Very high	94.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-82.8	-20.6	-174	-157.1	69.6	0	0	0	113.7	F344 F346 I347 N904 Q911 F912	F344-I908 HydrophobicContact CB-CG1 4.32Å; F344-I908 HydrophobicContact CD1-CD1 4.3Å; F344-I908 HydrophobicContact CD1-CG1 4.14Å; F346-I908 HydrophobicContact CB-CD1 4.35Å; I347-I908 HydrophobicContact CB-CG2 3.88Å; I347-I908 HydrophobicContact CD1-CG2 4.17Å; I347-I908 HydrophobicContact CG1-CG2 3.77Å; N904-I908 WeakPolarHBondContact O-CG2 3.17Å; N904-I908 PolarHBondContact O-N 3.36Å; I908-Q911 HydrophobicContact CD1-CB 4.23Å; I908-Q911 HydrophobicContact CD1-CG 4.35Å; I908-Q911 PolarHBondContact O-N 3.49Å; I908-Q911 VanDerWaalsContact O-N 3.15Å; I908-F912 PolarHBondContact O-N 2.88Å
909	L	95.2	Very high	93.9	Very high	13 Å²	13	16.3 Å²	16.3	7%	0.068	8%	0.08	C	C	.	.	H	α-helix	trans	-63.5	-45.1	-177.7	-178.4	59.5	0	0	0	113	L905 Q911 F912 L913 I987 L991	L905-L909 VanDerWaalsContact O-CB 3.28Å; L905-L909 WeakPolarHBondContact O-CB 3.29Å; L905-L909 PolarHBondContact O-N 3.3Å; L909-Q911 VanDerWaalsContact C-N 3.26Å; L909-Q911 PolarHBondContact O-N 3.07Å; L909-F912 HydrophobicContact CD1-CD1 3.9Å; L909-F912 WeakPolarHBondContact O-CB 3.38Å; L909-F912 PolarHBondContact O-N 3.39Å; L909-L913 HydrophobicContact CD1-CD1 4.37Å; L909-L913 HydrophobicContact CD1-CG 4.2Å; L909-L913 HydrophobicContact CG-CD1 4.05Å; L909-L913 HydrophobicContact CG-CG 4.38Å; L909-L913 VanDerWaalsContact O-CG 3.32Å; L909-L913 WeakPolarHBondContact O-CG 3.33Å; L909-L913 PolarHBondContact O-N 3.5Å; L909-I987 HydrophobicContact CD2-CB 4.2Å; L909-I987 HydrophobicContact CD2-CG1 4.31Å; L909-I987 HydrophobicContact CD2-CG2 4.09Å; L909-I987 WeakPolarHBondContact CD2-O 3.47Å; L909-L991 HydrophobicContact CD2-CG 4.38Å
910	P	95.8	Very high	93.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-55.8	-37.5	169.6	-26.6	33.9	0	0	0	113.9	C906 L913 Y914 L925 F993 F994 V1022	C906-P910 WeakPolarHBondContact O-CD 3.42Å; P910-L913 PolarHBondContact O-N 2.92Å; P910-Y914 WeakPolarHBondContact O-CB 3.41Å; P910-Y914 PolarHBondContact O-N 3.38Å; P910-L925 HydrophobicContact CB-CD2 3.65Å; P910-F993 HydrophobicContact CG-CB 4.25Å; P910-F994 HydrophobicContact CB-CB 4.06Å; P910-F994 HydrophobicContact CB-CD2 4.03Å; P910-F994 HydrophobicContact CG-CB 4.43Å; P910-F994 WeakPolarHBondContact O-CD2 3.44Å; P910-V1022 HydrophobicContact CB-CG1 3.79Å; P910-V1022 HydrophobicContact CG-CG1 4.05Å
911	Q	94.3	Very high	93.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-70.7	-32.3	179.1	-176.1	171.5	-16	0	0	112.8	L343 I908 L909 Q915 L925 Y926	L343-Q911 VanDerWaalsContact CD1-NE2 3.26Å; L343-Q911 PolarHBondContact O-NE2 2.86Å; I908-Q911 HydrophobicContact CD1-CB 4.23Å; I908-Q911 HydrophobicContact CD1-CG 4.35Å; I908-Q911 PolarHBondContact O-N 3.49Å; I908-Q911 VanDerWaalsContact O-N 3.15Å; L909-Q911 VanDerWaalsContact C-N 3.26Å; L909-Q911 PolarHBondContact O-N 3.07Å; Q911-Q915 WeakPolarHBondContact O-CG 3.48Å; Q911-Q915 PolarHBondContact O-NE2 2.94Å; Q911-L925 HydrophobicContact CB-CB 4.25Å; Q911-L925 HydrophobicContact CG-CB 4.29Å; Q911-Y926 HydrophobicContact CB-CE2 4.1Å
912	F	95.1	Very high	93.2	Very high	30 Å²	30	21.4 Å²	21.4	13%	0.132	11%	0.11	C	C	.	.	H	α-helix	trans	-68.6	-48.3	168.1	169.1	-99.2	0	0	0	111.5	K297 C301 F344 I908 L909 Y914 Q915 F916	K297-F912 HydrophobicContact CB-CD2 3.89Å; K297-F912 HydrophobicContact CB-CE2 3.81Å; K297-F912 HydrophobicContact CD-CD2 3.98Å; K297-F912 HydrophobicContact CD-CE2 4.36Å; K297-F912 HydrophobicContact CD-CG 4.21Å; K297-F912 HydrophobicContact CG-CD2 3.79Å; K297-F912 HydrophobicContact CG-CE2 3.69Å; K297-F912 HydrophobicContact CG-CG 4.41Å; K297-F912 HydrophobicContact CG-CZ 4.21Å; C301-F912 VanDerWaalsContact SG-CE2 3.52Å; F344-F912 HydrophobicContact CE1-CB 3.96Å; F344-F912 HydrophobicContact CE1-CD2 4.42Å; F344-F912 AromaticContact CE2-CD2 3.92Å; F344-F912 HydrophobicContact CE2-CD2 3.92Å; F344-F912 HydrophobicContact CZ-CB 4.12Å; F344-F912 AromaticContact CZ-CD2 3.75Å; F344-F912 HydrophobicContact CZ-CD2 3.75Å; F344-F912 HydrophobicContact CZ-CG 4.42Å; I908-F912 PolarHBondContact O-N 2.88Å; L909-F912 HydrophobicContact CD1-CD1 3.9Å; L909-F912 WeakPolarHBondContact O-CB 3.38Å; L909-F912 PolarHBondContact O-N 3.39Å; F912-Y914 VanDerWaalsContact C-N 3.26Å; F912-Y914 PolarHBondContact O-N 3.3Å; F912-Q915 WeakPolarHBondContact O-CB 3.49Å; F912-Q915 PolarHBondContact O-N 2.79Å; F912-Q915 VanDerWaalsContact O-N 3.1Å; F912-F916 HydrophobicContact CD1-CE2 4.05Å; F912-F916 AromaticContact CE1-CE2 3.64Å; F912-F916 HydrophobicContact CE1-CE2 3.64Å; F912-F916 AromaticContact CE1-CZ 4Å; F912-F916 HydrophobicContact CE1-CZ 4Å; F912-F916 HydrophobicContact CE2-CE2 4.14Å; F912-F916 HydrophobicContact CE2-CZ 4.39Å; F912-F916 HydrophobicContact CG-CE2 4.49Å; F912-F916 AromaticContact CZ-CE2 3.69Å; F912-F916 HydrophobicContact CZ-CE2 3.69Å; F912-F916 AromaticContact CZ-CZ 3.76Å; F912-F916 HydrophobicContact CZ-CZ 3.76Å; F912-F916 WeakPolarHBondContact O-CD2 3.44Å
913	L	94.9	Very high	93.1	Very high	20 Å²	20	24 Å²	24	11%	0.105	12%	0.122	C	C	.	.	H	α-helix	trans	-59.5	-36.9	177.9	-69	168.5	0	0	0	112	L909 P910 Q915 F916 F917 L991 F994 F995	L909-L913 HydrophobicContact CD1-CD1 4.37Å; L909-L913 HydrophobicContact CD1-CG 4.2Å; L909-L913 HydrophobicContact CG-CD1 4.05Å; L909-L913 HydrophobicContact CG-CG 4.38Å; L909-L913 VanDerWaalsContact O-CG 3.32Å; L909-L913 WeakPolarHBondContact O-CG 3.33Å; L909-L913 PolarHBondContact O-N 3.5Å; P910-L913 PolarHBondContact O-N 2.92Å; L913-Q915 PolarHBondContact O-N 2.68Å; L913-F916 WeakPolarHBondContact O-CD2 3.33Å; L913-F916 PolarHBondContact O-N 2.98Å; L913-F917 VanDerWaalsContact O-CD2 3.26Å; L913-F917 WeakPolarHBondContact O-CD2 3.38Å; L913-L991 HydrophobicContact CD1-CD2 3.98Å; L913-L991 HydrophobicContact CD2-CD2 4.38Å; L913-F994 HydrophobicContact CB-CB 4.42Å; L913-F994 HydrophobicContact CB-CD1 3.78Å; L913-F994 HydrophobicContact CB-CD2 4.01Å; L913-F994 HydrophobicContact CB-CE1 4.05Å; L913-F994 HydrophobicContact CB-CE2 4.25Å; L913-F994 HydrophobicContact CB-CG 3.77Å; L913-F994 HydrophobicContact CB-CZ 4.28Å; L913-F994 HydrophobicContact CD1-CB 3.71Å; L913-F994 HydrophobicContact CD1-CD1 4.11Å; L913-F994 HydrophobicContact CD1-CG 3.95Å; L913-F995 HydrophobicContact CD1-CE2 4.23Å; L913-F995 HydrophobicContact CD2-CE2 4.3Å
914	Y	94.9	Very high	93	Very high	37 Å²	37	24.7 Å²	24.7	15%	0.145	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-30.3	176.5	-169.8	-108.5	0	0	0	113.6	P910 F912 F916 F917 C918 Q923 L925 F994 Y1018	P910-Y914 WeakPolarHBondContact O-CB 3.41Å; P910-Y914 PolarHBondContact O-N 3.38Å; F912-Y914 VanDerWaalsContact C-N 3.26Å; F912-Y914 PolarHBondContact O-N 3.3Å; Y914-F916 PolarHBondContact O-N 3.35Å; Y914-F917 PolarHBondContact O-N 3.34Å; Y914-C918 HydrophobicContact CD1-CB 4.39Å; Y914-C918 HydrophobicContact CE1-CB 4.01Å; Y914-C918 PolarHBondContact O-N 3.02Å; Y914-C918 VanDerWaalsContact O-N 3.16Å; Y914-Q923 HydrophobicContact CE1-CB 4.32Å; Y914-Q923 HydrophobicContact CE1-CG 3.83Å; Y914-L925 HydrophobicContact CD1-CB 4.32Å; Y914-L925 HydrophobicContact CD2-CD1 3.87Å; Y914-L925 HydrophobicContact CE2-CD1 4.2Å; Y914-L925 HydrophobicContact CG-CB 4.28Å; Y914-L925 HydrophobicContact CG-CD1 4.06Å; Y914-F994 HydrophobicContact CD2-CE2 4.02Å; Y914-F994 HydrophobicContact CD2-CZ 4.41Å; Y914-F994 HydrophobicContact CG-CE2 4.44Å; Y914-Y1018 HydrophobicContact CD2-CE1 4.22Å; Y914-Y1018 HydrophobicContact CE2-CD1 4.43Å; Y914-Y1018 HydrophobicContact CE2-CE1 4.4Å
915	Q	94.5	Very high	93	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.1	-29.9	-178.4	-57.1	-48.3	-65.3	0	0	113.1	F340 L343 F344 Q911 F912 L913 F917 Y920 Q922 Q923	F340-Q915 HydrophobicContact CE1-CG 4.18Å; L343-Q915 HydrophobicContact CD2-CG 4.3Å; F344-Q915 HydrophobicContact CE1-CG 4.16Å; F344-Q915 HydrophobicContact CZ-CG 3.83Å; Q911-Q915 WeakPolarHBondContact O-CG 3.48Å; Q911-Q915 PolarHBondContact O-NE2 2.94Å; F912-Q915 WeakPolarHBondContact O-CB 3.49Å; F912-Q915 PolarHBondContact O-N 2.79Å; F912-Q915 VanDerWaalsContact O-N 3.1Å; L913-Q915 PolarHBondContact O-N 2.68Å; Q915-F917 PolarHBondContact O-N 2.74Å; Q915-Y920 HydrophobicContact CB-CD1 4.21Å; Q915-Y920 PolarHBondContact O-N 3.05Å; Q915-Q922 VanDerWaalsContact OE1-CA 3.32Å; Q915-Q923 PolarHBondContact NE2-O 3Å
916	F	93.6	Very high	92.8	Very high	77 Å²	77	24.7 Å²	24.7	34%	0.338	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.4	175.7	-64.1	-99.8	0	0	0	112.6	L304 F912 L913 Y914 Y920	L304-F916 HydrophobicContact CD1-CD1 4.46Å; L304-F916 HydrophobicContact CD1-CE1 3.71Å; L304-F916 HydrophobicContact CD1-CZ 4.33Å; F912-F916 HydrophobicContact CD1-CE2 4.05Å; F912-F916 AromaticContact CE1-CE2 3.64Å; F912-F916 HydrophobicContact CE1-CE2 3.64Å; F912-F916 AromaticContact CE1-CZ 4Å; F912-F916 HydrophobicContact CE1-CZ 4Å; F912-F916 HydrophobicContact CE2-CE2 4.14Å; F912-F916 HydrophobicContact CE2-CZ 4.39Å; F912-F916 HydrophobicContact CG-CE2 4.49Å; F912-F916 AromaticContact CZ-CE2 3.69Å; F912-F916 HydrophobicContact CZ-CE2 3.69Å; F912-F916 AromaticContact CZ-CZ 3.76Å; F912-F916 HydrophobicContact CZ-CZ 3.76Å; F912-F916 WeakPolarHBondContact O-CD2 3.44Å; L913-F916 WeakPolarHBondContact O-CD2 3.33Å; L913-F916 PolarHBondContact O-N 2.98Å; Y914-F916 PolarHBondContact O-N 3.35Å; F916-Y920 HydrophobicContact CD1-CE1 4.01Å; F916-Y920 WeakPolarHBondContact CD1-OH 3.35Å; F916-Y920 HydrophobicContact CE1-CE1 4.34Å; F916-Y920 HydrophobicContact CG-CE1 4.15Å
917	F	91.3	Very high	92.6	Very high	114 Å²	114	25.8 Å²	25.8	50%	0.5	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-15.7	-178	-60	-85.3	0	0	0	113.5	L913 Y914 Q915 F994 F995	L913-F917 VanDerWaalsContact O-CD2 3.26Å; L913-F917 WeakPolarHBondContact O-CD2 3.38Å; Y914-F917 PolarHBondContact O-N 3.34Å; Q915-F917 PolarHBondContact O-N 2.74Å; F917-F994 AromaticContact CD2-CE1 3.82Å; F917-F994 HydrophobicContact CD2-CE1 3.82Å; F917-F994 AromaticContact CD2-CZ 3.61Å; F917-F994 HydrophobicContact CD2-CZ 3.61Å; F917-F994 AromaticContact CE2-CE1 3.45Å; F917-F994 HydrophobicContact CE2-CE1 3.45Å; F917-F994 VanDerWaalsContact CE2-CE1 3.45Å; F917-F994 AromaticContact CE2-CZ 3.77Å; F917-F994 HydrophobicContact CE2-CZ 3.77Å; F917-F994 HydrophobicContact CZ-CE1 4.24Å; F917-F995 HydrophobicContact CZ-CE1 4.36Å
918	C	89.6	Confident	92.1	Very high	28 Å²	28	27.7 Å²	27.7	19%	0.189	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	14.7	176.6	78.8	0	0	0	0	113.9	Y914 Y920 S921	Y914-C918 HydrophobicContact CD1-CB 4.39Å; Y914-C918 HydrophobicContact CE1-CB 4.01Å; Y914-C918 PolarHBondContact O-N 3.02Å; Y914-C918 VanDerWaalsContact O-N 3.16Å; C918-Y920 VanDerWaalsContact C-N 3.33Å; C918-Y920 PolarHBondContact O-N 3.44Å; C918-S921 WeakPolarHBondContact O-CB 3.44Å; C918-S921 PolarHBondContact O-OG 2.86Å; C918-S921 PolarHBondContact SG-OG 2.87Å
919	G	88.2	Confident	91.7	Very high	17 Å²	17	28.2 Å²	28.2	18%	0.175	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	28.2	-178.8	0	0	0	0	0	113.9	S921	G919-S921 PolarHBondContact O-N 2.94Å
920	Y	91.1	Very high	91.4	Very high	24 Å²	24	27.8 Å²	27.8	9%	0.094	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	32.9	-178.6	-48.5	-79.9	0	0	0	113.9	L304 K305 W308 F340 Q915 F916 C918 Q922	L304-Y920 HydrophobicContact CB-CD1 4.22Å; L304-Y920 HydrophobicContact CB-CD2 4.38Å; L304-Y920 HydrophobicContact CB-CE1 3.71Å; L304-Y920 HydrophobicContact CB-CE2 3.9Å; L304-Y920 HydrophobicContact CD1-CE1 4.11Å; K305-Y920 HydrophobicContact CB-CG 4.34Å; K305-Y920 WeakPolarHBondContact CD-O 3.37Å; K305-Y920 WeakPolarHBondContact CE-O 3.12Å; W308-Y920 HydrophobicContact CB-CD2 4.14Å; W308-Y920 HydrophobicContact CB-CE2 4.23Å; W308-Y920 HydrophobicContact CG-CD2 4.48Å; F340-Y920 WeakPolarHBondContact CZ-O 3.42Å; Q915-Y920 HydrophobicContact CB-CD1 4.21Å; Q915-Y920 PolarHBondContact O-N 3.05Å; F916-Y920 HydrophobicContact CD1-CE1 4.01Å; F916-Y920 WeakPolarHBondContact CD1-OH 3.35Å; F916-Y920 HydrophobicContact CE1-CE1 4.34Å; F916-Y920 HydrophobicContact CG-CE1 4.15Å; C918-Y920 VanDerWaalsContact C-N 3.33Å; C918-Y920 PolarHBondContact O-N 3.44Å; Y920-Q922 VanDerWaalsContact C-N 3.26Å; Y920-Q922 PolarHBondContact O-N 3.43Å; Y920-Q922 PolarHBondContact O-NE2 3.18Å; Y920-Q922 PolarHBondContact O-OE1 3.43Å
921	S	88.1	Confident	91	Very high	62 Å²	62	27.9 Å²	27.9	43%	0.434	15%	0.15	S	C	.	.			trans	-81.9	17.6	-178.6	55.2	0	0	0	0	115.4	C918 G919 Q923	C918-S921 WeakPolarHBondContact O-CB 3.44Å; C918-S921 PolarHBondContact O-OG 2.86Å; C918-S921 PolarHBondContact SG-OG 2.87Å; G919-S921 PolarHBondContact O-N 2.94Å; S921-Q923 PolarHBondContact O-N 3.41Å
922	Q	90.4	Very high	90.6	Very high	22 Å²	22	29 Å²	29	10%	0.103	16%	0.157	C	C	.	.			trans	59.9	5.6	-179	-62.7	66.9	45.9	0	0	115.2	P85 F340 L343 Q915 Y920 P924	P85-Q922 HydrophobicContact CB-CB 4.15Å; P85-Q922 WeakPolarHBondContact CB-O 3.31Å; P85-Q922 HydrophobicContact CG-CB 4.1Å; F340-Q922 HydrophobicContact CD1-CG 4.35Å; F340-Q922 HydrophobicContact CE1-CG 4.13Å; F340-Q922 HydrophobicContact CZ-CG 4.29Å; L343-Q922 WeakPolarHBondContact CD1-O 3.22Å; L343-Q922 WeakPolarHBondContact CD2-O 3.37Å; Q915-Q922 VanDerWaalsContact OE1-CA 3.32Å; Y920-Q922 VanDerWaalsContact C-N 3.26Å; Y920-Q922 PolarHBondContact O-N 3.43Å; Y920-Q922 PolarHBondContact O-NE2 3.18Å; Y920-Q922 PolarHBondContact O-OE1 3.43Å; Q922-P924 WeakPolarHBondContact O-CD 3.29Å
923	Q	91.6	Very high	90.2	Very high	54 Å²	54	30.3 Å²	30.3	25%	0.252	16%	0.164	S	C	.	.			trans	-60	123.4	-175.5	171.5	61.4	44	0	0	111.2	Y914 Q915 S921	Y914-Q923 HydrophobicContact CE1-CB 4.32Å; Y914-Q923 HydrophobicContact CE1-CG 3.83Å; Q915-Q923 PolarHBondContact NE2-O 3Å; S921-Q923 PolarHBondContact O-N 3.41Å
924	P	91.9	Very high	89.9	Confident	15 Å²	15	29.3 Å²	29.3	10%	0.097	16%	0.159	C	C	.	.			trans	-69.4	140.6	174	28.2	-34.6	0	0	0	111.3	L343 Q922	L343-P924 HydrophobicContact CD1-CB 4.08Å; Q922-P924 WeakPolarHBondContact O-CD 3.29Å
925	L	93.7	Very high	89.4	Confident	3 Å²	3	28 Å²	28	2%	0.016	16%	0.155	C	C	.	.	S	Bend	trans	-75.7	-32.4	175.7	175.1	61.2	0	0	0	112.2	P910 Q911 Y914 Y1018 G1019 V1022	P910-L925 HydrophobicContact CB-CD2 3.65Å; Q911-L925 HydrophobicContact CB-CB 4.25Å; Q911-L925 HydrophobicContact CG-CB 4.29Å; Y914-L925 HydrophobicContact CD1-CB 4.32Å; Y914-L925 HydrophobicContact CD2-CD1 3.87Å; Y914-L925 HydrophobicContact CE2-CD1 4.2Å; Y914-L925 HydrophobicContact CG-CB 4.28Å; Y914-L925 HydrophobicContact CG-CD1 4.06Å; L925-Y1018 HydrophobicContact CD1-CD1 3.6Å; L925-Y1018 HydrophobicContact CD1-CE1 3.76Å; L925-G1019 WeakPolarHBondContact O-CA 3.43Å; L925-V1022 HydrophobicContact CD2-CG1 4.26Å
926	Y	91.6	Very high	88.9	Confident	2 Å²	2	30 Å²	30	1%	0.008	17%	0.165	C	C	.	.	S	Bend	trans	-112.1	151.9	-177.1	-43.2	-67.5	0	0	0	110.8	F907 Q911 L931 V1022 F1023	F907-Y926 HydrophobicContact CD2-CD2 4.09Å; F907-Y926 AromaticContact CD2-CE2 3.52Å; F907-Y926 HydrophobicContact CD2-CE2 3.52Å; F907-Y926 AromaticContact CD2-CZ 3.99Å; F907-Y926 AromaticContact CE2-CD2 3.44Å; F907-Y926 HydrophobicContact CE2-CD2 3.44Å; F907-Y926 VanDerWaalsContact CE2-CD2 3.44Å; F907-Y926 AromaticContact CE2-CE2 3.39Å; F907-Y926 HydrophobicContact CE2-CE2 3.39Å; F907-Y926 HydrophobicContact CE2-CG 4.22Å; F907-Y926 HydrophobicContact CZ-CD2 4.22Å; F907-Y926 HydrophobicContact CZ-CE2 4.4Å; F907-Y926 VanDerWaalsContact O-CE2 3.31Å; F907-Y926 WeakPolarHBondContact O-CE2 3.44Å; F907-Y926 PolarHBondContact O-OH 3.4Å; Q911-Y926 HydrophobicContact CB-CE2 4.1Å; Y926-L931 HydrophobicContact CD2-CD2 3.94Å; Y926-L931 HydrophobicContact CG-CD2 4.46Å; Y926-V1022 HydrophobicContact CE1-CB 4.44Å; Y926-V1022 HydrophobicContact CE1-CG1 4.07Å; Y926-F1023 HydrophobicContact CD1-CB 3.91Å; Y926-F1023 AromaticContact CD1-CD2 3.82Å; Y926-F1023 HydrophobicContact CD1-CD2 3.82Å; Y926-F1023 HydrophobicContact CD1-CG 4.29Å; Y926-F1023 HydrophobicContact CE1-CB 3.98Å; Y926-F1023 AromaticContact CE1-CD2 3.99Å; Y926-F1023 HydrophobicContact CE1-CD2 3.99Å; Y926-F1023 HydrophobicContact CE1-CG 4.5Å; Y926-F1023 HydrophobicContact CG-CD2 4.21Å
927	D	89.4	Confident	88.6	Confident	23 Å²	23	28.2 Å²	28.2	12%	0.123	16%	0.162	C	C	.	.			trans	-70.1	153.6	173.6	-179.1	61.7	0	0	0	112.5	A929 Y930 L931 W1016 L1076	D927-A929 PolarHBondContact O-N 3.19Å; D927-A929 WeakPolarHBondContact OD2-CB 3.45Å; D927-A929 PolarHBondContact OD2-N 2.92Å; D927-Y930 HydrophobicContact CB-CD2 4.43Å; D927-Y930 PolarHBondContact O-N 3.23Å; D927-L931 WeakPolarHBondContact O-CG 3.36Å; D927-L931 PolarHBondContact O-N 3.01Å; D927-W1016 HydrophobicContact CB-CE3 4.41Å; D927-W1016 HydrophobicContact CB-CZ3 4.31Å; D927-L1076 HydrophobicContact CB-CD1 3.55Å; D927-L1076 HydrophobicContact CB-CD2 4.12Å; D927-L1076 HydrophobicContact CB-CG 3.83Å
928	A	85.1	Confident	88.6	Confident	41 Å²	41	22.8 Å²	22.8	34%	0.339	14%	0.138	S	C	.	.	H	α-helix	trans	-55.8	-31.7	179.8	0	0	0	0	0	114	T90 T932	T90-A928 HydrophobicContact CG2-CB 3.97Å; A928-T932 PolarHBondContact O-N 3.37Å; A928-T932 PolarHBondContact O-OG1 3.21Å
929	A	86.2	Confident	88.7	Confident	10 Å²	10	21.5 Å²	21.5	8%	0.083	13%	0.129	C	C	.	.	H	α-helix	trans	-70.6	-35.4	175.7	0	0	0	0	0	112.7	D927 T932 M933 F1059 W1063	D927-A929 PolarHBondContact O-N 3.19Å; D927-A929 WeakPolarHBondContact OD2-CB 3.45Å; D927-A929 PolarHBondContact OD2-N 2.92Å; A929-T932 PolarHBondContact O-OG1 2.91Å; A929-T932 VanDerWaalsContact O-OG1 3.13Å; A929-M933 VanDerWaalsContact O-CB 3.31Å; A929-M933 WeakPolarHBondContact O-CB 3.37Å; A929-M933 VanDerWaalsContact O-CG 3.24Å; A929-M933 WeakPolarHBondContact O-CG 3.37Å; A929-M933 PolarHBondContact O-N 3.08Å; A929-M933 VanDerWaalsContact O-N 3.1Å; A929-F1059 HydrophobicContact CB-CE1 4.38Å; A929-F1059 HydrophobicContact CB-CZ 4.26Å; A929-W1063 HydrophobicContact CB-CD2 4.36Å; A929-W1063 HydrophobicContact CB-CZ2 3.89Å; A929-W1063 VanDerWaalsContact CB-NE1 3.32Å
930	Y	88.9	Confident	88.7	Confident	4 Å²	4	21.2 Å²	21.2	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-72.9	-36.8	174	-65	-25.2	0	0	0	111.6	D927 T932 Y934 F938 T1020 F1023 Y1056 F1059 S1060 L1076	D927-Y930 HydrophobicContact CB-CD2 4.43Å; D927-Y930 PolarHBondContact O-N 3.23Å; Y930-T932 VanDerWaalsContact C-N 3.32Å; Y930-T932 PolarHBondContact O-N 2.83Å; Y930-Y934 VanDerWaalsContact O-CB 3.29Å; Y930-Y934 WeakPolarHBondContact O-CB 3.29Å; Y930-Y934 PolarHBondContact O-N 3.45Å; Y930-Y934 VanDerWaalsContact O-N 3.07Å; Y930-F938 HydrophobicContact CD1-CE2 4.31Å; Y930-T1020 HydrophobicContact CE2-CG2 4.12Å; Y930-F1023 HydrophobicContact CD1-CD1 4.41Å; Y930-F1023 HydrophobicContact CD1-CE1 4.05Å; Y930-F1023 HydrophobicContact CD2-CD1 4.15Å; Y930-F1023 HydrophobicContact CD2-CE1 4.47Å; Y930-F1023 HydrophobicContact CD2-CG 4.33Å; Y930-F1023 HydrophobicContact CG-CD1 4.06Å; Y930-F1023 AromaticContact CG-CE1 3.92Å; Y930-F1023 HydrophobicContact CG-CE1 3.92Å; Y930-F1023 HydrophobicContact CG-CG 4.46Å; Y930-F1023 HydrophobicContact CG-CZ 4.21Å; Y930-Y1056 HydrophobicContact CE1-CE2 4.36Å; Y930-F1059 HydrophobicContact CD1-CE1 4.34Å; Y930-F1059 HydrophobicContact CE1-CD1 4.33Å; Y930-F1059 HydrophobicContact CE1-CE1 4.23Å; Y930-S1060 PolarHBondContact OH-OG 3.45Å; Y930-L1076 HydrophobicContact CE1-CD1 4.45Å; Y930-L1076 HydrophobicContact CE2-CD1 3.97Å; Y930-L1076 HydrophobicContact CE2-CD2 4.33Å
931	L	87.2	Confident	88.7	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-57.6	-41.2	175.9	-65.1	179.7	0	0	0	112.7	T86 F346 F907 Y926 D927	T86-L931 HydrophobicContact CG2-CD1 3.99Å; F346-L931 HydrophobicContact CD2-CD2 4.3Å; F346-L931 HydrophobicContact CE1-CB 4.45Å; F346-L931 HydrophobicContact CE2-CB 4.15Å; F346-L931 HydrophobicContact CE2-CD1 3.95Å; F346-L931 HydrophobicContact CE2-CD2 4.1Å; F346-L931 HydrophobicContact CE2-CG 4.29Å; F346-L931 HydrophobicContact CZ-CB 3.91Å; F346-L931 HydrophobicContact CZ-CD1 4.31Å; F907-L931 HydrophobicContact CE2-CD2 4.23Å; F907-L931 HydrophobicContact CZ-CD2 3.64Å; Y926-L931 HydrophobicContact CD2-CD2 3.94Å; Y926-L931 HydrophobicContact CG-CD2 4.46Å; D927-L931 WeakPolarHBondContact O-CG 3.36Å; D927-L931 PolarHBondContact O-N 3.01Å
932	T	84.8	Confident	89	Confident	23 Å²	23	22.5 Å²	22.5	14%	0.141	13%	0.126	C	C	.	.	H	α-helix	trans	-79.3	-49.3	178.4	52.1	0	0	0	0	112.7	T90 A928 A929 Y930 Y934	T90-T932 HydrophobicContact CG2-CG2 4.12Å; A928-T932 PolarHBondContact O-N 3.37Å; A928-T932 PolarHBondContact O-OG1 3.21Å; A929-T932 PolarHBondContact O-OG1 2.91Å; A929-T932 VanDerWaalsContact O-OG1 3.13Å; Y930-T932 VanDerWaalsContact C-N 3.32Å; Y930-T932 PolarHBondContact O-N 2.83Å; T932-Y934 VanDerWaalsContact C-N 3.33Å; T932-Y934 PolarHBondContact O-N 2.9Å
933	M	87.5	Confident	89.2	Confident	58 Å²	58	21.4 Å²	21.4	29%	0.286	12%	0.121	S	C	.	.	H	α-helix	trans	-69.9	-26.2	-172.8	-67.3	-64.3	-176.2	0	0	113.6	A929 N935 C937 F938 F1059	A929-M933 VanDerWaalsContact O-CB 3.31Å; A929-M933 WeakPolarHBondContact O-CB 3.37Å; A929-M933 VanDerWaalsContact O-CG 3.24Å; A929-M933 WeakPolarHBondContact O-CG 3.37Å; A929-M933 PolarHBondContact O-N 3.08Å; A929-M933 VanDerWaalsContact O-N 3.1Å; M933-N935 PolarHBondContact O-N 3.46Å; M933-C937 WeakPolarHBondContact O-CA 3.07Å; M933-C937 PolarHBondContact O-N 3.34Å; M933-C937 HydrophobicContact SD-CB 4.15Å; M933-F938 HydrophobicContact CB-CD1 4.48Å; M933-F938 HydrophobicContact CB-CD2 4.03Å; M933-F938 HydrophobicContact CB-CE1 3.97Å; M933-F938 HydrophobicContact CB-CE2 3.46Å; M933-F938 VanDerWaalsContact CB-CE2 3.46Å; M933-F938 HydrophobicContact CB-CG 4.49Å; M933-F938 HydrophobicContact CB-CZ 3.41Å; M933-F938 VanDerWaalsContact CB-CZ 3.41Å; M933-F938 HydrophobicContact CG-CZ 4.21Å; M933-F938 PolarHBondContact O-N 3.24Å; M933-F1059 HydrophobicContact CE-CE2 3.97Å; M933-F1059 HydrophobicContact CE-CZ 4.34Å; M933-F1059 HydrophobicContact CG-CE1 4.41Å; M933-F1059 HydrophobicContact CG-CE2 4.25Å; M933-F1059 HydrophobicContact CG-CZ 3.99Å
934	Y	89.3	Confident	89.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.116	C	C	.	.	I	π-helix	trans	-53.3	-49.9	178.6	-179.2	-111.6	0	0	0	113	K903 F907 Y930 T932 T939 F1023 L1026 V1027	K903-Y934 PolarHBondContact O-OH 3.09Å; F907-Y934 HydrophobicContact CB-CD1 4.21Å; F907-Y934 HydrophobicContact CB-CE1 3.53Å; F907-Y934 AromaticContact CD1-CD1 3.55Å; F907-Y934 HydrophobicContact CD1-CD1 3.55Å; F907-Y934 AromaticContact CD1-CE1 3.68Å; F907-Y934 HydrophobicContact CD1-CE1 3.68Å; F907-Y934 HydrophobicContact CD1-CG 4.47Å; F907-Y934 HydrophobicContact CD2-CD1 4.15Å; F907-Y934 HydrophobicContact CD2-CE1 4.25Å; F907-Y934 HydrophobicContact CD2-CG 4.42Å; F907-Y934 AromaticContact CE1-CD1 3.8Å; F907-Y934 HydrophobicContact CE1-CD1 3.8Å; F907-Y934 HydrophobicContact CE1-CE1 4.4Å; F907-Y934 HydrophobicContact CE1-CG 4.47Å; F907-Y934 HydrophobicContact CE2-CD1 4.37Å; F907-Y934 HydrophobicContact CE2-CG 4.42Å; F907-Y934 AromaticContact CG-CD1 3.73Å; F907-Y934 HydrophobicContact CG-CD1 3.73Å; F907-Y934 AromaticContact CG-CE1 3.58Å; F907-Y934 HydrophobicContact CG-CE1 3.58Å; F907-Y934 HydrophobicContact CG-CG 4.44Å; F907-Y934 HydrophobicContact CZ-CD1 4.2Å; F907-Y934 HydrophobicContact CZ-CG 4.44Å; Y930-Y934 VanDerWaalsContact O-CB 3.29Å; Y930-Y934 WeakPolarHBondContact O-CB 3.29Å; Y930-Y934 PolarHBondContact O-N 3.45Å; Y930-Y934 VanDerWaalsContact O-N 3.07Å; T932-Y934 VanDerWaalsContact C-N 3.33Å; T932-Y934 PolarHBondContact O-N 2.9Å; Y934-T939 HydrophobicContact CD2-CG2 3.93Å; Y934-T939 HydrophobicContact CE2-CG2 3.55Å; Y934-T939 PolarHBondContact O-N 3.27Å; Y934-T939 PolarHBondContact O-OG1 2.94Å; Y934-F1023 AromaticContact CD2-CE2 3.9Å; Y934-F1023 HydrophobicContact CD2-CE2 3.9Å; Y934-F1023 AromaticContact CD2-CZ 3.87Å; Y934-F1023 HydrophobicContact CD2-CZ 3.87Å; Y934-F1023 HydrophobicContact CG-CE2 4.17Å; Y934-F1023 HydrophobicContact CG-CZ 4.27Å; Y934-L1026 HydrophobicContact CD2-CD2 4.44Å; Y934-L1026 HydrophobicContact CE2-CD2 3.87Å; Y934-L1026 HydrophobicContact CE2-CG 4.08Å; Y934-V1027 HydrophobicContact CD2-CG2 4.05Å; Y934-V1027 HydrophobicContact CE2-CG2 4.16Å
935	N	83.9	Confident	89.4	Confident	10 Å²	10	20 Å²	20	5%	0.053	12%	0.115	C	C	.	.	I	π-helix	trans	-91.8	-21.1	-172.4	-92.1	-42.3	0	0	0	114.5	S351 K903 N904 M933	S351-N935 WeakPolarHBondContact CB-O 3.49Å; S351-N935 PolarHBondContact OG-O 2.85Å; K903-N935 PolarHBondContact NZ-OD1 2.96Å; N904-N935 PolarHBondContact ND2-OD1 2.67Å; N904-N935 PolarHBondContact OD1-ND2 2.87Å; N904-N935 PolarHBondContact OD1-OD1 2.7Å; N904-N935 VanDerWaalsContact OD1-OD1 3.09Å; M933-N935 PolarHBondContact O-N 3.46Å
936	I	83.6	Confident	89.5	Confident	40 Å²	40	20.3 Å²	20.3	21%	0.205	12%	0.117	C	C	.	.	I	π-helix	trans	-95	-36.9	179.5	-59.1	179.7	0	0	0	111.8	L93 P94 S940	L93-I936 HydrophobicContact CD2-CD1 3.91Å; P94-I936 HydrophobicContact CB-CD1 4.03Å; P94-I936 HydrophobicContact CG-CD1 3.94Å; I936-S940 WeakPolarHBondContact O-CB 3.46Å; I936-S940 PolarHBondContact O-OG 3.07Å
937	C	86.4	Confident	89.6	Confident	41 Å²	41	20.2 Å²	20.2	28%	0.277	12%	0.116	S	C	.	.	I	π-helix	trans	-121.3	-56.5	-168.2	-59.1	0	0	0	0	113.5	M933 T939 S940 F1055	M933-C937 WeakPolarHBondContact O-CA 3.07Å; M933-C937 PolarHBondContact O-N 3.34Å; M933-C937 HydrophobicContact SD-CB 4.15Å; C937-T939 PolarHBondContact O-N 3.31Å; C937-S940 PolarHBondContact O-OG 3.05Å; C937-F1055 HydrophobicContact CB-CE1 4.04Å
938	F	91.1	Very high	89.8	Confident	0 Å²	0	20 Å²	20	0%	0	12%	0.115	C	C	.	.	I	π-helix	trans	-69	-34.7	-168	-56.7	-33.4	0	0	0	113.7	Y930 M933 F1023 S1052 F1055 Y1056 F1059	Y930-F938 HydrophobicContact CD1-CE2 4.31Å; M933-F938 HydrophobicContact CB-CD1 4.48Å; M933-F938 HydrophobicContact CB-CD2 4.03Å; M933-F938 HydrophobicContact CB-CE1 3.97Å; M933-F938 HydrophobicContact CB-CE2 3.46Å; M933-F938 VanDerWaalsContact CB-CE2 3.46Å; M933-F938 HydrophobicContact CB-CG 4.49Å; M933-F938 HydrophobicContact CB-CZ 3.41Å; M933-F938 VanDerWaalsContact CB-CZ 3.41Å; M933-F938 HydrophobicContact CG-CZ 4.21Å; M933-F938 PolarHBondContact O-N 3.24Å; F938-F1023 AromaticContact CD2-CE1 3.91Å; F938-F1023 HydrophobicContact CD2-CE1 3.91Å; F938-F1023 AromaticContact CD2-CZ 3.88Å; F938-F1023 HydrophobicContact CD2-CZ 3.88Å; F938-F1023 AromaticContact CE2-CE1 3.82Å; F938-F1023 HydrophobicContact CE2-CE1 3.82Å; F938-F1023 AromaticContact CE2-CZ 3.99Å; F938-F1023 HydrophobicContact CE2-CZ 3.99Å; F938-S1052 WeakPolarHBondContact O-CB 3.45Å; F938-F1055 AromaticContact CD1-CD1 3.87Å; F938-F1055 HydrophobicContact CD1-CD1 3.87Å; F938-F1055 AromaticContact CD1-CE1 3.96Å; F938-F1055 HydrophobicContact CD1-CE1 3.96Å; F938-F1055 AromaticContact CE1-CD1 3.96Å; F938-F1055 HydrophobicContact CE1-CD1 3.96Å; F938-F1055 AromaticContact CE1-CE1 3.76Å; F938-F1055 HydrophobicContact CE1-CE1 3.76Å; F938-Y1056 HydrophobicContact CD1-CD2 4.38Å; F938-Y1056 AromaticContact CD2-CD2 4Å; F938-Y1056 HydrophobicContact CD2-CD2 4Å; F938-Y1056 HydrophobicContact CE1-CD2 4.19Å; F938-Y1056 AromaticContact CE2-CD2 3.79Å; F938-Y1056 HydrophobicContact CE2-CD2 3.79Å; F938-Y1056 HydrophobicContact CE2-CE2 4.35Å; F938-Y1056 HydrophobicContact CG-CD2 4.32Å; F938-Y1056 AromaticContact CZ-CD2 3.9Å; F938-Y1056 HydrophobicContact CZ-CD2 3.9Å; F938-F1059 HydrophobicContact CE1-CB 4.08Å; F938-F1059 HydrophobicContact CE1-CD1 4.2Å; F938-F1059 HydrophobicContact CE1-CG 4.1Å; F938-F1059 HydrophobicContact CZ-CB 4.31Å; F938-F1059 AromaticContact CZ-CD1 3.59Å; F938-F1059 HydrophobicContact CZ-CD1 3.59Å; F938-F1059 HydrophobicContact CZ-CE1 4.12Å; F938-F1059 AromaticContact CZ-CG 3.97Å; F938-F1059 HydrophobicContact CZ-CG 3.97Å
939	T	91.6	Very high	90.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.6	14.2	-172	66.5	0	0	0	0	114.4	K903 Y934 C937 V1030	K903-T939 PolarHBondContact NZ-OG1 3.23Å; Y934-T939 HydrophobicContact CD2-CG2 3.93Å; Y934-T939 HydrophobicContact CE2-CG2 3.55Å; Y934-T939 PolarHBondContact O-N 3.27Å; Y934-T939 PolarHBondContact O-OG1 2.94Å; C937-T939 PolarHBondContact O-N 3.31Å; T939-V1030 HydrophobicContact CG2-CG2 3.81Å
940	S	89.1	Confident	90.4	Very high	11 Å²	11	19.4 Å²	19.4	8%	0.077	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-52.4	-178	53.5	0	0	0	0	112.6	I936 C937 I943 L944	I936-S940 WeakPolarHBondContact O-CB 3.46Å; I936-S940 PolarHBondContact O-OG 3.07Å; C937-S940 PolarHBondContact O-OG 3.05Å; S940-I943 VanDerWaalsContact O-CG2 3.22Å; S940-I943 WeakPolarHBondContact O-CG2 3.49Å; S940-I943 PolarHBondContact O-N 3.02Å; S940-L944 PolarHBondContact O-N 2.98Å; S940-L944 VanDerWaalsContact O-N 3.09Å
941	M	90.7	Very high	90.5	Very high	112 Å²	112	21.9 Å²	21.9	55%	0.552	12%	0.116	S	C	*	.	H	α-helix	trans	-61.5	-42.3	-178.3	-65.2	-63.7	-165.8	0	0	113	I943 L944 A945 V1048	M941-I943 PolarHBondContact O-N 3.26Å; M941-L944 PolarHBondContact O-N 2.96Å; M941-L944 HydrophobicContact SD-CD2 4.47Å; M941-A945 WeakPolarHBondContact O-CB 3.38Å; M941-A945 PolarHBondContact O-N 3.09Å; M941-V1048 HydrophobicContact CB-CG1 3.57Å
942	P	94.4	Very high	90.4	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-59.7	-41.9	179.2	-27.3	37.2	0	0	0	113.3	Y946 L1034 V1048 I1049 S1052	P942-Y946 WeakPolarHBondContact O-CB 3.36Å; P942-Y946 PolarHBondContact O-N 2.98Å; P942-L1034 VanDerWaalsContact C-CD2 3.5Å; P942-L1034 HydrophobicContact CB-CD2 3.79Å; P942-V1048 HydrophobicContact CB-CG1 4.46Å; P942-V1048 HydrophobicContact CG-CG1 4.15Å; P942-I1049 HydrophobicContact CB-CG1 4.2Å; P942-S1052 WeakPolarHBondContact CD-OG 3.36Å; P942-S1052 WeakPolarHBondContact CG-OG 3.49Å
943	I	94.9	Very high	90.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-75.9	-30.1	179.6	-170.2	66.3	0	0	0	112.5	L896 Y899 F900 S940 M941 Y946 S947 L1034	L896-I943 HydrophobicContact CB-CD1 4.43Å; L896-I943 HydrophobicContact CB-CG1 4.22Å; L896-I943 HydrophobicContact CD1-CG1 4.24Å; L896-I943 HydrophobicContact CG-CG1 3.93Å; Y899-I943 HydrophobicContact CD1-CB 3.87Å; Y899-I943 HydrophobicContact CD1-CD1 3.51Å; Y899-I943 HydrophobicContact CD1-CG1 3.56Å; Y899-I943 HydrophobicContact CD1-CG2 4.4Å; Y899-I943 HydrophobicContact CE1-CB 3.81Å; Y899-I943 HydrophobicContact CE1-CD1 4.1Å; Y899-I943 HydrophobicContact CE1-CG1 4.05Å; Y899-I943 HydrophobicContact CE1-CG2 4.26Å; Y899-I943 HydrophobicContact CG-CD1 3.83Å; Y899-I943 HydrophobicContact CG-CG1 4.34Å; F900-I943 HydrophobicContact CD2-CG1 4.45Å; F900-I943 HydrophobicContact CD2-CG2 4.31Å; F900-I943 HydrophobicContact CE2-CG1 4.31Å; F900-I943 HydrophobicContact CE2-CG2 3.53Å; F900-I943 HydrophobicContact CZ-CG2 3.93Å; S940-I943 VanDerWaalsContact O-CG2 3.22Å; S940-I943 WeakPolarHBondContact O-CG2 3.49Å; S940-I943 PolarHBondContact O-N 3.02Å; M941-I943 PolarHBondContact O-N 3.26Å; I943-Y946 HydrophobicContact CD1-CD1 3.83Å; I943-Y946 HydrophobicContact CD1-CE1 4.48Å; I943-S947 VanDerWaalsContact O-CB 3.23Å; I943-S947 WeakPolarHBondContact O-CB 3.4Å; I943-S947 PolarHBondContact O-N 3.06Å; I943-L1034 HydrophobicContact CB-CD2 4.09Å; I943-L1034 HydrophobicContact CD1-CD1 3.67Å; I943-L1034 HydrophobicContact CD1-CD2 4.09Å
944	L	94	Very high	90.7	Very high	27 Å²	27	24.3 Å²	24.3	14%	0.141	13%	0.132	C	C	.	.	H	α-helix	trans	-65.9	-46.5	170.8	-178.6	57.5	0	0	0	111.4	T355 M358 Q359 S940 M941 S947 L948	T355-L944 HydrophobicContact CG2-CB 3.93Å; T355-L944 HydrophobicContact CG2-CD1 3.98Å; T355-L944 HydrophobicContact CG2-CG 4.42Å; M358-L944 HydrophobicContact CG-CD1 4.48Å; M358-L944 HydrophobicContact CG-CD2 4.26Å; Q359-L944 HydrophobicContact CB-CD1 3.97Å; S940-L944 PolarHBondContact O-N 2.98Å; S940-L944 VanDerWaalsContact O-N 3.09Å; M941-L944 PolarHBondContact O-N 2.96Å; M941-L944 HydrophobicContact SD-CD2 4.47Å; L944-S947 PolarHBondContact O-N 3.19Å; L944-L948 HydrophobicContact CD1-CD1 3.88Å; L944-L948 HydrophobicContact CD1-CG 4.24Å; L944-L948 HydrophobicContact CG-CD1 4.03Å; L944-L948 WeakPolarHBondContact O-CG 3.39Å; L944-L948 PolarHBondContact O-N 2.93Å
945	A	94.2	Very high	90.7	Very high	11 Å²	11	26.3 Å²	26.3	9%	0.091	14%	0.142	C	C	.	.	H	α-helix	trans	-60	-49.4	177.5	0	0	0	0	0	111.5	M941 S947 L948 L949 V1048	M941-A945 WeakPolarHBondContact O-CB 3.38Å; M941-A945 PolarHBondContact O-N 3.09Å; A945-S947 PolarHBondContact O-N 3.25Å; A945-L948 PolarHBondContact O-N 3.09Å; A945-L949 WeakPolarHBondContact O-CB 3.03Å; A945-L949 WeakPolarHBondContact O-CG 3.3Å; A945-L949 PolarHBondContact O-N 3.08Å; A945-V1048 HydrophobicContact CB-CB 4.24Å; A945-V1048 HydrophobicContact CB-CG1 4.18Å; A945-V1048 HydrophobicContact CB-CG2 4.28Å
946	Y	94.7	Very high	91	Very high	11 Å²	11	32 Å²	32	4%	0.043	17%	0.168	C	C	.	.	H	α-helix	trans	-55.3	-51	173.3	170.6	-98.9	0	0	0	112.4	H895 P942 I943 L948 L949 E950 L1034 T1038	H895-Y946 HydrophobicContact CB-CE1 3.97Å; H895-Y946 PolarHBondContact CD2-OH 3.45Å; H895-Y946 AromaticContact CE1-CE1 3.8Å; H895-Y946 AromaticContact CE1-CZ 3.98Å; H895-Y946 AromaticContact CG-CE1 3.63Å; H895-Y946 AromaticContact CG-CZ 3.9Å; H895-Y946 AromaticContact ND1-CE1 3.19Å; H895-Y946 WeakPolarHBondContact ND1-CE1 3.39Å; H895-Y946 AromaticContact ND1-CZ 3.72Å; P942-Y946 WeakPolarHBondContact O-CB 3.36Å; P942-Y946 PolarHBondContact O-N 2.98Å; I943-Y946 HydrophobicContact CD1-CD1 3.83Å; I943-Y946 HydrophobicContact CD1-CE1 4.48Å; Y946-L948 PolarHBondContact O-N 3.39Å; Y946-L949 PolarHBondContact O-N 2.96Å; Y946-E950 HydrophobicContact CD2-CB 3.68Å; Y946-E950 HydrophobicContact CD2-CG 3.92Å; Y946-E950 HydrophobicContact CE2-CB 3.7Å; Y946-E950 HydrophobicContact CE2-CG 3.41Å; Y946-E950 VanDerWaalsContact CE2-CG 3.41Å; Y946-E950 HydrophobicContact CG-CB 4.29Å; Y946-E950 WeakPolarHBondContact O-CB 3.28Å; Y946-E950 PolarHBondContact O-N 3.47Å; Y946-L1034 HydrophobicContact CD1-CD1 4.04Å; Y946-L1034 HydrophobicContact CD2-CD1 4.32Å; Y946-L1034 HydrophobicContact CE1-CD1 4.42Å; Y946-L1034 HydrophobicContact CG-CD1 3.95Å; Y946-T1038 HydrophobicContact CD2-CG2 3.4Å; Y946-T1038 HydrophobicContact CE2-CG2 3.97Å; Y946-T1038 HydrophobicContact CG-CG2 4.29Å
947	S	94.4	Very high	91.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-73.8	-6.8	-175.8	-160.4	0	0	0	0	114	Q359 R892 L896 I943 L944 A945	Q359-S947 WeakPolarHBondContact CG-O 3.46Å; Q359-S947 PolarHBondContact NE2-O 3Å; R892-S947 VanDerWaalsContact C-OG 3.24Å; R892-S947 WeakPolarHBondContact CB-O 3.25Å; R892-S947 WeakPolarHBondContact CD-O 3.39Å; R892-S947 PolarHBondContact O-OG 3.16Å; L896-S947 VanDerWaalsContact CD1-CB 3.41Å; L896-S947 WeakPolarHBondContact CD1-OG 3.45Å; I943-S947 VanDerWaalsContact O-CB 3.23Å; I943-S947 WeakPolarHBondContact O-CB 3.4Å; I943-S947 PolarHBondContact O-N 3.06Å; L944-S947 PolarHBondContact O-N 3.19Å; A945-S947 PolarHBondContact O-N 3.25Å
948	L	93.8	Very high	91.5	Very high	18 Å²	18	31 Å²	31	9%	0.094	16%	0.162	C	C	.	.	H	α-helix	trans	-94.7	-44.5	167.7	-74	169.5	0	0	0	112.3	Q359 L362 F366 R892 L944 A945 Y946	Q359-L948 HydrophobicContact CG-CD2 4.14Å; Q359-L948 HydrophobicContact CG-CG 4.35Å; Q359-L948 WeakPolarHBondContact O-CD2 3.36Å; L362-L948 HydrophobicContact CB-CD1 4.3Å; L362-L948 HydrophobicContact CB-CD2 3.82Å; L362-L948 HydrophobicContact CD1-CD1 3.95Å; F366-L948 HydrophobicContact CE2-CB 4.19Å; F366-L948 HydrophobicContact CE2-CD2 4.14Å; R892-L948 PolarHBondContact NH1-O 3.44Å; L944-L948 HydrophobicContact CD1-CD1 3.88Å; L944-L948 HydrophobicContact CD1-CG 4.24Å; L944-L948 HydrophobicContact CG-CD1 4.03Å; L944-L948 WeakPolarHBondContact O-CG 3.39Å; L944-L948 PolarHBondContact O-N 2.93Å; A945-L948 PolarHBondContact O-N 3.09Å; Y946-L948 PolarHBondContact O-N 3.39Å
949	L	92.6	Very high	91.4	Very high	36 Å²	36	33.1 Å²	33.1	19%	0.188	17%	0.173	C	C	.	.	H	α-helix	trans	-104.4	-19.2	-163.7	-58	177.1	0	0	0	114.9	F366 A945 Y946 Q951 I1044	F366-L949 HydrophobicContact CZ-CD2 4.22Å; A945-L949 WeakPolarHBondContact O-CB 3.03Å; A945-L949 WeakPolarHBondContact O-CG 3.3Å; A945-L949 PolarHBondContact O-N 3.08Å; Y946-L949 PolarHBondContact O-N 2.96Å; L949-Q951 PolarHBondContact O-N 3.42Å; L949-I1044 HydrophobicContact CD1-CB 3.63Å; L949-I1044 HydrophobicContact CD1-CD1 3.77Å; L949-I1044 HydrophobicContact CD1-CG1 4.23Å; L949-I1044 HydrophobicContact CD1-CG2 3.69Å
950	E	92	Very high	91.4	Very high	3 Å²	3	39.5 Å²	39.5	1%	0.014	20%	0.203	C	C	.	.			trans	-60.8	135.4	-172.4	175.5	64.8	-176.9	0	0	112.3	R892 Y946 H952 R1039 H1040	R892-E950 VanDerWaalsContact CZ-O 3.29Å; R892-E950 PolarHBondContact NE-O 3.16Å; R892-E950 PolarHBondContact NH2-O 3.2Å; Y946-E950 HydrophobicContact CD2-CB 3.68Å; Y946-E950 HydrophobicContact CD2-CG 3.92Å; Y946-E950 HydrophobicContact CE2-CB 3.7Å; Y946-E950 HydrophobicContact CE2-CG 3.41Å; Y946-E950 VanDerWaalsContact CE2-CG 3.41Å; Y946-E950 HydrophobicContact CG-CB 4.29Å; Y946-E950 WeakPolarHBondContact O-CB 3.28Å; Y946-E950 PolarHBondContact O-N 3.47Å; E950-H952 HydrophobicContact CG-CB 4.49Å; E950-R1039 VanDerWaalsContact OE1-CB 3.26Å; E950-R1039 WeakPolarHBondContact OE1-CB 3.31Å; E950-R1039 PolarHBondContact OE1-N 3.23Å; E950-R1039 PolarHBondContact OE2-N 3.46Å; E950-H1040 PolarHBondContact OE2-N 2.87Å
951	Q	89.7	Confident	91.4	Very high	56 Å²	56	43 Å²	43	26%	0.262	22%	0.218	S	C	.	.			trans	-128.3	81.8	172.5	-63	-168.9	37.3	0	0	109	L888 L949 I953 H1040	L888-Q951 HydrophobicContact CD1-CG 4.42Å; L949-Q951 PolarHBondContact O-N 3.42Å; Q951-I953 CarbonylContact C-O 3.54Å; Q951-I953 PolarHBondContact O-N 2.9Å; Q951-I953 VanDerWaalsContact O-N 3.14Å; Q951-H1040 HydrophobicContact CB-CB 4.05Å
952	H	86.6	Confident	91.3	Very high	32 Å²	32	38.6 Å²	38.6	15%	0.148	20%	0.198	C	C	.	.	S	Bend	trans	-64	-18.2	-176.3	71.8	-80.3	0	0	0	114.1	H887 E950 R1039	H887-H952 AromaticContact CD2-CE1 3.51Å; H887-H952 AromaticContact CD2-NE2 3.85Å; H887-H952 AromaticContact NE2-CE1 3.34Å; H887-H952 PolarHBondContact NE2-CE1 2.9Å; H887-H952 VanDerWaalsContact NE2-CE1 3.34Å; H887-H952 AromaticContact NE2-NE2 3.18Å; H887-H952 PolarHBondContact NE2-NE2 3.2Å; H887-H952 VanDerWaalsContact NE2-NE2 3.18Å; E950-H952 HydrophobicContact CG-CB 4.49Å; H952-R1039 WeakPolarHBondContact O-CD 3.42Å; H952-R1039 PolarHBondContact O-NH1 3.31Å
953	I	88.9	Confident	91.1	Very high	46 Å²	46	42.4 Å²	42.4	24%	0.236	22%	0.222	C	C	.	.	S	Bend	trans	-139.7	146.5	167.2	-60.8	170.9	0	0	0	105.5	Q951 V957 L958 L964	Q951-I953 CarbonylContact C-O 3.54Å; Q951-I953 PolarHBondContact O-N 2.9Å; Q951-I953 VanDerWaalsContact O-N 3.14Å; I953-V957 HydrophobicContact CG2-CB 3.98Å; I953-V957 HydrophobicContact CG2-CG1 3.99Å; I953-L958 HydrophobicContact CB-CD2 4.18Å; I953-L958 HydrophobicContact CB-CG 4.31Å; I953-L958 HydrophobicContact CD1-CD2 4.24Å; I953-L958 HydrophobicContact CG2-CD2 3.95Å; I953-L958 HydrophobicContact CG2-CG 3.95Å; I953-L964 HydrophobicContact CD1-CD1 4.3Å
954	C	88.5	Confident	90.8	Very high	56 Å²	56	44.3 Å²	44.3	38%	0.378	23%	0.232	S	C	.	.			trans	-69.3	146.4	176.7	-174.9	0	0	0	0	111.7	E956 V957 L958	C954-E956 VanDerWaalsContact C-N 3.32Å; C954-E956 PolarHBondContact O-N 3.12Å; C954-V957 HydrophobicContact CB-CG2 4.33Å; C954-V957 PolarHBondContact O-N 2.85Å; C954-L958 PolarHBondContact O-N 3.14Å
955	I	89.3	Confident	90.6	Very high	41 Å²	41	43.4 Å²	43.4	21%	0.21	23%	0.226	C	C	.	.	H	α-helix	trans	-54.1	-44.8	178.7	-72.8	171.2	0	0	0	112	A884 L888 V957 L958 L959	A884-I955 HydrophobicContact CB-CG1 4.42Å; A884-I955 HydrophobicContact CB-CG2 3.86Å; L888-I955 HydrophobicContact CD1-CD1 4.25Å; L888-I955 HydrophobicContact CD1-CG1 3.79Å; I955-V957 PolarHBondContact O-N 2.92Å; I955-L958 WeakPolarHBondContact O-CB 3.49Å; I955-L958 PolarHBondContact O-N 3.11Å; I955-L958 VanDerWaalsContact O-N 3.11Å; I955-L959 HydrophobicContact CG2-CD1 4.24Å; I955-L959 WeakPolarHBondContact O-CG 3.34Å; I955-L959 PolarHBondContact O-N 3.19Å
956	E	90	Very high	90.2	Very high	130 Å²	130	47 Å²	47	61%	0.607	24%	0.238	S	C	*	.	H	α-helix	trans	-56.9	-46.9	-179.7	-65.3	163.5	-175.7	0	0	112	C954 L958 L959 E960	C954-E956 VanDerWaalsContact C-N 3.32Å; C954-E956 PolarHBondContact O-N 3.12Å; E956-L958 VanDerWaalsContact C-N 3.28Å; E956-L958 PolarHBondContact O-N 2.84Å; E956-L959 WeakPolarHBondContact O-CB 3.35Å; E956-L959 PolarHBondContact O-N 3.18Å; E956-E960 PolarHBondContact O-N 3.45Å
957	V	90.6	Very high	89.7	Confident	56 Å²	56	52.3 Å²	52.3	34%	0.339	27%	0.267	S	S	.	.	H	α-helix	trans	-66.3	-29.9	179.5	-178.8	0	0	0	0	111.9	I953 C954 I955 L959 H961 L964	I953-V957 HydrophobicContact CG2-CB 3.98Å; I953-V957 HydrophobicContact CG2-CG1 3.99Å; C954-V957 HydrophobicContact CB-CG2 4.33Å; C954-V957 PolarHBondContact O-N 2.85Å; I955-V957 PolarHBondContact O-N 2.92Å; V957-L959 VanDerWaalsContact C-N 3.32Å; V957-H961 WeakPolarHBondContact O-CB 3.41Å; V957-H961 PolarHBondContact O-N 2.94Å; V957-L964 HydrophobicContact CG1-CD1 4.32Å
958	L	90.1	Very high	89.4	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-71.7	-25.3	173.1	-65.8	171.5	0	0	0	112.7	L888 I953 C954 I955 E956 L964	L888-L958 HydrophobicContact CD1-CD1 4.47Å; L888-L958 HydrophobicContact CD2-CD1 4.22Å; L888-L958 HydrophobicContact CG-CD1 4.04Å; I953-L958 HydrophobicContact CB-CD2 4.18Å; I953-L958 HydrophobicContact CB-CG 4.31Å; I953-L958 HydrophobicContact CD1-CD2 4.24Å; I953-L958 HydrophobicContact CG2-CD2 3.95Å; I953-L958 HydrophobicContact CG2-CG 3.95Å; C954-L958 PolarHBondContact O-N 3.14Å; I955-L958 WeakPolarHBondContact O-CB 3.49Å; I955-L958 PolarHBondContact O-N 3.11Å; I955-L958 VanDerWaalsContact O-N 3.11Å; E956-L958 VanDerWaalsContact C-N 3.28Å; E956-L958 PolarHBondContact O-N 2.84Å; L958-L964 HydrophobicContact CD2-CB 4.25Å; L958-L964 HydrophobicContact CD2-CD1 4.02Å
959	L	90.2	Very high	88.9	Confident	45 Å²	45	52.6 Å²	52.6	24%	0.236	27%	0.271	C	S	.	.	H	α-helix	trans	-84.7	-31.8	175.7	-59.7	176.4	0	0	0	112.6	K880 A884 I955 E956 V957	K880-L959 HydrophobicContact CB-CD2 3.98Å; K880-L959 HydrophobicContact CG-CD1 4.35Å; K880-L959 HydrophobicContact CG-CD2 4.14Å; A884-L959 HydrophobicContact CB-CD2 4.07Å; I955-L959 HydrophobicContact CG2-CD1 4.24Å; I955-L959 WeakPolarHBondContact O-CG 3.34Å; I955-L959 PolarHBondContact O-N 3.19Å; E956-L959 WeakPolarHBondContact O-CB 3.35Å; E956-L959 PolarHBondContact O-N 3.18Å; V957-L959 VanDerWaalsContact C-N 3.32Å
960	E	90.4	Very high	88.4	Confident	135 Å²	135	56.8 Å²	56.8	63%	0.631	29%	0.288	S	S	*	.	H	α-helix	trans	-77	-36.6	175.4	-166.2	-170.9	167.2	0	0	112.3	E956	E956-E960 PolarHBondContact O-N 3.45Å
961	H	89.6	Confident	88.1	Confident	85 Å²	85	58 Å²	58	39%	0.394	29%	0.294	S	S	.	.			trans	-118	71.8	-175.5	-64	-6.7	0	0	0	111.6	V957 T963 L964	V957-H961 WeakPolarHBondContact O-CB 3.41Å; V957-H961 PolarHBondContact O-N 2.94Å; H961-T963 PolarHBondContact O-N 3.46Å; H961-L964 HydrophobicContact CB-CD1 3.82Å; H961-L964 HydrophobicContact CB-CG 4.08Å; H961-L964 WeakPolarHBondContact O-CB 3.35Å; H961-L964 WeakPolarHBondContact O-CG 3.4Å; H961-L964 PolarHBondContact O-N 2.88Å
962	S	88.8	Confident	87.9	Confident	19 Å²	19	56.7 Å²	56.7	13%	0.133	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-56.7	-24.7	-177.3	71.5	0	0	0	0	114.3	A683 A687 L964 Y965	A683-S962 VanDerWaalsContact O-CB 3.23Å; A683-S962 WeakPolarHBondContact O-CB 3.29Å; A683-S962 PolarHBondContact O-OG 2.84Å; A687-S962 WeakPolarHBondContact CA-O 3.32Å; A687-S962 WeakPolarHBondContact CB-O 3.3Å; A687-S962 PolarHBondContact N-OG 3.33Å; S962-L964 PolarHBondContact O-N 3.08Å; S962-L964 VanDerWaalsContact O-N 3.15Å; S962-Y965 WeakPolarHBondContact O-CB 3.44Å; S962-Y965 PolarHBondContact O-N 3.01Å
963	T	89.3	Confident	87.9	Confident	81 Å²	81	57.9 Å²	57.9	50%	0.497	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-58.1	-23.7	175.2	53.4	0	0	0	0	114	H961 Y965 R966	H961-T963 PolarHBondContact O-N 3.46Å; T963-Y965 PolarHBondContact O-N 3.3Å; T963-R966 WeakPolarHBondContact O-CB 3.38Å; T963-R966 VanDerWaalsContact O-CG 3.26Å; T963-R966 WeakPolarHBondContact O-CG 3.34Å; T963-R966 PolarHBondContact O-N 3.33Å
964	L	88.6	Confident	87.9	Confident	40 Å²	40	56 Å²	56	21%	0.209	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-61.6	-27.1	177.7	-67.5	171	0	0	0	113.2	I953 V957 L958 H961 S962 R966 D967	I953-L964 HydrophobicContact CD1-CD1 4.3Å; V957-L964 HydrophobicContact CG1-CD1 4.32Å; L958-L964 HydrophobicContact CD2-CB 4.25Å; L958-L964 HydrophobicContact CD2-CD1 4.02Å; H961-L964 HydrophobicContact CB-CD1 3.82Å; H961-L964 HydrophobicContact CB-CG 4.08Å; H961-L964 WeakPolarHBondContact O-CB 3.35Å; H961-L964 WeakPolarHBondContact O-CG 3.4Å; H961-L964 PolarHBondContact O-N 2.88Å; S962-L964 PolarHBondContact O-N 3.08Å; S962-L964 VanDerWaalsContact O-N 3.15Å; L964-R966 PolarHBondContact O-N 3.32Å; L964-D967 PolarHBondContact O-N 3.45Å
965	Y	89.6	Confident	88	Confident	7 Å²	7	59.6 Å²	59.6	3%	0.027	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-60.9	-25.6	174.3	-175.5	-86.9	0	0	0	112.3	L393 G394 Q395 V396 A687 M689 L883 S962 T963 D967 I968 A969	L393-Y965 PolarHBondContact O-OH 2.98Å; G394-Y965 VanDerWaalsContact C-OH 3.32Å; Q395-Y965 PolarHBondContact N-OH 3.27Å; V396-Y965 PolarHBondContact N-OH 3.41Å; V396-Y965 WeakPolarHBondContact O-CE1 3.07Å; V396-Y965 PolarHBondContact O-OH 2.97Å; A687-Y965 HydrophobicContact CB-CD1 4.3Å; A687-Y965 HydrophobicContact CB-CG 4.35Å; A687-Y965 WeakPolarHBondContact O-CD1 3.2Å; M689-Y965 HydrophobicContact CE-CD1 3.84Å; M689-Y965 HydrophobicContact CE-CD2 4.05Å; M689-Y965 HydrophobicContact CE-CE1 3.43Å; M689-Y965 VanDerWaalsContact CE-CE1 3.43Å; M689-Y965 HydrophobicContact CE-CE2 3.65Å; M689-Y965 HydrophobicContact CE-CG 4.14Å; M689-Y965 HydrophobicContact CG-CE1 4.26Å; L883-Y965 HydrophobicContact CD2-CD2 4.24Å; L883-Y965 HydrophobicContact CD2-CG 4.29Å; S962-Y965 WeakPolarHBondContact O-CB 3.44Å; S962-Y965 PolarHBondContact O-N 3.01Å; T963-Y965 PolarHBondContact O-N 3.3Å; Y965-D967 PolarHBondContact O-N 3.31Å; Y965-I968 HydrophobicContact CD2-CD1 4.28Å; Y965-I968 HydrophobicContact CE2-CD1 4.41Å; Y965-I968 WeakPolarHBondContact O-CG1 3.02Å; Y965-I968 PolarHBondContact O-N 3.44Å; Y965-A969 PolarHBondContact O-N 2.92Å
966	R	86.9	Confident	88	Confident	86 Å²	86	64 Å²	64	33%	0.325	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-68.9	-22.6	-178.9	-55.6	179.5	83.1	-154.5	2.3	112.9	A687 R761 T963 L964	A687-R966 WeakPolarHBondContact O-CG 3.5Å; R761-R966 PolarHBondContact O-NH1 2.86Å; R761-R966 VanDerWaalsContact O-NH1 3.13Å; R761-R966 PolarHBondContact O-NH2 2.94Å; T963-R966 WeakPolarHBondContact O-CB 3.38Å; T963-R966 VanDerWaalsContact O-CG 3.26Å; T963-R966 WeakPolarHBondContact O-CG 3.34Å; T963-R966 PolarHBondContact O-N 3.33Å; L964-R966 PolarHBondContact O-N 3.32Å
967	D	84	Confident	88.1	Confident	123 Å²	123	66.8 Å²	66.8	66%	0.658	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-74.4	-27.1	178.9	-72.4	-17.4	0	0	0	112.9	L964 Y965 A972	L964-D967 PolarHBondContact O-N 3.45Å; Y965-D967 PolarHBondContact O-N 3.31Å; D967-A972 VanDerWaalsContact O-CB 3.23Å; D967-A972 WeakPolarHBondContact O-CB 3.22Å
968	I	87.6	Confident	88.1	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.015	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-22.4	179.6	62.2	161.8	0	0	0	113.4	G394 Q395 H887 Y890 V891 Y965 A972 M973	G394-I968 VanDerWaalsContact O-CD1 3.23Å; G394-I968 WeakPolarHBondContact O-CD1 3.44Å; Q395-I968 PolarHBondContact NE2-O 3.06Å; H887-I968 HydrophobicContact CB-CD1 3.96Å; H887-I968 VanDerWaalsContact ND1-CD1 3.33Å; H887-I968 WeakPolarHBondContact ND1-CD1 3.29Å; Y890-I968 HydrophobicContact CD1-CB 3.67Å; Y890-I968 HydrophobicContact CD1-CD1 3.95Å; Y890-I968 HydrophobicContact CD1-CG1 4.38Å; Y890-I968 HydrophobicContact CD1-CG2 4.08Å; Y890-I968 HydrophobicContact CE1-CB 3.81Å; Y890-I968 HydrophobicContact CE1-CG2 4.28Å; Y890-I968 HydrophobicContact CG-CD1 4.39Å; V891-I968 HydrophobicContact CG2-CG2 3.71Å; Y965-I968 HydrophobicContact CD2-CD1 4.28Å; Y965-I968 HydrophobicContact CE2-CD1 4.41Å; Y965-I968 WeakPolarHBondContact O-CG1 3.02Å; Y965-I968 PolarHBondContact O-N 3.44Å; I968-A972 PolarHBondContact O-N 3.41Å; I968-M973 HydrophobicContact CG2-CE 4.36Å
969	A	83.7	Confident	88.2	Confident	21 Å²	21	67 Å²	67	17%	0.174	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	155.9	-177.4	0	0	0	0	0	113.4	Y965 N971	Y965-A969 PolarHBondContact O-N 2.92Å; A969-N971 VanDerWaalsContact C-N 3.27Å; A969-N971 PolarHBondContact O-N 3.24Å
970	K	83.2	Confident	88.3	Confident	125 Å²	125	69.9 Å²	69.9	54%	0.543	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	45	-176.2	-67.4	172.6	-177.2	-177.2	0	111.8	E397 A972 R975	E397-K970 WeakPolarHBondContact OE1-CE 3.22Å; E397-K970 WeakPolarHBondContact OE1-CG 3.34Å; E397-K970 WeakPolarHBondContact OE2-CE 3.2Å; E397-K970 IonicContact OE2-NZ 2.78Å; E397-K970 PolarHBondContact OE2-NZ 2.83Å; E397-K970 VanDerWaalsContact OE2-NZ 3.17Å; K970-A972 VanDerWaalsContact C-N 3.3Å; K970-A972 PolarHBondContact O-N 3.39Å; K970-R975 VanDerWaalsContact CB-NH2 3.28Å; K970-R975 PolarHBondContact O-NE 3.02Å; K970-R975 PolarHBondContact O-NH2 3.11Å
971	N	84.9	Confident	88.4	Confident	27 Å²	27	67 Å²	67	14%	0.144	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	45.1	174.5	-159	4.5	0	0	0	114.1	S282 Y890 A969 M973 L974 R975	S282-N971 PolarHBondContact OG-ND2 2.99Å; Y890-N971 WeakPolarHBondContact CE2-OD1 3.23Å; Y890-N971 WeakPolarHBondContact OH-CA 3.31Å; Y890-N971 PolarHBondContact OH-O 3.25Å; Y890-N971 PolarHBondContact OH-OD1 3.46Å; A969-N971 VanDerWaalsContact C-N 3.27Å; A969-N971 PolarHBondContact O-N 3.24Å; N971-M973 VanDerWaalsContact C-N 3.31Å; N971-M973 PolarHBondContact O-N 2.98Å; N971-L974 PolarHBondContact O-N 3.41Å; N971-L974 WeakPolarHBondContact OD1-CB 3.47Å; N971-R975 WeakPolarHBondContact O-CG 3.45Å; N971-R975 PolarHBondContact O-N 3.42Å
972	A	85.7	Confident	88.7	Confident	29 Å²	29	63.8 Å²	63.8	24%	0.24	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-56	-39.7	-167.9	0	0	0	0	0	113.9	Y890 D967 I968 K970	Y890-A972 PolarHBondContact OH-N 2.98Å; D967-A972 VanDerWaalsContact O-CB 3.23Å; D967-A972 WeakPolarHBondContact O-CB 3.22Å; I968-A972 PolarHBondContact O-N 3.41Å; K970-A972 VanDerWaalsContact C-N 3.3Å; K970-A972 PolarHBondContact O-N 3.39Å
973	M	86.4	Confident	88.9	Confident	58 Å²	58	63.7 Å²	63.7	29%	0.286	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-82.6	-14.9	-176	-65.2	-164.6	-179.8	0	0	114.5	Y890 V891 A894 Q898 I968 N971 L978	Y890-M973 HydrophobicContact CE1-CB 4.09Å; Y890-M973 HydrophobicContact CE1-CG 4.18Å; Y890-M973 PolarHBondContact OH-N 3.46Å; V891-M973 HydrophobicContact CB-CE 4.48Å; V891-M973 HydrophobicContact CB-SD 4.31Å; V891-M973 HydrophobicContact CG1-CE 4.02Å; V891-M973 HydrophobicContact CG1-SD 3.96Å; V891-M973 HydrophobicContact CG2-CE 3.76Å; V891-M973 HydrophobicContact CG2-SD 3.98Å; A894-M973 HydrophobicContact CB-CB 3.72Å; Q898-M973 PolarHBondContact NE2-O 3.47Å; I968-M973 HydrophobicContact CG2-CE 4.36Å; N971-M973 VanDerWaalsContact C-N 3.31Å; N971-M973 PolarHBondContact O-N 2.98Å; M973-L978 HydrophobicContact CB-CD2 4.42Å
974	L	88.8	Confident	89.1	Confident	7 Å²	7	62.5 Å²	62.5	4%	0.037	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-109.7	24.3	173.2	-54	171.2	0	0	0	112.3	V279 F286 A894 V897 Q898 N971	V279-L974 HydrophobicContact CB-CD1 4.17Å; V279-L974 HydrophobicContact CG1-CD1 3.73Å; V279-L974 HydrophobicContact CG2-CD1 3.84Å; F286-L974 HydrophobicContact CE2-CB 4.34Å; F286-L974 HydrophobicContact CE2-CD2 4.06Å; F286-L974 HydrophobicContact CZ-CB 4.24Å; F286-L974 WeakPolarHBondContact CZ-O 3.39Å; A894-L974 HydrophobicContact CB-CD1 4.39Å; A894-L974 HydrophobicContact CB-CD2 4.05Å; A894-L974 HydrophobicContact CB-CG 3.99Å; V897-L974 HydrophobicContact CB-CD2 4.28Å; V897-L974 HydrophobicContact CG1-CD2 4.16Å; Q898-L974 HydrophobicContact CG-CD2 4.12Å; N971-L974 PolarHBondContact O-N 3.41Å; N971-L974 WeakPolarHBondContact OD1-CB 3.47Å
975	R	90.1	Very high	89.4	Confident	131 Å²	131	61.3 Å²	61.3	49%	0.494	29%	0.293	S	S	.	.	S	Bend	trans	-74	147.6	167.5	-63.6	-170.2	-175.5	168.9	10.9	111.2	K970 N971 K977 L978 F979	K970-R975 VanDerWaalsContact CB-NH2 3.28Å; K970-R975 PolarHBondContact O-NE 3.02Å; K970-R975 PolarHBondContact O-NH2 3.11Å; N971-R975 WeakPolarHBondContact O-CG 3.45Å; N971-R975 PolarHBondContact O-N 3.42Å; R975-K977 PolarHBondContact O-N 3.28Å; R975-L978 PolarHBondContact O-N 2.78Å; R975-F979 PolarHBondContact O-N 3.22Å
976	W	90.1	Very high	89.7	Confident	133 Å²	133	61 Å²	61	50%	0.504	29%	0.292	S	S	.	.	H	α-helix	trans	-47	-37.6	178.8	-68.5	114	0	0	0	114.6	A285 F286 V289 L978 F979 L980	A285-W976 HydrophobicContact CB-CH2 4.41Å; A285-W976 HydrophobicContact CB-CZ2 4.39Å; F286-W976 HydrophobicContact CD1-CE3 4.3Å; F286-W976 AromaticContact CD1-CH2 3.95Å; F286-W976 HydrophobicContact CD1-CH2 3.95Å; F286-W976 AromaticContact CD1-CZ3 3.71Å; F286-W976 HydrophobicContact CD1-CZ3 3.71Å; F286-W976 HydrophobicContact CE1-CD2 4.47Å; F286-W976 AromaticContact CE1-CE3 4Å; F286-W976 HydrophobicContact CE1-CE3 4Å; F286-W976 HydrophobicContact CE1-CH2 4.25Å; F286-W976 AromaticContact CE1-CZ3 3.87Å; F286-W976 HydrophobicContact CE1-CZ3 3.87Å; V289-W976 HydrophobicContact CG2-CH2 3.82Å; V289-W976 HydrophobicContact CG2-CZ3 3.9Å; W976-L978 PolarHBondContact O-N 3.21Å; W976-F979 AromaticContact CE3-CD1 3.75Å; W976-F979 HydrophobicContact CE3-CD1 3.75Å; W976-F979 HydrophobicContact CE3-CE1 4.19Å; W976-F979 AromaticContact CZ3-CD1 3.86Å; W976-F979 HydrophobicContact CZ3-CD1 3.86Å; W976-F979 AromaticContact CZ3-CE1 3.84Å; W976-F979 HydrophobicContact CZ3-CE1 3.84Å; W976-F979 PolarHBondContact O-N 2.98Å; W976-L980 WeakPolarHBondContact O-CB 3.25Å; W976-L980 VanDerWaalsContact O-CG 3.24Å; W976-L980 WeakPolarHBondContact O-CG 3.19Å; W976-L980 PolarHBondContact O-N 2.88Å
977	K	90.9	Very high	90.1	Very high	188 Å²	188	60.4 Å²	60.4	82%	0.817	29%	0.294	S	S	*	.	H	α-helix	trans	-59.3	-41.5	178.4	-173.9	177	-179.7	179	0	113.2	R975 Y981	R975-K977 PolarHBondContact O-N 3.28Å; K977-Y981 PolarHBondContact O-N 2.68Å
978	L	90.6	Very high	90.6	Very high	63 Å²	63	58.2 Å²	58.2	33%	0.33	28%	0.279	S	S	.	.	H	α-helix	trans	-80.2	-36.4	-179.9	-170.9	54	0	0	0	111.2	M973 R975 W976 L980 Y981 W982	M973-L978 HydrophobicContact CB-CD2 4.42Å; R975-L978 PolarHBondContact O-N 2.78Å; W976-L978 PolarHBondContact O-N 3.21Å; L978-L980 PolarHBondContact O-N 3.08Å; L978-Y981 HydrophobicContact CD1-CD1 4.19Å; L978-Y981 HydrophobicContact CD1-CG 4.5Å; L978-Y981 WeakPolarHBondContact O-CB 3.38Å; L978-Y981 PolarHBondContact O-N 3.27Å; L978-W982 PolarHBondContact O-N 2.97Å
979	F	92.3	Very high	91	Very high	2 Å²	2	58 Å²	58	1%	0.009	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-44	172.3	173.3	-99	0	0	0	113	F286 V289 Y290 F901 R975 W976 Y981 W982 T983	F286-F979 HydrophobicContact CB-CD2 4.24Å; F286-F979 HydrophobicContact CB-CE2 3.54Å; F286-F979 HydrophobicContact CB-CZ 3.9Å; F286-F979 HydrophobicContact CD1-CD1 4.14Å; F286-F979 AromaticContact CD1-CD2 3.64Å; F286-F979 HydrophobicContact CD1-CD2 3.64Å; F286-F979 HydrophobicContact CD1-CE1 4.19Å; F286-F979 AromaticContact CD1-CE2 3.69Å; F286-F979 HydrophobicContact CD1-CE2 3.69Å; F286-F979 AromaticContact CD1-CG 3.86Å; F286-F979 HydrophobicContact CD1-CG 3.86Å; F286-F979 AromaticContact CD1-CZ 3.95Å; F286-F979 HydrophobicContact CD1-CZ 3.95Å; F286-F979 AromaticContact CD2-CD2 3.47Å; F286-F979 HydrophobicContact CD2-CD2 3.47Å; F286-F979 VanDerWaalsContact CD2-CD2 3.47Å; F286-F979 AromaticContact CD2-CE2 3.64Å; F286-F979 HydrophobicContact CD2-CE2 3.64Å; F286-F979 HydrophobicContact CD2-CG 4.35Å; F286-F979 HydrophobicContact CE1-CB 3.85Å; F286-F979 HydrophobicContact CE1-CD1 4.12Å; F286-F979 AromaticContact CE1-CD2 3.74Å; F286-F979 HydrophobicContact CE1-CD2 3.74Å; F286-F979 HydrophobicContact CE1-CE2 4.27Å; F286-F979 AromaticContact CE1-CG 3.63Å; F286-F979 HydrophobicContact CE1-CG 3.63Å; F286-F979 HydrophobicContact CE2-CB 4.23Å; F286-F979 AromaticContact CE2-CD2 3.56Å; F286-F979 HydrophobicContact CE2-CD2 3.56Å; F286-F979 HydrophobicContact CE2-CE2 4.21Å; F286-F979 HydrophobicContact CE2-CG 4.14Å; F286-F979 AromaticContact CG-CD2 3.52Å; F286-F979 HydrophobicContact CG-CD2 3.52Å; F286-F979 AromaticContact CG-CE2 3.34Å; F286-F979 HydrophobicContact CG-CE2 3.34Å; F286-F979 HydrophobicContact CG-CG 4.22Å; F286-F979 AromaticContact CG-CZ 3.93Å; F286-F979 HydrophobicContact CG-CZ 3.93Å; F286-F979 HydrophobicContact CZ-CB 3.66Å; F286-F979 AromaticContact CZ-CD2 3.69Å; F286-F979 HydrophobicContact CZ-CD2 3.69Å; F286-F979 AromaticContact CZ-CG 3.78Å; F286-F979 HydrophobicContact CZ-CG 3.78Å; V289-F979 HydrophobicContact CG1-CE1 4.29Å; Y290-F979 HydrophobicContact CD2-CE2 4.21Å; Y290-F979 AromaticContact CD2-CZ 3.87Å; Y290-F979 HydrophobicContact CD2-CZ 3.87Å; Y290-F979 AromaticContact CE2-CE2 3.65Å; Y290-F979 HydrophobicContact CE2-CE2 3.65Å; Y290-F979 AromaticContact CE2-CZ 3.48Å; Y290-F979 HydrophobicContact CE2-CZ 3.48Å; Y290-F979 VanDerWaalsContact CE2-CZ 3.48Å; F901-F979 HydrophobicContact CD2-CE2 4.38Å; R975-F979 PolarHBondContact O-N 3.22Å; W976-F979 AromaticContact CE3-CD1 3.75Å; W976-F979 HydrophobicContact CE3-CD1 3.75Å; W976-F979 HydrophobicContact CE3-CE1 4.19Å; W976-F979 AromaticContact CZ3-CD1 3.86Å; W976-F979 HydrophobicContact CZ3-CD1 3.86Å; W976-F979 AromaticContact CZ3-CE1 3.84Å; W976-F979 HydrophobicContact CZ3-CE1 3.84Å; W976-F979 PolarHBondContact O-N 2.98Å; F979-Y981 VanDerWaalsContact C-N 3.33Å; F979-Y981 PolarHBondContact O-N 2.63Å; F979-W982 PolarHBondContact O-N 3.32Å; F979-T983 WeakPolarHBondContact O-CB 3.47Å; F979-T983 PolarHBondContact O-N 2.85Å; F979-T983 PolarHBondContact O-OG1 3.3Å
980	L	92.9	Very high	91.6	Very high	104 Å²	104	57 Å²	57	55%	0.545	27%	0.27	S	S	.	.	H	α-helix	trans	-66.5	-34	175.7	-71.2	169.8	0	0	0	112	W976 L978 T983 A984	W976-L980 WeakPolarHBondContact O-CB 3.25Å; W976-L980 VanDerWaalsContact O-CG 3.24Å; W976-L980 WeakPolarHBondContact O-CG 3.19Å; W976-L980 PolarHBondContact O-N 2.88Å; L978-L980 PolarHBondContact O-N 3.08Å; L980-T983 PolarHBondContact O-N 2.54Å; L980-A984 WeakPolarHBondContact O-CB 3.47Å; L980-A984 PolarHBondContact O-N 2.73Å
981	Y	93.3	Very high	92.2	Very high	74 Å²	74	54.2 Å²	54.2	29%	0.29	26%	0.26	S	S	.	.	H	α-helix	trans	-61.2	-52.3	172	174.6	-87.5	0	0	0	111.8	K977 L978 F979 T983 A984 L985 E1104 L1107	K977-Y981 PolarHBondContact O-N 2.68Å; L978-Y981 HydrophobicContact CD1-CD1 4.19Å; L978-Y981 HydrophobicContact CD1-CG 4.5Å; L978-Y981 WeakPolarHBondContact O-CB 3.38Å; L978-Y981 PolarHBondContact O-N 3.27Å; F979-Y981 VanDerWaalsContact C-N 3.33Å; F979-Y981 PolarHBondContact O-N 2.63Å; Y981-T983 VanDerWaalsContact C-N 3.26Å; Y981-T983 PolarHBondContact O-N 3.44Å; Y981-A984 PolarHBondContact O-N 2.89Å; Y981-L985 WeakPolarHBondContact O-CB 3.38Å; Y981-L985 PolarHBondContact O-N 2.85Å; Y981-E1104 PolarHBondContact OH-OE1 2.95Å; Y981-L1107 HydrophobicContact CE2-CD1 4.21Å; Y981-L1107 VanDerWaalsContact OH-CD1 3.29Å; Y981-L1107 WeakPolarHBondContact OH-CD1 3.02Å
982	W	94.2	Very high	92.7	Very high	19 Å²	19	53.8 Å²	53.8	7%	0.072	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-34.9	177.3	-78.6	106.2	0	0	0	112.7	H895 Q898 Y902 L978 F979 L985 G986 D1037	H895-W982 AromaticContact CD2-CZ2 3.98Å; H895-W982 AromaticContact NE2-CH2 3.75Å; H895-W982 AromaticContact NE2-CZ2 3.77Å; Q898-W982 HydrophobicContact CB-CD2 4.16Å; Q898-W982 HydrophobicContact CB-CG 3.94Å; Y902-W982 HydrophobicContact CD1-CE3 4.15Å; Y902-W982 AromaticContact CD1-CZ3 3.96Å; Y902-W982 HydrophobicContact CD1-CZ3 3.96Å; Y902-W982 HydrophobicContact CD2-CE3 4Å; Y902-W982 HydrophobicContact CD2-CZ3 4.41Å; Y902-W982 HydrophobicContact CE1-CZ3 4.4Å; Y902-W982 AromaticContact CG-CE3 3.69Å; Y902-W982 HydrophobicContact CG-CE3 3.69Å; Y902-W982 AromaticContact CG-CZ3 3.99Å; Y902-W982 HydrophobicContact CG-CZ3 3.99Å; L978-W982 PolarHBondContact O-N 2.97Å; F979-W982 PolarHBondContact O-N 3.32Å; W982-L985 HydrophobicContact CE3-CD2 4.15Å; W982-L985 HydrophobicContact CZ3-CD2 4.3Å; W982-G986 PolarHBondContact O-N 3.1Å; W982-D1037 WeakPolarHBondContact CH2-OD2 3.4Å
983	T	93.8	Very high	93.2	Very high	17 Å²	17	52.4 Å²	52.4	10%	0.104	25%	0.247	C	C	.	.	H	α-helix	trans	-67	-44.6	174.7	-57.9	0	0	0	0	111.4	Y290 L905 F979 L980 Y981 G986 I987	Y290-T983 PolarHBondContact OH-OG1 2.87Å; L905-T983 HydrophobicContact CD2-CG2 3.7Å; L905-T983 WeakPolarHBondContact CD2-O 3.49Å; F979-T983 WeakPolarHBondContact O-CB 3.47Å; F979-T983 PolarHBondContact O-N 2.85Å; F979-T983 PolarHBondContact O-OG1 3.3Å; L980-T983 PolarHBondContact O-N 2.54Å; Y981-T983 VanDerWaalsContact C-N 3.26Å; Y981-T983 PolarHBondContact O-N 3.44Å; T983-G986 PolarHBondContact O-N 2.79Å; T983-I987 HydrophobicContact CG2-CD1 4.43Å; T983-I987 WeakPolarHBondContact O-CG1 3.31Å; T983-I987 PolarHBondContact O-N 2.97Å
984	A	94.5	Very high	93.6	Very high	56 Å²	56	49.7 Å²	49.7	46%	0.463	23%	0.234	S	C	.	.	H	α-helix	trans	-66.2	-40.4	176.5	0	0	0	0	0	112.5	L980 Y981 G986 I987 F988	L980-A984 WeakPolarHBondContact O-CB 3.47Å; L980-A984 PolarHBondContact O-N 2.73Å; Y981-A984 PolarHBondContact O-N 2.89Å; A984-G986 VanDerWaalsContact C-N 3.33Å; A984-G986 PolarHBondContact O-N 3.3Å; A984-I987 PolarHBondContact O-N 3.49Å; A984-F988 PolarHBondContact O-N 3.36Å
985	L	94.4	Very high	93.9	Very high	15 Å²	15	52.7 Å²	52.7	8%	0.079	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-43.4	172.7	-175.3	70.7	0	0	0	111.3	Y902 Y981 W982 I987 F988 H989 E1104	Y902-L985 HydrophobicContact CD2-CD2 4.24Å; Y902-L985 HydrophobicContact CD2-CG 4.41Å; Y902-L985 HydrophobicContact CE2-CD2 3.87Å; Y902-L985 HydrophobicContact CE2-CG 3.96Å; Y981-L985 WeakPolarHBondContact O-CB 3.38Å; Y981-L985 PolarHBondContact O-N 2.85Å; W982-L985 HydrophobicContact CE3-CD2 4.15Å; W982-L985 HydrophobicContact CZ3-CD2 4.3Å; L985-I987 VanDerWaalsContact C-N 3.3Å; L985-I987 PolarHBondContact O-N 3.03Å; L985-F988 PolarHBondContact O-N 2.93Å; L985-H989 PolarHBondContact O-N 2.98Å; L985-E1104 HydrophobicContact CD1-CG 3.96Å; L985-E1104 HydrophobicContact CD2-CG 4.17Å; L985-E1104 WeakPolarHBondContact CD2-OE1 3.37Å
986	G	95	Very high	94	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-34.5	176.1	0	0	0	0	0	113.4	C906 W982 T983 A984 G990	C906-G986 VanDerWaalsContact SG-CA 3.59Å; W982-G986 PolarHBondContact O-N 3.1Å; T983-G986 PolarHBondContact O-N 2.79Å; A984-G986 VanDerWaalsContact C-N 3.33Å; A984-G986 PolarHBondContact O-N 3.3Å; G986-G990 PolarHBondContact O-N 2.95Å; G986-G990 VanDerWaalsContact O-N 3.09Å
987	I	95.2	Very high	94.1	Very high	73 Å²	73	40.8 Å²	40.8	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-67.5	-48.5	172	-69.3	164.1	0	0	0	110.8	L905 L909 T983 A984 L985 H989 G990 L991	L905-I987 HydrophobicContact CD2-CG1 4.11Å; L909-I987 HydrophobicContact CD2-CB 4.2Å; L909-I987 HydrophobicContact CD2-CG1 4.31Å; L909-I987 HydrophobicContact CD2-CG2 4.09Å; L909-I987 WeakPolarHBondContact CD2-O 3.47Å; T983-I987 HydrophobicContact CG2-CD1 4.43Å; T983-I987 WeakPolarHBondContact O-CG1 3.31Å; T983-I987 PolarHBondContact O-N 2.97Å; A984-I987 PolarHBondContact O-N 3.49Å; L985-I987 VanDerWaalsContact C-N 3.3Å; L985-I987 PolarHBondContact O-N 3.03Å; I987-H989 PolarHBondContact O-N 3.11Å; I987-G990 PolarHBondContact O-N 3.34Å; I987-L991 HydrophobicContact CG2-CD1 3.78Å; I987-L991 HydrophobicContact CG2-CG 4.38Å; I987-L991 VanDerWaalsContact O-CG 3.28Å; I987-L991 WeakPolarHBondContact O-CG 3.38Å; I987-L991 PolarHBondContact O-N 3.44Å
988	F	95.8	Very high	94.1	Very high	77 Å²	77	36.2 Å²	36.2	34%	0.338	18%	0.184	S	C	.	.	H	α-helix	trans	-57.7	-50.2	179	170.6	-106.3	0	0	0	111.9	A984 L985 L991 V992 P1103	A984-F988 PolarHBondContact O-N 3.36Å; L985-F988 PolarHBondContact O-N 2.93Å; F988-L991 WeakPolarHBondContact O-CB 3.35Å; F988-L991 PolarHBondContact O-N 3.4Å; F988-V992 HydrophobicContact CD2-CG2 4.22Å; F988-V992 HydrophobicContact CE1-CG2 4.18Å; F988-V992 HydrophobicContact CE2-CG2 3.73Å; F988-V992 HydrophobicContact CZ-CG2 3.7Å; F988-V992 WeakPolarHBondContact O-CG2 3.37Å; F988-V992 PolarHBondContact O-N 3.03Å; F988-P1103 HydrophobicContact CE1-CG 3.73Å; F988-P1103 HydrophobicContact CZ-CG 3.98Å
989	H	95.9	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-45.9	177.2	-69	170.5	0	0	0	112.3	Y902 L985 I987 L991 V992 F993 S1100	Y902-H989 AromaticContact CE2-ND1 3.47Å; Y902-H989 WeakPolarHBondContact CE2-ND1 3.08Å; Y902-H989 AromaticContact CZ-ND1 3.6Å; Y902-H989 PolarHBondContact OH-CE1 3.5Å; Y902-H989 PolarHBondContact OH-ND1 2.97Å; L985-H989 PolarHBondContact O-N 2.98Å; I987-H989 PolarHBondContact O-N 3.11Å; H989-L991 VanDerWaalsContact C-N 3.27Å; H989-L991 PolarHBondContact O-N 3.35Å; H989-V992 PolarHBondContact O-N 2.77Å; H989-V992 VanDerWaalsContact O-N 3.13Å; H989-F993 HydrophobicContact CB-CE1 4.26Å; H989-F993 HydrophobicContact CB-CE2 3.91Å; H989-F993 HydrophobicContact CB-CZ 3.7Å; H989-F993 WeakPolarHBondContact O-CD1 3.24Å; H989-F993 VanDerWaalsContact O-CD2 3.31Å; H989-F993 WeakPolarHBondContact O-CD2 3.33Å; H989-F993 WeakPolarHBondContact O-CG 3.36Å; H989-F993 PolarHBondContact O-N 3.48Å; H989-S1100 PolarHBondContact NE2-O 3.32Å
990	G	95.4	Very high	93.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.4	-31.1	177.8	0	0	0	0	0	114	G986 I987 F994	G986-G990 PolarHBondContact O-N 2.95Å; G986-G990 VanDerWaalsContact O-N 3.09Å; I987-G990 PolarHBondContact O-N 3.34Å; G990-F994 PolarHBondContact O-N 3.38Å
991	L	95.9	Very high	93.5	Very high	66 Å²	66	37.8 Å²	37.8	35%	0.346	19%	0.185	S	C	.	.	H	α-helix	trans	-68.6	-47.8	170.5	-71.2	165.1	0	0	0	111.4	L909 L913 I987 F988 H989 F993 F994 F995	L909-L991 HydrophobicContact CD2-CG 4.38Å; L913-L991 HydrophobicContact CD1-CD2 3.98Å; L913-L991 HydrophobicContact CD2-CD2 4.38Å; I987-L991 HydrophobicContact CG2-CD1 3.78Å; I987-L991 HydrophobicContact CG2-CG 4.38Å; I987-L991 VanDerWaalsContact O-CG 3.28Å; I987-L991 WeakPolarHBondContact O-CG 3.38Å; I987-L991 PolarHBondContact O-N 3.44Å; F988-L991 WeakPolarHBondContact O-CB 3.35Å; F988-L991 PolarHBondContact O-N 3.4Å; H989-L991 VanDerWaalsContact C-N 3.27Å; H989-L991 PolarHBondContact O-N 3.35Å; L991-F993 PolarHBondContact O-N 2.86Å; L991-F994 PolarHBondContact O-N 3.24Å; L991-F995 HydrophobicContact CB-CD2 4.48Å; L991-F995 HydrophobicContact CD2-CD2 4.09Å; L991-F995 HydrophobicContact CD2-CE2 3.73Å; L991-F995 WeakPolarHBondContact O-CB 3.32Å; L991-F995 WeakPolarHBondContact O-CD2 3.36Å; L991-F995 PolarHBondContact O-N 2.89Å
992	V	95.9	Very high	93	Very high	18 Å²	18	38.1 Å²	38.1	11%	0.109	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-45.2	179.1	172.5	0	0	0	0	111.4	F988 H989 F994 G996 L1096 L1099 S1100	F988-V992 HydrophobicContact CD2-CG2 4.22Å; F988-V992 HydrophobicContact CE1-CG2 4.18Å; F988-V992 HydrophobicContact CE2-CG2 3.73Å; F988-V992 HydrophobicContact CZ-CG2 3.7Å; F988-V992 WeakPolarHBondContact O-CG2 3.37Å; F988-V992 PolarHBondContact O-N 3.03Å; H989-V992 PolarHBondContact O-N 2.77Å; H989-V992 VanDerWaalsContact O-N 3.13Å; V992-F994 PolarHBondContact O-N 3.21Å; V992-G996 WeakPolarHBondContact O-CA 3.46Å; V992-G996 PolarHBondContact O-N 3.49Å; V992-L1096 HydrophobicContact CG1-CD2 4.1Å; V992-L1099 HydrophobicContact CG1-CD2 3.7Å; V992-L1099 HydrophobicContact CG2-CD2 3.98Å; V992-S1100 VanDerWaalsContact CG1-OG 3.3Å; V992-S1100 WeakPolarHBondContact CG1-OG 3.24Å
993	F	95.4	Very high	92.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-44.8	178.3	-56.7	-24	0	0	0	111.9	C906 P910 H989 L991 V997 V1022 V1025 L1026 T1029 S1100	C906-F993 HydrophobicContact CB-CE2 4.16Å; P910-F993 HydrophobicContact CG-CB 4.25Å; H989-F993 HydrophobicContact CB-CE1 4.26Å; H989-F993 HydrophobicContact CB-CE2 3.91Å; H989-F993 HydrophobicContact CB-CZ 3.7Å; H989-F993 WeakPolarHBondContact O-CD1 3.24Å; H989-F993 VanDerWaalsContact O-CD2 3.31Å; H989-F993 WeakPolarHBondContact O-CD2 3.33Å; H989-F993 WeakPolarHBondContact O-CG 3.36Å; H989-F993 PolarHBondContact O-N 3.48Å; L991-F993 PolarHBondContact O-N 2.86Å; F993-V997 WeakPolarHBondContact O-CG2 3.44Å; F993-V1022 HydrophobicContact CB-CG1 4.26Å; F993-V1025 HydrophobicContact CD1-CB 4.47Å; F993-V1025 HydrophobicContact CD1-CG1 3.49Å; F993-V1025 VanDerWaalsContact CD1-CG1 3.49Å; F993-V1025 HydrophobicContact CE1-CG1 3.83Å; F993-V1025 HydrophobicContact CG-CG1 4.34Å; F993-L1026 HydrophobicContact CD2-CB 4.23Å; F993-L1026 HydrophobicContact CD2-CD1 4.02Å; F993-L1026 HydrophobicContact CE2-CB 4.22Å; F993-L1026 HydrophobicContact CE2-CD1 3.57Å; F993-T1029 HydrophobicContact CE1-CG2 3.78Å; F993-T1029 HydrophobicContact CZ-CG2 3.66Å; F993-S1100 WeakPolarHBondContact CE1-OG 3.35Å
994	F	95.6	Very high	91.3	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	25%	0.25	C	C	.	.	H	α-helix	trans	-74.1	-55.2	-178	-174.1	-92.5	0	0	0	112.2	P910 L913 Y914 F917 G990 L991 V992 G996 V997 R998 Y1018	P910-F994 HydrophobicContact CB-CB 4.06Å; P910-F994 HydrophobicContact CB-CD2 4.03Å; P910-F994 HydrophobicContact CG-CB 4.43Å; P910-F994 WeakPolarHBondContact O-CD2 3.44Å; L913-F994 HydrophobicContact CB-CB 4.42Å; L913-F994 HydrophobicContact CB-CD1 3.78Å; L913-F994 HydrophobicContact CB-CD2 4.01Å; L913-F994 HydrophobicContact CB-CE1 4.05Å; L913-F994 HydrophobicContact CB-CE2 4.25Å; L913-F994 HydrophobicContact CB-CG 3.77Å; L913-F994 HydrophobicContact CB-CZ 4.28Å; L913-F994 HydrophobicContact CD1-CB 3.71Å; L913-F994 HydrophobicContact CD1-CD1 4.11Å; L913-F994 HydrophobicContact CD1-CG 3.95Å; Y914-F994 HydrophobicContact CD2-CE2 4.02Å; Y914-F994 HydrophobicContact CD2-CZ 4.41Å; Y914-F994 HydrophobicContact CG-CE2 4.44Å; F917-F994 AromaticContact CD2-CE1 3.82Å; F917-F994 HydrophobicContact CD2-CE1 3.82Å; F917-F994 AromaticContact CD2-CZ 3.61Å; F917-F994 HydrophobicContact CD2-CZ 3.61Å; F917-F994 AromaticContact CE2-CE1 3.45Å; F917-F994 HydrophobicContact CE2-CE1 3.45Å; F917-F994 VanDerWaalsContact CE2-CE1 3.45Å; F917-F994 AromaticContact CE2-CZ 3.77Å; F917-F994 HydrophobicContact CE2-CZ 3.77Å; F917-F994 HydrophobicContact CZ-CE1 4.24Å; G990-F994 PolarHBondContact O-N 3.38Å; L991-F994 PolarHBondContact O-N 3.24Å; V992-F994 PolarHBondContact O-N 3.21Å; F994-G996 PolarHBondContact O-N 3.39Å; F994-V997 PolarHBondContact O-N 3.09Å; F994-R998 WeakPolarHBondContact O-CB 3.49Å; F994-R998 PolarHBondContact O-N 2.98Å; F994-Y1018 HydrophobicContact CD2-CE1 4.45Å; F994-Y1018 AromaticContact CE2-CE1 3.97Å; F994-Y1018 HydrophobicContact CE2-CE1 3.97Å; F994-Y1018 WeakPolarHBondContact CE2-OH 3.29Å; F994-Y1018 WeakPolarHBondContact CZ-OH 3.45Å; F994-Y1018 PolarHBondContact O-OH 3.04Å
995	F	95	Very high	90.5	Very high	69 Å²	69	45.8 Å²	45.8	30%	0.303	24%	0.244	S	C	.	.	H	α-helix	trans	-70.8	-33	-175	-74.2	-70.4	0	0	0	112.5	L913 F917 L991 R998 F999	L913-F995 HydrophobicContact CD1-CE2 4.23Å; L913-F995 HydrophobicContact CD2-CE2 4.3Å; F917-F995 HydrophobicContact CZ-CE1 4.36Å; L991-F995 HydrophobicContact CB-CD2 4.48Å; L991-F995 HydrophobicContact CD2-CD2 4.09Å; L991-F995 HydrophobicContact CD2-CE2 3.73Å; L991-F995 WeakPolarHBondContact O-CB 3.32Å; L991-F995 WeakPolarHBondContact O-CD2 3.36Å; L991-F995 PolarHBondContact O-N 2.89Å; F995-R998 PolarHBondContact O-N 3.35Å; F995-F999 HydrophobicContact CB-CE2 4.1Å; F995-F999 WeakPolarHBondContact O-CD2 3.31Å; F995-F999 WeakPolarHBondContact O-CG 3.36Å; F995-F999 PolarHBondContact O-N 3.05Å
996	G	92.4	Very high	89.8	Confident	15 Å²	15	45.9 Å²	45.9	16%	0.155	25%	0.245	C	C	.	.	H	α-helix	trans	-58	-49	174.4	0	0	0	0	0	112.9	V992 F994 F999 L1000	V992-G996 WeakPolarHBondContact O-CA 3.46Å; V992-G996 PolarHBondContact O-N 3.49Å; F994-G996 PolarHBondContact O-N 3.39Å; G996-F999 PolarHBondContact O-N 3.38Å; G996-L1000 PolarHBondContact O-N 3.46Å
997	V	92.1	Very high	89.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-71.6	-32.3	175.7	-173.1	0	0	0	0	111	F993 F994 F999 L1000 F1001 Y1018 I1021 V1022 L1096	F993-V997 WeakPolarHBondContact O-CG2 3.44Å; F994-V997 PolarHBondContact O-N 3.09Å; V997-F999 VanDerWaalsContact C-N 3.33Å; V997-F999 PolarHBondContact O-N 3.17Å; V997-L1000 WeakPolarHBondContact O-CB 3.28Å; V997-L1000 PolarHBondContact O-N 2.92Å; V997-F1001 HydrophobicContact CG1-CD2 3.88Å; V997-F1001 HydrophobicContact CG1-CE2 3.9Å; V997-F1001 WeakPolarHBondContact O-CD2 3.34Å; V997-F1001 PolarHBondContact O-N 2.78Å; V997-Y1018 HydrophobicContact CB-CE2 4.1Å; V997-Y1018 HydrophobicContact CG1-CD2 3.66Å; V997-Y1018 HydrophobicContact CG1-CE2 3.66Å; V997-Y1018 HydrophobicContact CG1-CG 4.39Å; V997-I1021 HydrophobicContact CB-CG2 4.49Å; V997-I1021 HydrophobicContact CG1-CB 4.09Å; V997-I1021 HydrophobicContact CG1-CG2 3.88Å; V997-I1021 HydrophobicContact CG2-CB 4.48Å; V997-I1021 HydrophobicContact CG2-CG2 3.68Å; V997-V1022 HydrophobicContact CB-CG2 3.81Å; V997-V1022 HydrophobicContact CG1-CG2 4.09Å; V997-V1022 HydrophobicContact CG2-CG2 3.76Å; V997-L1096 HydrophobicContact CG2-CD1 3.84Å
998	R	90.9	Very high	88.1	Confident	92 Å²	92	49.8 Å²	49.8	35%	0.347	27%	0.266	S	S	.	.	H	α-helix	trans	-61	-38.9	173.2	-175.7	60.1	-165.4	96.6	-12.7	112.8	F994 F995 F1001 S1002	F994-R998 WeakPolarHBondContact O-CB 3.49Å; F994-R998 PolarHBondContact O-N 2.98Å; F995-R998 PolarHBondContact O-N 3.35Å; R998-F1001 PolarHBondContact NH1-O 3.07Å; R998-F1001 CarbonylContact O-C 3.51Å; R998-F1001 PolarHBondContact O-N 3.34Å; R998-S1002 PolarHBondContact O-N 3.44Å
999	F	90.3	Very high	87.4	Confident	143 Å²	143	50.7 Å²	50.7	63%	0.627	27%	0.274	S	S	*	.	H	α-helix	trans	-69	-36	175.9	-66.6	-53.4	0	0	0	112.5	F995 G996 V997 S1002	F995-F999 HydrophobicContact CB-CE2 4.1Å; F995-F999 WeakPolarHBondContact O-CD2 3.31Å; F995-F999 WeakPolarHBondContact O-CG 3.36Å; F995-F999 PolarHBondContact O-N 3.05Å; G996-F999 PolarHBondContact O-N 3.38Å; V997-F999 VanDerWaalsContact C-N 3.33Å; V997-F999 PolarHBondContact O-N 3.17Å; F999-S1002 WeakPolarHBondContact O-CB 3.05Å; F999-S1002 PolarHBondContact O-N 3.19Å; F999-S1002 PolarHBondContact O-OG 2.96Å
1000	L	86.1	Confident	86.6	Confident	17 Å²	17	53 Å²	53	9%	0.089	30%	0.298	C	S	.	.	H	α-helix	trans	-59.9	-46.3	172.1	179.4	61.1	0	0	0	111.3	G996 V997 S1002 N1003 L1006 V1092	G996-L1000 PolarHBondContact O-N 3.46Å; V997-L1000 WeakPolarHBondContact O-CB 3.28Å; V997-L1000 PolarHBondContact O-N 2.92Å; L1000-S1002 PolarHBondContact O-N 3.34Å; L1000-S1002 VanDerWaalsContact O-N 3.1Å; L1000-N1003 PolarHBondContact O-N 3.21Å; L1000-N1003 VanDerWaalsContact O-N 3.14Å; L1000-N1003 PolarHBondContact O-ND2 3.15Å; L1000-L1006 HydrophobicContact CD1-CD1 4.41Å; L1000-L1006 HydrophobicContact CD1-CD2 3.46Å; L1000-L1006 VanDerWaalsContact CD1-CD2 3.46Å; L1000-L1006 HydrophobicContact CD2-CD1 4.32Å; L1000-L1006 HydrophobicContact CG-CD1 3.88Å; L1000-L1006 HydrophobicContact CG-CD2 3.87Å; L1000-V1092 HydrophobicContact CB-CG1 4.44Å; L1000-V1092 HydrophobicContact CB-CG2 4.41Å; L1000-V1092 HydrophobicContact CD1-CG2 3.89Å; L1000-V1092 HydrophobicContact CD2-CB 3.97Å; L1000-V1092 HydrophobicContact CD2-CG1 4.05Å; L1000-V1092 HydrophobicContact CD2-CG2 3.99Å; L1000-V1092 HydrophobicContact CG-CG2 4.3Å
1001	F	85.5	Confident	86	Confident	42 Å²	42	57.9 Å²	57.9	18%	0.184	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	17.3	176.6	-80.4	-114.8	0	0	0	113.9	V997 R998 N1003 L1006 F1013 Y1018 I1021	V997-F1001 HydrophobicContact CG1-CD2 3.88Å; V997-F1001 HydrophobicContact CG1-CE2 3.9Å; V997-F1001 WeakPolarHBondContact O-CD2 3.34Å; V997-F1001 PolarHBondContact O-N 2.78Å; R998-F1001 PolarHBondContact NH1-O 3.07Å; R998-F1001 CarbonylContact O-C 3.51Å; R998-F1001 PolarHBondContact O-N 3.34Å; F1001-N1003 VanDerWaalsContact C-N 3.33Å; F1001-L1006 HydrophobicContact CD2-CD1 3.82Å; F1001-L1006 HydrophobicContact CE2-CD1 3.8Å; F1001-L1006 HydrophobicContact CG-CD1 4.2Å; F1001-L1006 HydrophobicContact CZ-CD1 4.19Å; F1001-F1013 HydrophobicContact CE1-CB 3.56Å; F1001-F1013 HydrophobicContact CZ-CB 3.64Å; F1001-F1013 AromaticContact CZ-CD2 3.95Å; F1001-F1013 HydrophobicContact CZ-CD2 3.95Å; F1001-F1013 HydrophobicContact CZ-CG 4.23Å; F1001-Y1018 HydrophobicContact CB-CD2 4.21Å; F1001-Y1018 HydrophobicContact CB-CE2 4.35Å; F1001-Y1018 AromaticContact CD1-CD2 3.87Å; F1001-Y1018 HydrophobicContact CD1-CD2 3.87Å; F1001-Y1018 AromaticContact CD2-CD2 3.72Å; F1001-Y1018 HydrophobicContact CD2-CD2 3.72Å; F1001-Y1018 HydrophobicContact CD2-CE2 4.31Å; F1001-Y1018 HydrophobicContact CE1-CD2 4.1Å; F1001-Y1018 AromaticContact CE2-CD2 3.97Å; F1001-Y1018 HydrophobicContact CE2-CD2 3.97Å; F1001-Y1018 AromaticContact CG-CD2 3.67Å; F1001-Y1018 HydrophobicContact CG-CD2 3.67Å; F1001-Y1018 HydrophobicContact CG-CE2 4.25Å; F1001-Y1018 HydrophobicContact CZ-CD2 4.15Å; F1001-I1021 HydrophobicContact CE2-CD1 3.61Å; F1001-I1021 HydrophobicContact CZ-CD1 3.9Å
1002	S	83.3	Confident	85.5	Confident	81 Å²	81	60.1 Å²	60.1	57%	0.566	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-18.1	159	-63.8	0	0	0	0	112	R998 F999 L1000	R998-S1002 PolarHBondContact O-N 3.44Å; F999-S1002 WeakPolarHBondContact O-CB 3.05Å; F999-S1002 PolarHBondContact O-N 3.19Å; F999-S1002 PolarHBondContact O-OG 2.96Å; L1000-S1002 PolarHBondContact O-N 3.34Å; L1000-S1002 VanDerWaalsContact O-N 3.1Å
1003	N	79.8	Confident	85.1	Confident	93 Å²	93	60.7 Å²	60.7	50%	0.497	34%	0.339	S	S	.	.	S	Bend	trans	-84	136.9	170.8	-59.4	-65.2	0	0	0	110.1	L1000 F1001 L1006	L1000-N1003 PolarHBondContact O-N 3.21Å; L1000-N1003 VanDerWaalsContact O-N 3.14Å; L1000-N1003 PolarHBondContact O-ND2 3.15Å; F1001-N1003 VanDerWaalsContact C-N 3.33Å; N1003-L1006 HydrophobicContact CB-CD2 4.02Å
1004	P	71.8	Confident	84.7	Confident	118 Å²	118	62.6 Å²	62.6	77%	0.766	36%	0.358	S	S	*	.	S	Bend	trans	-74.6	-28.7	-172.9	28.4	-35	0	0	0	114	V1012	P1004-V1012 WeakPolarHBondContact O-CG1 3.42Å
1005	A	79.8	Confident	84.5	Confident	42 Å²	42	65.8 Å²	65.8	35%	0.347	38%	0.375	S	S	.	.			trans	-129.8	145.7	174.8	0	0	0	0	0	109.7
1006	L	78.5	Confident	84.3	Confident	16 Å²	16	64.3 Å²	64.3	8%	0.084	37%	0.367	C	S	.	.			trans	-134.4	-5.2	-172.4	-71.1	172.5	0	0	0	113.8	L1000 F1001 N1003 F1013 S1086 S1088	L1000-L1006 HydrophobicContact CD1-CD1 4.41Å; L1000-L1006 HydrophobicContact CD1-CD2 3.46Å; L1000-L1006 VanDerWaalsContact CD1-CD2 3.46Å; L1000-L1006 HydrophobicContact CD2-CD1 4.32Å; L1000-L1006 HydrophobicContact CG-CD1 3.88Å; L1000-L1006 HydrophobicContact CG-CD2 3.87Å; F1001-L1006 HydrophobicContact CD2-CD1 3.82Å; F1001-L1006 HydrophobicContact CE2-CD1 3.8Å; F1001-L1006 HydrophobicContact CG-CD1 4.2Å; F1001-L1006 HydrophobicContact CZ-CD1 4.19Å; N1003-L1006 HydrophobicContact CB-CD2 4.02Å; L1006-F1013 HydrophobicContact CB-CD2 3.7Å; L1006-F1013 HydrophobicContact CB-CE2 3.67Å; L1006-F1013 HydrophobicContact CD1-CD2 3.84Å; L1006-F1013 HydrophobicContact CD1-CE2 4.4Å; L1006-F1013 HydrophobicContact CG-CD2 4.4Å; L1006-S1086 WeakPolarHBondContact O-CB 3.45Å; L1006-S1086 PolarHBondContact O-OG 2.8Å; L1006-S1088 PolarHBondContact O-OG 3.31Å
1007	Q	79.5	Confident	84.2	Confident	11 Å²	11	64.1 Å²	64.1	5%	0.051	36%	0.364	C	S	.	.	S	Bend	trans	-104.5	147.7	167.4	-71.3	-171.3	-18.4	0	0	109.8	N1009 G1010 F1013 N1082	Q1007-N1009 WeakPolarHBondContact CB-OD1 3.44Å; Q1007-N1009 PolarHBondContact O-N 3.3Å; Q1007-N1009 VanDerWaalsContact O-N 3.13Å; Q1007-N1009 PolarHBondContact OE1-ND2 2.91Å; Q1007-N1009 PolarHBondContact OE1-OD1 2.96Å; Q1007-N1009 VanDerWaalsContact OE1-OD1 3.1Å; Q1007-G1010 PolarHBondContact O-N 3.05Å; Q1007-F1013 HydrophobicContact CG-CE1 3.84Å; Q1007-F1013 HydrophobicContact CG-CZ 3.67Å; Q1007-N1082 PolarHBondContact NE2-O 2.72Å
1008	D	75.3	Confident	84.1	Confident	144 Å²	144	64.8 Å²	64.8	77%	0.77	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.8	-177.7	-48.9	-43.2	0	0	0	113.2	G1010	D1008-G1010 VanDerWaalsContact C-N 3.31Å
1009	N	80.1	Confident	84.2	Confident	96 Å²	96	60.5 Å²	60.5	51%	0.513	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	0.7	172.8	66.5	10.6	0	0	0	113.8	Q1007 Q1011	Q1007-N1009 WeakPolarHBondContact CB-OD1 3.44Å; Q1007-N1009 PolarHBondContact O-N 3.3Å; Q1007-N1009 VanDerWaalsContact O-N 3.13Å; Q1007-N1009 PolarHBondContact OE1-ND2 2.91Å; Q1007-N1009 PolarHBondContact OE1-OD1 2.96Å; Q1007-N1009 VanDerWaalsContact OE1-OD1 3.1Å; N1009-Q1011 VanDerWaalsContact C-N 3.35Å; N1009-Q1011 PolarHBondContact O-N 3.06Å; N1009-Q1011 VanDerWaalsContact OD1-CB 3.31Å; N1009-Q1011 WeakPolarHBondContact OD1-CB 3.44Å; N1009-Q1011 WeakPolarHBondContact OD1-CG 3.44Å; N1009-Q1011 PolarHBondContact OD1-N 3.16Å
1010	G	79.1	Confident	84.4	Confident	49 Å²	49	53.8 Å²	53.8	51%	0.505	32%	0.321	S	S	.	.			trans	78.7	4.4	-178.7	0	0	0	0	0	116.1	Q1007 D1008	Q1007-G1010 PolarHBondContact O-N 3.05Å; D1008-G1010 VanDerWaalsContact C-N 3.31Å
1011	Q	83.3	Confident	84.7	Confident	102 Å²	102	53 Å²	53	48%	0.477	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-72.5	148.4	179.1	-65.8	-177	9.9	0	0	112.6	N1009	N1009-Q1011 VanDerWaalsContact C-N 3.35Å; N1009-Q1011 PolarHBondContact O-N 3.06Å; N1009-Q1011 VanDerWaalsContact OD1-CB 3.31Å; N1009-Q1011 WeakPolarHBondContact OD1-CB 3.44Å; N1009-Q1011 WeakPolarHBondContact OD1-CG 3.44Å; N1009-Q1011 PolarHBondContact OD1-N 3.16Å
1012	V	86.2	Confident	85.2	Confident	114 Å²	114	51 Å²	51	69%	0.691	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-94.1	144.4	-179	-57.3	0	0	0	0	111.4	P1004	P1004-V1012 WeakPolarHBondContact O-CG1 3.42Å
1013	F	86.9	Confident	85.8	Confident	30 Å²	30	47.1 Å²	47.1	13%	0.132	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-93.8	136.1	177.5	-78.7	-33.8	0	0	0	112.5	F1001 L1006 Q1007 N1082	F1001-F1013 HydrophobicContact CE1-CB 3.56Å; F1001-F1013 HydrophobicContact CZ-CB 3.64Å; F1001-F1013 AromaticContact CZ-CD2 3.95Å; F1001-F1013 HydrophobicContact CZ-CD2 3.95Å; F1001-F1013 HydrophobicContact CZ-CG 4.23Å; L1006-F1013 HydrophobicContact CB-CD2 3.7Å; L1006-F1013 HydrophobicContact CB-CE2 3.67Å; L1006-F1013 HydrophobicContact CD1-CD2 3.84Å; L1006-F1013 HydrophobicContact CD1-CE2 4.4Å; L1006-F1013 HydrophobicContact CG-CD2 4.4Å; Q1007-F1013 HydrophobicContact CG-CE1 3.84Å; Q1007-F1013 HydrophobicContact CG-CZ 3.67Å; F1013-N1082 HydrophobicContact CE1-CB 4.3Å; F1013-N1082 WeakPolarHBondContact CZ-O 3.08Å
1014	G	88.1	Confident	86.5	Confident	40 Å²	40	43 Å²	43	41%	0.412	26%	0.26	S	S	.	.			trans	-82.5	175.9	177.6	0	0	0	0	0	114.1	W1016 S1017 Y1018	G1014-W1016 VanDerWaalsContact C-N 3.31Å; G1014-W1016 PolarHBondContact O-N 3.48Å; G1014-S1017 WeakPolarHBondContact O-CB 3.39Å; G1014-S1017 PolarHBondContact O-N 2.9Å; G1014-S1017 VanDerWaalsContact O-N 3.09Å; G1014-Y1018 PolarHBondContact O-N 3.33Å
1015	N	89.9	Confident	87.6	Confident	67 Å²	67	37.4 Å²	37.4	36%	0.358	22%	0.223	S	C	.	.	H	α-helix	trans	-59.2	-37	176.3	63.1	-22.4	0	0	0	113.3	S1017 Y1018 G1019	N1015-S1017 VanDerWaalsContact C-N 3.34Å; N1015-Y1018 WeakPolarHBondContact O-CB 3.3Å; N1015-Y1018 PolarHBondContact O-N 3.23Å; N1015-G1019 PolarHBondContact O-N 3.05Å
1016	W	90.9	Very high	88.4	Confident	38 Å²	38	35.4 Å²	35.4	14%	0.144	21%	0.207	C	C	.	.	H	α-helix	trans	-68.5	-31.7	175.4	-58.1	111.9	0	0	0	112.6	D927 G1014 T1020 R1075 L1076 V1079	D927-W1016 HydrophobicContact CB-CE3 4.41Å; D927-W1016 HydrophobicContact CB-CZ3 4.31Å; G1014-W1016 VanDerWaalsContact C-N 3.31Å; G1014-W1016 PolarHBondContact O-N 3.48Å; W1016-T1020 VanDerWaalsContact O-CB 3.31Å; W1016-T1020 WeakPolarHBondContact O-CB 3.39Å; W1016-T1020 PolarHBondContact O-N 3.48Å; W1016-T1020 PolarHBondContact O-OG1 3.34Å; W1016-R1075 HydrophobicContact CD2-CB 4.47Å; W1016-L1076 HydrophobicContact CB-CD2 4.26Å; W1016-V1079 HydrophobicContact CB-CG1 4.4Å; W1016-V1079 HydrophobicContact CB-CG2 4.36Å
1017	S	90.5	Very high	89.2	Confident	11 Å²	11	34.7 Å²	34.7	8%	0.077	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-47.6	170.8	-53.1	0	0	0	0	110.8	G1014 N1015 G1019 T1020 I1021	G1014-S1017 WeakPolarHBondContact O-CB 3.39Å; G1014-S1017 PolarHBondContact O-N 2.9Å; G1014-S1017 VanDerWaalsContact O-N 3.09Å; N1015-S1017 VanDerWaalsContact C-N 3.34Å; S1017-G1019 PolarHBondContact O-N 3.04Å; S1017-T1020 PolarHBondContact O-N 3.43Å; S1017-I1021 WeakPolarHBondContact O-CG1 3.49Å; S1017-I1021 PolarHBondContact O-N 2.93Å
1018	Y	91.4	Very high	90	Very high	15 Å²	15	36.6 Å²	36.6	6%	0.059	21%	0.211	C	C	.	.	H	α-helix	trans	-54.7	-51.1	174.5	180	-90.8	0	0	0	111.8	Y914 L925 F994 V997 F1001 G1014 N1015 T1020 I1021 V1022	Y914-Y1018 HydrophobicContact CD2-CE1 4.22Å; Y914-Y1018 HydrophobicContact CE2-CD1 4.43Å; Y914-Y1018 HydrophobicContact CE2-CE1 4.4Å; L925-Y1018 HydrophobicContact CD1-CD1 3.6Å; L925-Y1018 HydrophobicContact CD1-CE1 3.76Å; F994-Y1018 HydrophobicContact CD2-CE1 4.45Å; F994-Y1018 AromaticContact CE2-CE1 3.97Å; F994-Y1018 HydrophobicContact CE2-CE1 3.97Å; F994-Y1018 WeakPolarHBondContact CE2-OH 3.29Å; F994-Y1018 WeakPolarHBondContact CZ-OH 3.45Å; F994-Y1018 PolarHBondContact O-OH 3.04Å; V997-Y1018 HydrophobicContact CB-CE2 4.1Å; V997-Y1018 HydrophobicContact CG1-CD2 3.66Å; V997-Y1018 HydrophobicContact CG1-CE2 3.66Å; V997-Y1018 HydrophobicContact CG1-CG 4.39Å; F1001-Y1018 HydrophobicContact CB-CD2 4.21Å; F1001-Y1018 HydrophobicContact CB-CE2 4.35Å; F1001-Y1018 AromaticContact CD1-CD2 3.87Å; F1001-Y1018 HydrophobicContact CD1-CD2 3.87Å; F1001-Y1018 AromaticContact CD2-CD2 3.72Å; F1001-Y1018 HydrophobicContact CD2-CD2 3.72Å; F1001-Y1018 HydrophobicContact CD2-CE2 4.31Å; F1001-Y1018 HydrophobicContact CE1-CD2 4.1Å; F1001-Y1018 AromaticContact CE2-CD2 3.97Å; F1001-Y1018 HydrophobicContact CE2-CD2 3.97Å; F1001-Y1018 AromaticContact CG-CD2 3.67Å; F1001-Y1018 HydrophobicContact CG-CD2 3.67Å; F1001-Y1018 HydrophobicContact CG-CE2 4.25Å; F1001-Y1018 HydrophobicContact CZ-CD2 4.15Å; G1014-Y1018 PolarHBondContact O-N 3.33Å; N1015-Y1018 WeakPolarHBondContact O-CB 3.3Å; N1015-Y1018 PolarHBondContact O-N 3.23Å; Y1018-T1020 VanDerWaalsContact C-N 3.32Å; Y1018-T1020 PolarHBondContact O-N 3.39Å; Y1018-I1021 PolarHBondContact O-N 3.45Å; Y1018-V1022 HydrophobicContact CD1-CG2 4.45Å; Y1018-V1022 HydrophobicContact CE1-CG2 4.14Å; Y1018-V1022 WeakPolarHBondContact O-CG2 3.47Å; Y1018-V1022 PolarHBondContact O-N 3.28Å; Y1018-V1022 VanDerWaalsContact O-N 3.11Å
1019	G	92.9	Very high	91	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-60.7	-36.9	176.7	0	0	0	0	0	113.8	L925 N1015 S1017 F1023	L925-G1019 WeakPolarHBondContact O-CA 3.43Å; N1015-G1019 PolarHBondContact O-N 3.05Å; S1017-G1019 PolarHBondContact O-N 3.04Å; G1019-F1023 VanDerWaalsContact O-CB 3.29Å; G1019-F1023 WeakPolarHBondContact O-CB 3.45Å; G1019-F1023 PolarHBondContact O-N 2.94Å
1020	T	93.1	Very high	91.8	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-71.5	-35.4	178.6	-56	0	0	0	0	112.2	Y930 W1016 S1017 Y1018 F1023 T1024 F1080 M1083	Y930-T1020 HydrophobicContact CE2-CG2 4.12Å; W1016-T1020 VanDerWaalsContact O-CB 3.31Å; W1016-T1020 WeakPolarHBondContact O-CB 3.39Å; W1016-T1020 PolarHBondContact O-N 3.48Å; W1016-T1020 PolarHBondContact O-OG1 3.34Å; S1017-T1020 PolarHBondContact O-N 3.43Å; Y1018-T1020 VanDerWaalsContact C-N 3.32Å; Y1018-T1020 PolarHBondContact O-N 3.39Å; T1020-F1023 PolarHBondContact O-N 2.98Å; T1020-T1024 WeakPolarHBondContact O-CB 3.3Å; T1020-T1024 PolarHBondContact O-N 2.89Å; T1020-T1024 PolarHBondContact O-OG1 2.89Å; T1020-F1080 HydrophobicContact CG2-CD2 3.74Å; T1020-F1080 HydrophobicContact CG2-CE2 4.41Å; T1020-M1083 HydrophobicContact CG2-CE 4.36Å; T1020-M1083 HydrophobicContact CG2-SD 3.79Å
1021	I	93.3	Very high	92.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.5	-48.7	173.3	-63.6	162.3	0	0	0	110	V997 F1001 S1017 Y1018 F1023 T1024 V1025 M1083 I1093	V997-I1021 HydrophobicContact CB-CG2 4.49Å; V997-I1021 HydrophobicContact CG1-CB 4.09Å; V997-I1021 HydrophobicContact CG1-CG2 3.88Å; V997-I1021 HydrophobicContact CG2-CB 4.48Å; V997-I1021 HydrophobicContact CG2-CG2 3.68Å; F1001-I1021 HydrophobicContact CE2-CD1 3.61Å; F1001-I1021 HydrophobicContact CZ-CD1 3.9Å; S1017-I1021 WeakPolarHBondContact O-CG1 3.49Å; S1017-I1021 PolarHBondContact O-N 2.93Å; Y1018-I1021 PolarHBondContact O-N 3.45Å; I1021-F1023 VanDerWaalsContact C-N 3.29Å; I1021-F1023 PolarHBondContact O-N 3.41Å; I1021-T1024 WeakPolarHBondContact O-CB 3.26Å; I1021-T1024 PolarHBondContact O-N 3.31Å; I1021-V1025 WeakPolarHBondContact O-CG2 3.12Å; I1021-V1025 PolarHBondContact O-N 2.77Å; I1021-M1083 HydrophobicContact CB-SD 4.21Å; I1021-M1083 HydrophobicContact CD1-CG 4.15Å; I1021-M1083 HydrophobicContact CG1-CG 3.51Å; I1021-M1083 HydrophobicContact CG1-SD 3.38Å; I1021-M1083 WeakPolarHBondContact CG1-SD 3.2Å; I1021-I1093 HydrophobicContact CG2-CD1 4.49Å; I1021-I1093 HydrophobicContact CG2-CG1 4.11Å
1022	V	95.6	Very high	93.1	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57.3	-43.5	176.1	176	0	0	0	0	111	P910 L925 Y926 F993 V997 Y1018 V1025 L1026	P910-V1022 HydrophobicContact CB-CG1 3.79Å; P910-V1022 HydrophobicContact CG-CG1 4.05Å; L925-V1022 HydrophobicContact CD2-CG1 4.26Å; Y926-V1022 HydrophobicContact CE1-CB 4.44Å; Y926-V1022 HydrophobicContact CE1-CG1 4.07Å; F993-V1022 HydrophobicContact CB-CG1 4.26Å; V997-V1022 HydrophobicContact CB-CG2 3.81Å; V997-V1022 HydrophobicContact CG1-CG2 4.09Å; V997-V1022 HydrophobicContact CG2-CG2 3.76Å; Y1018-V1022 HydrophobicContact CD1-CG2 4.45Å; Y1018-V1022 HydrophobicContact CE1-CG2 4.14Å; Y1018-V1022 WeakPolarHBondContact O-CG2 3.47Å; Y1018-V1022 PolarHBondContact O-N 3.28Å; Y1018-V1022 VanDerWaalsContact O-N 3.11Å; V1022-V1025 PolarHBondContact O-N 2.91Å; V1022-L1026 WeakPolarHBondContact O-CB 3.18Å; V1022-L1026 PolarHBondContact O-N 3.16Å
1023	F	95.3	Very high	93.5	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.1	-35.7	178.5	-166.6	-96.6	0	0	0	113	F907 Y926 Y930 Y934 F938 G1019 T1020 I1021 L1026 V1027 Y1056	F907-F1023 HydrophobicContact CD2-CE2 4.34Å; F907-F1023 HydrophobicContact CE2-CD2 4.22Å; F907-F1023 AromaticContact CE2-CE2 3.85Å; F907-F1023 HydrophobicContact CE2-CE2 3.85Å; Y926-F1023 HydrophobicContact CD1-CB 3.91Å; Y926-F1023 AromaticContact CD1-CD2 3.82Å; Y926-F1023 HydrophobicContact CD1-CD2 3.82Å; Y926-F1023 HydrophobicContact CD1-CG 4.29Å; Y926-F1023 HydrophobicContact CE1-CB 3.98Å; Y926-F1023 AromaticContact CE1-CD2 3.99Å; Y926-F1023 HydrophobicContact CE1-CD2 3.99Å; Y926-F1023 HydrophobicContact CE1-CG 4.5Å; Y926-F1023 HydrophobicContact CG-CD2 4.21Å; Y930-F1023 HydrophobicContact CD1-CD1 4.41Å; Y930-F1023 HydrophobicContact CD1-CE1 4.05Å; Y930-F1023 HydrophobicContact CD2-CD1 4.15Å; Y930-F1023 HydrophobicContact CD2-CE1 4.47Å; Y930-F1023 HydrophobicContact CD2-CG 4.33Å; Y930-F1023 HydrophobicContact CG-CD1 4.06Å; Y930-F1023 AromaticContact CG-CE1 3.92Å; Y930-F1023 HydrophobicContact CG-CE1 3.92Å; Y930-F1023 HydrophobicContact CG-CG 4.46Å; Y930-F1023 HydrophobicContact CG-CZ 4.21Å; Y934-F1023 AromaticContact CD2-CE2 3.9Å; Y934-F1023 HydrophobicContact CD2-CE2 3.9Å; Y934-F1023 AromaticContact CD2-CZ 3.87Å; Y934-F1023 HydrophobicContact CD2-CZ 3.87Å; Y934-F1023 HydrophobicContact CG-CE2 4.17Å; Y934-F1023 HydrophobicContact CG-CZ 4.27Å; F938-F1023 AromaticContact CD2-CE1 3.91Å; F938-F1023 HydrophobicContact CD2-CE1 3.91Å; F938-F1023 AromaticContact CD2-CZ 3.88Å; F938-F1023 HydrophobicContact CD2-CZ 3.88Å; F938-F1023 AromaticContact CE2-CE1 3.82Å; F938-F1023 HydrophobicContact CE2-CE1 3.82Å; F938-F1023 AromaticContact CE2-CZ 3.99Å; F938-F1023 HydrophobicContact CE2-CZ 3.99Å; G1019-F1023 VanDerWaalsContact O-CB 3.29Å; G1019-F1023 WeakPolarHBondContact O-CB 3.45Å; G1019-F1023 PolarHBondContact O-N 2.94Å; T1020-F1023 PolarHBondContact O-N 2.98Å; I1021-F1023 VanDerWaalsContact C-N 3.29Å; I1021-F1023 PolarHBondContact O-N 3.41Å; F1023-L1026 HydrophobicContact CD2-CD2 4.08Å; F1023-L1026 HydrophobicContact CE2-CD2 4.36Å; F1023-L1026 WeakPolarHBondContact O-CB 3.42Å; F1023-L1026 PolarHBondContact O-N 2.86Å; F1023-V1027 HydrophobicContact CD1-CG2 3.91Å; F1023-V1027 HydrophobicContact CE1-CG2 3.55Å; F1023-V1027 HydrophobicContact CE2-CG2 4.46Å; F1023-V1027 HydrophobicContact CZ-CG2 3.86Å; F1023-V1027 WeakPolarHBondContact O-CG2 3.26Å; F1023-V1027 PolarHBondContact O-N 3.32Å; F1023-Y1056 AromaticContact CD1-CE2 3.63Å; F1023-Y1056 HydrophobicContact CD1-CE2 3.63Å; F1023-Y1056 AromaticContact CD1-CZ 3.9Å; F1023-Y1056 HydrophobicContact CE1-CD2 4.08Å; F1023-Y1056 AromaticContact CE1-CE2 3.54Å; F1023-Y1056 HydrophobicContact CE1-CE2 3.54Å
1024	T	94.8	Very high	93.9	Very high	7 Å²	7	13.2 Å²	13.2	4%	0.043	8%	0.075	C	C	.	.	H	α-helix	trans	-61.9	-51.7	174.2	-58.3	0	0	0	0	110.6	T1020 I1021 L1026 V1027 F1028 Y1056 M1083 I1093	T1020-T1024 WeakPolarHBondContact O-CB 3.3Å; T1020-T1024 PolarHBondContact O-N 2.89Å; T1020-T1024 PolarHBondContact O-OG1 2.89Å; I1021-T1024 WeakPolarHBondContact O-CB 3.26Å; I1021-T1024 PolarHBondContact O-N 3.31Å; T1024-L1026 VanDerWaalsContact C-N 3.31Å; T1024-L1026 PolarHBondContact O-N 2.98Å; T1024-V1027 PolarHBondContact O-N 3.25Å; T1024-F1028 HydrophobicContact CG2-CD2 4.14Å; T1024-F1028 HydrophobicContact CG2-CE2 4.25Å; T1024-F1028 WeakPolarHBondContact O-CD2 3.21Å; T1024-F1028 PolarHBondContact O-N 3.26Å; T1024-F1028 VanDerWaalsContact O-N 3.11Å; T1024-Y1056 HydrophobicContact CG2-CE1 4.32Å; T1024-Y1056 PolarHBondContact OG1-OH 3.18Å; T1024-Y1056 VanDerWaalsContact OG1-OH 3.05Å; T1024-M1083 HydrophobicContact CG2-CE 4.48Å; T1024-M1083 WeakPolarHBondContact OG1-CE 3.33Å; T1024-I1093 HydrophobicContact CG2-CD1 4.08Å; T1024-I1093 HydrophobicContact CG2-CG1 4.5Å; T1024-I1093 HydrophobicContact CG2-CG2 4.12Å
1025	V	95.8	Very high	94.1	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.8	-42.2	178	177.8	0	0	0	0	110.9	F993 I1021 V1022 T1029 I1093 L1096 I1097	F993-V1025 HydrophobicContact CD1-CB 4.47Å; F993-V1025 HydrophobicContact CD1-CG1 3.49Å; F993-V1025 VanDerWaalsContact CD1-CG1 3.49Å; F993-V1025 HydrophobicContact CE1-CG1 3.83Å; F993-V1025 HydrophobicContact CG-CG1 4.34Å; I1021-V1025 WeakPolarHBondContact O-CG2 3.12Å; I1021-V1025 PolarHBondContact O-N 2.77Å; V1022-V1025 PolarHBondContact O-N 2.91Å; V1025-T1029 WeakPolarHBondContact O-CB 3.25Å; V1025-T1029 PolarHBondContact O-N 3.42Å; V1025-T1029 PolarHBondContact O-OG1 3.16Å; V1025-I1093 HydrophobicContact CG2-CB 4.26Å; V1025-I1093 HydrophobicContact CG2-CG1 3.95Å; V1025-I1093 HydrophobicContact CG2-CG2 4.28Å; V1025-L1096 HydrophobicContact CG1-CB 3.75Å; V1025-L1096 HydrophobicContact CG2-CB 4.31Å; V1025-L1096 HydrophobicContact CG2-CD1 4.35Å; V1025-I1097 HydrophobicContact CG1-CG1 4.35Å
1026	L	96	Very high	94.2	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-57.6	-57.6	175.3	169.4	71.7	0	0	0	112.1	C906 F907 Y934 F993 V1022 F1023 T1024 F1028 T1029 V1030	C906-L1026 HydrophobicContact CB-CD1 3.73Å; F907-L1026 HydrophobicContact CB-CD1 4.38Å; F907-L1026 HydrophobicContact CB-CD2 3.89Å; F907-L1026 HydrophobicContact CD2-CD2 3.54Å; F907-L1026 HydrophobicContact CG-CD2 4.14Å; Y934-L1026 HydrophobicContact CD2-CD2 4.44Å; Y934-L1026 HydrophobicContact CE2-CD2 3.87Å; Y934-L1026 HydrophobicContact CE2-CG 4.08Å; F993-L1026 HydrophobicContact CD2-CB 4.23Å; F993-L1026 HydrophobicContact CD2-CD1 4.02Å; F993-L1026 HydrophobicContact CE2-CB 4.22Å; F993-L1026 HydrophobicContact CE2-CD1 3.57Å; V1022-L1026 WeakPolarHBondContact O-CB 3.18Å; V1022-L1026 PolarHBondContact O-N 3.16Å; F1023-L1026 HydrophobicContact CD2-CD2 4.08Å; F1023-L1026 HydrophobicContact CE2-CD2 4.36Å; F1023-L1026 WeakPolarHBondContact O-CB 3.42Å; F1023-L1026 PolarHBondContact O-N 2.86Å; T1024-L1026 VanDerWaalsContact C-N 3.31Å; T1024-L1026 PolarHBondContact O-N 2.98Å; L1026-F1028 PolarHBondContact O-N 2.82Å; L1026-T1029 PolarHBondContact O-N 3.36Å; L1026-V1030 HydrophobicContact CD1-CG1 3.95Å; L1026-V1030 WeakPolarHBondContact O-CG2 3.25Å; L1026-V1030 PolarHBondContact O-N 2.93Å
1027	V	95.9	Very high	94.2	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.006	6%	0.064	C	C	.	.	H	α-helix	trans	-61.3	-44	-173.9	169.1	0	0	0	0	111.2	Y934 F1023 T1024 T1031 L1053 Y1056	Y934-V1027 HydrophobicContact CD2-CG2 4.05Å; Y934-V1027 HydrophobicContact CE2-CG2 4.16Å; F1023-V1027 HydrophobicContact CD1-CG2 3.91Å; F1023-V1027 HydrophobicContact CE1-CG2 3.55Å; F1023-V1027 HydrophobicContact CE2-CG2 4.46Å; F1023-V1027 HydrophobicContact CZ-CG2 3.86Å; F1023-V1027 WeakPolarHBondContact O-CG2 3.26Å; F1023-V1027 PolarHBondContact O-N 3.32Å; T1024-V1027 PolarHBondContact O-N 3.25Å; V1027-T1031 VanDerWaalsContact O-CB 3.3Å; V1027-T1031 WeakPolarHBondContact O-CB 3.29Å; V1027-T1031 PolarHBondContact O-N 3.21Å; V1027-T1031 PolarHBondContact O-OG1 2.95Å; V1027-L1053 HydrophobicContact CG1-CD2 4.09Å; V1027-Y1056 HydrophobicContact CB-CD1 4.32Å; V1027-Y1056 HydrophobicContact CB-CE1 4.49Å; V1027-Y1056 HydrophobicContact CG1-CD1 3.88Å; V1027-Y1056 HydrophobicContact CG1-CG 3.9Å
1028	F	96.1	Very high	94.2	Very high	52 Å²	52	12.1 Å²	12.1	23%	0.228	6%	0.063	C	C	.	.	H	α-helix	trans	-64.3	-47.9	174.5	-83.6	-104.4	0	0	0	111.8	T1024 L1026 V1030 T1031 L1032 L1053 Y1056 V1057 I1097	T1024-F1028 HydrophobicContact CG2-CD2 4.14Å; T1024-F1028 HydrophobicContact CG2-CE2 4.25Å; T1024-F1028 WeakPolarHBondContact O-CD2 3.21Å; T1024-F1028 PolarHBondContact O-N 3.26Å; T1024-F1028 VanDerWaalsContact O-N 3.11Å; L1026-F1028 PolarHBondContact O-N 2.82Å; F1028-V1030 PolarHBondContact O-N 3.48Å; F1028-T1031 PolarHBondContact O-N 3.43Å; F1028-L1032 HydrophobicContact CB-CD1 4.47Å; F1028-L1032 VanDerWaalsContact O-CB 3.28Å; F1028-L1032 WeakPolarHBondContact O-CB 3.22Å; F1028-L1032 VanDerWaalsContact O-CG 3.24Å; F1028-L1032 WeakPolarHBondContact O-CG 3.29Å; F1028-L1032 PolarHBondContact O-N 3.37Å; F1028-L1053 HydrophobicContact CD1-CD1 4.09Å; F1028-L1053 HydrophobicContact CD1-CD2 4.17Å; F1028-L1053 HydrophobicContact CD2-CD2 4.14Å; F1028-L1053 HydrophobicContact CE1-CD1 4.14Å; F1028-L1053 HydrophobicContact CE1-CD2 4.36Å; F1028-L1053 HydrophobicContact CE2-CD2 4.34Å; F1028-L1053 HydrophobicContact CG-CD2 4.06Å; F1028-L1053 HydrophobicContact CZ-CB 4.5Å; F1028-L1053 HydrophobicContact CZ-CD2 4.45Å; F1028-Y1056 HydrophobicContact CE2-CD1 4.03Å; F1028-Y1056 HydrophobicContact CE2-CE1 4.22Å; F1028-V1057 HydrophobicContact CE2-CG2 4.27Å; F1028-V1057 HydrophobicContact CZ-CG2 4.15Å; F1028-I1097 HydrophobicContact CB-CD1 3.56Å; F1028-I1097 HydrophobicContact CB-CG1 4.14Å; F1028-I1097 HydrophobicContact CD1-CD1 4.37Å; F1028-I1097 HydrophobicContact CG-CD1 4.14Å
1029	T	96.3	Very high	94	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64.9	-42.9	-176.3	-56.2	0	0	0	0	112.9	F993 V1025 L1026 T1031 K1033 L1101	F993-T1029 HydrophobicContact CE1-CG2 3.78Å; F993-T1029 HydrophobicContact CZ-CG2 3.66Å; V1025-T1029 WeakPolarHBondContact O-CB 3.25Å; V1025-T1029 PolarHBondContact O-N 3.42Å; V1025-T1029 PolarHBondContact O-OG1 3.16Å; L1026-T1029 PolarHBondContact O-N 3.36Å; T1029-T1031 VanDerWaalsContact C-N 3.35Å; T1029-T1031 PolarHBondContact O-N 3.38Å; T1029-K1033 VanDerWaalsContact O-CB 3.22Å; T1029-K1033 WeakPolarHBondContact O-CB 3.25Å; T1029-K1033 PolarHBondContact O-N 3.32Å; T1029-L1101 HydrophobicContact CG2-CD2 3.83Å; T1029-L1101 HydrophobicContact CG2-CG 4.17Å
1030	V	96.1	Very high	93.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67.4	-38	178.9	-59.3	0	0	0	0	111.6	Y899 Y902 K903 C906 T939 L1026 F1028 K1033 L1034	Y899-V1030 PolarHBondContact OH-O 2.86Å; Y899-V1030 VanDerWaalsContact OH-O 3.07Å; Y902-V1030 HydrophobicContact CE1-CG1 4.26Å; K903-V1030 HydrophobicContact CB-CB 4.46Å; K903-V1030 HydrophobicContact CB-CG1 4.32Å; C906-V1030 HydrophobicContact CB-CG1 4.3Å; T939-V1030 HydrophobicContact CG2-CG2 3.81Å; L1026-V1030 HydrophobicContact CD1-CG1 3.95Å; L1026-V1030 WeakPolarHBondContact O-CG2 3.25Å; L1026-V1030 PolarHBondContact O-N 2.93Å; F1028-V1030 PolarHBondContact O-N 3.48Å; V1030-K1033 PolarHBondContact O-N 3.07Å; V1030-L1034 PolarHBondContact O-N 2.97Å; V1030-L1034 VanDerWaalsContact O-N 3.12Å
1031	T	95.8	Very high	93.7	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-72.2	-41.4	-179.2	-51.8	0	0	0	0	111.5	V1027 F1028 T1029 L1034 A1035 I1049 L1053	V1027-T1031 VanDerWaalsContact O-CB 3.3Å; V1027-T1031 WeakPolarHBondContact O-CB 3.29Å; V1027-T1031 PolarHBondContact O-N 3.21Å; V1027-T1031 PolarHBondContact O-OG1 2.95Å; F1028-T1031 PolarHBondContact O-N 3.43Å; T1029-T1031 VanDerWaalsContact C-N 3.35Å; T1029-T1031 PolarHBondContact O-N 3.38Å; T1031-L1034 WeakPolarHBondContact O-CB 3.32Å; T1031-L1034 PolarHBondContact O-N 3.4Å; T1031-A1035 PolarHBondContact O-N 2.68Å; T1031-I1049 HydrophobicContact CG2-CG2 4.05Å; T1031-L1053 HydrophobicContact CG2-CD1 4.22Å; T1031-L1053 HydrophobicContact CG2-CD2 3.99Å; T1031-L1053 HydrophobicContact CG2-CG 3.92Å
1032	L	95.1	Very high	93.7	Very high	41 Å²	41	29 Å²	29	22%	0.215	13%	0.132	C	C	.	.	H	α-helix	trans	-69.5	-32	173.5	-68.7	170.6	0	0	0	112.2	F1028 L1034 A1035 L1036 W1050 I1097 L1101	F1028-L1032 HydrophobicContact CB-CD1 4.47Å; F1028-L1032 VanDerWaalsContact O-CB 3.28Å; F1028-L1032 WeakPolarHBondContact O-CB 3.22Å; F1028-L1032 VanDerWaalsContact O-CG 3.24Å; F1028-L1032 WeakPolarHBondContact O-CG 3.29Å; F1028-L1032 PolarHBondContact O-N 3.37Å; L1032-L1034 VanDerWaalsContact C-N 3.32Å; L1032-L1034 PolarHBondContact O-N 2.85Å; L1032-A1035 WeakPolarHBondContact O-CB 3.35Å; L1032-A1035 PolarHBondContact O-N 2.95Å; L1032-L1036 WeakPolarHBondContact O-CG 3.3Å; L1032-L1036 PolarHBondContact O-N 2.91Å; L1032-W1050 HydrophobicContact CD2-CH2 4.23Å; L1032-W1050 HydrophobicContact CD2-CZ3 3.96Å; L1032-I1097 HydrophobicContact CD1-CG2 3.7Å; L1032-L1101 HydrophobicContact CB-CD1 3.79Å; L1032-L1101 HydrophobicContact CD1-CD1 4.42Å
1033	K	94.6	Very high	93.7	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.009	17%	0.168	C	C	.	.	H	α-helix	trans	-60.9	-40.6	170	173.9	59.6	177.9	113.2	0	111.6	Y902 T1029 V1030 L1036 D1037 L1101 E1104	Y902-K1033 HydrophobicContact CE1-CG 4.12Å; T1029-K1033 VanDerWaalsContact O-CB 3.22Å; T1029-K1033 WeakPolarHBondContact O-CB 3.25Å; T1029-K1033 PolarHBondContact O-N 3.32Å; V1030-K1033 PolarHBondContact O-N 3.07Å; K1033-L1036 PolarHBondContact O-N 3.17Å; K1033-D1037 IonicContact NZ-OD1 2.73Å; K1033-D1037 PolarHBondContact NZ-OD1 3.46Å; K1033-D1037 IonicContact NZ-OD2 2.89Å; K1033-D1037 PolarHBondContact NZ-OD2 3.48Å; K1033-D1037 PolarHBondContact O-N 2.88Å; K1033-L1101 HydrophobicContact CB-CD2 3.96Å; K1033-E1104 HydrophobicContact CD-CG 4.06Å; K1033-E1104 VanDerWaalsContact CE-CD 3.45Å; K1033-E1104 WeakPolarHBondContact CE-OE2 3.39Å; K1033-E1104 IonicContact NZ-OE2 2.76Å; K1033-E1104 PolarHBondContact NZ-OE2 3.5Å
1034	L	94.3	Very high	93.6	Very high	0 Å²	0	41 Å²	41	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.8	-41.9	174.2	-175.4	61.1	0	0	0	111.6	Y899 P942 I943 Y946 V1030 T1031 L1032 L1036 D1037 T1038	Y899-L1034 HydrophobicContact CD2-CD1 4.46Å; Y899-L1034 HydrophobicContact CE1-CD2 4.49Å; Y899-L1034 HydrophobicContact CE2-CB 3.89Å; Y899-L1034 HydrophobicContact CE2-CD1 4.47Å; P942-L1034 VanDerWaalsContact C-CD2 3.5Å; P942-L1034 HydrophobicContact CB-CD2 3.79Å; I943-L1034 HydrophobicContact CB-CD2 4.09Å; I943-L1034 HydrophobicContact CD1-CD1 3.67Å; I943-L1034 HydrophobicContact CD1-CD2 4.09Å; Y946-L1034 HydrophobicContact CD1-CD1 4.04Å; Y946-L1034 HydrophobicContact CD2-CD1 4.32Å; Y946-L1034 HydrophobicContact CE1-CD1 4.42Å; Y946-L1034 HydrophobicContact CG-CD1 3.95Å; V1030-L1034 PolarHBondContact O-N 2.97Å; V1030-L1034 VanDerWaalsContact O-N 3.12Å; T1031-L1034 WeakPolarHBondContact O-CB 3.32Å; T1031-L1034 PolarHBondContact O-N 3.4Å; L1032-L1034 VanDerWaalsContact C-N 3.32Å; L1032-L1034 PolarHBondContact O-N 2.85Å; L1034-L1036 VanDerWaalsContact C-N 3.28Å; L1034-L1036 PolarHBondContact O-N 3.13Å; L1034-D1037 PolarHBondContact O-N 3.04Å; L1034-T1038 HydrophobicContact CG-CG2 4.41Å; L1034-T1038 WeakPolarHBondContact O-CG2 3.36Å; L1034-T1038 PolarHBondContact O-N 2.96Å
1035	A	93.4	Very high	93.5	Very high	12 Å²	12	40.7 Å²	40.7	10%	0.099	18%	0.179	C	C	.	.	H	α-helix	trans	-59.4	-35.3	174.5	0	0	0	0	0	113.2	T1031 L1032 D1037 T1038 W1041 I1049	T1031-A1035 PolarHBondContact O-N 2.68Å; L1032-A1035 WeakPolarHBondContact O-CB 3.35Å; L1032-A1035 PolarHBondContact O-N 2.95Å; A1035-D1037 VanDerWaalsContact C-N 3.31Å; A1035-T1038 PolarHBondContact O-OG1 3.49Å; A1035-W1041 HydrophobicContact CB-CH2 3.75Å; A1035-W1041 HydrophobicContact CB-CZ2 3.81Å; A1035-W1041 WeakPolarHBondContact O-CZ2 3.38Å; A1035-I1049 HydrophobicContact CB-CD1 4.43Å; A1035-I1049 HydrophobicContact CB-CG2 4.38Å
1036	L	91.4	Very high	93.4	Very high	81 Å²	81	44.4 Å²	44.4	42%	0.424	20%	0.197	S	C	.	.	H	α-helix	trans	-69.6	-25.7	173.4	-71.1	173.9	0	0	0	113.5	L1032 K1033 L1034 L1101 I1105	L1032-L1036 WeakPolarHBondContact O-CG 3.3Å; L1032-L1036 PolarHBondContact O-N 2.91Å; K1033-L1036 PolarHBondContact O-N 3.17Å; L1034-L1036 VanDerWaalsContact C-N 3.28Å; L1034-L1036 PolarHBondContact O-N 3.13Å; L1036-L1101 HydrophobicContact CD1-CB 4.29Å; L1036-L1101 HydrophobicContact CD1-CD1 4.28Å; L1036-L1101 HydrophobicContact CD1-CD2 4.15Å; L1036-L1101 HydrophobicContact CD1-CG 4.47Å; L1036-I1105 HydrophobicContact CD1-CD1 4.36Å; L1036-I1105 HydrophobicContact CD1-CG1 3.91Å; L1036-I1105 HydrophobicContact CD2-CG1 4.45Å
1037	D	89.9	Confident	93.4	Very high	31 Å²	31	51.5 Å²	51.5	17%	0.166	23%	0.228	C	C	.	.	H	α-helix	trans	-86.2	-28.3	177.1	-71.6	-17.2	0	0	0	112.8	H895 W982 K1033 L1034 A1035 R1039	H895-D1037 IonicContact CE1-OD2 2.78Å; H895-D1037 IonicContact NE2-OD2 2.76Å; H895-D1037 PolarHBondContact NE2-OD2 2.87Å; W982-D1037 WeakPolarHBondContact CH2-OD2 3.4Å; K1033-D1037 IonicContact NZ-OD1 2.73Å; K1033-D1037 PolarHBondContact NZ-OD1 3.46Å; K1033-D1037 IonicContact NZ-OD2 2.89Å; K1033-D1037 PolarHBondContact NZ-OD2 3.48Å; K1033-D1037 PolarHBondContact O-N 2.88Å; L1034-D1037 PolarHBondContact O-N 3.04Å; A1035-D1037 VanDerWaalsContact C-N 3.31Å; D1037-R1039 PolarHBondContact O-N 3.36Å
1038	T	90.4	Very high	93.4	Very high	8 Å²	8	52.6 Å²	52.6	5%	0.049	24%	0.235	C	C	.	.			trans	-64.8	119.5	177.1	62.1	0	0	0	0	111.3	Y946 L1034 A1035 W1041 I1049	Y946-T1038 HydrophobicContact CD2-CG2 3.4Å; Y946-T1038 HydrophobicContact CE2-CG2 3.97Å; Y946-T1038 HydrophobicContact CG-CG2 4.29Å; L1034-T1038 HydrophobicContact CG-CG2 4.41Å; L1034-T1038 WeakPolarHBondContact O-CG2 3.36Å; L1034-T1038 PolarHBondContact O-N 2.96Å; A1035-T1038 PolarHBondContact O-OG1 3.49Å; T1038-W1041 PolarHBondContact O-NE1 2.91Å; T1038-W1041 WeakPolarHBondContact OG1-CZ2 3.46Å; T1038-W1041 PolarHBondContact OG1-NE1 3.13Å; T1038-I1049 HydrophobicContact CG2-CD1 4.28Å
1039	R	88.9	Confident	93.3	Very high	179 Å²	179	50.3 Å²	50.3	68%	0.675	22%	0.224	S	C	*	.			trans	-99	-32.2	175.7	-54.6	-174.5	177.5	-174	-2.5	112.1	E950 H952 D1037	E950-R1039 VanDerWaalsContact OE1-CB 3.26Å; E950-R1039 WeakPolarHBondContact OE1-CB 3.31Å; E950-R1039 PolarHBondContact OE1-N 3.23Å; E950-R1039 PolarHBondContact OE2-N 3.46Å; H952-R1039 WeakPolarHBondContact O-CD 3.42Å; H952-R1039 PolarHBondContact O-NH1 3.31Å; D1037-R1039 PolarHBondContact O-N 3.36Å
1040	H	88.4	Confident	93.3	Very high	72 Å²	72	56.2 Å²	56.2	33%	0.333	25%	0.247	S	C	.	.	S	Bend	trans	-99.5	88.2	179.7	-169.2	64.6	0	0	0	110.6	E950 Q951 T1042 N1045	E950-H1040 PolarHBondContact OE2-N 2.87Å; Q951-H1040 HydrophobicContact CB-CB 4.05Å; H1040-T1042 VanDerWaalsContact CD2-CG2 3.47Å; H1040-T1042 WeakPolarHBondContact CD2-CG2 3.38Å; H1040-T1042 PolarHBondContact O-N 3Å; H1040-N1045 PolarHBondContact O-ND2 3.5Å
1041	W	91.5	Very high	93.3	Very high	93 Å²	93	57.8 Å²	57.8	35%	0.352	26%	0.263	S	S	.	.			trans	-76.2	109.8	177.5	-77.9	90.1	0	0	0	111.2	A1035 T1038 N1045 H1046 I1049 W1050	A1035-W1041 HydrophobicContact CB-CH2 3.75Å; A1035-W1041 HydrophobicContact CB-CZ2 3.81Å; A1035-W1041 WeakPolarHBondContact O-CZ2 3.38Å; T1038-W1041 PolarHBondContact O-NE1 2.91Å; T1038-W1041 WeakPolarHBondContact OG1-CZ2 3.46Å; T1038-W1041 PolarHBondContact OG1-NE1 3.13Å; W1041-N1045 HydrophobicContact CE3-CB 4.33Å; W1041-H1046 AromaticContact CD2-CE1 3.78Å; W1041-H1046 AromaticContact CE3-CE1 3.11Å; W1041-H1046 AromaticContact CE3-CG 3.82Å; W1041-H1046 AromaticContact CE3-ND1 3.22Å; W1041-H1046 AromaticContact CE3-NE2 3.65Å; W1041-H1046 AromaticContact CZ3-CE1 3.55Å; W1041-H1046 AromaticContact CZ3-ND1 3.26Å; W1041-H1046 VanDerWaalsContact CZ3-ND1 3.26Å; W1041-H1046 WeakPolarHBondContact CZ3-ND1 3.37Å; W1041-I1049 HydrophobicContact CH2-CD1 3.76Å; W1041-I1049 HydrophobicContact CZ3-CD1 3.78Å; W1041-W1050 HydrophobicContact CH2-CZ2 4.36Å
1042	T	92.4	Very high	93.3	Very high	28 Å²	28	58.2 Å²	58.2	17%	0.172	27%	0.266	C	S	.	.			trans	-103.8	164.1	172.2	65.7	0	0	0	0	110.3	H1040 I1044 N1045 H1046	H1040-T1042 VanDerWaalsContact CD2-CG2 3.47Å; H1040-T1042 WeakPolarHBondContact CD2-CG2 3.38Å; H1040-T1042 PolarHBondContact O-N 3Å; T1042-I1044 PolarHBondContact O-N 3.3Å; T1042-N1045 PolarHBondContact O-N 3.28Å; T1042-N1045 VanDerWaalsContact O-N 3.14Å; T1042-N1045 VanDerWaalsContact OG1-CG 3.28Å; T1042-N1045 PolarHBondContact OG1-N 3.09Å; T1042-N1045 PolarHBondContact OG1-ND2 3.34Å; T1042-H1046 PolarHBondContact O-CD2 3.25Å; T1042-H1046 PolarHBondContact O-N 2.95Å
1043	W	95.1	Very high	93.3	Very high	198 Å²	198	56.9 Å²	56.9	75%	0.75	26%	0.259	S	S	*	.	H	α-helix	trans	-58.8	-33.7	172.5	71.8	-97.7	0	0	0	112.2	H1046 F1047	W1043-H1046 PolarHBondContact O-N 3.49Å; W1043-F1047 VanDerWaalsContact O-CB 3.32Å; W1043-F1047 WeakPolarHBondContact O-CB 3.35Å; W1043-F1047 PolarHBondContact O-N 2.92Å
1044	I	93.9	Very high	93.4	Very high	54 Å²	54	59.7 Å²	59.7	28%	0.277	28%	0.283	S	S	.	.	H	α-helix	trans	-66.9	-44.9	175.5	-55.3	175.6	0	0	0	110.3	L949 T1042 H1046 F1047 V1048	L949-I1044 HydrophobicContact CD1-CB 3.63Å; L949-I1044 HydrophobicContact CD1-CD1 3.77Å; L949-I1044 HydrophobicContact CD1-CG1 4.23Å; L949-I1044 HydrophobicContact CD1-CG2 3.69Å; T1042-I1044 PolarHBondContact O-N 3.3Å; I1044-H1046 VanDerWaalsContact C-N 3.34Å; I1044-H1046 PolarHBondContact O-N 2.94Å; I1044-F1047 PolarHBondContact O-N 3.42Å; I1044-V1048 HydrophobicContact CG2-CG2 4.04Å; I1044-V1048 WeakPolarHBondContact O-CB 3.49Å; I1044-V1048 VanDerWaalsContact O-CG2 3.32Å; I1044-V1048 WeakPolarHBondContact O-CG2 3.28Å; I1044-V1048 PolarHBondContact O-N 3.02Å
1045	N	91.8	Very high	93.4	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-42.4	178	-71.6	-16	0	0	0	111	H1040 W1041 T1042 I1049	H1040-N1045 PolarHBondContact O-ND2 3.5Å; W1041-N1045 HydrophobicContact CE3-CB 4.33Å; T1042-N1045 PolarHBondContact O-N 3.28Å; T1042-N1045 VanDerWaalsContact O-N 3.14Å; T1042-N1045 VanDerWaalsContact OG1-CG 3.28Å; T1042-N1045 PolarHBondContact OG1-N 3.09Å; T1042-N1045 PolarHBondContact OG1-ND2 3.34Å; N1045-I1049 WeakPolarHBondContact O-CB 3.36Å; N1045-I1049 WeakPolarHBondContact O-CD1 3.41Å; N1045-I1049 WeakPolarHBondContact O-CG1 3.46Å; N1045-I1049 PolarHBondContact O-N 3.19Å
1046	H	93.8	Very high	93.5	Very high	79 Å²	79	63.3 Å²	63.3	37%	0.366	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-51.3	171.3	-74.2	-56.5	0	0	0	112.8	W1041 T1042 W1043 I1044 V1048 W1050	W1041-H1046 AromaticContact CD2-CE1 3.78Å; W1041-H1046 AromaticContact CE3-CE1 3.11Å; W1041-H1046 AromaticContact CE3-CG 3.82Å; W1041-H1046 AromaticContact CE3-ND1 3.22Å; W1041-H1046 AromaticContact CE3-NE2 3.65Å; W1041-H1046 AromaticContact CZ3-CE1 3.55Å; W1041-H1046 AromaticContact CZ3-ND1 3.26Å; W1041-H1046 VanDerWaalsContact CZ3-ND1 3.26Å; W1041-H1046 WeakPolarHBondContact CZ3-ND1 3.37Å; T1042-H1046 PolarHBondContact O-CD2 3.25Å; T1042-H1046 PolarHBondContact O-N 2.95Å; W1043-H1046 PolarHBondContact O-N 3.49Å; I1044-H1046 VanDerWaalsContact C-N 3.34Å; I1044-H1046 PolarHBondContact O-N 2.94Å; H1046-V1048 VanDerWaalsContact C-N 3.32Å; H1046-V1048 PolarHBondContact O-N 2.88Å; H1046-W1050 AromaticContact ND1-NE1 3.42Å; H1046-W1050 PolarHBondContact ND1-NE1 3.36Å; H1046-W1050 WeakPolarHBondContact O-CB 3.41Å; H1046-W1050 PolarHBondContact O-N 2.88Å
1047	F	95.9	Very high	93.6	Very high	149 Å²	149	61.6 Å²	61.6	65%	0.654	29%	0.289	S	S	*	.	H	α-helix	trans	-57.4	-44.2	-178.6	175.6	-102.9	0	0	0	112	W1043 I1044 G1051	W1043-F1047 VanDerWaalsContact O-CB 3.32Å; W1043-F1047 WeakPolarHBondContact O-CB 3.35Å; W1043-F1047 PolarHBondContact O-N 2.92Å; I1044-F1047 PolarHBondContact O-N 3.42Å; F1047-G1051 WeakPolarHBondContact O-CA 3.44Å; F1047-G1051 PolarHBondContact O-N 3.23Å
1048	V	95.6	Very high	93.8	Very high	24 Å²	24	66.2 Å²	66.2	15%	0.145	31%	0.308	C	S	.	.	H	α-helix	trans	-77.7	-43	-176.9	179.3	0	0	0	0	112.2	M941 P942 A945 I1044 H1046 S1052	M941-V1048 HydrophobicContact CB-CG1 3.57Å; P942-V1048 HydrophobicContact CB-CG1 4.46Å; P942-V1048 HydrophobicContact CG-CG1 4.15Å; A945-V1048 HydrophobicContact CB-CB 4.24Å; A945-V1048 HydrophobicContact CB-CG1 4.18Å; A945-V1048 HydrophobicContact CB-CG2 4.28Å; I1044-V1048 HydrophobicContact CG2-CG2 4.04Å; I1044-V1048 WeakPolarHBondContact O-CB 3.49Å; I1044-V1048 VanDerWaalsContact O-CG2 3.32Å; I1044-V1048 WeakPolarHBondContact O-CG2 3.28Å; I1044-V1048 PolarHBondContact O-N 3.02Å; H1046-V1048 VanDerWaalsContact C-N 3.32Å; H1046-V1048 PolarHBondContact O-N 2.88Å; V1048-S1052 WeakPolarHBondContact O-CB 3.5Å; V1048-S1052 PolarHBondContact O-N 2.89Å; V1048-S1052 PolarHBondContact O-OG 3.2Å
1049	I	95	Very high	94	Very high	3 Å²	3	66.7 Å²	66.7	2%	0.015	31%	0.31	C	S	.	.	H	α-helix	trans	-64.5	-50.4	179.7	-70.3	169.4	0	0	0	110.6	P942 T1031 A1035 T1038 W1041 N1045 L1053	P942-I1049 HydrophobicContact CB-CG1 4.2Å; T1031-I1049 HydrophobicContact CG2-CG2 4.05Å; A1035-I1049 HydrophobicContact CB-CD1 4.43Å; A1035-I1049 HydrophobicContact CB-CG2 4.38Å; T1038-I1049 HydrophobicContact CG2-CD1 4.28Å; W1041-I1049 HydrophobicContact CH2-CD1 3.76Å; W1041-I1049 HydrophobicContact CZ3-CD1 3.78Å; N1045-I1049 WeakPolarHBondContact O-CB 3.36Å; N1045-I1049 WeakPolarHBondContact O-CD1 3.41Å; N1045-I1049 WeakPolarHBondContact O-CG1 3.46Å; N1045-I1049 PolarHBondContact O-N 3.19Å; I1049-L1053 PolarHBondContact O-N 3.05Å
1050	W	95.9	Very high	94.2	Very high	124 Å²	124	58.1 Å²	58.1	47%	0.47	28%	0.277	S	S	.	.	H	α-helix	trans	-73.6	-36.5	179.4	-54.2	136.9	0	0	0	111.9	L1032 W1041 H1046 S1052 L1053 A1054	L1032-W1050 HydrophobicContact CD2-CH2 4.23Å; L1032-W1050 HydrophobicContact CD2-CZ3 3.96Å; W1041-W1050 HydrophobicContact CH2-CZ2 4.36Å; H1046-W1050 AromaticContact ND1-NE1 3.42Å; H1046-W1050 PolarHBondContact ND1-NE1 3.36Å; H1046-W1050 WeakPolarHBondContact O-CB 3.41Å; H1046-W1050 PolarHBondContact O-N 2.88Å; W1050-S1052 PolarHBondContact O-N 3.26Å; W1050-L1053 HydrophobicContact CE3-CD1 4.14Å; W1050-L1053 HydrophobicContact CZ3-CD1 4.22Å; W1050-L1053 PolarHBondContact O-N 3.32Å; W1050-A1054 WeakPolarHBondContact O-CB 3.39Å; W1050-A1054 PolarHBondContact O-N 2.88Å
1051	G	95.8	Very high	94.3	Very high	33 Å²	33	59.5 Å²	59.5	34%	0.34	28%	0.283	S	S	.	.	H	α-helix	trans	-60.5	-41.1	174.6	0	0	0	0	0	113	F1047 A1054 F1055	F1047-G1051 WeakPolarHBondContact O-CA 3.44Å; F1047-G1051 PolarHBondContact O-N 3.23Å; G1051-A1054 PolarHBondContact O-N 2.99Å; G1051-F1055 WeakPolarHBondContact O-CB 3.41Å; G1051-F1055 PolarHBondContact O-N 3.07Å
1052	S	95.6	Very high	94.3	Very high	10 Å²	10	59.5 Å²	59.5	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-65.2	-38.1	175.3	-81.5	0	0	0	0	113.2	F938 P942 V1048 W1050 Y1056	F938-S1052 WeakPolarHBondContact O-CB 3.45Å; P942-S1052 WeakPolarHBondContact CD-OG 3.36Å; P942-S1052 WeakPolarHBondContact CG-OG 3.49Å; V1048-S1052 WeakPolarHBondContact O-CB 3.5Å; V1048-S1052 PolarHBondContact O-N 2.89Å; V1048-S1052 PolarHBondContact O-OG 3.2Å; W1050-S1052 PolarHBondContact O-N 3.26Å; S1052-Y1056 PolarHBondContact O-N 3.1Å
1053	L	95.6	Very high	94.2	Very high	13 Å²	13	60.3 Å²	60.3	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-70	-44.5	175.3	-68	-179.7	0	0	0	111.9	V1027 F1028 T1031 I1049 W1050 F1055 Y1056 V1057	V1027-L1053 HydrophobicContact CG1-CD2 4.09Å; F1028-L1053 HydrophobicContact CD1-CD1 4.09Å; F1028-L1053 HydrophobicContact CD1-CD2 4.17Å; F1028-L1053 HydrophobicContact CD2-CD2 4.14Å; F1028-L1053 HydrophobicContact CE1-CD1 4.14Å; F1028-L1053 HydrophobicContact CE1-CD2 4.36Å; F1028-L1053 HydrophobicContact CE2-CD2 4.34Å; F1028-L1053 HydrophobicContact CG-CD2 4.06Å; F1028-L1053 HydrophobicContact CZ-CB 4.5Å; F1028-L1053 HydrophobicContact CZ-CD2 4.45Å; T1031-L1053 HydrophobicContact CG2-CD1 4.22Å; T1031-L1053 HydrophobicContact CG2-CD2 3.99Å; T1031-L1053 HydrophobicContact CG2-CG 3.92Å; I1049-L1053 PolarHBondContact O-N 3.05Å; W1050-L1053 HydrophobicContact CE3-CD1 4.14Å; W1050-L1053 HydrophobicContact CZ3-CD1 4.22Å; W1050-L1053 PolarHBondContact O-N 3.32Å; L1053-F1055 VanDerWaalsContact C-N 3.35Å; L1053-F1055 PolarHBondContact O-N 3.33Å; L1053-Y1056 PolarHBondContact O-N 3.28Å; L1053-V1057 WeakPolarHBondContact O-CG2 3.29Å; L1053-V1057 PolarHBondContact O-N 3.45Å; L1053-V1057 VanDerWaalsContact O-N 3.13Å
1054	A	95.9	Very high	93.9	Very high	62 Å²	62	51.1 Å²	51.1	51%	0.512	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-41.7	175.1	0	0	0	0	0	111.8	W1050 G1051 V1057 F1058	W1050-A1054 WeakPolarHBondContact O-CB 3.39Å; W1050-A1054 PolarHBondContact O-N 2.88Å; G1051-A1054 PolarHBondContact O-N 2.99Å; A1054-V1057 PolarHBondContact O-N 3.48Å; A1054-F1058 WeakPolarHBondContact O-CB 3.44Å; A1054-F1058 PolarHBondContact O-N 3.37Å
1055	F	95.3	Very high	93.5	Very high	87 Å²	87	50.7 Å²	50.7	38%	0.382	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-37.9	175.9	177.6	-102.7	0	0	0	112.5	C937 F938 G1051 L1053 F1059	C937-F1055 HydrophobicContact CB-CE1 4.04Å; F938-F1055 AromaticContact CD1-CD1 3.87Å; F938-F1055 HydrophobicContact CD1-CD1 3.87Å; F938-F1055 AromaticContact CD1-CE1 3.96Å; F938-F1055 HydrophobicContact CD1-CE1 3.96Å; F938-F1055 AromaticContact CE1-CD1 3.96Å; F938-F1055 HydrophobicContact CE1-CD1 3.96Å; F938-F1055 AromaticContact CE1-CE1 3.76Å; F938-F1055 HydrophobicContact CE1-CE1 3.76Å; G1051-F1055 WeakPolarHBondContact O-CB 3.41Å; G1051-F1055 PolarHBondContact O-N 3.07Å; L1053-F1055 VanDerWaalsContact C-N 3.35Å; L1053-F1055 PolarHBondContact O-N 3.33Å; F1055-F1059 WeakPolarHBondContact O-CB 3.36Å; F1055-F1059 PolarHBondContact O-N 2.93Å
1056	Y	95.3	Very high	93.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-46.5	173.1	165.2	-112.6	0	0	0	112.1	Y930 F938 F1023 T1024 V1027 F1028 S1052 L1053 F1059 S1060	Y930-Y1056 HydrophobicContact CE1-CE2 4.36Å; F938-Y1056 HydrophobicContact CD1-CD2 4.38Å; F938-Y1056 AromaticContact CD2-CD2 4Å; F938-Y1056 HydrophobicContact CD2-CD2 4Å; F938-Y1056 HydrophobicContact CE1-CD2 4.19Å; F938-Y1056 AromaticContact CE2-CD2 3.79Å; F938-Y1056 HydrophobicContact CE2-CD2 3.79Å; F938-Y1056 HydrophobicContact CE2-CE2 4.35Å; F938-Y1056 HydrophobicContact CG-CD2 4.32Å; F938-Y1056 AromaticContact CZ-CD2 3.9Å; F938-Y1056 HydrophobicContact CZ-CD2 3.9Å; F1023-Y1056 AromaticContact CD1-CE2 3.63Å; F1023-Y1056 HydrophobicContact CD1-CE2 3.63Å; F1023-Y1056 AromaticContact CD1-CZ 3.9Å; F1023-Y1056 HydrophobicContact CE1-CD2 4.08Å; F1023-Y1056 AromaticContact CE1-CE2 3.54Å; F1023-Y1056 HydrophobicContact CE1-CE2 3.54Å; T1024-Y1056 HydrophobicContact CG2-CE1 4.32Å; T1024-Y1056 PolarHBondContact OG1-OH 3.18Å; T1024-Y1056 VanDerWaalsContact OG1-OH 3.05Å; V1027-Y1056 HydrophobicContact CB-CD1 4.32Å; V1027-Y1056 HydrophobicContact CB-CE1 4.49Å; V1027-Y1056 HydrophobicContact CG1-CD1 3.88Å; V1027-Y1056 HydrophobicContact CG1-CG 3.9Å; F1028-Y1056 HydrophobicContact CE2-CD1 4.03Å; F1028-Y1056 HydrophobicContact CE2-CE1 4.22Å; S1052-Y1056 PolarHBondContact O-N 3.1Å; L1053-Y1056 PolarHBondContact O-N 3.28Å; Y1056-F1059 PolarHBondContact O-N 3.37Å; Y1056-S1060 WeakPolarHBondContact CE2-OG 3.46Å; Y1056-S1060 WeakPolarHBondContact O-CB 3.48Å; Y1056-S1060 PolarHBondContact O-N 2.63Å; Y1056-S1060 PolarHBondContact O-OG 2.82Å
1057	V	94	Very high	93	Very high	45 Å²	45	55 Å²	55	27%	0.273	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-47.2	177.9	174	0	0	0	0	110.7	F1028 L1053 A1054 S1060 F1061 F1080	F1028-V1057 HydrophobicContact CE2-CG2 4.27Å; F1028-V1057 HydrophobicContact CZ-CG2 4.15Å; L1053-V1057 WeakPolarHBondContact O-CG2 3.29Å; L1053-V1057 PolarHBondContact O-N 3.45Å; L1053-V1057 VanDerWaalsContact O-N 3.13Å; A1054-V1057 PolarHBondContact O-N 3.48Å; V1057-S1060 PolarHBondContact O-N 2.95Å; V1057-F1061 HydrophobicContact CG1-CD2 3.96Å; V1057-F1061 HydrophobicContact CG1-CE2 3.93Å; V1057-F1061 WeakPolarHBondContact O-CD2 3.3Å; V1057-F1061 PolarHBondContact O-N 3.47Å; V1057-F1080 HydrophobicContact CG1-CE1 4.11Å; V1057-F1080 HydrophobicContact CG1-CZ 4.3Å; V1057-F1080 WeakPolarHBondContact O-CE1 3.47Å
1058	F	94.4	Very high	92.5	Very high	128 Å²	128	50.1 Å²	50.1	56%	0.561	26%	0.262	S	S	*	.	H	α-helix	trans	-59.1	-47.8	175.6	173.7	-97.5	0	0	0	112.2	A1054 S1060 F1061 F1062	A1054-F1058 WeakPolarHBondContact O-CB 3.44Å; A1054-F1058 PolarHBondContact O-N 3.37Å; F1058-S1060 VanDerWaalsContact C-N 3.32Å; F1058-S1060 PolarHBondContact O-N 3.29Å; F1058-F1061 PolarHBondContact O-N 2.89Å; F1058-F1062 HydrophobicContact CE1-CB 4.4Å; F1058-F1062 HydrophobicContact CZ-CB 4.47Å; F1058-F1062 VanDerWaalsContact O-CB 3.32Å; F1058-F1062 WeakPolarHBondContact O-CB 3.48Å; F1058-F1062 PolarHBondContact O-N 3.41Å
1059	F	93.8	Very high	92.1	Very high	18 Å²	18	55.2 Å²	55.2	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-42.8	178.4	178.1	-87	0	0	0	111.5	A929 Y930 M933 F938 F1055 Y1056 F1061 F1062 W1063	A929-F1059 HydrophobicContact CB-CE1 4.38Å; A929-F1059 HydrophobicContact CB-CZ 4.26Å; Y930-F1059 HydrophobicContact CD1-CE1 4.34Å; Y930-F1059 HydrophobicContact CE1-CD1 4.33Å; Y930-F1059 HydrophobicContact CE1-CE1 4.23Å; M933-F1059 HydrophobicContact CE-CE2 3.97Å; M933-F1059 HydrophobicContact CE-CZ 4.34Å; M933-F1059 HydrophobicContact CG-CE1 4.41Å; M933-F1059 HydrophobicContact CG-CE2 4.25Å; M933-F1059 HydrophobicContact CG-CZ 3.99Å; F938-F1059 HydrophobicContact CE1-CB 4.08Å; F938-F1059 HydrophobicContact CE1-CD1 4.2Å; F938-F1059 HydrophobicContact CE1-CG 4.1Å; F938-F1059 HydrophobicContact CZ-CB 4.31Å; F938-F1059 AromaticContact CZ-CD1 3.59Å; F938-F1059 HydrophobicContact CZ-CD1 3.59Å; F938-F1059 HydrophobicContact CZ-CE1 4.12Å; F938-F1059 AromaticContact CZ-CG 3.97Å; F938-F1059 HydrophobicContact CZ-CG 3.97Å; F1055-F1059 WeakPolarHBondContact O-CB 3.36Å; F1055-F1059 PolarHBondContact O-N 2.93Å; Y1056-F1059 PolarHBondContact O-N 3.37Å; F1059-F1061 PolarHBondContact O-N 2.94Å; F1059-F1062 PolarHBondContact O-N 2.97Å; F1059-W1063 HydrophobicContact CD1-CB 4.28Å; F1059-W1063 HydrophobicContact CE1-CB 3.89Å; F1059-W1063 HydrophobicContact CE1-CG 4.03Å; F1059-W1063 HydrophobicContact CZ-CB 4.02Å; F1059-W1063 HydrophobicContact CZ-CD2 4.13Å; F1059-W1063 HydrophobicContact CZ-CE3 4.38Å; F1059-W1063 AromaticContact CZ-CG 3.98Å; F1059-W1063 HydrophobicContact CZ-CG 3.98Å; F1059-W1063 WeakPolarHBondContact O-CB 3.4Å; F1059-W1063 PolarHBondContact O-N 2.92Å
1060	S	92.1	Very high	91.6	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.3	-34.3	-179.1	-57.4	0	0	0	0	112.4	Y930 Y1056 V1057 F1058 G1064	Y930-S1060 PolarHBondContact OH-OG 3.45Å; Y1056-S1060 WeakPolarHBondContact CE2-OG 3.46Å; Y1056-S1060 WeakPolarHBondContact O-CB 3.48Å; Y1056-S1060 PolarHBondContact O-N 2.63Å; Y1056-S1060 PolarHBondContact O-OG 2.82Å; V1057-S1060 PolarHBondContact O-N 2.95Å; F1058-S1060 VanDerWaalsContact C-N 3.32Å; F1058-S1060 PolarHBondContact O-N 3.29Å; S1060-G1064 PolarHBondContact O-N 3.24Å
1061	F	92.1	Very high	90.9	Very high	101 Å²	101	58.2 Å²	58.2	44%	0.443	31%	0.314	S	S	.	.	H	α-helix	trans	-67.4	-48.5	168.1	-86.8	-65.5	0	0	0	112.6	V1057 F1058 F1059 G1065 F1080 A1081 L1084	V1057-F1061 HydrophobicContact CG1-CD2 3.96Å; V1057-F1061 HydrophobicContact CG1-CE2 3.93Å; V1057-F1061 WeakPolarHBondContact O-CD2 3.3Å; V1057-F1061 PolarHBondContact O-N 3.47Å; F1058-F1061 PolarHBondContact O-N 2.89Å; F1059-F1061 PolarHBondContact O-N 2.94Å; F1061-G1065 WeakPolarHBondContact O-CA 3.49Å; F1061-G1065 PolarHBondContact O-N 2.67Å; F1061-F1080 HydrophobicContact CD1-CD1 4.07Å; F1061-F1080 AromaticContact CD2-CD1 3.88Å; F1061-F1080 HydrophobicContact CD2-CD1 3.88Å; F1061-F1080 AromaticContact CD2-CE1 3.62Å; F1061-F1080 HydrophobicContact CD2-CE1 3.62Å; F1061-F1080 HydrophobicContact CE1-CD1 4.26Å; F1061-F1080 HydrophobicContact CE2-CD1 4.08Å; F1061-F1080 AromaticContact CE2-CE1 3.72Å; F1061-F1080 HydrophobicContact CE2-CE1 3.72Å; F1061-F1080 AromaticContact CG-CD1 3.87Å; F1061-F1080 HydrophobicContact CG-CD1 3.87Å; F1061-F1080 HydrophobicContact CG-CE1 4.09Å; F1061-F1080 HydrophobicContact CZ-CD1 4.27Å; F1061-F1080 HydrophobicContact CZ-CE1 4.29Å; F1061-A1081 HydrophobicContact CE1-CB 4.38Å; F1061-L1084 HydrophobicContact CE2-CD1 3.73Å; F1061-L1084 HydrophobicContact CZ-CD1 3.6Å
1062	F	91.3	Very high	89.9	Confident	92 Å²	92	66 Å²	66	40%	0.404	34%	0.339	S	S	.	.	H	α-helix	trans	-64.5	-47.6	-177	177.8	-103.9	0	0	0	112.4	F1058 F1059 I1066 W1068	F1058-F1062 HydrophobicContact CE1-CB 4.4Å; F1058-F1062 HydrophobicContact CZ-CB 4.47Å; F1058-F1062 VanDerWaalsContact O-CB 3.32Å; F1058-F1062 WeakPolarHBondContact O-CB 3.48Å; F1058-F1062 PolarHBondContact O-N 3.41Å; F1059-F1062 PolarHBondContact O-N 2.97Å; F1062-I1066 HydrophobicContact CD2-CD1 3.83Å; F1062-I1066 HydrophobicContact CE2-CD1 3.52Å; F1062-I1066 HydrophobicContact CZ-CD1 4.01Å; F1062-I1066 PolarHBondContact O-N 2.78Å; F1062-W1068 HydrophobicContact CD1-CZ2 4.1Å; F1062-W1068 AromaticContact CE1-CH2 3.6Å; F1062-W1068 HydrophobicContact CE1-CH2 3.6Å; F1062-W1068 AromaticContact CE1-CZ2 3.61Å; F1062-W1068 HydrophobicContact CE1-CZ2 3.61Å; F1062-W1068 AromaticContact CZ-CH2 3.64Å; F1062-W1068 HydrophobicContact CZ-CH2 3.64Å; F1062-W1068 AromaticContact CZ-CZ2 3.97Å; F1062-W1068 HydrophobicContact CZ-CZ2 3.97Å
1063	W	89.4	Confident	88.9	Confident	46 Å²	46	71.1 Å²	71.1	17%	0.174	36%	0.361	C	S	.	.	H	α-helix	trans	-69.2	-39	179.8	-171.8	-108.7	0	0	0	112.2	A929 F1059 W1068 F1070 L1071	A929-W1063 HydrophobicContact CB-CD2 4.36Å; A929-W1063 HydrophobicContact CB-CZ2 3.89Å; A929-W1063 VanDerWaalsContact CB-NE1 3.32Å; F1059-W1063 HydrophobicContact CD1-CB 4.28Å; F1059-W1063 HydrophobicContact CE1-CB 3.89Å; F1059-W1063 HydrophobicContact CE1-CG 4.03Å; F1059-W1063 HydrophobicContact CZ-CB 4.02Å; F1059-W1063 HydrophobicContact CZ-CD2 4.13Å; F1059-W1063 HydrophobicContact CZ-CE3 4.38Å; F1059-W1063 AromaticContact CZ-CG 3.98Å; F1059-W1063 HydrophobicContact CZ-CG 3.98Å; F1059-W1063 WeakPolarHBondContact O-CB 3.4Å; F1059-W1063 PolarHBondContact O-N 2.92Å; W1063-W1068 AromaticContact CE3-CE2 3.82Å; W1063-W1068 HydrophobicContact CE3-CZ2 4.09Å; W1063-W1068 AromaticContact CE3-NE1 3.62Å; W1063-W1068 HydrophobicContact CZ3-CD2 4.33Å; W1063-W1068 HydrophobicContact CZ3-CZ2 4.42Å; W1063-W1068 PolarHBondContact O-NE1 3.46Å; W1063-F1070 HydrophobicContact CH2-CE2 4.06Å; W1063-F1070 AromaticContact CH2-CZ 3.93Å; W1063-F1070 HydrophobicContact CH2-CZ 3.93Å; W1063-F1070 HydrophobicContact CZ3-CZ 4.08Å; W1063-L1071 HydrophobicContact CH2-CD1 4.15Å; W1063-L1071 HydrophobicContact CH2-CD2 4.28Å; W1063-L1071 HydrophobicContact CZ2-CD1 3.79Å; W1063-L1071 HydrophobicContact CZ2-CD2 4.19Å
1064	G	88.7	Confident	88.3	Confident	5 Å²	5	73.6 Å²	73.6	5%	0.052	37%	0.373	C	S	.	.	H	α-helix	trans	-81.4	-20.3	178.3	0	0	0	0	0	115.1	S1060 Y1077 F1078	S1060-G1064 PolarHBondContact O-N 3.24Å; G1064-Y1077 CarbonylContact O-C 3.59Å; G1064-Y1077 WeakPolarHBondContact O-CA 3.29Å; G1064-F1078 PolarHBondContact O-N 3.43Å
1065	G	87.1	Confident	87.8	Confident	45 Å²	45	76.2 Å²	76.2	46%	0.464	37%	0.369	S	S	.	.	H	α-helix	trans	-86.1	-26	-178.2	0	0	0	0	0	114.7	F1061	F1061-G1065 WeakPolarHBondContact O-CA 3.49Å; F1061-G1065 PolarHBondContact O-N 2.67Å
1066	I	88.1	Confident	87.4	Confident	67 Å²	67	72.5 Å²	72.5	34%	0.344	35%	0.353	S	S	.	.	S	Bend	trans	-99	135.7	-176.4	-63.2	173.6	0	0	0	110.3	F1062 W1068	F1062-I1066 HydrophobicContact CD2-CD1 3.83Å; F1062-I1066 HydrophobicContact CE2-CD1 3.52Å; F1062-I1066 HydrophobicContact CZ-CD1 4.01Å; F1062-I1066 PolarHBondContact O-N 2.78Å; I1066-W1068 HydrophobicContact CB-CD2 4.39Å; I1066-W1068 HydrophobicContact CB-CZ2 3.91Å; I1066-W1068 HydrophobicContact CD1-CH2 4.06Å; I1066-W1068 HydrophobicContact CD1-CZ2 3.88Å; I1066-W1068 HydrophobicContact CG1-CZ2 4.45Å; I1066-W1068 HydrophobicContact CG2-CD2 3.84Å; I1066-W1068 HydrophobicContact CG2-CE3 4.12Å; I1066-W1068 HydrophobicContact CG2-CG 4.32Å; I1066-W1068 HydrophobicContact CG2-CH2 4.27Å; I1066-W1068 HydrophobicContact CG2-CZ2 3.97Å; I1066-W1068 HydrophobicContact CG2-CZ3 4.34Å; I1066-W1068 PolarHBondContact O-NE1 2.76Å
1067	I	85.6	Confident	87.1	Confident	104 Å²	104	78.2 Å²	78.2	53%	0.533	38%	0.376	S	S	.	.			trans	-84.1	109.8	168.7	-64.3	174.2	0	0	0	107.7	P1069 Q1074 Y1077	I1067-P1069 WeakPolarHBondContact O-CD 3.42Å; I1067-Q1074 HydrophobicContact CG2-CG 4.14Å; I1067-Y1077 HydrophobicContact CD1-CD2 4.44Å; I1067-Y1077 HydrophobicContact CD1-CE2 4Å; I1067-Y1077 HydrophobicContact CG1-CD2 3.72Å; I1067-Y1077 HydrophobicContact CG1-CE2 3.59Å; I1067-Y1077 HydrophobicContact CG1-CG 4.47Å
1068	W	85.9	Confident	86.9	Confident	45 Å²	45	80.9 Å²	80.9	17%	0.17	38%	0.384	C	S	.	.			trans	-90.6	117.6	-170.5	-66.9	98.6	0	0	0	112.1	F1062 W1063 I1066 F1070 L1071 Q1074	F1062-W1068 HydrophobicContact CD1-CZ2 4.1Å; F1062-W1068 AromaticContact CE1-CH2 3.6Å; F1062-W1068 HydrophobicContact CE1-CH2 3.6Å; F1062-W1068 AromaticContact CE1-CZ2 3.61Å; F1062-W1068 HydrophobicContact CE1-CZ2 3.61Å; F1062-W1068 AromaticContact CZ-CH2 3.64Å; F1062-W1068 HydrophobicContact CZ-CH2 3.64Å; F1062-W1068 AromaticContact CZ-CZ2 3.97Å; F1062-W1068 HydrophobicContact CZ-CZ2 3.97Å; W1063-W1068 AromaticContact CE3-CE2 3.82Å; W1063-W1068 HydrophobicContact CE3-CZ2 4.09Å; W1063-W1068 AromaticContact CE3-NE1 3.62Å; W1063-W1068 HydrophobicContact CZ3-CD2 4.33Å; W1063-W1068 HydrophobicContact CZ3-CZ2 4.42Å; W1063-W1068 PolarHBondContact O-NE1 3.46Å; I1066-W1068 HydrophobicContact CB-CD2 4.39Å; I1066-W1068 HydrophobicContact CB-CZ2 3.91Å; I1066-W1068 HydrophobicContact CD1-CH2 4.06Å; I1066-W1068 HydrophobicContact CD1-CZ2 3.88Å; I1066-W1068 HydrophobicContact CG1-CZ2 4.45Å; I1066-W1068 HydrophobicContact CG2-CD2 3.84Å; I1066-W1068 HydrophobicContact CG2-CE3 4.12Å; I1066-W1068 HydrophobicContact CG2-CG 4.32Å; I1066-W1068 HydrophobicContact CG2-CH2 4.27Å; I1066-W1068 HydrophobicContact CG2-CZ2 3.97Å; I1066-W1068 HydrophobicContact CG2-CZ3 4.34Å; I1066-W1068 PolarHBondContact O-NE1 2.76Å; W1068-F1070 HydrophobicContact CB-CD1 4.39Å; W1068-F1070 HydrophobicContact CB-CE1 4.05Å; W1068-F1070 HydrophobicContact CB-CZ 4.16Å; W1068-F1070 HydrophobicContact CD2-CE1 4.08Å; W1068-F1070 HydrophobicContact CD2-CZ 4.22Å; W1068-F1070 HydrophobicContact CE3-CD1 4.48Å; W1068-F1070 AromaticContact CE3-CE1 3.53Å; W1068-F1070 HydrophobicContact CE3-CE1 3.53Å; W1068-F1070 HydrophobicContact CE3-CZ 4.07Å; W1068-F1070 HydrophobicContact CG-CE1 4.33Å; W1068-F1070 HydrophobicContact CG-CZ 4.29Å; W1068-F1070 HydrophobicContact CZ3-CE1 4.31Å; W1068-F1070 PolarHBondContact O-N 2.82Å; W1068-L1071 HydrophobicContact CB-CB 4.25Å; W1068-L1071 HydrophobicContact CB-CD1 3.77Å; W1068-L1071 HydrophobicContact CB-CG 3.75Å; W1068-L1071 HydrophobicContact CG-CD1 4.09Å; W1068-L1071 HydrophobicContact CG-CG 4.48Å; W1068-L1071 PolarHBondContact O-N 3.24Å; W1068-Q1074 VanDerWaalsContact N-OE1 3.12Å; W1068-Q1074 PolarHBondContact O-NE2 2.66Å
1069	P	86.2	Confident	86.7	Confident	131 Å²	131	75.6 Å²	75.6	85%	0.851	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-22.5	-174.6	-26.8	36	0	0	0	115.5	I1067	I1067-P1069 WeakPolarHBondContact O-CD 3.42Å
1070	F	85.9	Confident	86.5	Confident	137 Å²	137	75 Å²	75	60%	0.601	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-9.2	179.1	64.8	-98.7	0	0	0	114.1	W1063 W1068	W1063-F1070 HydrophobicContact CH2-CE2 4.06Å; W1063-F1070 AromaticContact CH2-CZ 3.93Å; W1063-F1070 HydrophobicContact CH2-CZ 3.93Å; W1063-F1070 HydrophobicContact CZ3-CZ 4.08Å; W1068-F1070 HydrophobicContact CB-CD1 4.39Å; W1068-F1070 HydrophobicContact CB-CE1 4.05Å; W1068-F1070 HydrophobicContact CB-CZ 4.16Å; W1068-F1070 HydrophobicContact CD2-CE1 4.08Å; W1068-F1070 HydrophobicContact CD2-CZ 4.22Å; W1068-F1070 HydrophobicContact CE3-CD1 4.48Å; W1068-F1070 AromaticContact CE3-CE1 3.53Å; W1068-F1070 HydrophobicContact CE3-CE1 3.53Å; W1068-F1070 HydrophobicContact CE3-CZ 4.07Å; W1068-F1070 HydrophobicContact CG-CE1 4.33Å; W1068-F1070 HydrophobicContact CG-CZ 4.29Å; W1068-F1070 HydrophobicContact CZ3-CE1 4.31Å; W1068-F1070 PolarHBondContact O-N 2.82Å
1071	L	81.2	Confident	86.4	Confident	53 Å²	53	76.1 Å²	76.1	28%	0.277	37%	0.369	S	S	.	.			trans	-86.7	119.9	178.8	-68	-176.5	0	0	0	111	W1063 W1068 H1073 Q1074	W1063-L1071 HydrophobicContact CH2-CD1 4.15Å; W1063-L1071 HydrophobicContact CH2-CD2 4.28Å; W1063-L1071 HydrophobicContact CZ2-CD1 3.79Å; W1063-L1071 HydrophobicContact CZ2-CD2 4.19Å; W1068-L1071 HydrophobicContact CB-CB 4.25Å; W1068-L1071 HydrophobicContact CB-CD1 3.77Å; W1068-L1071 HydrophobicContact CB-CG 3.75Å; W1068-L1071 HydrophobicContact CG-CD1 4.09Å; W1068-L1071 HydrophobicContact CG-CG 4.48Å; W1068-L1071 PolarHBondContact O-N 3.24Å; L1071-H1073 PolarHBondContact O-N 3.06Å; L1071-Q1074 PolarHBondContact O-NE2 3.2Å
1072	K	74.7	Confident	86.2	Confident	198 Å²	198	73.6 Å²	73.6	86%	0.861	36%	0.36	S	S	*	.	S	Bend	trans	-59.5	-25.5	175.1	-67	-174.3	176	-176	0	113.6
1073	H	73.9	Confident	86	Confident	117 Å²	117	69.2 Å²	69.2	54%	0.542	34%	0.341	S	S	.	.			trans	-145.8	127	178.7	-52.1	-62.5	0	0	0	110.9	L1071 R1075	L1071-H1073 PolarHBondContact O-N 3.06Å; H1073-R1075 HydrophobicContact CB-CG 3.79Å; H1073-R1075 PolarHBondContact CD2-NH2 3.15Å; H1073-R1075 PolarHBondContact O-N 3.45Å
1074	Q	83.5	Confident	85.9	Confident	65 Å²	65	68.4 Å²	68.4	30%	0.304	34%	0.34	S	S	.	.			trans	-85.1	52.2	-176.8	-52.9	-62.8	-26	0	0	112.4	I1067 W1068 L1071 L1076 Y1077	I1067-Q1074 HydrophobicContact CG2-CG 4.14Å; W1068-Q1074 VanDerWaalsContact N-OE1 3.12Å; W1068-Q1074 PolarHBondContact O-NE2 2.66Å; L1071-Q1074 PolarHBondContact O-NE2 3.2Å; Q1074-L1076 VanDerWaalsContact C-N 3.28Å; Q1074-L1076 PolarHBondContact O-N 3.37Å; Q1074-Y1077 WeakPolarHBondContact O-CB 3.43Å; Q1074-Y1077 PolarHBondContact O-N 3.47Å; Q1074-Y1077 VanDerWaalsContact O-N 3.12Å
1075	R	85.3	Confident	85.8	Confident	116 Å²	116	72 Å²	72	44%	0.438	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.8	-164.9	-65.6	176.7	178.4	-178.9	-0.1	115.6	W1016 H1073	W1016-R1075 HydrophobicContact CD2-CB 4.47Å; H1073-R1075 HydrophobicContact CB-CG 3.79Å; H1073-R1075 PolarHBondContact CD2-NH2 3.15Å; H1073-R1075 PolarHBondContact O-N 3.45Å
1076	L	86.1	Confident	85.8	Confident	10 Å²	10	69.9 Å²	69.9	5%	0.052	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	4.5	177.9	-74.2	-176.2	0	0	0	114.2	D927 Y930 W1016 Q1074 F1078 V1079	D927-L1076 HydrophobicContact CB-CD1 3.55Å; D927-L1076 HydrophobicContact CB-CD2 4.12Å; D927-L1076 HydrophobicContact CB-CG 3.83Å; Y930-L1076 HydrophobicContact CE1-CD1 4.45Å; Y930-L1076 HydrophobicContact CE2-CD1 3.97Å; Y930-L1076 HydrophobicContact CE2-CD2 4.33Å; W1016-L1076 HydrophobicContact CB-CD2 4.26Å; Q1074-L1076 VanDerWaalsContact C-N 3.28Å; Q1074-L1076 PolarHBondContact O-N 3.37Å; L1076-F1078 PolarHBondContact O-N 3.2Å; L1076-V1079 HydrophobicContact CD2-CB 4.42Å; L1076-V1079 HydrophobicContact CD2-CG1 4.38Å; L1076-V1079 WeakPolarHBondContact O-CB 3.39Å; L1076-V1079 PolarHBondContact O-N 2.91Å; L1076-V1079 VanDerWaalsContact O-N 3.12Å
1077	Y	89.9	Confident	85.8	Confident	120 Å²	120	71 Å²	71	47%	0.471	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	123.4	-175.8	-178.3	-109.3	0	0	0	111.9	G1064 I1067 Q1074 V1079	G1064-Y1077 CarbonylContact O-C 3.59Å; G1064-Y1077 WeakPolarHBondContact O-CA 3.29Å; I1067-Y1077 HydrophobicContact CD1-CD2 4.44Å; I1067-Y1077 HydrophobicContact CD1-CE2 4Å; I1067-Y1077 HydrophobicContact CG1-CD2 3.72Å; I1067-Y1077 HydrophobicContact CG1-CE2 3.59Å; I1067-Y1077 HydrophobicContact CG1-CG 4.47Å; Q1074-Y1077 WeakPolarHBondContact O-CB 3.43Å; Q1074-Y1077 PolarHBondContact O-N 3.47Å; Q1074-Y1077 VanDerWaalsContact O-N 3.12Å; Y1077-V1079 PolarHBondContact O-N 3.18Å
1078	F	89.4	Confident	85.9	Confident	100 Å²	100	67.7 Å²	67.7	44%	0.439	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	2.6	-177	-145.9	-113.5	0	0	0	116.7	G1064 L1076 F1080 A1081 N1082	G1064-F1078 PolarHBondContact O-N 3.43Å; L1076-F1078 PolarHBondContact O-N 3.2Å; F1078-F1080 PolarHBondContact O-N 3.14Å; F1078-A1081 HydrophobicContact CD1-CB 4.29Å; F1078-A1081 HydrophobicContact CD2-CB 3.86Å; F1078-A1081 HydrophobicContact CE1-CB 4.12Å; F1078-A1081 HydrophobicContact CE2-CB 3.67Å; F1078-A1081 HydrophobicContact CG-CB 4.16Å; F1078-A1081 HydrophobicContact CZ-CB 3.8Å; F1078-A1081 PolarHBondContact O-N 3.03Å; F1078-N1082 WeakPolarHBondContact CD1-OD1 3.46Å; F1078-N1082 VanDerWaalsContact CE1-OD1 3.29Å; F1078-N1082 WeakPolarHBondContact CE1-OD1 3.46Å; F1078-N1082 WeakPolarHBondContact O-CB 3.45Å; F1078-N1082 PolarHBondContact O-N 2.77Å
1079	V	89.9	Confident	85.9	Confident	17 Å²	17	65.6 Å²	65.6	10%	0.103	33%	0.33	C	S	.	.	H	α-helix	trans	-59.6	-43.8	-175.2	171.5	0	0	0	0	112.4	W1016 L1076 Y1077 M1083	W1016-V1079 HydrophobicContact CB-CG1 4.4Å; W1016-V1079 HydrophobicContact CB-CG2 4.36Å; L1076-V1079 HydrophobicContact CD2-CB 4.42Å; L1076-V1079 HydrophobicContact CD2-CG1 4.38Å; L1076-V1079 WeakPolarHBondContact O-CB 3.39Å; L1076-V1079 PolarHBondContact O-N 2.91Å; L1076-V1079 VanDerWaalsContact O-N 3.12Å; Y1077-V1079 PolarHBondContact O-N 3.18Å; V1079-M1083 WeakPolarHBondContact O-CB 3.29Å; V1079-M1083 PolarHBondContact O-N 3.27Å
1080	F	90.4	Very high	86	Confident	5 Å²	5	65.1 Å²	65.1	2%	0.022	31%	0.312	C	S	.	.	H	α-helix	trans	-72	-38.1	-178.8	-167.4	-113.3	0	0	0	112.4	T1020 V1057 F1061 F1078 M1083 L1084	T1020-F1080 HydrophobicContact CG2-CD2 3.74Å; T1020-F1080 HydrophobicContact CG2-CE2 4.41Å; V1057-F1080 HydrophobicContact CG1-CE1 4.11Å; V1057-F1080 HydrophobicContact CG1-CZ 4.3Å; V1057-F1080 WeakPolarHBondContact O-CE1 3.47Å; F1061-F1080 HydrophobicContact CD1-CD1 4.07Å; F1061-F1080 AromaticContact CD2-CD1 3.88Å; F1061-F1080 HydrophobicContact CD2-CD1 3.88Å; F1061-F1080 AromaticContact CD2-CE1 3.62Å; F1061-F1080 HydrophobicContact CD2-CE1 3.62Å; F1061-F1080 HydrophobicContact CE1-CD1 4.26Å; F1061-F1080 HydrophobicContact CE2-CD1 4.08Å; F1061-F1080 AromaticContact CE2-CE1 3.72Å; F1061-F1080 HydrophobicContact CE2-CE1 3.72Å; F1061-F1080 AromaticContact CG-CD1 3.87Å; F1061-F1080 HydrophobicContact CG-CD1 3.87Å; F1061-F1080 HydrophobicContact CG-CE1 4.09Å; F1061-F1080 HydrophobicContact CZ-CD1 4.27Å; F1061-F1080 HydrophobicContact CZ-CE1 4.29Å; F1078-F1080 PolarHBondContact O-N 3.14Å; F1080-M1083 HydrophobicContact CD2-CE 3.6Å; F1080-M1083 HydrophobicContact CE2-CE 3.51Å; F1080-M1083 HydrophobicContact CZ-CE 4.46Å; F1080-M1083 WeakPolarHBondContact O-CB 3.17Å; F1080-M1083 PolarHBondContact O-N 3.19Å; F1080-L1084 HydrophobicContact CD1-CD1 3.89Å; F1080-L1084 HydrophobicContact CE1-CD1 3.44Å; F1080-L1084 VanDerWaalsContact CE1-CD1 3.44Å; F1080-L1084 HydrophobicContact CE1-CG 4.36Å; F1080-L1084 HydrophobicContact CE2-CD1 4.35Å; F1080-L1084 HydrophobicContact CZ-CD1 3.71Å; F1080-L1084 HydrophobicContact CZ-CG 4.38Å; F1080-L1084 WeakPolarHBondContact O-CG 3.49Å; F1080-L1084 PolarHBondContact O-N 3.07Å
1081	A	89.4	Confident	86.2	Confident	25 Å²	25	64 Å²	64	21%	0.207	31%	0.311	C	S	.	.	H	α-helix	trans	-64.4	-47	175.4	0	0	0	0	0	111.3	F1061 F1078 M1083 L1084 S1085	F1061-A1081 HydrophobicContact CE1-CB 4.38Å; F1078-A1081 HydrophobicContact CD1-CB 4.29Å; F1078-A1081 HydrophobicContact CD2-CB 3.86Å; F1078-A1081 HydrophobicContact CE1-CB 4.12Å; F1078-A1081 HydrophobicContact CE2-CB 3.67Å; F1078-A1081 HydrophobicContact CG-CB 4.16Å; F1078-A1081 HydrophobicContact CZ-CB 3.8Å; F1078-A1081 PolarHBondContact O-N 3.03Å; A1081-M1083 VanDerWaalsContact C-N 3.3Å; A1081-M1083 PolarHBondContact O-N 3.14Å; A1081-L1084 PolarHBondContact O-N 3.31Å; A1081-S1085 WeakPolarHBondContact O-CB 3.5Å; A1081-S1085 PolarHBondContact O-N 2.93Å
1082	N	87.4	Confident	86.6	Confident	47 Å²	47	62.7 Å²	62.7	25%	0.251	31%	0.306	S	S	.	.	H	α-helix	trans	-60.3	-37.8	174.5	-87.1	-11.8	0	0	0	112.8	Q1007 F1013 F1078	Q1007-N1082 PolarHBondContact NE2-O 2.72Å; F1013-N1082 HydrophobicContact CE1-CB 4.3Å; F1013-N1082 WeakPolarHBondContact CZ-O 3.08Å; F1078-N1082 WeakPolarHBondContact CD1-OD1 3.46Å; F1078-N1082 VanDerWaalsContact CE1-OD1 3.29Å; F1078-N1082 WeakPolarHBondContact CE1-OD1 3.46Å; F1078-N1082 WeakPolarHBondContact O-CB 3.45Å; F1078-N1082 PolarHBondContact O-N 2.77Å
1083	M	88.4	Confident	87.5	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-50.5	175.1	-175.6	-170.2	82.5	0	0	111.8	T1020 I1021 T1024 V1079 F1080 A1081 S1085 S1086 I1093	T1020-M1083 HydrophobicContact CG2-CE 4.36Å; T1020-M1083 HydrophobicContact CG2-SD 3.79Å; I1021-M1083 HydrophobicContact CB-SD 4.21Å; I1021-M1083 HydrophobicContact CD1-CG 4.15Å; I1021-M1083 HydrophobicContact CG1-CG 3.51Å; I1021-M1083 HydrophobicContact CG1-SD 3.38Å; I1021-M1083 WeakPolarHBondContact CG1-SD 3.2Å; T1024-M1083 HydrophobicContact CG2-CE 4.48Å; T1024-M1083 WeakPolarHBondContact OG1-CE 3.33Å; V1079-M1083 WeakPolarHBondContact O-CB 3.29Å; V1079-M1083 PolarHBondContact O-N 3.27Å; F1080-M1083 HydrophobicContact CD2-CE 3.6Å; F1080-M1083 HydrophobicContact CE2-CE 3.51Å; F1080-M1083 HydrophobicContact CZ-CE 4.46Å; F1080-M1083 WeakPolarHBondContact O-CB 3.17Å; F1080-M1083 PolarHBondContact O-N 3.19Å; A1081-M1083 VanDerWaalsContact C-N 3.3Å; A1081-M1083 PolarHBondContact O-N 3.14Å; M1083-S1085 VanDerWaalsContact C-N 3.28Å; M1083-S1085 PolarHBondContact O-N 3.4Å; M1083-S1086 PolarHBondContact O-N 3.06Å; M1083-I1093 HydrophobicContact CE-CD1 4.36Å
1084	L	86.3	Confident	88.4	Confident	29 Å²	29	52.4 Å²	52.4	15%	0.152	26%	0.263	C	S	.	.	H	α-helix	trans	-75.7	-14.1	-177	-61.7	-177	0	0	0	113.8	F1061 F1080 A1081 S1086 W1090	F1061-L1084 HydrophobicContact CE2-CD1 3.73Å; F1061-L1084 HydrophobicContact CZ-CD1 3.6Å; F1080-L1084 HydrophobicContact CD1-CD1 3.89Å; F1080-L1084 HydrophobicContact CE1-CD1 3.44Å; F1080-L1084 VanDerWaalsContact CE1-CD1 3.44Å; F1080-L1084 HydrophobicContact CE1-CG 4.36Å; F1080-L1084 HydrophobicContact CE2-CD1 4.35Å; F1080-L1084 HydrophobicContact CZ-CD1 3.71Å; F1080-L1084 HydrophobicContact CZ-CG 4.38Å; F1080-L1084 WeakPolarHBondContact O-CG 3.49Å; F1080-L1084 PolarHBondContact O-N 3.07Å; A1081-L1084 PolarHBondContact O-N 3.31Å; L1084-S1086 PolarHBondContact O-N 3.48Å; L1084-W1090 HydrophobicContact CB-CZ2 4.28Å; L1084-W1090 HydrophobicContact CD1-CZ2 4.4Å; L1084-W1090 HydrophobicContact CD2-CH2 4.13Å; L1084-W1090 HydrophobicContact CD2-CZ2 3.65Å; L1084-W1090 HydrophobicContact CG-CZ2 4.32Å; L1084-W1090 PolarHBondContact O-NE1 3.41Å
1085	S	87.3	Confident	89	Confident	81 Å²	81	54.1 Å²	54.1	57%	0.566	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-8.3	169.3	-169.8	0	0	0	0	113.5	A1081 M1083	A1081-S1085 WeakPolarHBondContact O-CB 3.5Å; A1081-S1085 PolarHBondContact O-N 2.93Å; M1083-S1085 VanDerWaalsContact C-N 3.28Å; M1083-S1085 PolarHBondContact O-N 3.4Å
1086	S	87.6	Confident	89.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.256	C	S	.	.			trans	-98.6	119	178.9	172	0	0	0	0	111.9	L1006 M1083 L1084 S1088 A1089 W1090	L1006-S1086 WeakPolarHBondContact O-CB 3.45Å; L1006-S1086 PolarHBondContact O-OG 2.8Å; M1083-S1086 PolarHBondContact O-N 3.06Å; L1084-S1086 PolarHBondContact O-N 3.48Å; S1086-S1088 VanDerWaalsContact C-N 3.28Å; S1086-S1088 PolarHBondContact O-N 3.43Å; S1086-S1088 PolarHBondContact OG-N 3.05Å; S1086-S1088 PolarHBondContact OG-OG 3.21Å; S1086-A1089 PolarHBondContact O-N 3.22Å; S1086-A1089 PolarHBondContact OG-N 3.14Å; S1086-W1090 VanDerWaalsContact O-CD1 3.31Å; S1086-W1090 PolarHBondContact O-N 3.24Å
1087	V	88	Confident	89.9	Confident	89 Å²	89	49.6 Å²	49.6	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-63	-35.5	173.3	-176.4	0	0	0	0	111.3	A1089 W1090 L1091	V1087-A1089 VanDerWaalsContact C-N 3.34Å; V1087-A1089 PolarHBondContact O-N 3.1Å; V1087-W1090 PolarHBondContact O-N 3.18Å; V1087-L1091 HydrophobicContact CG1-CD1 4.22Å; V1087-L1091 HydrophobicContact CG1-CG 4.45Å; V1087-L1091 WeakPolarHBondContact O-CG 3.36Å; V1087-L1091 PolarHBondContact O-N 3.35Å
1088	S	86.6	Confident	90.1	Very high	36 Å²	36	48.9 Å²	48.9	25%	0.252	26%	0.262	S	S	.	.	H	α-helix	trans	-65.4	-36.7	178.2	76.2	0	0	0	0	112.2	L1006 S1086 V1092	L1006-S1088 PolarHBondContact O-OG 3.31Å; S1086-S1088 VanDerWaalsContact C-N 3.28Å; S1086-S1088 PolarHBondContact O-N 3.43Å; S1086-S1088 PolarHBondContact OG-N 3.05Å; S1086-S1088 PolarHBondContact OG-OG 3.21Å; S1088-V1092 PolarHBondContact O-N 3.19Å; S1088-V1092 VanDerWaalsContact O-N 3.16Å
1089	A	86.1	Confident	90.3	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-64.7	-45.3	174.1	0	0	0	0	0	111.8	S1086 V1087 V1092 I1093	S1086-A1089 PolarHBondContact O-N 3.22Å; S1086-A1089 PolarHBondContact OG-N 3.14Å; V1087-A1089 VanDerWaalsContact C-N 3.34Å; V1087-A1089 PolarHBondContact O-N 3.1Å; A1089-V1092 PolarHBondContact O-N 2.89Å; A1089-I1093 WeakPolarHBondContact O-CB 3.5Å; A1089-I1093 WeakPolarHBondContact O-CD1 3Å; A1089-I1093 VanDerWaalsContact O-CG1 3.23Å; A1089-I1093 WeakPolarHBondContact O-CG1 3.33Å; A1089-I1093 PolarHBondContact O-N 3.01Å
1090	W	89.3	Confident	90.5	Very high	120 Å²	120	47.3 Å²	47.3	46%	0.455	26%	0.257	S	S	.	.	H	α-helix	trans	-59.4	-47.2	176.3	-81.4	106.3	0	0	0	112.9	L1084 S1086 V1087 V1092 I1093 I1094	L1084-W1090 HydrophobicContact CB-CZ2 4.28Å; L1084-W1090 HydrophobicContact CD1-CZ2 4.4Å; L1084-W1090 HydrophobicContact CD2-CH2 4.13Å; L1084-W1090 HydrophobicContact CD2-CZ2 3.65Å; L1084-W1090 HydrophobicContact CG-CZ2 4.32Å; L1084-W1090 PolarHBondContact O-NE1 3.41Å; S1086-W1090 VanDerWaalsContact O-CD1 3.31Å; S1086-W1090 PolarHBondContact O-N 3.24Å; V1087-W1090 PolarHBondContact O-N 3.18Å; W1090-V1092 VanDerWaalsContact C-N 3.32Å; W1090-V1092 PolarHBondContact O-N 3.3Å; W1090-I1093 PolarHBondContact O-N 3.48Å; W1090-I1094 WeakPolarHBondContact O-CG1 3.39Å; W1090-I1094 PolarHBondContact O-N 3.41Å
1091	L	90.4	Very high	90.7	Very high	114 Å²	114	47.7 Å²	47.7	60%	0.597	26%	0.259	S	S	*	.	H	α-helix	trans	-59.8	-42.4	179.2	-71.6	172.6	0	0	0	111.6	V1087 L1095	V1087-L1091 HydrophobicContact CG1-CD1 4.22Å; V1087-L1091 HydrophobicContact CG1-CG 4.45Å; V1087-L1091 WeakPolarHBondContact O-CG 3.36Å; V1087-L1091 PolarHBondContact O-N 3.35Å; L1091-L1095 WeakPolarHBondContact O-CB 3.49Å; L1091-L1095 PolarHBondContact O-N 2.9Å
1092	V	89	Confident	90.8	Very high	26 Å²	26	51.6 Å²	51.6	16%	0.158	28%	0.276	C	S	.	.	H	α-helix	trans	-70.7	-38	176.3	170.6	0	0	0	0	112.4	L1000 S1088 A1089 W1090 I1094 L1095 L1096	L1000-V1092 HydrophobicContact CB-CG1 4.44Å; L1000-V1092 HydrophobicContact CB-CG2 4.41Å; L1000-V1092 HydrophobicContact CD1-CG2 3.89Å; L1000-V1092 HydrophobicContact CD2-CB 3.97Å; L1000-V1092 HydrophobicContact CD2-CG1 4.05Å; L1000-V1092 HydrophobicContact CD2-CG2 3.99Å; L1000-V1092 HydrophobicContact CG-CG2 4.3Å; S1088-V1092 PolarHBondContact O-N 3.19Å; S1088-V1092 VanDerWaalsContact O-N 3.16Å; A1089-V1092 PolarHBondContact O-N 2.89Å; W1090-V1092 VanDerWaalsContact C-N 3.32Å; W1090-V1092 PolarHBondContact O-N 3.3Å; V1092-I1094 PolarHBondContact O-N 2.98Å; V1092-L1095 PolarHBondContact O-N 3.33Å; V1092-L1096 HydrophobicContact CG1-CD1 3.54Å; V1092-L1096 HydrophobicContact CG1-CG 3.9Å; V1092-L1096 WeakPolarHBondContact O-CB 3.46Å; V1092-L1096 VanDerWaalsContact O-CG 3.25Å; V1092-L1096 WeakPolarHBondContact O-CG 3.42Å; V1092-L1096 PolarHBondContact O-N 2.98Å
1093	I	92.6	Very high	90.9	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-59.1	-48.9	175.5	-72.4	161.4	0	0	0	110.2	I1021 T1024 V1025 M1083 A1089 W1090 I1097	I1021-I1093 HydrophobicContact CG2-CD1 4.49Å; I1021-I1093 HydrophobicContact CG2-CG1 4.11Å; T1024-I1093 HydrophobicContact CG2-CD1 4.08Å; T1024-I1093 HydrophobicContact CG2-CG1 4.5Å; T1024-I1093 HydrophobicContact CG2-CG2 4.12Å; V1025-I1093 HydrophobicContact CG2-CB 4.26Å; V1025-I1093 HydrophobicContact CG2-CG1 3.95Å; V1025-I1093 HydrophobicContact CG2-CG2 4.28Å; M1083-I1093 HydrophobicContact CE-CD1 4.36Å; A1089-I1093 WeakPolarHBondContact O-CB 3.5Å; A1089-I1093 WeakPolarHBondContact O-CD1 3Å; A1089-I1093 VanDerWaalsContact O-CG1 3.23Å; A1089-I1093 WeakPolarHBondContact O-CG1 3.33Å; A1089-I1093 PolarHBondContact O-N 3.01Å; W1090-I1093 PolarHBondContact O-N 3.48Å; I1093-I1097 HydrophobicContact CG2-CD1 3.8Å; I1093-I1097 WeakPolarHBondContact O-CD1 3.44Å; I1093-I1097 WeakPolarHBondContact O-CG1 3.26Å; I1093-I1097 PolarHBondContact O-N 3.16Å; I1093-I1097 VanDerWaalsContact O-N 3.08Å
1094	I	94.5	Very high	90.9	Very high	92 Å²	92	52.1 Å²	52.1	47%	0.472	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-47	178.1	-65.6	166.3	0	0	0	110.8	W1090 V1092 L1096 I1097 L1098	W1090-I1094 WeakPolarHBondContact O-CG1 3.39Å; W1090-I1094 PolarHBondContact O-N 3.41Å; V1092-I1094 PolarHBondContact O-N 2.98Å; I1094-L1096 PolarHBondContact O-N 3.23Å; I1094-I1097 PolarHBondContact O-N 3.31Å; I1094-L1098 HydrophobicContact CG2-CD1 3.94Å; I1094-L1098 WeakPolarHBondContact O-CG 3.37Å; I1094-L1098 PolarHBondContact O-N 3.26Å
1095	L	94.4	Very high	91	Very high	102 Å²	102	54.3 Å²	54.3	53%	0.534	29%	0.292	S	S	.	.	H	α-helix	trans	-61.2	-42.9	179.9	179.4	62	0	0	0	112.4	L1091 V1092 L1098 L1099	L1091-L1095 WeakPolarHBondContact O-CB 3.49Å; L1091-L1095 PolarHBondContact O-N 2.9Å; V1092-L1095 PolarHBondContact O-N 3.33Å; L1095-L1098 PolarHBondContact O-N 3.21Å; L1095-L1099 VanDerWaalsContact O-CB 3.25Å; L1095-L1099 WeakPolarHBondContact O-CB 3.26Å; L1095-L1099 PolarHBondContact O-N 3.15Å
1096	L	95.3	Very high	91.1	Very high	13 Å²	13	54.7 Å²	54.7	7%	0.068	29%	0.288	C	S	.	.	H	α-helix	trans	-72.1	-34.8	-179.8	-67.2	178.4	0	0	0	112.6	V992 V997 V1025 V1092 I1094 S1100	V992-L1096 HydrophobicContact CG1-CD2 4.1Å; V997-L1096 HydrophobicContact CG2-CD1 3.84Å; V1025-L1096 HydrophobicContact CG1-CB 3.75Å; V1025-L1096 HydrophobicContact CG2-CB 4.31Å; V1025-L1096 HydrophobicContact CG2-CD1 4.35Å; V1092-L1096 HydrophobicContact CG1-CD1 3.54Å; V1092-L1096 HydrophobicContact CG1-CG 3.9Å; V1092-L1096 WeakPolarHBondContact O-CB 3.46Å; V1092-L1096 VanDerWaalsContact O-CG 3.25Å; V1092-L1096 WeakPolarHBondContact O-CG 3.42Å; V1092-L1096 PolarHBondContact O-N 2.98Å; I1094-L1096 PolarHBondContact O-N 3.23Å; L1096-S1100 VanDerWaalsContact O-CB 3.25Å; L1096-S1100 WeakPolarHBondContact O-CB 3.38Å; L1096-S1100 PolarHBondContact O-N 3.47Å; L1096-S1100 PolarHBondContact O-OG 3.48Å
1097	I	95.4	Very high	90.9	Very high	18 Å²	18	56.7 Å²	56.7	9%	0.092	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-49.9	170.1	-68.4	161.4	0	0	0	109.9	V1025 F1028 L1032 I1093 I1094 S1100 L1101	V1025-I1097 HydrophobicContact CG1-CG1 4.35Å; F1028-I1097 HydrophobicContact CB-CD1 3.56Å; F1028-I1097 HydrophobicContact CB-CG1 4.14Å; F1028-I1097 HydrophobicContact CD1-CD1 4.37Å; F1028-I1097 HydrophobicContact CG-CD1 4.14Å; L1032-I1097 HydrophobicContact CD1-CG2 3.7Å; I1093-I1097 HydrophobicContact CG2-CD1 3.8Å; I1093-I1097 WeakPolarHBondContact O-CD1 3.44Å; I1093-I1097 WeakPolarHBondContact O-CG1 3.26Å; I1093-I1097 PolarHBondContact O-N 3.16Å; I1093-I1097 VanDerWaalsContact O-N 3.08Å; I1094-I1097 PolarHBondContact O-N 3.31Å; I1097-S1100 PolarHBondContact O-N 3.46Å; I1097-L1101 HydrophobicContact CG2-CD1 3.91Å; I1097-L1101 WeakPolarHBondContact O-CG 3.32Å; I1097-L1101 PolarHBondContact O-N 2.92Å
1098	L	94.1	Very high	90.6	Very high	104 Å²	104	55.4 Å²	55.4	55%	0.545	29%	0.29	S	S	.	.	H	α-helix	trans	-60.7	-49.3	178.5	-71.8	171.6	0	0	0	111.9	I1094 L1095 S1100 L1101 L1102	I1094-L1098 HydrophobicContact CG2-CD1 3.94Å; I1094-L1098 WeakPolarHBondContact O-CG 3.37Å; I1094-L1098 PolarHBondContact O-N 3.26Å; L1095-L1098 PolarHBondContact O-N 3.21Å; L1098-S1100 VanDerWaalsContact C-N 3.31Å; L1098-S1100 PolarHBondContact O-N 2.96Å; L1098-L1101 PolarHBondContact O-N 3.18Å; L1098-L1102 VanDerWaalsContact O-CB 3.29Å; L1098-L1102 WeakPolarHBondContact O-CB 3.21Å; L1098-L1102 PolarHBondContact O-N 3.43Å
1099	L	93.9	Very high	90.5	Very high	84 Å²	84	57.9 Å²	57.9	44%	0.44	30%	0.304	S	S	.	.	H	α-helix	trans	-65.9	-32.6	-178.5	-171.5	147.8	0	0	0	112.6	V992 L1095	V992-L1099 HydrophobicContact CG1-CD2 3.7Å; V992-L1099 HydrophobicContact CG2-CD2 3.98Å; L1095-L1099 VanDerWaalsContact O-CB 3.25Å; L1095-L1099 WeakPolarHBondContact O-CB 3.26Å; L1095-L1099 PolarHBondContact O-N 3.15Å
1100	S	94.2	Very high	90.2	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-69.4	-45.2	173.1	-57.8	0	0	0	0	111.9	H989 V992 F993 L1096 I1097 L1098 P1103	H989-S1100 PolarHBondContact NE2-O 3.32Å; V992-S1100 VanDerWaalsContact CG1-OG 3.3Å; V992-S1100 WeakPolarHBondContact CG1-OG 3.24Å; F993-S1100 WeakPolarHBondContact CE1-OG 3.35Å; L1096-S1100 VanDerWaalsContact O-CB 3.25Å; L1096-S1100 WeakPolarHBondContact O-CB 3.38Å; L1096-S1100 PolarHBondContact O-N 3.47Å; L1096-S1100 PolarHBondContact O-OG 3.48Å; I1097-S1100 PolarHBondContact O-N 3.46Å; L1098-S1100 VanDerWaalsContact C-N 3.31Å; L1098-S1100 PolarHBondContact O-N 2.96Å; S1100-P1103 WeakPolarHBondContact O-CD 3.4Å
1101	L	93.9	Very high	89.3	Confident	13 Å²	13	66.6 Å²	66.6	7%	0.068	34%	0.344	C	S	.	.	H	α-helix	trans	-78.1	-19.6	-177.3	-63	177	0	0	0	113.7	T1029 L1032 K1033 L1036 I1097 L1098 E1104 I1105	T1029-L1101 HydrophobicContact CG2-CD2 3.83Å; T1029-L1101 HydrophobicContact CG2-CG 4.17Å; L1032-L1101 HydrophobicContact CB-CD1 3.79Å; L1032-L1101 HydrophobicContact CD1-CD1 4.42Å; K1033-L1101 HydrophobicContact CB-CD2 3.96Å; L1036-L1101 HydrophobicContact CD1-CB 4.29Å; L1036-L1101 HydrophobicContact CD1-CD1 4.28Å; L1036-L1101 HydrophobicContact CD1-CD2 4.15Å; L1036-L1101 HydrophobicContact CD1-CG 4.47Å; I1097-L1101 HydrophobicContact CG2-CD1 3.91Å; I1097-L1101 WeakPolarHBondContact O-CG 3.32Å; I1097-L1101 PolarHBondContact O-N 2.92Å; L1098-L1101 PolarHBondContact O-N 3.18Å; L1101-E1104 PolarHBondContact O-N 2.88Å; L1101-E1104 VanDerWaalsContact O-N 3.11Å; L1101-I1105 HydrophobicContact CB-CD1 4.03Å; L1101-I1105 WeakPolarHBondContact O-CG1 3.19Å; L1101-I1105 PolarHBondContact O-N 3.18Å
1102	L	92.1	Very high	87.7	Confident	107 Å²	107	69.4 Å²	69.4	56%	0.56	35%	0.352	S	S	*	.	H	α-helix	trans	-55.8	-42.2	-174.9	-177.8	135.5	0	0	0	114.6	L1098 E1104 I1105 L1106	L1098-L1102 VanDerWaalsContact O-CB 3.29Å; L1098-L1102 WeakPolarHBondContact O-CB 3.21Å; L1098-L1102 PolarHBondContact O-N 3.43Å; L1102-E1104 VanDerWaalsContact C-N 3.34Å; L1102-E1104 PolarHBondContact O-N 2.95Å; L1102-I1105 PolarHBondContact O-N 3.37Å; L1102-L1106 WeakPolarHBondContact O-CB 3.4Å; L1102-L1106 PolarHBondContact O-N 2.85Å
1103	P	89.3	Confident	85.6	Confident	49 Å²	49	72.2 Å²	72.2	32%	0.318	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-34.1	176.3	-24.5	37.1	0	0	0	113.8	F988 S1100 L1107	F988-P1103 HydrophobicContact CE1-CG 3.73Å; F988-P1103 HydrophobicContact CZ-CG 3.98Å; S1100-P1103 WeakPolarHBondContact O-CD 3.4Å; P1103-L1107 WeakPolarHBondContact O-CB 3.47Å; P1103-L1107 PolarHBondContact O-N 2.94Å
1104	E	88.1	Confident	82.8	Confident	11 Å²	11	84.1 Å²	84.1	5%	0.051	42%	0.415	C	S	.	.	H	α-helix	trans	-73	-43.6	176.1	-74.3	-75.5	134.8	0	0	111.1	Y981 L985 K1033 L1101 L1102 L1106 L1107 V1108	Y981-E1104 PolarHBondContact OH-OE1 2.95Å; L985-E1104 HydrophobicContact CD1-CG 3.96Å; L985-E1104 HydrophobicContact CD2-CG 4.17Å; L985-E1104 WeakPolarHBondContact CD2-OE1 3.37Å; K1033-E1104 HydrophobicContact CD-CG 4.06Å; K1033-E1104 VanDerWaalsContact CE-CD 3.45Å; K1033-E1104 WeakPolarHBondContact CE-OE2 3.39Å; K1033-E1104 IonicContact NZ-OE2 2.76Å; K1033-E1104 PolarHBondContact NZ-OE2 3.5Å; L1101-E1104 PolarHBondContact O-N 2.88Å; L1101-E1104 VanDerWaalsContact O-N 3.11Å; L1102-E1104 VanDerWaalsContact C-N 3.34Å; L1102-E1104 PolarHBondContact O-N 2.95Å; E1104-L1106 VanDerWaalsContact C-N 3.34Å; E1104-L1106 PolarHBondContact O-N 2.99Å; E1104-L1107 PolarHBondContact O-N 3.4Å; E1104-V1108 VanDerWaalsContact O-CG2 3.29Å; E1104-V1108 WeakPolarHBondContact O-CG2 3.45Å; E1104-V1108 PolarHBondContact O-N 3.26Å
1105	I	89.2	Confident	79.8	Confident	75 Å²	75	82.6 Å²	82.6	39%	0.385	42%	0.422	S	S	.	.	H	α-helix	trans	-59.2	-47	173.3	-65.6	166.5	0	0	0	110	L1036 L1101 L1102 L1107 V1108 V1109	L1036-I1105 HydrophobicContact CD1-CD1 4.36Å; L1036-I1105 HydrophobicContact CD1-CG1 3.91Å; L1036-I1105 HydrophobicContact CD2-CG1 4.45Å; L1101-I1105 HydrophobicContact CB-CD1 4.03Å; L1101-I1105 WeakPolarHBondContact O-CG1 3.19Å; L1101-I1105 PolarHBondContact O-N 3.18Å; L1102-I1105 PolarHBondContact O-N 3.37Å; I1105-L1107 VanDerWaalsContact C-N 3.33Å; I1105-L1107 PolarHBondContact O-N 2.75Å; I1105-V1108 PolarHBondContact O-N 2.74Å; I1105-V1109 WeakPolarHBondContact O-CG2 3.38Å; I1105-V1109 PolarHBondContact O-N 2.77Å
1106	L	88	Confident	77.1	Confident	89 Å²	89	84.1 Å²	84.1	47%	0.466	44%	0.438	S	S	.	.	H	α-helix	trans	-60.2	-42.1	176.1	-176	68.6	0	0	0	111.4	L1102 E1104 V1109 L1110	L1102-L1106 WeakPolarHBondContact O-CB 3.4Å; L1102-L1106 PolarHBondContact O-N 2.85Å; E1104-L1106 VanDerWaalsContact C-N 3.34Å; E1104-L1106 PolarHBondContact O-N 2.99Å; L1106-V1109 PolarHBondContact O-N 3.34Å; L1106-L1110 HydrophobicContact CD1-CD1 4Å; L1106-L1110 HydrophobicContact CD1-CG 4.11Å; L1106-L1110 HydrophobicContact CD2-CD1 4.27Å; L1106-L1110 HydrophobicContact CG-CD1 3.76Å; L1106-L1110 HydrophobicContact CG-CG 4.19Å; L1106-L1110 VanDerWaalsContact O-CB 3.26Å; L1106-L1110 WeakPolarHBondContact O-CB 3.25Å; L1106-L1110 VanDerWaalsContact O-CG 3.25Å; L1106-L1110 WeakPolarHBondContact O-CG 3.46Å; L1106-L1110 PolarHBondContact O-N 2.98Å
1107	L	84.9	Confident	74.4	Confident	42 Å²	42	92.1 Å²	92.1	22%	0.22	47%	0.474	C	S	.	.	H	α-helix	trans	-67.6	-37.4	177.2	175.7	144.6	0	0	0	112.7	Y981 P1103 E1104 I1105 R1111	Y981-L1107 HydrophobicContact CE2-CD1 4.21Å; Y981-L1107 VanDerWaalsContact OH-CD1 3.29Å; Y981-L1107 WeakPolarHBondContact OH-CD1 3.02Å; P1103-L1107 WeakPolarHBondContact O-CB 3.47Å; P1103-L1107 PolarHBondContact O-N 2.94Å; E1104-L1107 PolarHBondContact O-N 3.4Å; I1105-L1107 VanDerWaalsContact C-N 3.33Å; I1105-L1107 PolarHBondContact O-N 2.75Å; L1107-R1111 VanDerWaalsContact O-CB 3.3Å; L1107-R1111 WeakPolarHBondContact O-CB 3.42Å; L1107-R1111 VanDerWaalsContact O-CG 3.32Å; L1107-R1111 WeakPolarHBondContact O-CG 3.34Å; L1107-R1111 PolarHBondContact O-N 2.93Å
1108	V	81.3	Confident	71.4	Confident	62 Å²	62	96.3 Å²	96.3	38%	0.376	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-41.8	172.4	172.1	0	0	0	0	110.7	E1104 I1105 K1112	E1104-V1108 VanDerWaalsContact O-CG2 3.29Å; E1104-V1108 WeakPolarHBondContact O-CG2 3.45Å; E1104-V1108 PolarHBondContact O-N 3.26Å; I1105-V1108 PolarHBondContact O-N 2.74Å; V1108-K1112 HydrophobicContact CG1-CD 4.34Å; V1108-K1112 WeakPolarHBondContact O-CB 3.38Å; V1108-K1112 WeakPolarHBondContact O-CG 3.31Å; V1108-K1112 PolarHBondContact O-N 2.78Å
1109	V	84.6	Confident	68.7	Low	88 Å²	88	102.6 Å²	102.6	53%	0.533	53%	0.528	S	S	.	.	H	α-helix	trans	-67.8	-44.2	176.6	170.8	0	0	0	0	111.7	I1105 L1106 K1112 P1113	I1105-V1109 WeakPolarHBondContact O-CG2 3.38Å; I1105-V1109 PolarHBondContact O-N 2.77Å; L1106-V1109 PolarHBondContact O-N 3.34Å; V1109-K1112 PolarHBondContact O-N 2.93Å; V1109-P1113 VanDerWaalsContact O-CD 3.26Å; V1109-P1113 WeakPolarHBondContact O-CD 3.27Å
1110	L	80.6	Confident	66	Low	118 Å²	118	107.5 Å²	107.5	62%	0.618	55%	0.548	S	S	*	.	H	α-helix	trans	-76.8	-21.4	-178	-71.3	179.4	0	0	0	114.2	L1106 P1113	L1106-L1110 HydrophobicContact CD1-CD1 4Å; L1106-L1110 HydrophobicContact CD1-CG 4.11Å; L1106-L1110 HydrophobicContact CD2-CD1 4.27Å; L1106-L1110 HydrophobicContact CG-CD1 3.76Å; L1106-L1110 HydrophobicContact CG-CG 4.19Å; L1106-L1110 VanDerWaalsContact O-CB 3.26Å; L1106-L1110 WeakPolarHBondContact O-CB 3.25Å; L1106-L1110 VanDerWaalsContact O-CG 3.25Å; L1106-L1110 WeakPolarHBondContact O-CG 3.46Å; L1106-L1110 PolarHBondContact O-N 2.98Å; L1110-P1113 VanDerWaalsContact C-CD 3.45Å; L1110-P1113 WeakPolarHBondContact O-CD 3.47Å
1111	R	70.3	Confident	63.1	Low	186 Å²	186	115.4 Å²	115.4	70%	0.702	59%	0.588	S	S	*	*	H	α-helix	trans	-82.8	-17.5	169.1	-72.8	-177.3	-178.9	173.8	6	113.3	L1107 P1113	L1107-R1111 VanDerWaalsContact O-CB 3.3Å; L1107-R1111 WeakPolarHBondContact O-CB 3.42Å; L1107-R1111 VanDerWaalsContact O-CG 3.32Å; L1107-R1111 WeakPolarHBondContact O-CG 3.34Å; L1107-R1111 PolarHBondContact O-N 2.93Å; R1111-P1113 VanDerWaalsContact C-CD 3.49Å
1112	K	55.3	Low	60.1	Low	173 Å²	173	123.9 Å²	123.9	75%	0.752	62%	0.624	S	S	*	*	S	Bend	trans	-82.4	-3	179	-84	-177.3	172.1	-179.1	0	118.7	V1108 V1109	V1108-K1112 HydrophobicContact CG1-CD 4.34Å; V1108-K1112 WeakPolarHBondContact O-CB 3.38Å; V1108-K1112 WeakPolarHBondContact O-CG 3.31Å; V1108-K1112 PolarHBondContact O-N 2.78Å; V1109-K1112 PolarHBondContact O-N 2.93Å
1113	P	44.8	Very low	57.1	Low	84 Å²	84	126.3 Å²	126.3	55%	0.545	63%	0.632	S	S	.	*	S	Bend	trans	-126.6	60.6	-179.6	38.6	-18	0	0	0	113.1	V1109 L1110 R1111	V1109-P1113 VanDerWaalsContact O-CD 3.26Å; V1109-P1113 WeakPolarHBondContact O-CD 3.27Å; L1110-P1113 VanDerWaalsContact C-CD 3.45Å; L1110-P1113 WeakPolarHBondContact O-CD 3.47Å; R1111-P1113 VanDerWaalsContact C-CD 3.49Å
1114	R	34.5	Very low	54.2	Low	257 Å²	257	135.5 Å²	135.5	97%	0.97	66%	0.66	S	S	*	*	S	Bend	trans	-169	68.7	163.7	-105.4	152.6	-164.6	-164.8	4.5	112.4
1115	G	31.7	Very low	51.5	Low	59 Å²	59	141.4 Å²	141.4	61%	0.608	69%	0.692	S	S	*	*			trans	-175.4	115.7	173.7	0	0	0	0	0	111.4	H1117	G1115-H1117 VanDerWaalsContact C-N 3.27Å; G1115-H1117 PolarHBondContact O-N 3.49Å
1116	P	36.6	Very low	48.7	Very low	134 Å²	134	143.7 Å²	143.7	87%	0.87	71%	0.711	S	S	*	*	S	Bend	trans	-87.4	32.8	-173	35.3	-36.3	0	0	0	114.5
1117	H	39	Very low	45.9	Very low	182 Å²	182	145.3 Å²	145.3	84%	0.843	73%	0.73	S	S	*	*	S	Bend	trans	-140.8	166.2	170.1	-88.8	8.9	0	0	0	109.5	G1115	G1115-H1117 VanDerWaalsContact C-N 3.27Å; G1115-H1117 PolarHBondContact O-N 3.49Å
1118	A	32.8	Very low	43.4	Very low	105 Å²	105	148.9 Å²	148.9	87%	0.868	76%	0.759	S	S	*	*			trans	64.5	40	-175.5	0	0	0	0	0	116.4
1119	R	37	Very low	41.1	Very low	236 Å²	236	149.6 Å²	149.6	89%	0.891	78%	0.779	S	S	*	*	S	Bend		-67.2	147.3	127.7	-86.2	-175.6	171.7	170.4	-1.8	107.1	M1121	R1119-M1121 PolarHBondContact O-N 2.82Å
1120	Q	38.4	Very low	38.4	Very low	187 Å²	187	152.4 Å²	152.4	87%	0.874	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-50	131.1	164	-66.7	151.9	-62.8	0	0	108.1	K1122	Q1120-K1122 PolarHBondContact O-N 3.07Å; Q1120-K1122 VanDerWaalsContact O-N 3.09Å
1121	M	32	Very low	36	Very low	167 Å²	167	152.2 Å²	152.2	82%	0.823	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-59.5	118.7	161.7	-82.4	-148.8	-174.4	0	0	106.6	R1119 H1123	R1119-M1121 PolarHBondContact O-N 2.82Å; M1121-H1123 PolarHBondContact O-N 3.41Å
1122	K	30.8	Very low	34	Very low	191 Å²	191	149.5 Å²	149.5	83%	0.83	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-59.4	128.7	157.4	-82.6	-171.5	168.2	-168.6	0	106	Q1120 R1124	Q1120-K1122 PolarHBondContact O-N 3.07Å; Q1120-K1122 VanDerWaalsContact O-N 3.09Å; K1122-R1124 PolarHBondContact O-N 3.46Å
1123	H	29.9	Very low	32.8	Very low	158 Å²	158	148.5 Å²	148.5	73%	0.731	81%	0.81	S	S	*	*			trans	-51.7	111.7	162	-80.1	-96.8	0	0	0	108.2	M1121 L1125	M1121-H1123 PolarHBondContact O-N 3.41Å; H1123-L1125 VanDerWaalsContact C-N 3.29Å; H1123-L1125 HydrophobicContact CB-CD1 3.95Å; H1123-L1125 PolarHBondContact O-N 3.23Å
1124	R	28.1	Very low	31.9	Very low	242 Å²	242	153.8 Å²	153.8	91%	0.913	83%	0.825	S	S	*	*			trans	-80.7	89.1	151.9	-78.2	-175	169.4	-171.9	-3.4	105.7	K1122	K1122-R1124 PolarHBondContact O-N 3.46Å
1125	L	31.5	Very low	31.5	Very low	135 Å²	135	150 Å²	150	71%	0.707	82%	0.82	S	S	*	*			trans	-57.5	144.5	154.1	-77.3	94	0	0	0	107.7	H1123 S1127	H1123-L1125 VanDerWaalsContact C-N 3.29Å; H1123-L1125 HydrophobicContact CB-CD1 3.95Å; H1123-L1125 PolarHBondContact O-N 3.23Å; L1125-S1127 PolarHBondContact O-N 3Å
1126	P	30.8	Very low	31.2	Very low	122 Å²	122	155.3 Å²	155.3	79%	0.792	83%	0.834	S	S	*	*			trans	-59.9	120.8	169	26.3	-33.3	0	0	0	108.9	S1128	P1126-S1128 PolarHBondContact O-N 2.78Å; P1126-S1128 VanDerWaalsContact O-N 3.13Å
1127	S	29	Very low	30.8	Very low	124 Å²	124	153 Å²	153	87%	0.867	82%	0.821	S	S	*	*			trans	-79.6	100.3	-170.1	54.8	0	0	0	0	111.9	L1125	L1125-S1127 PolarHBondContact O-N 3Å
1128	S	33.4	Very low	30.3	Very low	117 Å²	117	152.8 Å²	152.8	82%	0.818	82%	0.82	S	S	*	*			trans	-123.7	139.5	152.9	61.6	0	0	0	0	108	P1126	P1126-S1128 PolarHBondContact O-N 2.78Å; P1126-S1128 VanDerWaalsContact O-N 3.13Å
1129	G	31.1	Very low	29.9	Very low	77 Å²	77	155.2 Å²	155.2	79%	0.794	83%	0.825	S	S	*	*	S	Bend	trans	107.7	119	-171.6	0	0	0	0	0	113.6
1130	T	29.7	Very low	29.5	Very low	147 Å²	147	147.9 Å²	147.9	90%	0.902	81%	0.814	S	S	*	*			trans	-58.8	158.4	-175.8	29.6	0	0	0	0	117.4
1131	S	28.8	Very low	29.2	Very low	113 Å²	113	144.2 Å²	144.2	79%	0.79	81%	0.809	S	S	*	*			trans	-89.9	138.7	-173.1	-46.8	0	0	0	0	115.9
1132	T	29	Very low	29.1	Very low	130 Å²	130	143 Å²	143	80%	0.798	81%	0.811	S	S	*	*			trans	-150.5	100.5	152	28.1	0	0	0	0	107.4
1133	I	30.3	Very low	29	Very low	151 Å²	151	142.9 Å²	142.9	77%	0.774	81%	0.813	S	S	*	*				72.5	112.6	86.8	-65.6	172.5	0	0	0	113.7
1134	F	26.5	Very low	28.8	Very low	195 Å²	195	140.7 Å²	140.7	86%	0.855	82%	0.816	S	S	*	*			trans	15.3	127.3	158	-87.4	-100.9	0	0	0	120.7
1135	M	24.6	Very low	28.9	Very low	177 Å²	177	137.6 Å²	137.6	87%	0.872	81%	0.809	S	S	*	*				-159.2	157.3	105.9	-116	-160.9	-70.8	0	0	114.5
1136	L	26.6	Very low	28.6	Very low	172 Å²	172	136.5 Å²	136.5	90%	0.901	81%	0.813	S	S	*	*			trans	-119.6	105.5	165.8	-97.6	166.8	0	0	0	107.2
1137	S	27.4	Very low	28.6	Very low	85 Å²	85	142.2 Å²	142.2	59%	0.594	82%	0.819	S	S	*	*			trans	-169.1	149.1	162	-164	0	0	0	0	112
1138	Q	27.8	Very low	28.9	Very low	178 Å²	178	141 Å²	141	83%	0.832	81%	0.81	S	S	*	*			trans	37.8	102.7	151.7	-69.2	163.4	-7.1	0	0	119.3
1139	T	25.8	Very low	29	Very low	156 Å²	156	146.9 Å²	146.9	96%	0.957	83%	0.833	S	S	*	*			trans	-100.1	90.7	150.7	45.5	0	0	0	0	110.3
1140	A	28.5	Very low	28.9	Very low	81 Å²	81	150.4 Å²	150.4	67%	0.669	83%	0.834	S	S	*	*			trans	-112.6	136.2	164.6	0	0	0	0	0	109.3
1141	S	32.1	Very low	28.9	Very low	110 Å²	110	150.5 Å²	150.5	77%	0.769	83%	0.831	S	S	*	*			trans	37.5	99.8	162.2	58.2	0	0	0	0	118.7
1142	T	28.5	Very low	28.9	Very low	141 Å²	141	152.6 Å²	152.6	87%	0.865	83%	0.833	S	S	*	*				-172.5	122.4	114.6	21.7	0	0	0	0	110.4
1143	H	29.8	Very low	28.9	Very low	189 Å²	189	153.9 Å²	153.9	88%	0.875	84%	0.835	S	S	*	*			trans	-96.7	120.2	159	-90.1	-83.9	0	0	0	107.8
1144	S	24.8	Very low	28.8	Very low	112 Å²	112	154.1 Å²	154.1	78%	0.783	84%	0.839	S	S	*	*			trans	-116.3	120.1	161.8	47.9	0	0	0	0	107.9
1145	F	31	Very low	29	Very low	178 Å²	178	151.4 Å²	151.4	78%	0.781	84%	0.838	S	S	*	*			trans	-80.2	134.5	167.7	-90.7	-101.3	0	0	0	108.5
1146	S	24.2	Very low	29.3	Very low	112 Å²	112	149.6 Å²	149.6	78%	0.783	84%	0.836	S	S	*	*			trans	-122.7	113	160.8	55.9	0	0	0	0	108.4
1147	W	32.4	Very low	29.5	Very low	241 Å²	241	147.8 Å²	147.8	91%	0.913	83%	0.831	S	S	*	*			trans	-85.4	139.9	160.7	-81.3	76.8	0	0	0	108.4
1148	S	34.5	Very low	29.7	Very low	99 Å²	99	153.1 Å²	153.1	69%	0.692	85%	0.85	S	S	*	*			trans	-161.5	105.3	162.6	55.5	0	0	0	0	108.4
1149	D	36.3	Very low	29.8	Very low	240 Å²	240	150.8 Å²	150.8	100%	1.283	85%	0.852	S	S	*	*			trans	42.3	0	154.4	-46.6	-17.7	0	0	0	119

Retrieved 1,149 of 1,149 residues in 2090 ms (Link to these results)

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