A0A077Z3H1_TRITR Loading...

Ribosome biogenesis protein bms1

AlphaFold DB , UniProt , Accession A0A077Z3H1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,137 aa.

						>A0A077Z3H1_TRITR|A0A077Z3H1
MEEEPKQKEHRARASGRKAEKKKRKLEKERETADGSEKPKNPKAFTFASAVRAARAIRRQADILEKKTHAPAVDRTPVLPPPFLVAVVGPPKVGKSLLIQCLVKHHTKQTVSAIKGPITVVTGKHRRLTLLECSNDINVMIDVAKIADLVLLLIDASFGFEMETFEFLNICQVHGMPRIMGVLTHLDYIKQAKKVRQVKKMLKHRFWTEIYQGAKLFYLSGLVDDRYLGNEVKNLARFISVMKFRPSIWRSTHPYLLIDRMEQVTDPSSIEANKHCDRNVAFYGYVRGCPFLKNSSVHIVGKMPSDVENFKTKKCFLFKKGVGDYPIGEISFLPDPCPLPSHEKRRALDEREKIIYAPFCGVGGILYDKDAVYVDMPRSRRHGNRVSAGFCLHLFIIFIIIDYEDDEWVAELSHPEKTIDAKLTESSLSMFSASKPISFDEVSMEENLPAVGQDGNHPIDFQESDEDTGADEENDQIMKDSIDRVKSLFNLPNLPSLSLATLVYSQRLDEFEVADSDEQSEEIGGLFRVSSRATGRPGEVPLFDRVDSAMVKTPFGKTNCNLFNRSNFDETMVTQFRALDSIKACFVSRAGESKGDAKAVTNNSDEGYSDDSELYDDFEDLEKEANNEKPEANDNKSEDAVAQNGTEGFDPIGEEMFFFVRKLKFTVATDAEAEQRQSRLEKKRRLKEMFNAEYDETRKFHRDMVAELDYQTNLNRLEFENMDDSDRIDYEGFRPGMYVRVQINGLPCELVDNFDPNYPYIIGGLLPGEQRLSYVQARIKKHRWYDRVLKTRDPLIISLGWRRFQTMVVYSTQDHNDRNRMLKYTPQFMHCHATFWGPTTPQNTGFLAVQTVSEVTVRCCAKQFRIVATGTVLGLDASVLVVKKLKLTGTPYKVFKKSALIKDMFSSALECAKFEGAALRSVSGIRGQIKKAMKNPPGSFRATFEDKILMKDIVFVRTWVPLDVPKFYAIVTNLLLSNTMKAKWVGMRTVGQLRFQRGLKPPQKLDALYKPIERKPYVPMPLRIPKELQKRLPYAVKPKHKATKERKGVDPIVSKHTQLALEPAERKVNEVMKMLKTVHQSKMVKASVTARIKAKEYRRKLSTFEKLRQMRERAEKKRICSKLTQRERSAKKKALTA
					

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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	36.3	Very low	44.9	Very low	235 Å²	235	196.4 Å²	196.4	100%	1.158	91%	0.909	S	S	*	*				0	133.6	0	-65.3	-177.2	-69	0	0	106.7
2	E	36.1	Very low	45.7	Very low	201 Å²	201	188 Å²	188	94%	0.939	90%	0.9	S	S	*	*			trans	161	138.5	153.6	-92.7	164.1	-164.7	0	0	107.9
3	E	39.8	Very low	46.2	Very low	195 Å²	195	191.1 Å²	191.1	91%	0.911	90%	0.897	S	S	*	*			trans	-104.3	129.3	-173.4	-62.8	-176.5	112	0	0	110.8
4	E	47.5	Very low	46.7	Very low	188 Å²	188	184.7 Å²	184.7	88%	0.879	89%	0.893	S	S	*	*			trans	-73.6	139.4	175.2	-75.6	-157.1	142.7	0	0	112.8	K6	E4-K6 PolarHBondContact O-N 2.95Å
5	P	40.7	Very low	47	Very low	116 Å²	116	179 Å²	179	75%	0.753	88%	0.879	S	S	*	*			trans	-78.2	120.3	-174.4	30.2	-34.8	0	0	0	112.8	Q7	P5-Q7 PolarHBondContact O-N 2.9Å
6	K	44.2	Very low	48.2	Very low	207 Å²	207	170.6 Å²	170.6	90%	0.9	85%	0.853	S	S	*	*			trans	-57.3	109.7	174.8	-70.9	173.9	179.2	167.6	0	112	E4	E4-K6 PolarHBondContact O-N 2.95Å
7	Q	51.5	Low	48.8	Very low	189 Å²	189	173.3 Å²	173.3	88%	0.883	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-67.2	146.2	173.3	-63.7	-171.7	4.9	0	0	111.5	P5	P5-Q7 PolarHBondContact O-N 2.9Å
8	K	42.5	Very low	49	Very low	201 Å²	201	174.4 Å²	174.4	87%	0.874	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-82.9	127.8	-175.5	-69.2	176	179.4	171.5	0	111.7
9	E	49.3	Very low	49.3	Very low	192 Å²	192	166.7 Å²	166.7	90%	0.897	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-58	138.9	175.1	-63.6	-170.9	134.6	0	0	113	R11	E9-R11 PolarHBondContact O-N 3.01Å
10	H	51	Low	49.6	Very low	190 Å²	190	161.2 Å²	161.2	88%	0.88	79%	0.79	S	S	*	*			trans	-73.8	112.4	175.1	-76.2	-66.8	0	0	0	111.8	A12	H10-A12 PolarHBondContact O-N 3.4Å
11	R	55.4	Low	49.8	Very low	246 Å²	246	160.7 Å²	160.7	93%	0.928	78%	0.784	S	S	*	*			trans	-51.4	125.7	170.9	-82.7	-175.9	169.3	-179.9	-3.4	111.8	E9 R13	E9-R11 PolarHBondContact O-N 3.01Å; R11-R13 PolarHBondContact O-N 2.96Å
12	A	53.8	Low	50.6	Low	96 Å²	96	156.2 Å²	156.2	79%	0.793	76%	0.758	S	S	*	*			trans	-57.9	136.5	168.1	0	0	0	0	0	110.7	H10 A14	H10-A12 PolarHBondContact O-N 3.4Å; A12-A14 PolarHBondContact O-N 3.27Å
13	R	52.3	Low	51.4	Low	228 Å²	228	149.3 Å²	149.3	86%	0.86	73%	0.725	S	S	*	*			trans	-68.8	107.2	-176.8	-64	-172.5	-175.2	-162.3	1	110.5	R11 S15 A19	R11-R13 PolarHBondContact O-N 2.96Å; R13-S15 VanDerWaalsContact C-N 3.27Å; R13-S15 PolarHBondContact O-N 2.99Å; R13-A19 VanDerWaalsContact O-CB 3.27Å; R13-A19 WeakPolarHBondContact O-CB 3.26Å
14	A	53.9	Low	52	Low	102 Å²	102	140.6 Å²	140.6	84%	0.843	68%	0.684	S	S	*	*			trans	-73.8	-13.7	179	0	0	0	0	0	114.1	A12	A12-A14 PolarHBondContact O-N 3.27Å
15	S	51.4	Low	52.1	Low	99 Å²	99	137.3 Å²	137.3	69%	0.692	67%	0.666	S	S	*	*	S	Bend	trans	-129.8	157.7	-171.7	59	0	0	0	0	114.2	R13	R13-S15 VanDerWaalsContact C-N 3.27Å; R13-S15 PolarHBondContact O-N 2.99Å
16	G	65.3	Low	52.6	Low	45 Å²	45	135.2 Å²	135.2	46%	0.464	65%	0.648	S	S	.	*	S	Bend	trans	91.4	167.7	170.7	0	0	0	0	0	116.4	K18 A19 E20	G16-K18 PolarHBondContact O-N 3.39Å; G16-A19 PolarHBondContact O-N 2.94Å; G16-E20 PolarHBondContact O-N 2.94Å; G16-E20 VanDerWaalsContact O-N 3.08Å
17	R	58.9	Low	52.7	Low	216 Å²	216	126.7 Å²	126.7	82%	0.815	61%	0.612	S	S	*	*	H	α-helix	trans	-51	-10.4	-170.1	-76.2	-177.1	175.3	178.9	-0.5	118.4	E20 K21	R17-E20 WeakPolarHBondContact CA-OE2 3.4Å; R17-K21 WeakPolarHBondContact O-CB 3.47Å
18	K	52.8	Low	52.5	Low	193 Å²	193	121.3 Å²	121.3	84%	0.839	59%	0.586	S	S	*	*	H	α-helix	trans	-98.3	-36.6	172	-80.4	-170.7	176.8	-176.6	0	112.7	G16 K21 K22	G16-K18 PolarHBondContact O-N 3.39Å; K18-K21 PolarHBondContact O-N 3.48Å; K18-K22 PolarHBondContact O-N 2.76Å
19	A	53.2	Low	52.6	Low	28 Å²	28	116.6 Å²	116.6	23%	0.231	57%	0.566	C	S	.	*	H	α-helix	trans	-70.7	-43	176.3	0	0	0	0	0	110.5	R13 G16	R13-A19 VanDerWaalsContact O-CB 3.27Å; R13-A19 WeakPolarHBondContact O-CB 3.26Å; G16-A19 PolarHBondContact O-N 2.94Å
20	E	55.7	Low	52.2	Low	57 Å²	57	115.9 Å²	115.9	27%	0.266	56%	0.556	S	S	.	*	H	α-helix	trans	-44.3	-76.5	157.8	-85.1	-167.1	116.1	0	0	109.7	G16 R17 K22 K23 E672 Q675	G16-E20 PolarHBondContact O-N 2.94Å; G16-E20 VanDerWaalsContact O-N 3.08Å; R17-E20 WeakPolarHBondContact CA-OE2 3.4Å; E20-K22 PolarHBondContact O-N 3.15Å; E20-K23 WeakPolarHBondContact O-CA 3.43Å; E20-K23 WeakPolarHBondContact O-CB 3.25Å; E20-K23 PolarHBondContact O-N 2.99Å; E20-E672 HydrophobicContact CB-CG 3.64Å; E20-E672 WeakPolarHBondContact CB-OE1 3.47Å; E20-E672 HydrophobicContact CG-CG 3.93Å; E20-Q675 PolarHBondContact OE1-NE2 3.22Å
21	K	54.4	Low	51.8	Low	150 Å²	150	111.6 Å²	111.6	65%	0.652	54%	0.536	S	S	*	.	H	α-helix	trans	-55.7	-19.4	-165	-171.4	179.3	177.5	-169	0	117.2	R17 K18 K23 E672	R17-K21 WeakPolarHBondContact O-CB 3.47Å; K18-K21 PolarHBondContact O-N 3.48Å; K21-K23 VanDerWaalsContact C-N 3.31Å; K21-E672 VanDerWaalsContact CA-OE1 3.3Å; K21-E672 WeakPolarHBondContact CA-OE1 3.41Å; K21-E672 WeakPolarHBondContact CA-OE2 3.28Å; K21-E672 PolarHBondContact N-OE1 3.42Å; K21-E672 PolarHBondContact N-OE2 3.11Å
22	K	53.6	Low	51.2	Low	142 Å²	142	103.5 Å²	103.5	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-76	-23.2	173.6	-162.6	175.2	-175.4	-178.1	0	112.1	K18 E20	K18-K22 PolarHBondContact O-N 2.76Å; E20-K22 PolarHBondContact O-N 3.15Å
23	K	53.2	Low	50.6	Low	55 Å²	55	102.8 Å²	102.8	24%	0.239	51%	0.508	C	S	.	.	H	α-helix	trans	-88.4	-40.6	-172.4	-116.6	159.9	153.4	-168	0	111.6	E20 K21 K25 L26 F665 V667 A668 T669	E20-K23 WeakPolarHBondContact O-CA 3.43Å; E20-K23 WeakPolarHBondContact O-CB 3.25Å; E20-K23 PolarHBondContact O-N 2.99Å; K21-K23 VanDerWaalsContact C-N 3.31Å; K23-K25 PolarHBondContact O-N 3.49Å; K23-L26 PolarHBondContact O-N 2.88Å; K23-F665 HydrophobicContact CG-CE1 4.32Å; K23-V667 WeakPolarHBondContact CE-O 3.45Å; K23-V667 PolarHBondContact NZ-O 2.64Å; K23-A668 WeakPolarHBondContact CB-O 3.36Å; K23-A668 WeakPolarHBondContact CD-O 3.24Å; K23-A668 VanDerWaalsContact CE-C 3.45Å; K23-A668 WeakPolarHBondContact CE-O 3.38Å; K23-A668 WeakPolarHBondContact CG-O 3.41Å; K23-T669 HydrophobicContact CB-CG2 4.08Å; K23-T669 HydrophobicContact CG-CG2 3.52Å; K23-T669 WeakPolarHBondContact O-CB 3.5Å; K23-T669 WeakPolarHBondContact O-CG2 3.28Å
24	R	51.2	Low	49.9	Very low	13 Å²	13	99.6 Å²	99.6	5%	0.049	51%	0.508	C	S	.	.	H	α-helix	trans	-50.3	-16.7	161.8	-98.9	164.4	-168.1	123.4	18.7	115.2	E672 Q675 R676 R679	R24-E672 WeakPolarHBondContact CA-OE2 3.19Å; R24-E672 HydrophobicContact CB-CB 4.45Å; R24-E672 WeakPolarHBondContact CB-OE2 3.28Å; R24-E672 VanDerWaalsContact CD-OE1 3.24Å; R24-E672 WeakPolarHBondContact CD-OE1 3.32Å; R24-E672 WeakPolarHBondContact CD-OE2 3.35Å; R24-E672 HydrophobicContact CG-CB 3.77Å; R24-E672 VanDerWaalsContact CG-CD 3.41Å; R24-E672 HydrophobicContact CG-CG 4.04Å; R24-E672 WeakPolarHBondContact CG-O 3.41Å; R24-E672 WeakPolarHBondContact CG-OE2 3.45Å; R24-E672 VanDerWaalsContact CZ-CD 3.46Å; R24-E672 IonicContact CZ-OE1 3.55Å; R24-E672 PolarHBondContact N-OE2 3.28Å; R24-E672 PolarHBondContact NE-O 2.66Å; R24-E672 IonicContact NE-OE1 3.48Å; R24-E672 PolarHBondContact NE-OE1 3.45Å; R24-E672 IonicContact NE-OE2 3.48Å; R24-E672 IonicContact NH1-OE1 2.77Å; R24-E672 PolarHBondContact NH1-OE1 3.06Å; R24-E672 PolarHBondContact NH2-O 3.28Å; R24-Q675 PolarHBondContact NH2-O 2.77Å; R24-R676 HydrophobicContact CG-CB 4.34Å; R24-R676 HydrophobicContact CG-CG 4.29Å; R24-R676 VanDerWaalsContact NH2-N 3.18Å; R24-R676 PolarHBondContact O-NH1 3.19Å; R24-R679 VanDerWaalsContact CZ-NH1 3.32Å
25	K	50.7	Low	49.1	Very low	119 Å²	119	97.2 Å²	97.2	52%	0.517	49%	0.493	S	S	.	.	H	α-helix	trans	-88.5	-40.4	-171.5	-161.4	177.1	178.6	-75.3	0	111.9	K23 K28 E29	K23-K25 PolarHBondContact O-N 3.49Å; K25-K28 PolarHBondContact O-N 3.26Å; K25-E29 IonicContact NZ-OE1 2.72Å; K25-E29 PolarHBondContact NZ-OE1 3.45Å; K25-E29 IonicContact NZ-OE2 3.68Å; K25-E29 WeakPolarHBondContact O-CG 3.49Å; K25-E29 PolarHBondContact O-N 3.28Å
26	L	49.7	Very low	48.3	Very low	71 Å²	71	98.5 Å²	98.5	37%	0.372	50%	0.502	S	S	.	.	H	α-helix	trans	-81.1	-24.8	-173	-87.5	150.2	0	0	0	114.4	K23 F665	K23-L26 PolarHBondContact O-N 2.88Å; L26-F665 HydrophobicContact CD1-CD1 3.72Å; L26-F665 HydrophobicContact CD1-CE1 3.34Å; L26-F665 HydrophobicContact CD1-CZ 4.1Å
27	E	46.6	Very low	47.3	Very low	28 Å²	28	104.8 Å²	104.8	13%	0.131	52%	0.52	C	S	.	.	S	Bend	trans	-66.8	-44.8	165.2	-82.7	158.3	167.9	0	0	112	E29 R30 E31 T669 D670 A673	E27-E29 PolarHBondContact O-N 3.25Å; E27-R30 CarbonylContact O-C 3.48Å; E27-R30 WeakPolarHBondContact O-CA 3.22Å; E27-R30 PolarHBondContact O-N 2.73Å; E27-E31 WeakPolarHBondContact O-CG 3.25Å; E27-E31 PolarHBondContact O-N 3.37Å; E27-T669 HydrophobicContact CG-CG2 4.41Å; E27-T669 WeakPolarHBondContact OE1-CB 3.31Å; E27-T669 PolarHBondContact OE1-OG1 2.63Å; E27-T669 WeakPolarHBondContact OE2-CB 3.45Å; E27-D670 WeakPolarHBondContact OE1-CA 3.29Å; E27-D670 PolarHBondContact OE1-N 3.21Å; E27-A673 VanDerWaalsContact OE2-CB 3.29Å; E27-A673 WeakPolarHBondContact OE2-CB 3.32Å
28	K	47.1	Very low	47	Very low	77 Å²	77	103.5 Å²	103.5	34%	0.335	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-5	-179.3	-74.1	-129.8	160.8	-69.3	0	114.3	K25 E31 T32	K25-K28 PolarHBondContact O-N 3.26Å; K28-E31 IonicContact NZ-OE2 2.91Å; K28-E31 PolarHBondContact NZ-OE2 3.18Å; K28-T32 WeakPolarHBondContact O-CG2 3.48Å; K28-T32 PolarHBondContact O-OG1 3.35Å
29	E	46.3	Very low	46.9	Very low	101 Å²	101	98.8 Å²	98.8	47%	0.472	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-4.7	171.7	-71.4	161	179.2	0	0	111.5	K25 E27	K25-E29 IonicContact NZ-OE1 2.72Å; K25-E29 PolarHBondContact NZ-OE1 3.45Å; K25-E29 IonicContact NZ-OE2 3.68Å; K25-E29 WeakPolarHBondContact O-CG 3.49Å; K25-E29 PolarHBondContact O-N 3.28Å; E27-E29 PolarHBondContact O-N 3.25Å
30	R	40.1	Very low	47.1	Very low	178 Å²	178	105.4 Å²	105.4	67%	0.672	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-40.8	171.6	-69.5	-179.9	171.3	-168.5	-4.5	112.9	E27 T32	E27-R30 CarbonylContact O-C 3.48Å; E27-R30 WeakPolarHBondContact O-CA 3.22Å; E27-R30 PolarHBondContact O-N 2.73Å; R30-T32 PolarHBondContact O-N 3.06Å
31	E	42.8	Very low	47.6	Very low	99 Å²	99	107 Å²	107	46%	0.463	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-12.2	175.8	-68.2	177.3	143.2	0	0	114	E27 K28	E27-E31 WeakPolarHBondContact O-CG 3.25Å; E27-E31 PolarHBondContact O-N 3.37Å; K28-E31 IonicContact NZ-OE2 2.91Å; K28-E31 PolarHBondContact NZ-OE2 3.18Å
32	T	41.7	Very low	48	Very low	77 Å²	77	104.2 Å²	104.2	47%	0.472	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	11.5	-172.5	49.9	0	0	0	0	114.7	K28 R30	K28-T32 WeakPolarHBondContact O-CG2 3.48Å; K28-T32 PolarHBondContact O-OG1 3.35Å; R30-T32 PolarHBondContact O-N 3.06Å
33	A	42.6	Very low	48.4	Very low	80 Å²	80	105.6 Å²	105.6	66%	0.661	55%	0.546	S	S	*	.	S	Bend	trans	-80.2	-44.9	174.7	0	0	0	0	0	112.3
34	D	36.7	Very low	49	Very low	162 Å²	162	106.3 Å²	106.3	87%	0.866	56%	0.562	S	S	*	*	S	Bend	trans	-104.7	18.1	-163.9	-54.8	-52.5	0	0	0	114.7
35	G	36.7	Very low	49.7	Very low	51 Å²	51	112.8 Å²	112.8	53%	0.526	59%	0.591	S	S	.	*			trans	-149.1	126.7	-175.2	0	0	0	0	0	114.3	E37	G35-E37 VanDerWaalsContact C-N 3.28Å; G35-E37 PolarHBondContact O-N 3.13Å
36	S	35.8	Very low	50.6	Low	127 Å²	127	111.9 Å²	111.9	89%	0.888	60%	0.595	S	S	*	*	S	Bend	trans	-75.9	-2	-170.6	51.8	0	0	0	0	115.9
37	E	43.1	Very low	51.8	Low	177 Å²	177	115.7 Å²	115.7	83%	0.827	61%	0.609	S	S	*	*			trans	-96.1	92.7	-178.3	-67.8	-139	132.2	0	0	113.8	G35	G35-E37 VanDerWaalsContact C-N 3.28Å; G35-E37 PolarHBondContact O-N 3.13Å
38	K	53.2	Low	53.3	Low	189 Å²	189	120 Å²	120	82%	0.822	65%	0.65	S	S	*	*			trans	-59.4	123.3	174.3	-70	179.4	179.5	174.8	0	111.5	K40	K38-K40 PolarHBondContact O-N 2.92Å
39	P	49.8	Very low	55	Low	93 Å²	93	119.1 Å²	119.1	60%	0.604	65%	0.653	S	S	*	*			trans	-69.1	99.3	-173.5	25.6	-34.3	0	0	0	112.5	N41	P39-N41 PolarHBondContact O-N 3.46Å
40	K	59	Low	56.9	Low	167 Å²	167	117.7 Å²	117.7	73%	0.726	66%	0.659	S	S	*	*			trans	-52.5	115.3	-176.4	-76.3	170.4	-176.9	160.9	0	112.5	K38 P42 F45	K38-K40 PolarHBondContact O-N 2.92Å; K40-P42 VanDerWaalsContact O-CD 3.28Å; K40-P42 WeakPolarHBondContact O-CD 3.44Å; K40-F45 HydrophobicContact CB-CD2 4.04Å; K40-F45 HydrophobicContact CB-CE2 3.58Å; K40-F45 HydrophobicContact CB-CZ 4.42Å; K40-F45 HydrophobicContact CD-CE2 4.35Å; K40-F45 HydrophobicContact CD-CZ 4.41Å; K40-F45 HydrophobicContact CG-CE2 3.81Å; K40-F45 HydrophobicContact CG-CZ 4.19Å
41	N	64.5	Low	59.1	Low	91 Å²	91	113.3 Å²	113.3	49%	0.487	65%	0.652	S	S	.	*			trans	-64.5	111.8	-177.7	176.3	1.8	0	0	0	111.8	P39 K43 A44 F45	P39-N41 PolarHBondContact O-N 3.46Å; N41-K43 PolarHBondContact O-N 3.12Å; N41-K43 WeakPolarHBondContact OD1-CB 3.38Å; N41-K43 PolarHBondContact OD1-N 3.3Å; N41-A44 HydrophobicContact CB-CB 4.25Å; N41-A44 WeakPolarHBondContact O-CB 3.45Å; N41-A44 PolarHBondContact O-N 3.27Å; N41-F45 WeakPolarHBondContact O-CD2 3.45Å; N41-F45 PolarHBondContact O-N 3.09Å
42	P	62.9	Low	61.2	Low	91 Å²	91	118.1 Å²	118.1	59%	0.591	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-2.8	-174.7	30.9	-36.9	0	0	0	114.1	K40	K40-P42 VanDerWaalsContact O-CD 3.28Å; K40-P42 WeakPolarHBondContact O-CD 3.44Å
43	K	62.7	Low	63.3	Low	172 Å²	172	115.2 Å²	115.2	75%	0.748	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-31.5	166.6	-68	-168.4	170.5	-163.6	0	112.7	N41 T46	N41-K43 PolarHBondContact O-N 3.12Å; N41-K43 WeakPolarHBondContact OD1-CB 3.38Å; N41-K43 PolarHBondContact OD1-N 3.3Å; K43-T46 WeakPolarHBondContact O-CG2 3.36Å; K43-T46 PolarHBondContact O-OG1 3.43Å
44	A	65.9	Low	65.4	Low	70 Å²	70	113.4 Å²	113.4	58%	0.579	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-38.3	176.4	0	0	0	0	0	111.2	N41 T46	N41-A44 HydrophobicContact CB-CB 4.25Å; N41-A44 WeakPolarHBondContact O-CB 3.45Å; N41-A44 PolarHBondContact O-N 3.27Å; A44-T46 PolarHBondContact O-N 3.41Å
45	F	65.6	Low	67.9	Low	148 Å²	148	114.4 Å²	114.4	65%	0.649	63%	0.626	S	S	*	*	S	Bend	trans	-84.6	54.8	175.5	-61.6	-77	0	0	0	112.3	K40 N41	K40-F45 HydrophobicContact CB-CD2 4.04Å; K40-F45 HydrophobicContact CB-CE2 3.58Å; K40-F45 HydrophobicContact CB-CZ 4.42Å; K40-F45 HydrophobicContact CD-CE2 4.35Å; K40-F45 HydrophobicContact CD-CZ 4.41Å; K40-F45 HydrophobicContact CG-CE2 3.81Å; K40-F45 HydrophobicContact CG-CZ 4.19Å; N41-F45 WeakPolarHBondContact O-CD2 3.45Å; N41-F45 PolarHBondContact O-N 3.09Å
46	T	70.1	Confident	70.5	Confident	100 Å²	100	114.6 Å²	114.6	61%	0.613	62%	0.622	S	S	*	*	S	Bend	trans	-111.1	155.4	173.8	53.1	0	0	0	0	111.5	K43 A44 A48	K43-T46 WeakPolarHBondContact O-CG2 3.36Å; K43-T46 PolarHBondContact O-OG1 3.43Å; A44-T46 PolarHBondContact O-N 3.41Å; T46-A48 PolarHBondContact O-N 3.01Å
47	F	74.1	Confident	72.9	Confident	151 Å²	151	111.9 Å²	111.9	66%	0.662	60%	0.597	S	S	*	*			trans	-71.8	127.1	179	-53.5	-72.5	0	0	0	111.1	S49 A53	F47-S49 PolarHBondContact O-N 3.09Å; F47-A53 HydrophobicContact CB-CB 4Å; F47-A53 HydrophobicContact CD1-CB 3.78Å; F47-A53 HydrophobicContact CD2-CB 3.83Å; F47-A53 HydrophobicContact CE1-CB 4.16Å; F47-A53 HydrophobicContact CE2-CB 4.21Å; F47-A53 HydrophobicContact CG-CB 3.6Å; F47-A53 HydrophobicContact CZ-CB 4.36Å
48	A	78.5	Confident	75	Confident	119 Å²	119	112.2 Å²	112.2	98%	0.983	59%	0.591	S	S	*	*	S	Bend	trans	-56.9	-18.7	173.4	0	0	0	0	0	114.1	T46	T46-A48 PolarHBondContact O-N 3.01Å
49	S	83.2	Confident	76.8	Confident	58 Å²	58	111.6 Å²	111.6	41%	0.406	58%	0.583	S	S	.	*			trans	-148.2	108.7	164.6	177.1	0	0	0	0	110.7	F47 V51 R52 A53	F47-S49 PolarHBondContact O-N 3.09Å; S49-V51 VanDerWaalsContact C-N 3.26Å; S49-V51 PolarHBondContact O-N 3.24Å; S49-R52 PolarHBondContact O-N 3.28Å; S49-R52 PolarHBondContact OG-N 3.22Å; S49-A53 PolarHBondContact O-N 3.1Å
50	A	85.7	Confident	78.8	Confident	71 Å²	71	112.1 Å²	112.1	59%	0.587	58%	0.578	S	S	*	*	H	α-helix	trans	-58.9	-37	176.4	0	0	0	0	0	112.4	A53 A54	A50-A53 PolarHBondContact O-N 3Å; A50-A54 WeakPolarHBondContact O-CB 3.48Å; A50-A54 PolarHBondContact O-N 3.41Å
51	V	86.2	Confident	80.1	Confident	87 Å²	87	106.3 Å²	106.3	53%	0.527	56%	0.561	S	S	.	*	H	α-helix	trans	-66.9	-40.5	177.8	-179.1	0	0	0	0	111.4	S49 R55	S49-V51 VanDerWaalsContact C-N 3.26Å; S49-V51 PolarHBondContact O-N 3.24Å; V51-R55 VanDerWaalsContact O-CG 3.32Å; V51-R55 WeakPolarHBondContact O-CG 3.47Å; V51-R55 PolarHBondContact O-N 3.38Å; V51-R55 VanDerWaalsContact O-N 3.11Å
52	R	86.7	Confident	81.3	Confident	200 Å²	200	105.7 Å²	105.7	76%	0.755	56%	0.557	S	S	*	*	H	α-helix	trans	-66.3	-43	175.3	-173.5	174.7	175	168.9	-2.8	111.2	S49 R55 A56	S49-R52 PolarHBondContact O-N 3.28Å; S49-R52 PolarHBondContact OG-N 3.22Å; R52-R55 PolarHBondContact O-N 3.22Å; R52-A56 WeakPolarHBondContact O-CB 3.46Å; R52-A56 PolarHBondContact O-N 3.23Å
53	A	86.6	Confident	82.7	Confident	15 Å²	15	104.9 Å²	104.9	12%	0.124	55%	0.547	C	S	.	.	H	α-helix	trans	-60.8	-50	175.9	0	0	0	0	0	111.7	F47 S49 A50 R55 A56 I57	F47-A53 HydrophobicContact CB-CB 4Å; F47-A53 HydrophobicContact CD1-CB 3.78Å; F47-A53 HydrophobicContact CD2-CB 3.83Å; F47-A53 HydrophobicContact CE1-CB 4.16Å; F47-A53 HydrophobicContact CE2-CB 4.21Å; F47-A53 HydrophobicContact CG-CB 3.6Å; F47-A53 HydrophobicContact CZ-CB 4.36Å; S49-A53 PolarHBondContact O-N 3.1Å; A50-A53 PolarHBondContact O-N 3Å; A53-R55 VanDerWaalsContact C-N 3.34Å; A53-R55 PolarHBondContact O-N 2.7Å; A53-A56 WeakPolarHBondContact O-CB 3.36Å; A53-A56 PolarHBondContact O-N 3.45Å; A53-I57 WeakPolarHBondContact O-CG1 3.29Å; A53-I57 PolarHBondContact O-N 2.97Å
54	A	86.1	Confident	83.7	Confident	42 Å²	42	98.5 Å²	98.5	35%	0.347	52%	0.521	S	S	.	.	H	α-helix	trans	-60.1	-39.5	178.9	0	0	0	0	0	113.1	A50 R58	A50-A54 WeakPolarHBondContact O-CB 3.48Å; A50-A54 PolarHBondContact O-N 3.41Å; A54-R58 WeakPolarHBondContact O-CG 3.36Å; A54-R58 PolarHBondContact O-N 3.29Å; A54-R58 VanDerWaalsContact O-N 3.12Å
55	R	89.5	Confident	84.7	Confident	184 Å²	184	101.7 Å²	101.7	69%	0.694	52%	0.524	S	S	*	.	H	α-helix	trans	-65.4	-39.4	173.2	-70.7	177.5	-166.4	178	6.3	112.2	V51 R52 A53 R59	V51-R55 VanDerWaalsContact O-CG 3.32Å; V51-R55 WeakPolarHBondContact O-CG 3.47Å; V51-R55 PolarHBondContact O-N 3.38Å; V51-R55 VanDerWaalsContact O-N 3.11Å; R52-R55 PolarHBondContact O-N 3.22Å; A53-R55 VanDerWaalsContact C-N 3.34Å; A53-R55 PolarHBondContact O-N 2.7Å; R55-R59 WeakPolarHBondContact O-CB 3.42Å; R55-R59 PolarHBondContact O-N 2.83Å
56	A	91	Very high	85.7	Confident	54 Å²	54	101.6 Å²	101.6	45%	0.446	52%	0.523	S	S	.	.	H	α-helix	trans	-66.8	-45.8	178	0	0	0	0	0	111.8	R52 A53 R59 Q60	R52-A56 WeakPolarHBondContact O-CB 3.46Å; R52-A56 PolarHBondContact O-N 3.23Å; A53-A56 WeakPolarHBondContact O-CB 3.36Å; A53-A56 PolarHBondContact O-N 3.45Å; A56-R59 PolarHBondContact O-N 3.16Å; A56-Q60 WeakPolarHBondContact O-CB 3.35Å; A56-Q60 PolarHBondContact O-N 3.35Å
57	I	87.5	Confident	86.5	Confident	70 Å²	70	103 Å²	103	36%	0.359	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-48	177.7	-66.5	162.5	0	0	0	110.7	A53 Q60 A61	A53-I57 WeakPolarHBondContact O-CG1 3.29Å; A53-I57 PolarHBondContact O-N 2.97Å; I57-Q60 WeakPolarHBondContact O-CB 3.5Å; I57-Q60 PolarHBondContact O-N 3.08Å; I57-A61 PolarHBondContact O-N 3.07Å
58	R	87	Confident	87	Confident	184 Å²	184	98 Å²	98	69%	0.694	50%	0.503	S	S	*	.	H	α-helix	trans	-60	-48.9	175.7	-71	177.2	-173.8	-179.5	2.3	112.2	A54 Q60 A61 D62	A54-R58 WeakPolarHBondContact O-CG 3.36Å; A54-R58 PolarHBondContact O-N 3.29Å; A54-R58 VanDerWaalsContact O-N 3.12Å; R58-Q60 PolarHBondContact O-N 3.19Å; R58-A61 WeakPolarHBondContact O-CB 3.15Å; R58-A61 PolarHBondContact O-N 3.39Å; R58-A61 VanDerWaalsContact O-N 3.14Å; R58-D62 VanDerWaalsContact O-CG 3.25Å; R58-D62 PolarHBondContact O-N 3.46Å
59	R	90.5	Very high	87.3	Confident	177 Å²	177	97.5 Å²	97.5	67%	0.668	48%	0.48	S	S	*	.	H	α-helix	trans	-60.3	-33	176.5	-178.7	179.7	176.3	-167	-1.1	112.2	R55 A56 I63	R55-R59 WeakPolarHBondContact O-CB 3.42Å; R55-R59 PolarHBondContact O-N 2.83Å; A56-R59 PolarHBondContact O-N 3.16Å; R59-I63 HydrophobicContact CG-CD1 4.02Å; R59-I63 WeakPolarHBondContact O-CD1 3.26Å; R59-I63 WeakPolarHBondContact O-CG1 3.49Å; R59-I63 PolarHBondContact O-N 2.97Å
60	Q	90.5	Very high	87.4	Confident	104 Å²	104	98.4 Å²	98.4	49%	0.486	49%	0.491	S	S	.	.	H	α-helix	trans	-69.4	-46.8	175.2	-175.8	163.2	-24	0	0	110.6	A56 I57 R58 D62 I63 L64 Y694	A56-Q60 WeakPolarHBondContact O-CB 3.35Å; A56-Q60 PolarHBondContact O-N 3.35Å; I57-Q60 WeakPolarHBondContact O-CB 3.5Å; I57-Q60 PolarHBondContact O-N 3.08Å; R58-Q60 PolarHBondContact O-N 3.19Å; Q60-D62 PolarHBondContact O-N 3.34Å; Q60-I63 PolarHBondContact O-N 2.98Å; Q60-I63 VanDerWaalsContact O-N 3.09Å; Q60-L64 HydrophobicContact CG-CD1 3.91Å; Q60-L64 HydrophobicContact CG-CG 4.23Å; Q60-L64 WeakPolarHBondContact O-CB 3.25Å; Q60-L64 VanDerWaalsContact O-CG 3.24Å; Q60-L64 WeakPolarHBondContact O-CG 3.3Å; Q60-L64 PolarHBondContact O-N 3.03Å; Q60-Y694 PolarHBondContact NE2-OH 3.34Å
61	A	86.7	Confident	87.4	Confident	45 Å²	45	97.2 Å²	97.2	37%	0.372	48%	0.477	S	S	.	.	H	α-helix	trans	-54.6	-49.5	172	0	0	0	0	0	111.8	I57 R58 I63 L64 E65	I57-A61 PolarHBondContact O-N 3.07Å; R58-A61 WeakPolarHBondContact O-CB 3.15Å; R58-A61 PolarHBondContact O-N 3.39Å; R58-A61 VanDerWaalsContact O-N 3.14Å; A61-I63 PolarHBondContact O-N 2.93Å; A61-I63 VanDerWaalsContact O-N 3.1Å; A61-L64 PolarHBondContact O-N 3.27Å; A61-E65 WeakPolarHBondContact O-CB 3.02Å; A61-E65 PolarHBondContact O-N 2.99Å
62	D	90.5	Very high	87.2	Confident	77 Å²	77	96 Å²	96	41%	0.412	48%	0.477	S	S	.	.	H	α-helix	trans	-55.6	-29.5	176.3	-65	-15.6	0	0	0	114.1	R58 Q60 K66	R58-D62 VanDerWaalsContact O-CG 3.25Å; R58-D62 PolarHBondContact O-N 3.46Å; Q60-D62 PolarHBondContact O-N 3.34Å; D62-K66 VanDerWaalsContact O-CD 3.22Å; D62-K66 WeakPolarHBondContact O-CD 3.32Å; D62-K66 WeakPolarHBondContact O-CG 3.41Å; D62-K66 PolarHBondContact O-NZ 2.76Å
63	I	91.1	Very high	86.9	Confident	75 Å²	75	89.2 Å²	89.2	39%	0.385	46%	0.457	S	S	.	.	H	α-helix	trans	-87.9	-32.5	178.9	-71.9	167.8	0	0	0	110.6	R59 Q60 A61 K67	R59-I63 HydrophobicContact CG-CD1 4.02Å; R59-I63 WeakPolarHBondContact O-CD1 3.26Å; R59-I63 WeakPolarHBondContact O-CG1 3.49Å; R59-I63 PolarHBondContact O-N 2.97Å; Q60-I63 PolarHBondContact O-N 2.98Å; Q60-I63 VanDerWaalsContact O-N 3.09Å; A61-I63 PolarHBondContact O-N 2.93Å; A61-I63 VanDerWaalsContact O-N 3.1Å; I63-K67 HydrophobicContact CG2-CD 4.49Å; I63-K67 VanDerWaalsContact O-CG 3.3Å; I63-K67 WeakPolarHBondContact O-CG 3.47Å; I63-K67 PolarHBondContact O-N 3.19Å
64	L	85	Confident	86.4	Confident	37 Å²	37	92.7 Å²	92.7	19%	0.194	47%	0.474	C	S	.	.	H	α-helix	trans	-73.9	-38.3	178.1	-73.8	179.2	0	0	0	111.8	Q60 A61 K67 T68 R698	Q60-L64 HydrophobicContact CG-CD1 3.91Å; Q60-L64 HydrophobicContact CG-CG 4.23Å; Q60-L64 WeakPolarHBondContact O-CB 3.25Å; Q60-L64 VanDerWaalsContact O-CG 3.24Å; Q60-L64 WeakPolarHBondContact O-CG 3.3Å; Q60-L64 PolarHBondContact O-N 3.03Å; A61-L64 PolarHBondContact O-N 3.27Å; L64-K67 PolarHBondContact O-N 2.87Å; L64-T68 PolarHBondContact O-N 2.92Å; L64-R698 PolarHBondContact O-NE 3.37Å; L64-R698 PolarHBondContact O-NH2 3.25Å
65	E	85.9	Confident	86.1	Confident	137 Å²	137	96.6 Å²	96.6	64%	0.64	48%	0.479	S	S	*	.	H	α-helix	trans	-64.9	-45.3	171.4	-172.8	-168.4	-176.9	0	0	111.1	A61 K67 T68	A61-E65 WeakPolarHBondContact O-CB 3.02Å; A61-E65 PolarHBondContact O-N 2.99Å; E65-K67 PolarHBondContact O-N 2.84Å; E65-T68 PolarHBondContact O-N 3.01Å; E65-T68 VanDerWaalsContact O-N 3.08Å; E65-T68 PolarHBondContact O-OG1 2.85Å
66	K	87.5	Confident	85.6	Confident	146 Å²	146	92 Å²	92	64%	0.635	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-9	176	-71.5	174.4	-168.3	107.5	0	114.4	D62	D62-K66 VanDerWaalsContact O-CD 3.22Å; D62-K66 WeakPolarHBondContact O-CD 3.32Å; D62-K66 WeakPolarHBondContact O-CG 3.41Å; D62-K66 PolarHBondContact O-NZ 2.76Å
67	K	86.5	Confident	85	Confident	131 Å²	131	91.1 Å²	91.1	57%	0.57	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-17	175.1	-77.3	176.2	177.8	-172.7	0	113.8	I63 L64 E65	I63-K67 HydrophobicContact CG2-CD 4.49Å; I63-K67 VanDerWaalsContact O-CG 3.3Å; I63-K67 WeakPolarHBondContact O-CG 3.47Å; I63-K67 PolarHBondContact O-N 3.19Å; L64-K67 PolarHBondContact O-N 2.87Å; E65-K67 PolarHBondContact O-N 2.84Å
68	T	85.7	Confident	84.5	Confident	45 Å²	45	93.2 Å²	93.2	28%	0.276	48%	0.477	S	S	.	.			trans	-78.2	133	174.1	46.3	0	0	0	0	109.2	L64 E65 H701	L64-T68 PolarHBondContact O-N 2.92Å; E65-T68 PolarHBondContact O-N 3.01Å; E65-T68 VanDerWaalsContact O-N 3.08Å; E65-T68 PolarHBondContact O-OG1 2.85Å; T68-H701 HydrophobicContact CG2-CB 4.29Å
69	H	84.5	Confident	84.2	Confident	108 Å²	108	88 Å²	88	50%	0.5	46%	0.463	S	S	.	.			trans	-138.4	159.6	-176.4	-67.2	-14.5	0	0	0	108	P71 H701	H69-P71 WeakPolarHBondContact O-CD 3.32Å; H69-H701 VanDerWaalsContact C-NE2 3.26Å; H69-H701 PolarHBondContact N-NE2 3.05Å; H69-H701 VanDerWaalsContact N-NE2 3.15Å; H69-H701 PolarHBondContact O-CD2 2.99Å; H69-H701 PolarHBondContact O-NE2 2.98Å
70	A	85.3	Confident	84	Confident	77 Å²	77	80.8 Å²	80.8	64%	0.636	44%	0.439	S	S	*	.			trans	-56	123.9	167.5	0	0	0	0	0	109.3	R245	A70-R245 PolarHBondContact O-NH2 3.42Å; A70-R245 VanDerWaalsContact O-NH2 3.12Å
71	P	85.4	Confident	84.1	Confident	47 Å²	47	76.8 Å²	76.8	31%	0.305	42%	0.422	S	S	.	.			trans	-61.9	149.2	174.8	27.5	-33.6	0	0	0	109.2	H69 M704 V705 L708	H69-P71 WeakPolarHBondContact O-CD 3.32Å; P71-M704 HydrophobicContact CG-CB 4.42Å; P71-M704 HydrophobicContact CG-CE 4.08Å; P71-M704 HydrophobicContact CG-SD 4.09Å; P71-V705 HydrophobicContact CB-CG2 4.12Å; P71-L708 HydrophobicContact CB-CD1 4.2Å
72	A	81.2	Confident	84.4	Confident	62 Å²	62	74.6 Å²	74.6	51%	0.512	40%	0.404	S	S	.	.			trans	-150.4	131.7	179.7	0	0	0	0	0	107.8	D74	A72-D74 PolarHBondContact O-N 3.01Å
73	V	81.3	Confident	84.6	Confident	57 Å²	57	72.7 Å²	72.7	35%	0.345	39%	0.392	S	S	.	.			trans	-59.6	120.9	178.1	-163.4	0	0	0	0	108.8	R75 L708	V73-R75 HydrophobicContact CB-CG 4.5Å; V73-R75 HydrophobicContact CG1-CG 4.12Å; V73-L708 HydrophobicContact CG2-CD1 4.4Å; V73-L708 HydrophobicContact CG2-CD2 3.91Å
74	D	76.1	Confident	84.7	Confident	88 Å²	88	69.1 Å²	69.1	47%	0.471	37%	0.374	S	S	.	.			trans	-75.8	132.1	165.3	-153.4	-31.2	0	0	0	108.3	A72 T76	A72-D74 PolarHBondContact O-N 3.01Å; D74-T76 WeakPolarHBondContact OD1-CG2 3.35Å; D74-T76 PolarHBondContact OD1-N 3.09Å; D74-T76 PolarHBondContact OD1-OG1 3.09Å; D74-T76 VanDerWaalsContact OD1-OG1 3.11Å
75	R	80.2	Confident	85.2	Confident	124 Å²	124	67.3 Å²	67.3	47%	0.468	36%	0.364	S	S	.	.			trans	-123.9	15.5	-178.5	-69.7	177.5	170.8	-164.6	-10	110.8	V73 S251 C289	V73-R75 HydrophobicContact CB-CG 4.5Å; V73-R75 HydrophobicContact CG1-CG 4.12Å; R75-S251 WeakPolarHBondContact CD-O 3.3Å; R75-S251 PolarHBondContact NH1-O 2.67Å; R75-C289 PolarHBondContact NH1-SG 3.09Å
76	T	77.4	Confident	85.6	Confident	88 Å²	88	60.8 Å²	60.8	54%	0.54	33%	0.334	S	S	.	.			trans	-71.9	128.7	173.8	58.9	0	0	0	0	110.7	D74	D74-T76 WeakPolarHBondContact OD1-CG2 3.35Å; D74-T76 PolarHBondContact OD1-N 3.09Å; D74-T76 PolarHBondContact OD1-OG1 3.09Å; D74-T76 VanDerWaalsContact OD1-OG1 3.11Å
77	P	78.8	Confident	86	Confident	34 Å²	34	53.9 Å²	53.9	22%	0.221	30%	0.304	C	S	.	.			trans	-75.5	169.1	178.8	35.8	-40.1	0	0	0	111.3	L79 P735	P77-L79 VanDerWaalsContact C-N 3.27Å; P77-L79 WeakPolarHBondContact CG-O 3.3Å; P77-L79 PolarHBondContact O-N 3.48Å; P77-P735 HydrophobicContact CB-CG 4.33Å; P77-P735 HydrophobicContact CG-CB 4.23Å; P77-P735 HydrophobicContact CG-CG 3.9Å; P77-P735 WeakPolarHBondContact CG-O 3.33Å
78	V	76.7	Confident	86.4	Confident	114 Å²	114	47.8 Å²	47.8	69%	0.691	28%	0.277	S	S	*	.	S	Bend	trans	-58.7	-37.7	175.8	-175.8	0	0	0	0	111.9	P80	V78-P80 VanDerWaalsContact O-CD 3.28Å; V78-P80 WeakPolarHBondContact O-CD 3.5Å
79	L	82	Confident	86.7	Confident	76 Å²	76	45.8 Å²	45.8	40%	0.398	27%	0.266	S	S	.	.	S	Bend	trans	-102.1	94.8	172.9	-173.1	76.7	0	0	0	110.4	P77 L339	P77-L79 VanDerWaalsContact C-N 3.27Å; P77-L79 WeakPolarHBondContact CG-O 3.3Å; P77-L79 PolarHBondContact O-N 3.48Å; L79-L339 HydrophobicContact CD1-CB 4.37Å; L79-L339 HydrophobicContact CD1-CD1 4.01Å
80	P	86.4	Confident	87	Confident	24 Å²	24	40.7 Å²	40.7	16%	0.156	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-67.7	140.8	-173.4	26	-34.8	0	0	0	112.8	V78 F83 R127 L339	V78-P80 VanDerWaalsContact O-CD 3.28Å; V78-P80 WeakPolarHBondContact O-CD 3.5Å; P80-F83 HydrophobicContact CB-CZ 4.34Å; P80-R127 PolarHBondContact O-NE 2.88Å; P80-L339 HydrophobicContact CG-CD1 4.35Å
81	P	91.2	Very high	87.1	Confident	20 Å²	20	40 Å²	40	13%	0.13	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-62.4	157.7	167.1	26.4	-33	0	0	0	111.2	F83 R287 P735	P81-F83 PolarHBondContact O-N 2.9Å; P81-R287 HydrophobicContact CB-CG 3.88Å; P81-R287 HydrophobicContact CG-CG 4.23Å; P81-P735 HydrophobicContact CG-CB 4.46Å
82	P	93.9	Very high	87.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-64.1	121.5	176.1	27	-33.2	0	0	0	111.3	L84 T119 R127 T129 Y285 R287	P82-L84 PolarHBondContact O-N 3.48Å; P82-T119 HydrophobicContact CB-CG2 3.87Å; P82-T119 HydrophobicContact CG-CG2 4.07Å; P82-R127 WeakPolarHBondContact CA-O 3.1Å; P82-R127 HydrophobicContact CB-CB 4.22Å; P82-R127 HydrophobicContact CB-CG 3.88Å; P82-T129 WeakPolarHBondContact CB-OG1 3.17Å; P82-T129 WeakPolarHBondContact CG-OG1 3.43Å; P82-Y285 HydrophobicContact CG-CD1 4.25Å; P82-Y285 HydrophobicContact CG-CD2 3.56Å; P82-Y285 HydrophobicContact CG-CE2 3.87Å; P82-Y285 HydrophobicContact CG-CG 3.76Å; P82-R287 PolarHBondContact O-NE 2.83Å
83	F	93.7	Very high	87.7	Confident	36 Å²	36	44.4 Å²	44.4	16%	0.158	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	130.1	-178.5	-61.9	-68.7	0	0	0	110	P80 P81 V85 R127 L128 T129 F244	P80-F83 HydrophobicContact CB-CZ 4.34Å; P81-F83 PolarHBondContact O-N 2.9Å; F83-V85 PolarHBondContact O-N 3.41Å; F83-R127 PolarHBondContact N-O 3.05Å; F83-L128 HydrophobicContact CB-CD2 4.06Å; F83-L128 HydrophobicContact CD2-CD2 4.43Å; F83-L128 WeakPolarHBondContact O-CA 3.35Å; F83-T129 PolarHBondContact O-N 2.95Å; F83-F244 HydrophobicContact CB-CD2 4.27Å; F83-F244 HydrophobicContact CB-CE2 3.85Å; F83-F244 HydrophobicContact CB-CZ 4.44Å; F83-F244 AromaticContact CD1-CD2 3.44Å; F83-F244 HydrophobicContact CD1-CD2 3.44Å; F83-F244 VanDerWaalsContact CD1-CD2 3.44Å; F83-F244 AromaticContact CD1-CE2 3.8Å; F83-F244 HydrophobicContact CD1-CE2 3.8Å; F83-F244 HydrophobicContact CD1-CG 4.36Å; F83-F244 HydrophobicContact CD2-CD2 4.15Å; F83-F244 AromaticContact CD2-CE2 3.73Å; F83-F244 HydrophobicContact CD2-CE2 3.73Å; F83-F244 AromaticContact CE1-CD2 3.69Å; F83-F244 HydrophobicContact CE1-CD2 3.69Å; F83-F244 HydrophobicContact CE1-CE2 4.27Å; F83-F244 HydrophobicContact CE2-CD2 4.35Å; F83-F244 HydrophobicContact CE2-CE2 4.21Å; F83-F244 AromaticContact CG-CD2 3.69Å; F83-F244 HydrophobicContact CG-CD2 3.69Å; F83-F244 AromaticContact CG-CE2 3.51Å; F83-F244 HydrophobicContact CG-CE2 3.51Å; F83-F244 HydrophobicContact CZ-CD2 4.14Å; F83-F244 HydrophobicContact CZ-CE2 4.46Å
84	L	94.3	Very high	88	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	118.3	-173.9	-174.4	63.2	0	0	0	111.5	P82 T129 L131 I146 D148 L149 L257	P82-L84 PolarHBondContact O-N 3.48Å; L84-T129 HydrophobicContact CD1-CG2 3.82Å; L84-L131 HydrophobicContact CD1-CB 3.92Å; L84-L131 HydrophobicContact CD1-CD2 4.28Å; L84-L131 HydrophobicContact CD2-CD2 4.46Å; L84-I146 HydrophobicContact CD2-CB 3.79Å; L84-I146 HydrophobicContact CD2-CD1 3.35Å; L84-I146 HydrophobicContact CD2-CG1 3.4Å; L84-D148 PolarHBondContact O-N 3.02Å; L84-L149 PolarHBondContact O-N 2.77Å; L84-L257 HydrophobicContact CD1-CD2 3.64Å; L84-L257 HydrophobicContact CD2-CD2 4.13Å
85	V	95.3	Very high	88.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	97.3	177.8	-173.5	0	0	0	0	109	F83 L128 T129 L130 L131 L149 L151 I239	F83-V85 PolarHBondContact O-N 3.41Å; V85-L128 HydrophobicContact CG2-CB 4.28Å; V85-L128 HydrophobicContact CG2-CD1 4.41Å; V85-L128 HydrophobicContact CG2-CD2 4.09Å; V85-L128 HydrophobicContact CG2-CG 4.5Å; V85-T129 PolarHBondContact N-O 2.9Å; V85-L130 HydrophobicContact CB-CD2 3.84Å; V85-L130 HydrophobicContact CG1-CD2 4.15Å; V85-L130 HydrophobicContact CG2-CD2 4.28Å; V85-L131 PolarHBondContact O-N 3.41Å; V85-L149 CarbonylContact C-O 3.59Å; V85-L149 WeakPolarHBondContact CA-O 3.22Å; V85-L149 HydrophobicContact CB-CB 4.49Å; V85-L149 HydrophobicContact CG1-CB 4.35Å; V85-L149 HydrophobicContact CG1-CD2 3.99Å; V85-L149 HydrophobicContact CG1-CG 4.22Å; V85-L149 HydrophobicContact CG2-CB 4.19Å; V85-L149 HydrophobicContact CG2-CD2 4.1Å; V85-L151 HydrophobicContact CG1-CD1 3.97Å; V85-L151 HydrophobicContact CG1-CD2 4.4Å; V85-L151 HydrophobicContact CG1-CG 3.79Å; V85-I239 HydrophobicContact CG2-CG2 4.38Å
86	A	95	Very high	89.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	129.5	176	0	0	0	0	0	111.4	V88 L131 V143 A147 L149 V150 L151	A86-V88 HydrophobicContact CB-CG2 3.97Å; A86-L131 WeakPolarHBondContact CA-O 3.31Å; A86-V143 HydrophobicContact CB-CG1 3.35Å; A86-A147 HydrophobicContact CB-CB 3.52Å; A86-L149 PolarHBondContact N-O 2.74Å; A86-V150 CarbonylContact O-C 3.47Å; A86-V150 WeakPolarHBondContact O-CA 3.42Å; A86-L151 PolarHBondContact O-N 3.39Å
87	V	95.6	Very high	90	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	108.1	174.5	-175.8	0	0	0	0	108.4	K95 L98 I99 L131 C133 L151 L153	V87-K95 HydrophobicContact CG1-CB 4.08Å; V87-K95 HydrophobicContact CG1-CG 4.26Å; V87-L98 HydrophobicContact CG1-CD2 4.45Å; V87-I99 HydrophobicContact CB-CD1 4.01Å; V87-I99 HydrophobicContact CB-CG1 4.18Å; V87-I99 HydrophobicContact CG1-CD1 4.47Å; V87-I99 HydrophobicContact CG1-CG1 4.37Å; V87-I99 HydrophobicContact CG2-CD1 3.89Å; V87-I99 HydrophobicContact CG2-CG1 3.64Å; V87-L131 PolarHBondContact N-O 3.12Å; V87-C133 WeakPolarHBondContact O-CB 3.07Å; V87-C133 PolarHBondContact O-N 3.37Å; V87-L151 HydrophobicContact CG2-CD1 4.28Å; V87-L153 HydrophobicContact CG1-CD1 3.64Å
88	V	94.6	Very high	90.7	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.4	-167.6	-172.8	0	0	0	0	109.8	A86 C133 V150 L151 L152 L153 F167	A86-V88 HydrophobicContact CB-CG2 3.97Å; V88-C133 HydrophobicContact CB-CB 4.32Å; V88-C133 HydrophobicContact CG1-CB 4.38Å; V88-C133 HydrophobicContact CG2-CB 3.74Å; V88-V150 HydrophobicContact CB-CG1 4.1Å; V88-V150 HydrophobicContact CG2-CG1 3.83Å; V88-L151 PolarHBondContact N-O 3.2Å; V88-L152 HydrophobicContact CG1-CD1 4.48Å; V88-L152 CarbonylContact O-C 3.56Å; V88-L152 WeakPolarHBondContact O-CA 3.22Å; V88-L153 PolarHBondContact O-N 2.73Å; V88-F167 HydrophobicContact CG1-CB 4.23Å; V88-F167 HydrophobicContact CG1-CD1 4.02Å; V88-F167 HydrophobicContact CG1-CD2 3.65Å; V88-F167 HydrophobicContact CG1-CE1 4.36Å; V88-F167 HydrophobicContact CG1-CE2 4.01Å; V88-F167 HydrophobicContact CG1-CG 3.67Å; V88-F167 HydrophobicContact CG1-CZ 4.36Å; V88-F167 HydrophobicContact CG2-CD2 4.4Å; V88-F167 HydrophobicContact CG2-CE1 4.17Å; V88-F167 HydrophobicContact CG2-CE2 3.89Å; V88-F167 HydrophobicContact CG2-CZ 3.77Å
89	G	91.4	Very high	91.6	Very high	4 Å²	4	26 Å²	26	4%	0.041	14%	0.142	C	C	.	.			trans	176.4	169.3	179.7	0	0	0	0	0	112	K95	G89-K95 PolarHBondContact O-NZ 2.97Å
90	P	90.8	Very high	92	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-63.5	176.1	179.8	8.9	-6.1	0	0	0	112.9	V93 L153 E161 T164	P90-V93 HydrophobicContact CB-CG1 4.23Å; P90-V93 HydrophobicContact CG-CG1 3.66Å; P90-V93 WeakPolarHBondContact O-CG2 3.49Å; P90-L153 WeakPolarHBondContact CD-O 3.12Å; P90-E161 HydrophobicContact CB-CB 4.05Å; P90-E161 HydrophobicContact CB-CG 4.08Å; P90-E161 WeakPolarHBondContact CB-OE1 3.24Å; P90-E161 WeakPolarHBondContact CB-OE2 3.28Å; P90-E161 HydrophobicContact CG-CB 4.01Å; P90-E161 HydrophobicContact CG-CG 4.08Å; P90-T164 HydrophobicContact CG-CG2 4.05Å
91	P	87.7	Confident	92.3	Very high	64 Å²	64	24.4 Å²	24.4	42%	0.416	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	151.5	176.6	27.3	-31.1	0	0	0	110.9	V93 N135 E163	P91-V93 PolarHBondContact O-N 3.08Å; P91-V93 VanDerWaalsContact O-N 3.08Å; P91-N135 WeakPolarHBondContact CA-ND2 3.16Å; P91-N135 WeakPolarHBondContact CB-ND2 3.46Å; P91-N135 WeakPolarHBondContact CD-ND2 3.44Å; P91-N135 VanDerWaalsContact N-ND2 3.12Å; P91-E163 WeakPolarHBondContact CD-OE2 3.47Å
92	K	88.4	Confident	92.5	Very high	200 Å²	200	23.5 Å²	23.5	87%	0.87	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	1.7	173.5	-54	-176.6	177.9	-173.2	0	117.8	G94	K92-G94 PolarHBondContact O-N 3.08Å
93	V	90.9	Very high	92.4	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	13%	0.126	C	C	.	.	S	Bend	trans	-73.6	9.6	179.2	-55.3	0	0	0	0	116.2	P90 P91 K95 L153 D155	P90-V93 HydrophobicContact CB-CG1 4.23Å; P90-V93 HydrophobicContact CG-CG1 3.66Å; P90-V93 WeakPolarHBondContact O-CG2 3.49Å; P91-V93 PolarHBondContact O-N 3.08Å; P91-V93 VanDerWaalsContact O-N 3.08Å; V93-K95 HydrophobicContact CG2-CG 3.87Å; V93-L153 HydrophobicContact CB-CB 4.37Å; V93-L153 HydrophobicContact CG2-CB 3.63Å; V93-L153 HydrophobicContact CG2-CD2 3.91Å; V93-L153 HydrophobicContact CG2-CG 4.43Å; V93-D155 HydrophobicContact CG1-CB 4.14Å
94	G	88.7	Confident	92.3	Very high	21 Å²	21	25.9 Å²	25.9	22%	0.216	14%	0.136	C	C	.	.			trans	74	38.4	178.9	0	0	0	0	0	115.1	K92 L97 L98	K92-G94 PolarHBondContact O-N 3.08Å; G94-L97 PolarHBondContact O-N 3.5Å; G94-L98 PolarHBondContact O-N 2.89Å
95	K	91.5	Very high	92.2	Very high	12 Å²	12	29.5 Å²	29.5	5%	0.052	15%	0.153	C	C	.	.	H	α-helix	trans	-57.1	-56.6	177	-71.6	-174.6	-70.3	-164.9	0	112.4	V87 G89 V93 L97 L98 I99 E132 C133 N135 L153	V87-K95 HydrophobicContact CG1-CB 4.08Å; V87-K95 HydrophobicContact CG1-CG 4.26Å; G89-K95 PolarHBondContact O-NZ 2.97Å; V93-K95 HydrophobicContact CG2-CG 3.87Å; K95-L97 VanDerWaalsContact C-N 3.32Å; K95-L97 PolarHBondContact O-N 2.84Å; K95-L98 WeakPolarHBondContact O-CB 3.39Å; K95-L98 PolarHBondContact O-N 2.82Å; K95-L98 VanDerWaalsContact O-N 3.16Å; K95-I99 PolarHBondContact O-N 2.84Å; K95-E132 HydrophobicContact CB-CG 4.18Å; K95-E132 WeakPolarHBondContact CB-OE1 3.04Å; K95-E132 HydrophobicContact CD-CG 4.43Å; K95-E132 VanDerWaalsContact CE-OE1 3.25Å; K95-E132 WeakPolarHBondContact CE-OE1 3.41Å; K95-C133 PolarHBondContact NZ-O 3.4Å; K95-N135 PolarHBondContact NZ-OD1 3.25Å; K95-L153 HydrophobicContact CG-CD2 4.15Å
96	S	91.4	Very high	92	Very high	48 Å²	48	30.7 Å²	30.7	34%	0.336	16%	0.158	S	C	.	.	H	α-helix	trans	-61	-40.8	178.5	-26.6	0	0	0	0	111.6	L98 I99 Q100 I114 E132	S96-L98 VanDerWaalsContact C-N 3.31Å; S96-L98 PolarHBondContact O-N 3.43Å; S96-I99 WeakPolarHBondContact O-CB 3.22Å; S96-I99 PolarHBondContact O-N 2.55Å; S96-I99 VanDerWaalsContact O-N 3.08Å; S96-Q100 PolarHBondContact O-N 2.96Å; S96-I114 WeakPolarHBondContact O-CD1 3.47Å; S96-E132 VanDerWaalsContact CA-OE2 3.28Å; S96-E132 WeakPolarHBondContact CA-OE2 3.43Å; S96-E132 VanDerWaalsContact CB-OE2 3.24Å; S96-E132 WeakPolarHBondContact CB-OE2 3.25Å; S96-E132 PolarHBondContact N-OE2 2.75Å; S96-E132 PolarHBondContact OG-OE1 2.64Å; S96-E132 PolarHBondContact OG-OE2 3.22Å
97	L	92.2	Very high	91.7	Very high	35 Å²	35	31.2 Å²	31.2	18%	0.183	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-37.8	176.8	-162.5	158	0	0	0	111.8	G94 K95 Q100 C101 L222 D225 Y227	G94-L97 PolarHBondContact O-N 3.5Å; K95-L97 VanDerWaalsContact C-N 3.32Å; K95-L97 PolarHBondContact O-N 2.84Å; L97-Q100 PolarHBondContact O-N 3.09Å; L97-C101 WeakPolarHBondContact O-CB 3.34Å; L97-C101 PolarHBondContact O-N 3Å; L97-C101 PolarHBondContact O-SG 3.11Å; L97-L222 HydrophobicContact CD1-CD1 4.25Å; L97-L222 HydrophobicContact CD1-CD2 3.94Å; L97-L222 HydrophobicContact CD2-CD2 3.64Å; L97-L222 HydrophobicContact CG-CD2 4.5Å; L97-D225 WeakPolarHBondContact CD1-O 3.04Å; L97-Y227 HydrophobicContact CD2-CD1 4.42Å; L97-Y227 HydrophobicContact CD2-CD2 3.44Å; L97-Y227 VanDerWaalsContact CD2-CD2 3.44Å; L97-Y227 HydrophobicContact CD2-CE1 4.38Å; L97-Y227 HydrophobicContact CD2-CE2 3.4Å; L97-Y227 HydrophobicContact CD2-CG 3.98Å
98	L	93.7	Very high	91.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-41.7	173	-174.4	62.4	0	0	0	112	V87 G94 K95 S96 C101 L102 L151 L153 V182 L219 Y227 L235	V87-L98 HydrophobicContact CG1-CD2 4.45Å; G94-L98 PolarHBondContact O-N 2.89Å; K95-L98 WeakPolarHBondContact O-CB 3.39Å; K95-L98 PolarHBondContact O-N 2.82Å; K95-L98 VanDerWaalsContact O-N 3.16Å; S96-L98 VanDerWaalsContact C-N 3.31Å; S96-L98 PolarHBondContact O-N 3.43Å; L98-C101 PolarHBondContact O-N 3.13Å; L98-L102 HydrophobicContact CG-CD1 4.15Å; L98-L102 WeakPolarHBondContact O-CG 3.34Å; L98-L102 PolarHBondContact O-N 2.67Å; L98-L151 HydrophobicContact CD2-CD1 4.23Å; L98-L153 HydrophobicContact CB-CD2 4.47Å; L98-L153 HydrophobicContact CD2-CD1 3.77Å; L98-L153 HydrophobicContact CD2-CD2 4.21Å; L98-L153 HydrophobicContact CD2-CG 4.24Å; L98-V182 HydrophobicContact CD2-CG2 4.49Å; L98-L219 HydrophobicContact CD1-CD1 3.76Å; L98-Y227 HydrophobicContact CB-CD2 4.49Å; L98-Y227 HydrophobicContact CB-CE2 3.97Å; L98-Y227 HydrophobicContact CD1-CD2 3.96Å; L98-Y227 HydrophobicContact CD1-CE2 4.06Å; L98-L235 HydrophobicContact CD1-CD2 3.91Å; L98-L235 HydrophobicContact CD2-CD2 4.41Å
99	I	94	Very high	91	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-63.9	-47.8	176.2	-65.4	170.2	0	0	0	110.2	V87 K95 S96 C101 L102 V103 I114 I118 L130 E132	V87-I99 HydrophobicContact CB-CD1 4.01Å; V87-I99 HydrophobicContact CB-CG1 4.18Å; V87-I99 HydrophobicContact CG1-CD1 4.47Å; V87-I99 HydrophobicContact CG1-CG1 4.37Å; V87-I99 HydrophobicContact CG2-CD1 3.89Å; V87-I99 HydrophobicContact CG2-CG1 3.64Å; K95-I99 PolarHBondContact O-N 2.84Å; S96-I99 WeakPolarHBondContact O-CB 3.22Å; S96-I99 PolarHBondContact O-N 2.55Å; S96-I99 VanDerWaalsContact O-N 3.08Å; I99-C101 VanDerWaalsContact C-N 3.26Å; I99-C101 PolarHBondContact O-N 3.09Å; I99-L102 PolarHBondContact O-N 3.18Å; I99-L102 VanDerWaalsContact O-N 3.12Å; I99-V103 HydrophobicContact CG2-CG2 4.11Å; I99-V103 WeakPolarHBondContact O-CB 3.08Å; I99-V103 WeakPolarHBondContact O-CG2 3.46Å; I99-V103 PolarHBondContact O-N 3.44Å; I99-I114 HydrophobicContact CB-CD1 3.59Å; I99-I114 HydrophobicContact CG2-CD1 3.54Å; I99-I114 HydrophobicContact CG2-CG1 4.15Å; I99-I118 HydrophobicContact CG2-CD1 3.89Å; I99-L130 HydrophobicContact CG2-CB 4.38Å; I99-L130 HydrophobicContact CG2-CD1 4.05Å; I99-E132 HydrophobicContact CD1-CB 3.8Å
100	Q	92.1	Very high	90.6	Very high	59 Å²	59	45 Å²	45	28%	0.276	23%	0.229	S	C	.	.	H	α-helix	trans	-53.8	-43.7	174.6	-74.2	173.7	-30	0	0	111.7	S96 L97 K104 V111 S112 I114	S96-Q100 PolarHBondContact O-N 2.96Å; L97-Q100 PolarHBondContact O-N 3.09Å; Q100-K104 VanDerWaalsContact O-CB 3.3Å; Q100-K104 WeakPolarHBondContact O-CB 3.12Å; Q100-K104 PolarHBondContact O-N 3.34Å; Q100-V111 PolarHBondContact NE2-O 3.34Å; Q100-S112 PolarHBondContact NE2-O 3.2Å; Q100-I114 HydrophobicContact CG-CD1 3.66Å; Q100-I114 HydrophobicContact CG-CG1 4.35Å
101	C	92.8	Very high	90.3	Very high	9 Å²	9	45.5 Å²	45.5	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-40.9	178	-68.6	0	0	0	0	112.8	L97 L98 I99 H105 Y227 V232	L97-C101 WeakPolarHBondContact O-CB 3.34Å; L97-C101 PolarHBondContact O-N 3Å; L97-C101 PolarHBondContact O-SG 3.11Å; L98-C101 PolarHBondContact O-N 3.13Å; I99-C101 VanDerWaalsContact C-N 3.26Å; I99-C101 PolarHBondContact O-N 3.09Å; C101-H105 WeakPolarHBondContact O-CB 3.46Å; C101-H105 PolarHBondContact O-N 3.35Å; C101-Y227 HydrophobicContact CB-CD2 4.41Å; C101-Y227 PolarHBondContact SG-N 2.98Å; C101-Y227 VanDerWaalsContact SG-N 3.36Å; C101-V232 HydrophobicContact CB-CG1 4.15Å; C101-V232 HydrophobicContact CB-CG2 3.99Å
102	L	93.8	Very high	89.9	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-67.4	-45.7	176.3	-74.5	169.5	0	0	0	111.6	L98 I99 H105 H106 L130 L151 V232 L235 A236 I239	L98-L102 HydrophobicContact CG-CD1 4.15Å; L98-L102 WeakPolarHBondContact O-CG 3.34Å; L98-L102 PolarHBondContact O-N 2.67Å; I99-L102 PolarHBondContact O-N 3.18Å; I99-L102 VanDerWaalsContact O-N 3.12Å; L102-H105 WeakPolarHBondContact O-CB 3.21Å; L102-H105 PolarHBondContact O-N 3.44Å; L102-H106 PolarHBondContact O-CD2 3.01Å; L102-H106 PolarHBondContact O-N 3.25Å; L102-L130 HydrophobicContact CB-CD1 4.13Å; L102-L151 HydrophobicContact CD1-CD1 3.86Å; L102-V232 HydrophobicContact CD2-CG1 4.14Å; L102-L235 HydrophobicContact CD2-CD2 4.26Å; L102-A236 HydrophobicContact CD2-CB 4.25Å; L102-I239 HydrophobicContact CD1-CD1 4.39Å; L102-I239 HydrophobicContact CD2-CD1 4.22Å
103	V	93.2	Very high	89.6	Confident	2 Å²	2	38 Å²	38	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-49.2	176	173.5	0	0	0	0	110.4	I99 H105 H106 T107 V111 I118 L130 I355	I99-V103 HydrophobicContact CG2-CG2 4.11Å; I99-V103 WeakPolarHBondContact O-CB 3.08Å; I99-V103 WeakPolarHBondContact O-CG2 3.46Å; I99-V103 PolarHBondContact O-N 3.44Å; V103-H105 VanDerWaalsContact C-N 3.29Å; V103-H105 PolarHBondContact O-N 2.86Å; V103-H106 PolarHBondContact O-N 3.2Å; V103-H106 VanDerWaalsContact O-N 3.16Å; V103-T107 HydrophobicContact CG1-CG2 4.29Å; V103-T107 WeakPolarHBondContact O-CB 3.33Å; V103-T107 PolarHBondContact O-N 3.04Å; V103-T107 PolarHBondContact O-OG1 3.1Å; V103-V111 HydrophobicContact CG1-CG2 4.01Å; V103-I118 HydrophobicContact CG2-CD1 4.33Å; V103-I118 HydrophobicContact CG2-CG2 3.92Å; V103-L130 HydrophobicContact CG2-CD1 3.83Å; V103-I355 HydrophobicContact CG1-CD1 3.67Å
104	K	91.1	Very high	89.4	Confident	84 Å²	84	39 Å²	39	37%	0.365	21%	0.213	S	C	.	.	H	α-helix	trans	-60.7	-36.4	176.6	-169.7	-178.3	-176.4	-178.5	0	112.5	Q100 K108 Q109 T110	Q100-K104 VanDerWaalsContact O-CB 3.3Å; Q100-K104 WeakPolarHBondContact O-CB 3.12Å; Q100-K104 PolarHBondContact O-N 3.34Å; K104-K108 WeakPolarHBondContact O-CA 3.39Å; K104-K108 PolarHBondContact O-N 3.49Å; K104-Q109 VanDerWaalsContact CA-O 3.3Å; K104-Q109 WeakPolarHBondContact CA-O 3.09Å; K104-T110 HydrophobicContact CD-CG2 4.01Å; K104-T110 HydrophobicContact CG-CG2 4.42Å
105	H	91.9	Very high	89.2	Confident	76 Å²	76	40.6 Å²	40.6	35%	0.352	21%	0.214	S	C	.	.	H	α-helix	trans	-65.4	-38.8	175.8	173.2	-87.5	0	0	0	112.9	C101 L102 V103 V232 K233 A236	C101-H105 WeakPolarHBondContact O-CB 3.46Å; C101-H105 PolarHBondContact O-N 3.35Å; L102-H105 WeakPolarHBondContact O-CB 3.21Å; L102-H105 PolarHBondContact O-N 3.44Å; V103-H105 VanDerWaalsContact C-N 3.29Å; V103-H105 PolarHBondContact O-N 2.86Å; H105-V232 HydrophobicContact CB-CG1 4.07Å; H105-K233 WeakPolarHBondContact NE2-CA 3.4Å; H105-A236 WeakPolarHBondContact ND1-CB 3.45Å
106	H	90.8	Very high	88.8	Confident	24 Å²	24	40.5 Å²	40.5	11%	0.111	22%	0.216	C	C	.	.	H	α-helix	trans	-85.8	-38.7	-177.1	-73.9	-68.7	0	0	0	114	L102 V103 V120 K353	L102-H106 PolarHBondContact O-CD2 3.01Å; L102-H106 PolarHBondContact O-N 3.25Å; V103-H106 PolarHBondContact O-N 3.2Å; V103-H106 VanDerWaalsContact O-N 3.16Å; H106-V120 HydrophobicContact CB-CG1 3.67Å; H106-K353 WeakPolarHBondContact O-CD 3.11Å
107	T	89.2	Confident	88.9	Confident	11 Å²	11	38.5 Å²	38.5	7%	0.067	20%	0.202	C	C	.	.	H	α-helix	trans	-106.9	-11	-170	66.4	0	0	0	0	113.9	V103 Q109 V120 I355	V103-T107 HydrophobicContact CG1-CG2 4.29Å; V103-T107 WeakPolarHBondContact O-CB 3.33Å; V103-T107 PolarHBondContact O-N 3.04Å; V103-T107 PolarHBondContact O-OG1 3.1Å; T107-Q109 PolarHBondContact O-N 3.33Å; T107-Q109 PolarHBondContact OG1-N 3.46Å; T107-V120 HydrophobicContact CG2-CG1 3.61Å; T107-V120 HydrophobicContact CG2-CG2 4.38Å; T107-I355 HydrophobicContact CG2-CB 3.94Å; T107-I355 HydrophobicContact CG2-CD1 4.43Å
108	K	88.2	Confident	88.9	Confident	128 Å²	128	36.9 Å²	36.9	56%	0.557	19%	0.194	S	C	*	.	S	Bend	trans	61.9	-19.4	-163.1	-58	-175.1	177.4	-179.5	0	116	K104 E350	K104-K108 WeakPolarHBondContact O-CA 3.39Å; K104-K108 PolarHBondContact O-N 3.49Å; K108-E350 VanDerWaalsContact CE-OE1 3.23Å; K108-E350 WeakPolarHBondContact CE-OE1 3.19Å; K108-E350 WeakPolarHBondContact CE-OE2 3.29Å; K108-E350 IonicContact NZ-OE1 3.07Å; K108-E350 PolarHBondContact NZ-OE1 2.94Å; K108-E350 IonicContact NZ-OE2 2.97Å; K108-E350 PolarHBondContact NZ-OE2 3.07Å
109	Q	86.1	Confident	88.9	Confident	88 Å²	88	36.9 Å²	36.9	41%	0.411	19%	0.194	S	C	.	.			trans	-72.7	159.3	-178	-62.2	-178.4	-1.3	0	0	112.7	K104 T107	K104-Q109 VanDerWaalsContact CA-O 3.3Å; K104-Q109 WeakPolarHBondContact CA-O 3.09Å; T107-Q109 PolarHBondContact O-N 3.33Å; T107-Q109 PolarHBondContact OG1-N 3.46Å
110	T	84.7	Confident	88.9	Confident	82 Å²	82	37 Å²	37	50%	0.503	19%	0.194	S	C	.	.			trans	-113.1	130.1	174.7	47.7	0	0	0	0	110.6	K104	K104-T110 HydrophobicContact CD-CG2 4.01Å; K104-T110 HydrophobicContact CG-CG2 4.42Å
111	V	83.7	Confident	88.9	Confident	9 Å²	9	34.2 Å²	34.2	6%	0.055	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-105.3	125.2	175.8	177.4	0	0	0	0	108.8	Q100 V103 A113 I114 I355 C360 V362	Q100-V111 PolarHBondContact NE2-O 3.34Å; V103-V111 HydrophobicContact CG1-CG2 4.01Å; V111-A113 VanDerWaalsContact CG1-O 3.32Å; V111-A113 WeakPolarHBondContact CG1-O 3.47Å; V111-I114 HydrophobicContact CG1-CG1 4.35Å; V111-I355 HydrophobicContact CG2-CD1 4.28Å; V111-C360 HydrophobicContact CG1-CB 3.83Å; V111-V362 HydrophobicContact CG2-CG2 4.38Å
112	S	79.4	Confident	88.7	Confident	68 Å²	68	34.7 Å²	34.7	48%	0.476	18%	0.184	S	C	.	.	S	Bend	trans	-70.8	-64.2	-177.9	54	0	0	0	0	111.4	Q100	Q100-S112 PolarHBondContact NE2-O 3.2Å
113	A	82.6	Confident	88.4	Confident	39 Å²	39	35.6 Å²	35.6	32%	0.322	19%	0.194	S	C	.	.	S	Bend	trans	-109.6	130.5	175.7	0	0	0	0	0	111	V111 G361	V111-A113 VanDerWaalsContact CG1-O 3.32Å; V111-A113 WeakPolarHBondContact CG1-O 3.47Å; A113-G361 PolarHBondContact O-N 3.17Å
114	I	86.1	Confident	88	Confident	22 Å²	22	36.9 Å²	36.9	11%	0.113	20%	0.2	C	C	.	.			trans	-91.6	125.9	169.1	-68.4	156	0	0	0	108.8	S96 I99 Q100 V111 I118	S96-I114 WeakPolarHBondContact O-CD1 3.47Å; I99-I114 HydrophobicContact CB-CD1 3.59Å; I99-I114 HydrophobicContact CG2-CD1 3.54Å; I99-I114 HydrophobicContact CG2-CG1 4.15Å; Q100-I114 HydrophobicContact CG-CD1 3.66Å; Q100-I114 HydrophobicContact CG-CG1 4.35Å; V111-I114 HydrophobicContact CG1-CG1 4.35Å; I114-I118 HydrophobicContact CG1-CD1 4.04Å; I114-I118 HydrophobicContact CG2-CD1 4.1Å
115	K	84.4	Confident	87.8	Confident	55 Å²	55	39.9 Å²	39.9	24%	0.239	21%	0.214	C	C	.	.			trans	-144.9	140.5	169.8	-61.5	174.4	177.8	178.7	0	107.5	F359 C360 P756	K115-F359 HydrophobicContact CB-CB 4.12Å; K115-F359 WeakPolarHBondContact CB-O 3.29Å; K115-C360 PolarHBondContact N-SG 3.28Å; K115-C360 VanDerWaalsContact N-SG 3.39Å; K115-C360 PolarHBondContact O-SG 3.35Å; K115-P756 HydrophobicContact CB-CB 4.02Å; K115-P756 HydrophobicContact CB-CG 3.84Å; K115-P756 HydrophobicContact CD-CG 3.93Å; K115-P756 HydrophobicContact CG-CG 4.31Å
116	G	84.2	Confident	87.6	Confident	9 Å²	9	39.4 Å²	39.4	9%	0.093	21%	0.209	C	C	.	.	S	Bend	trans	70.2	-170	179.4	0	0	0	0	0	115	P756	G116-P756 WeakPolarHBondContact CA-O 3.22Å; G116-P756 PolarHBondContact N-O 2.83Å
117	P	91.9	Very high	87.7	Confident	6 Å²	6	38.3 Å²	38.3	4%	0.039	21%	0.205	C	C	.	.			trans	-77.3	147.2	174.7	31.3	-33.4	0	0	0	112.4	T129 L130 L257 D259	P117-T129 HydrophobicContact CB-CG2 3.56Å; P117-L130 WeakPolarHBondContact CA-O 3.19Å; P117-L257 HydrophobicContact CB-CD2 4.08Å; P117-D259 HydrophobicContact CG-CB 4.24Å; P117-D259 WeakPolarHBondContact CG-OD1 3.17Å
118	I	93.4	Very high	87.9	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	109.4	177.2	-57.9	-178.3	0	0	0	108.6	I99 V103 I114 V120 T129 L130 I355 A357	I99-I118 HydrophobicContact CG2-CD1 3.89Å; V103-I118 HydrophobicContact CG2-CD1 4.33Å; V103-I118 HydrophobicContact CG2-CG2 3.92Å; I114-I118 HydrophobicContact CG1-CD1 4.04Å; I114-I118 HydrophobicContact CG2-CD1 4.1Å; I118-V120 HydrophobicContact CG2-CG2 3.87Å; I118-T129 CarbonylContact O-C 3.54Å; I118-T129 WeakPolarHBondContact O-CA 3.28Å; I118-L130 HydrophobicContact CB-CB 4.42Å; I118-L130 PolarHBondContact N-O 3.15Å; I118-L130 PolarHBondContact O-N 3.21Å; I118-I355 HydrophobicContact CG2-CD1 3.98Å; I118-I355 HydrophobicContact CG2-CG1 4.1Å; I118-A357 HydrophobicContact CB-CB 4.19Å; I118-A357 HydrophobicContact CG1-CB 3.93Å; I118-A357 HydrophobicContact CG2-CB 3.99Å
119	T	94.2	Very high	88.2	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	133.7	176.5	-65.3	0	0	0	0	111.1	P82 L128 T129 Y285 C337 I355 Y356	P82-T119 HydrophobicContact CB-CG2 3.87Å; P82-T119 HydrophobicContact CG-CG2 4.07Å; T119-L128 CarbonylContact C-O 3.58Å; T119-L128 VanDerWaalsContact CA-O 3.31Å; T119-L128 WeakPolarHBondContact CA-O 3.47Å; T119-T129 PolarHBondContact OG1-OG1 2.93Å; T119-Y285 HydrophobicContact CG2-CE2 4.21Å; T119-C337 HydrophobicContact CG2-CB 4.05Å; T119-I355 WeakPolarHBondContact O-CA 3.47Å; T119-Y356 PolarHBondContact N-O 3.17Å; T119-Y356 PolarHBondContact O-N 3.33Å
120	V	93	Very high	88.7	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.018	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	132.9	-173.4	-175.8	0	0	0	0	111.4	H106 T107 I118 T122 R127 L128 I355	H106-V120 HydrophobicContact CB-CG1 3.67Å; T107-V120 HydrophobicContact CG2-CG1 3.61Å; T107-V120 HydrophobicContact CG2-CG2 4.38Å; I118-V120 HydrophobicContact CG2-CG2 3.87Å; V120-T122 PolarHBondContact O-N 3.21Å; V120-R127 WeakPolarHBondContact O-CA 3.47Å; V120-L128 PolarHBondContact N-O 3.14Å; V120-L128 PolarHBondContact O-N 2.94Å; V120-I355 HydrophobicContact CG2-CG1 4.3Å
121	V	91.9	Very high	89.1	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	123.2	171	-176.4	0	0	0	0	109.9	C337 L348 E352 I354	V121-C337 HydrophobicContact CG2-CB 4.25Å; V121-L348 HydrophobicContact CG1-CD1 4.16Å; V121-L348 HydrophobicContact CG1-CD2 4.16Å; V121-E352 WeakPolarHBondContact CB-O 3.48Å; V121-E352 WeakPolarHBondContact CG1-O 3.38Å; V121-I354 HydrophobicContact CG2-CB 4.14Å; V121-I354 PolarHBondContact N-O 2.93Å; V121-I354 VanDerWaalsContact N-O 3.13Å
122	T	89.8	Confident	89.5	Confident	19 Å²	19	26.1 Å²	26.1	12%	0.117	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-22.1	-173.8	-67	0	0	0	0	113	V120 R126 L128 S240	V120-T122 PolarHBondContact O-N 3.21Å; T122-R126 CarbonylContact C-O 3.42Å; T122-R126 WeakPolarHBondContact CA-O 3.3Å; T122-R126 WeakPolarHBondContact CB-O 3.3Å; T122-R126 PolarHBondContact N-O 2.93Å; T122-L128 HydrophobicContact CG2-CD1 4.05Å; T122-L128 HydrophobicContact CG2-CG 4.48Å; T122-L128 VanDerWaalsContact OG1-CD1 3.32Å; T122-L128 WeakPolarHBondContact OG1-CD1 3.15Å; T122-L128 WeakPolarHBondContact OG1-CG 3.36Å; T122-S240 WeakPolarHBondContact CG2-OG 3.18Å
123	G	86.5	Confident	90	Very high	21 Å²	21	22.9 Å²	22.9	22%	0.216	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.2	169.3	176.1	0	0	0	0	0	110.5	H125 R126	G123-H125 PolarHBondContact O-N 3.49Å; G123-R126 PolarHBondContact N-O 3.01Å; G123-R126 CarbonylContact O-C 3.56Å; G123-R126 PolarHBondContact O-N 2.8Å
124	K	85.5	Confident	90.2	Very high	29 Å²	29	22.4 Å²	22.4	13%	0.126	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-26.9	-166.1	-61.3	-166.6	170.1	-81.9	0	116.5	P340 E343 R345 A347 L348 E352	K124-P340 HydrophobicContact CB-CG 4.29Å; K124-P340 HydrophobicContact CG-CG 4.09Å; K124-E343 WeakPolarHBondContact CE-O 3.4Å; K124-R345 VanDerWaalsContact CE-O 3.28Å; K124-R345 WeakPolarHBondContact CE-O 3.23Å; K124-A347 WeakPolarHBondContact CE-O 3.35Å; K124-L348 HydrophobicContact CG-CD1 4.31Å; K124-E352 IonicContact NZ-OE1 2.73Å; K124-E352 PolarHBondContact NZ-OE1 3.41Å; K124-E352 IonicContact NZ-OE2 3.91Å; K124-E352 PolarHBondContact NZ-OE2 2.75Å
125	H	86.2	Confident	90	Very high	146 Å²	146	22.9 Å²	22.9	68%	0.676	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.1	15.7	176	-45.8	-58.8	0	0	0	112.9	G123	G123-H125 PolarHBondContact O-N 3.49Å
126	R	88.4	Confident	90	Very high	66 Å²	66	20.5 Å²	20.5	25%	0.249	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	114.5	-167.1	-70.4	-170.2	161.3	-144.9	-18.6	113	T122 G123 S240 M242	T122-R126 CarbonylContact C-O 3.42Å; T122-R126 WeakPolarHBondContact CA-O 3.3Å; T122-R126 WeakPolarHBondContact CB-O 3.3Å; T122-R126 PolarHBondContact N-O 2.93Å; G123-R126 PolarHBondContact N-O 3.01Å; G123-R126 CarbonylContact O-C 3.56Å; G123-R126 PolarHBondContact O-N 2.8Å; R126-S240 WeakPolarHBondContact CD-O 3.45Å; R126-S240 PolarHBondContact NH1-O 3.13Å; R126-M242 VanDerWaalsContact CZ-O 3.27Å; R126-M242 PolarHBondContact NH1-O 2.88Å; R126-M242 PolarHBondContact NH2-O 3.35Å
127	R	92.2	Very high	90.1	Very high	2 Å²	2	20 Å²	20	1%	0.008	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	151.8	169.2	44.9	176.2	179	-176.7	1.7	109.5	P80 P82 F83 V120 Y285 D335 C337 L339 G736	P80-R127 PolarHBondContact O-NE 2.88Å; P82-R127 WeakPolarHBondContact CA-O 3.1Å; P82-R127 HydrophobicContact CB-CB 4.22Å; P82-R127 HydrophobicContact CB-CG 3.88Å; F83-R127 PolarHBondContact N-O 3.05Å; V120-R127 WeakPolarHBondContact O-CA 3.47Å; R127-Y285 VanDerWaalsContact NH1-CE1 3.28Å; R127-Y285 PolarHBondContact NH1-OH 2.92Å; R127-D335 IonicContact CZ-OD1 3.83Å; R127-D335 IonicContact CZ-OD2 3.3Å; R127-D335 IonicContact NH1-OD1 2.91Å; R127-D335 PolarHBondContact NH1-OD1 3.06Å; R127-D335 IonicContact NH1-OD2 3.18Å; R127-D335 PolarHBondContact NH1-OD2 2.69Å; R127-D335 IonicContact NH2-OD2 2.67Å; R127-D335 PolarHBondContact NH2-OD2 3.42Å; R127-C337 PolarHBondContact NH1-O 3.42Å; R127-L339 HydrophobicContact CB-CD2 4.23Å; R127-L339 HydrophobicContact CG-CD1 4.47Å; R127-L339 HydrophobicContact CG-CD2 4.03Å; R127-L339 HydrophobicContact CG-CG 4.38Å; R127-G736 PolarHBondContact NH2-O 3.34Å; R127-G736 VanDerWaalsContact NH2-O 3.13Å
128	L	94	Very high	89.9	Confident	7 Å²	7	19.9 Å²	19.9	4%	0.037	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.2	-176	-57.7	176.3	0	0	0	109.3	F83 V85 T119 V120 T122 I239	F83-L128 HydrophobicContact CB-CD2 4.06Å; F83-L128 HydrophobicContact CD2-CD2 4.43Å; F83-L128 WeakPolarHBondContact O-CA 3.35Å; V85-L128 HydrophobicContact CG2-CB 4.28Å; V85-L128 HydrophobicContact CG2-CD1 4.41Å; V85-L128 HydrophobicContact CG2-CD2 4.09Å; V85-L128 HydrophobicContact CG2-CG 4.5Å; T119-L128 CarbonylContact C-O 3.58Å; T119-L128 VanDerWaalsContact CA-O 3.31Å; T119-L128 WeakPolarHBondContact CA-O 3.47Å; V120-L128 PolarHBondContact N-O 3.14Å; V120-L128 PolarHBondContact O-N 2.94Å; T122-L128 HydrophobicContact CG2-CD1 4.05Å; T122-L128 HydrophobicContact CG2-CG 4.48Å; T122-L128 VanDerWaalsContact OG1-CD1 3.32Å; T122-L128 WeakPolarHBondContact OG1-CD1 3.15Å; T122-L128 WeakPolarHBondContact OG1-CG 3.36Å; L128-I239 HydrophobicContact CD1-CG2 3.51Å; L128-I239 HydrophobicContact CD2-CG2 4.34Å
129	T	94.9	Very high	89.7	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118.1	163	-54.1	0	0	0	0	107.9	P82 F83 L84 V85 P117 I118 T119 L257 R287	P82-T129 WeakPolarHBondContact CB-OG1 3.17Å; P82-T129 WeakPolarHBondContact CG-OG1 3.43Å; F83-T129 PolarHBondContact O-N 2.95Å; L84-T129 HydrophobicContact CD1-CG2 3.82Å; V85-T129 PolarHBondContact N-O 2.9Å; P117-T129 HydrophobicContact CB-CG2 3.56Å; I118-T129 CarbonylContact O-C 3.54Å; I118-T129 WeakPolarHBondContact O-CA 3.28Å; T119-T129 PolarHBondContact OG1-OG1 2.93Å; T129-L257 HydrophobicContact CG2-CD2 4.19Å; T129-R287 PolarHBondContact OG1-NH2 3.07Å; T129-R287 VanDerWaalsContact OG1-NH2 3.13Å
130	L	95.2	Very high	89.5	Confident	8 Å²	8	20.1 Å²	20.1	4%	0.042	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	136.8	169.7	-51.8	-176.5	0	0	0	108.8	V85 I99 L102 V103 P117 I118	V85-L130 HydrophobicContact CB-CD2 3.84Å; V85-L130 HydrophobicContact CG1-CD2 4.15Å; V85-L130 HydrophobicContact CG2-CD2 4.28Å; I99-L130 HydrophobicContact CG2-CB 4.38Å; I99-L130 HydrophobicContact CG2-CD1 4.05Å; L102-L130 HydrophobicContact CB-CD1 4.13Å; V103-L130 HydrophobicContact CG2-CD1 3.83Å; P117-L130 WeakPolarHBondContact CA-O 3.19Å; I118-L130 HydrophobicContact CB-CB 4.42Å; I118-L130 PolarHBondContact N-O 3.15Å; I118-L130 PolarHBondContact O-N 3.21Å
131	L	93.2	Very high	89.5	Confident	4 Å²	4	20.3 Å²	20.3	2%	0.021	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	127.7	178.8	177.5	65	0	0	0	110.5	L84 V85 A86 V87 V143 I146 L257 P759	L84-L131 HydrophobicContact CD1-CB 3.92Å; L84-L131 HydrophobicContact CD1-CD2 4.28Å; L84-L131 HydrophobicContact CD2-CD2 4.46Å; V85-L131 PolarHBondContact O-N 3.41Å; A86-L131 WeakPolarHBondContact CA-O 3.31Å; V87-L131 PolarHBondContact N-O 3.12Å; L131-V143 HydrophobicContact CD2-CG2 4.06Å; L131-I146 HydrophobicContact CD2-CD1 4.37Å; L131-L257 HydrophobicContact CD2-CD1 4.46Å; L131-L257 HydrophobicContact CD2-CD2 4.23Å; L131-P759 HydrophobicContact CD1-CB 4.17Å; L131-P759 HydrophobicContact CD2-CB 3.94Å; L131-P759 HydrophobicContact CD2-CG 4.33Å
132	E	92.6	Very high	89.4	Confident	42 Å²	42	20.5 Å²	20.5	20%	0.196	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	138.4	170.2	-174.7	158.7	175.9	0	0	111.2	K95 S96 I99	K95-E132 HydrophobicContact CB-CG 4.18Å; K95-E132 WeakPolarHBondContact CB-OE1 3.04Å; K95-E132 HydrophobicContact CD-CG 4.43Å; K95-E132 VanDerWaalsContact CE-OE1 3.25Å; K95-E132 WeakPolarHBondContact CE-OE1 3.41Å; S96-E132 VanDerWaalsContact CA-OE2 3.28Å; S96-E132 WeakPolarHBondContact CA-OE2 3.43Å; S96-E132 VanDerWaalsContact CB-OE2 3.24Å; S96-E132 WeakPolarHBondContact CB-OE2 3.25Å; S96-E132 PolarHBondContact N-OE2 2.75Å; S96-E132 PolarHBondContact OG-OE1 2.64Å; S96-E132 PolarHBondContact OG-OE2 3.22Å; I99-E132 HydrophobicContact CD1-CB 3.8Å
133	C	90.6	Very high	89.5	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.007	10%	0.099	C	C	.	.			trans	-102.8	111.4	175.4	-172.9	0	0	0	0	110.8	V87 V88 K95 V143	V87-C133 WeakPolarHBondContact O-CB 3.07Å; V87-C133 PolarHBondContact O-N 3.37Å; V88-C133 HydrophobicContact CB-CB 4.32Å; V88-C133 HydrophobicContact CG1-CB 4.38Å; V88-C133 HydrophobicContact CG2-CB 3.74Å; K95-C133 PolarHBondContact NZ-O 3.4Å; C133-V143 HydrophobicContact CB-CG1 4.36Å; C133-V143 HydrophobicContact CB-CG2 4.4Å
134	S	85.8	Confident	89.8	Confident	29 Å²	29	18.6 Å²	18.6	20%	0.203	9%	0.089	C	C	.	.			trans	-61.1	151.8	169.4	-68	0	0	0	0	111.8	D136 N757	S134-D136 PolarHBondContact O-N 2.79Å; S134-N757 PolarHBondContact OG-O 3.21Å; S134-N757 VanDerWaalsContact OG-O 3.13Å
135	N	82.7	Confident	90.2	Very high	31 Å²	31	17.7 Å²	17.7	17%	0.166	9%	0.085	C	C	.	.	S	Bend	trans	-72.1	-2.9	-170.3	-64.5	24.9	0	0	0	114.8	P91 K95 I137 M140 E163 R865	P91-N135 WeakPolarHBondContact CA-ND2 3.16Å; P91-N135 WeakPolarHBondContact CB-ND2 3.46Å; P91-N135 WeakPolarHBondContact CD-ND2 3.44Å; P91-N135 VanDerWaalsContact N-ND2 3.12Å; K95-N135 PolarHBondContact NZ-OD1 3.25Å; N135-I137 PolarHBondContact O-N 2.97Å; N135-M140 WeakPolarHBondContact O-CE 3.3Å; N135-E163 PolarHBondContact ND2-OE2 3.16Å; N135-R865 PolarHBondContact O-NH1 3.49Å
136	D	83.8	Confident	90.4	Very high	5 Å²	5	10.7 Å²	10.7	3%	0.027	5%	0.053	C	C	.	.			trans	-67.7	126.2	-179.6	-137.6	3.8	0	0	0	110	S134 N138 V139 M140 N973 A982	S134-D136 PolarHBondContact O-N 2.79Å; D136-N138 PolarHBondContact O-N 3.24Å; D136-V139 HydrophobicContact CB-CB 4.3Å; D136-V139 HydrophobicContact CB-CG2 4.03Å; D136-V139 PolarHBondContact O-N 3.09Å; D136-M140 PolarHBondContact O-N 3.32Å; D136-N973 PolarHBondContact OD2-ND2 2.73Å; D136-A982 WeakPolarHBondContact OD1-CA 3.36Å
137	I	86.9	Confident	90.7	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-58.5	-27.5	-179.1	-171.7	165.3	0	0	0	112.3	N135 I141 I170 V849 V852 R865 I866	N135-I137 PolarHBondContact O-N 2.97Å; I137-I141 HydrophobicContact CG1-CD1 4.21Å; I137-I141 WeakPolarHBondContact O-CB 3.16Å; I137-I141 WeakPolarHBondContact O-CD1 3.45Å; I137-I141 WeakPolarHBondContact O-CG1 3.5Å; I137-I141 PolarHBondContact O-N 3.47Å; I137-I170 HydrophobicContact CG1-CD1 4.34Å; I137-V849 HydrophobicContact CD1-CG2 3.84Å; I137-V852 HydrophobicContact CG2-CB 4.46Å; I137-V852 HydrophobicContact CG2-CG1 4.13Å; I137-V852 HydrophobicContact CG2-CG2 4.24Å; I137-R865 HydrophobicContact CD1-CB 3.67Å; I137-I866 HydrophobicContact CD1-CG1 4.06Å
138	N	88.1	Confident	90.7	Very high	3 Å²	3	8.6 Å²	8.6	2%	0.016	5%	0.046	C	C	.	.	H	α-helix	trans	-62	-48.3	171.3	-79.6	-14.7	0	0	0	112.1	D136 I141 D142 R803 N973	D136-N138 PolarHBondContact O-N 3.24Å; N138-I141 WeakPolarHBondContact O-CB 3.02Å; N138-I141 PolarHBondContact O-N 2.88Å; N138-D142 PolarHBondContact O-N 3.43Å; N138-R803 PolarHBondContact O-NH1 2.64Å; N138-N973 PolarHBondContact ND2-ND2 3.41Å
139	V	88.6	Confident	90.7	Very high	3 Å²	3	8.2 Å²	8.2	2%	0.018	5%	0.045	C	C	.	.	H	α-helix	trans	-68.2	-38.8	178	177.2	0	0	0	0	110.7	D136 I141 D142 V143 Y758 P759	D136-V139 HydrophobicContact CB-CB 4.3Å; D136-V139 HydrophobicContact CB-CG2 4.03Å; D136-V139 PolarHBondContact O-N 3.09Å; V139-I141 VanDerWaalsContact C-N 3.33Å; V139-I141 PolarHBondContact O-N 2.82Å; V139-D142 PolarHBondContact O-N 3.42Å; V139-V143 HydrophobicContact CG1-CG2 3.92Å; V139-V143 VanDerWaalsContact O-CB 3.29Å; V139-V143 WeakPolarHBondContact O-CB 3.5Å; V139-V143 VanDerWaalsContact O-CG2 3.24Å; V139-V143 WeakPolarHBondContact O-CG2 3.44Å; V139-V143 PolarHBondContact O-N 2.74Å; V139-Y758 HydrophobicContact CG2-CD1 3.44Å; V139-Y758 VanDerWaalsContact CG2-CD1 3.44Å; V139-Y758 HydrophobicContact CG2-CE1 3.78Å; V139-Y758 HydrophobicContact CG2-CG 4.43Å; V139-P759 HydrophobicContact CG1-CG 3.95Å
140	M	90.8	Very high	90.7	Very high	3 Å²	3	8.2 Å²	8.2	2%	0.015	5%	0.045	C	C	.	.	H	α-helix	trans	-58	-42.7	172.6	-70.4	-178.9	-175.9	0	0	112.8	N135 D136 A144 E163 F167 I170	N135-M140 WeakPolarHBondContact O-CE 3.3Å; D136-M140 PolarHBondContact O-N 3.32Å; M140-A144 WeakPolarHBondContact O-CB 3.49Å; M140-A144 PolarHBondContact O-N 3.1Å; M140-E163 HydrophobicContact CE-CB 3.93Å; M140-F167 HydrophobicContact CB-CD2 3.87Å; M140-F167 HydrophobicContact CG-CD2 4.05Å; M140-F167 WeakPolarHBondContact O-CE2 3.48Å; M140-F167 HydrophobicContact SD-CB 4.49Å; M140-I170 HydrophobicContact CB-CD1 4Å
141	I	91.9	Very high	90.8	Very high	6 Å²	6	7.9 Å²	7.9	3%	0.031	4%	0.043	C	C	.	.	H	α-helix	trans	-62.3	-47.7	175.6	-75.8	166.7	0	0	0	111.2	I137 N138 V139 K145 I170 S798 L847	I137-I141 HydrophobicContact CG1-CD1 4.21Å; I137-I141 WeakPolarHBondContact O-CB 3.16Å; I137-I141 WeakPolarHBondContact O-CD1 3.45Å; I137-I141 WeakPolarHBondContact O-CG1 3.5Å; I137-I141 PolarHBondContact O-N 3.47Å; N138-I141 WeakPolarHBondContact O-CB 3.02Å; N138-I141 PolarHBondContact O-N 2.88Å; V139-I141 VanDerWaalsContact C-N 3.33Å; V139-I141 PolarHBondContact O-N 2.82Å; I141-K145 WeakPolarHBondContact O-CG 3.18Å; I141-K145 PolarHBondContact O-N 3.45Å; I141-I170 HydrophobicContact CG1-CD1 3.84Å; I141-I170 HydrophobicContact CG1-CG1 4.27Å; I141-I170 HydrophobicContact CG1-CG2 4.18Å; I141-S798 WeakPolarHBondContact CG2-OG 3.45Å; I141-L847 HydrophobicContact CD1-CD2 3.6Å; I141-L847 HydrophobicContact CG1-CD2 3.85Å
142	D	90.2	Very high	90.9	Very high	6 Å²	6	7.7 Å²	7.7	3%	0.032	4%	0.042	C	C	.	.	H	α-helix	trans	-66.4	-51.2	-176.4	-66.7	-2.2	0	0	0	111	N138 V139 A144 K145 I146 I761 R803	N138-D142 PolarHBondContact O-N 3.43Å; V139-D142 PolarHBondContact O-N 3.42Å; D142-A144 VanDerWaalsContact C-N 3.33Å; D142-A144 PolarHBondContact O-N 2.96Å; D142-K145 WeakPolarHBondContact O-CB 3.35Å; D142-K145 PolarHBondContact O-N 2.81Å; D142-K145 VanDerWaalsContact O-N 3.1Å; D142-I146 PolarHBondContact O-N 2.81Å; D142-I761 HydrophobicContact CB-CD1 3.75Å; D142-R803 IonicContact OD1-CZ 2.93Å; D142-R803 IonicContact OD1-NE 2.86Å; D142-R803 IonicContact OD1-NH1 3.62Å; D142-R803 PolarHBondContact OD1-NH1 2.66Å; D142-R803 IonicContact OD2-CZ 3.29Å; D142-R803 IonicContact OD2-NH1 3.23Å; D142-R803 PolarHBondContact OD2-NH1 2.91Å
143	V	92.1	Very high	91	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-59.3	-40.7	177.4	171.8	0	0	0	0	111.7	A86 L131 C133 V139 K145 I146 A147 F167 P759	A86-V143 HydrophobicContact CB-CG1 3.35Å; L131-V143 HydrophobicContact CD2-CG2 4.06Å; C133-V143 HydrophobicContact CB-CG1 4.36Å; C133-V143 HydrophobicContact CB-CG2 4.4Å; V139-V143 HydrophobicContact CG1-CG2 3.92Å; V139-V143 VanDerWaalsContact O-CB 3.29Å; V139-V143 WeakPolarHBondContact O-CB 3.5Å; V139-V143 VanDerWaalsContact O-CG2 3.24Å; V139-V143 WeakPolarHBondContact O-CG2 3.44Å; V139-V143 PolarHBondContact O-N 2.74Å; V143-K145 VanDerWaalsContact C-N 3.29Å; V143-K145 PolarHBondContact O-N 2.81Å; V143-I146 WeakPolarHBondContact O-CG1 3.33Å; V143-I146 PolarHBondContact O-N 2.67Å; V143-A147 HydrophobicContact CG1-CB 4.31Å; V143-A147 VanDerWaalsContact O-CB 3.25Å; V143-A147 WeakPolarHBondContact O-CB 3.45Å; V143-A147 PolarHBondContact O-N 3.49Å; V143-F167 HydrophobicContact CG1-CE2 4.4Å; V143-P759 HydrophobicContact CG2-CG 3.79Å
144	A	93.3	Very high	91.2	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-64.4	-30.6	177.4	0	0	0	0	0	113.3	M140 D142 I146 F167 I170 R250	M140-A144 WeakPolarHBondContact O-CB 3.49Å; M140-A144 PolarHBondContact O-N 3.1Å; D142-A144 VanDerWaalsContact C-N 3.33Å; D142-A144 PolarHBondContact O-N 2.96Å; A144-I146 VanDerWaalsContact C-N 3.33Å; A144-F167 HydrophobicContact CB-CE2 3.95Å; A144-F167 HydrophobicContact CB-CZ 4.01Å; A144-I170 HydrophobicContact CB-CB 4.41Å; A144-I170 HydrophobicContact CB-CG2 3.46Å; A144-I170 VanDerWaalsContact CB-CG2 3.46Å; A144-R250 PolarHBondContact O-NH2 3.37Å; A144-R250 VanDerWaalsContact O-NH2 3.11Å
145	K	91.9	Very high	91.6	Very high	9 Å²	9	5.2 Å²	5.2	4%	0.039	3%	0.027	C	C	.	.	H	α-helix	trans	-66.5	-34.3	175.1	-68.7	170.5	-166.5	-176.4	0	111.9	I141 D142 V143 H174 R250 S798 G800 W801	I141-K145 WeakPolarHBondContact O-CG 3.18Å; I141-K145 PolarHBondContact O-N 3.45Å; D142-K145 WeakPolarHBondContact O-CB 3.35Å; D142-K145 PolarHBondContact O-N 2.81Å; D142-K145 VanDerWaalsContact O-N 3.1Å; V143-K145 VanDerWaalsContact C-N 3.29Å; V143-K145 PolarHBondContact O-N 2.81Å; K145-H174 HydrophobicContact CG-CB 4.38Å; K145-R250 PolarHBondContact O-NE 3.23Å; K145-R250 PolarHBondContact O-NH2 3.11Å; K145-S798 WeakPolarHBondContact CE-OG 3.32Å; K145-S798 PolarHBondContact NZ-OG 3.38Å; K145-G800 VanDerWaalsContact CE-O 3.31Å; K145-G800 WeakPolarHBondContact CE-O 3.46Å; K145-G800 PolarHBondContact NZ-O 3.28Å; K145-W801 HydrophobicContact CB-CZ3 4.06Å; K145-W801 HydrophobicContact CD-CE3 4.26Å; K145-W801 HydrophobicContact CD-CZ3 4.47Å; K145-W801 PolarHBondContact NZ-O 3.47Å
146	I	91.8	Very high	92	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-101.8	-30.1	-172.9	58.1	170.6	0	0	0	115.5	L84 L131 D142 V143 A144 D148 Y255 L257 I761 W801	L84-I146 HydrophobicContact CD2-CB 3.79Å; L84-I146 HydrophobicContact CD2-CD1 3.35Å; L84-I146 HydrophobicContact CD2-CG1 3.4Å; L131-I146 HydrophobicContact CD2-CD1 4.37Å; D142-I146 PolarHBondContact O-N 2.81Å; V143-I146 WeakPolarHBondContact O-CG1 3.33Å; V143-I146 PolarHBondContact O-N 2.67Å; A144-I146 VanDerWaalsContact C-N 3.33Å; I146-D148 PolarHBondContact O-N 3.19Å; I146-Y255 HydrophobicContact CB-CD2 4.35Å; I146-Y255 HydrophobicContact CB-CE2 3.94Å; I146-Y255 HydrophobicContact CG2-CD2 3.61Å; I146-Y255 HydrophobicContact CG2-CE2 3.69Å; I146-L257 HydrophobicContact CD1-CD1 3.99Å; I146-L257 HydrophobicContact CD1-CD2 4.48Å; I146-I761 HydrophobicContact CD1-CD1 3.62Å; I146-I761 HydrophobicContact CD1-CG1 4.04Å; I146-I761 HydrophobicContact CG1-CD1 4.16Å; I146-I761 HydrophobicContact CG2-CD1 4Å; I146-I761 HydrophobicContact CG2-CG2 4.2Å; I146-W801 HydrophobicContact CG2-CH2 4.39Å; I146-W801 HydrophobicContact CG2-CZ3 4.11Å
147	A	93.3	Very high	92.3	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.043	C	C	.	.			trans	-71.3	121.8	-168.7	0	0	0	0	0	114.5	A86 V143 V150 P177 R250	A86-A147 HydrophobicContact CB-CB 3.52Å; V143-A147 HydrophobicContact CG1-CB 4.31Å; V143-A147 VanDerWaalsContact O-CB 3.25Å; V143-A147 WeakPolarHBondContact O-CB 3.45Å; V143-A147 PolarHBondContact O-N 3.49Å; A147-V150 HydrophobicContact CB-CG2 4.15Å; A147-P177 WeakPolarHBondContact O-CB 3.41Å; A147-R250 PolarHBondContact O-NH1 2.95Å; A147-R250 PolarHBondContact O-NH2 3.14Å
148	D	92.6	Very high	92.5	Very high	23 Å²	23	14 Å²	14	12%	0.123	7%	0.074	C	C	.	.	S	Bend	trans	-79.7	-33.9	176.3	-62.6	-46.7	0	0	0	112.6	L84 I146 R178 F244 R250	L84-D148 PolarHBondContact O-N 3.02Å; I146-D148 PolarHBondContact O-N 3.19Å; D148-R178 PolarHBondContact O-N 2.99Å; D148-F244 HydrophobicContact CB-CD1 4.17Å; D148-F244 HydrophobicContact CB-CG 4.21Å; D148-R250 IonicContact OD1-CZ 2.59Å; D148-R250 IonicContact OD1-NH1 3.22Å; D148-R250 PolarHBondContact OD1-NH1 2.61Å
149	L	94.4	Very high	92.6	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.7	171.3	-173.9	59.2	0	0	0	110	L84 V85 A86 L151 R178 M180 I239 M242 F244	L84-L149 PolarHBondContact O-N 2.77Å; V85-L149 CarbonylContact C-O 3.59Å; V85-L149 WeakPolarHBondContact CA-O 3.22Å; V85-L149 HydrophobicContact CB-CB 4.49Å; V85-L149 HydrophobicContact CG1-CB 4.35Å; V85-L149 HydrophobicContact CG1-CD2 3.99Å; V85-L149 HydrophobicContact CG1-CG 4.22Å; V85-L149 HydrophobicContact CG2-CB 4.19Å; V85-L149 HydrophobicContact CG2-CD2 4.1Å; A86-L149 PolarHBondContact N-O 2.74Å; L149-L151 HydrophobicContact CD2-CD2 4.24Å; L149-L151 HydrophobicContact CG-CD2 4.34Å; L149-R178 CarbonylContact C-O 3.58Å; L149-R178 WeakPolarHBondContact CA-O 3.45Å; L149-R178 HydrophobicContact CD1-CB 3.7Å; L149-M180 HydrophobicContact CD1-CG 4.04Å; L149-M180 HydrophobicContact CD1-SD 3.85Å; L149-M180 HydrophobicContact CD2-SD 3.94Å; L149-M180 HydrophobicContact CG-SD 4.38Å; L149-I239 HydrophobicContact CD2-CB 4.34Å; L149-I239 HydrophobicContact CD2-CG1 4.06Å; L149-I239 HydrophobicContact CD2-CG2 3.76Å; L149-M242 HydrophobicContact CD1-SD 3.83Å; L149-F244 HydrophobicContact CB-CE1 3.85Å; L149-F244 HydrophobicContact CB-CZ 4.49Å; L149-F244 HydrophobicContact CD1-CE1 4.4Å; L149-F244 HydrophobicContact CD2-CE1 4.41Å; L149-F244 HydrophobicContact CG-CE1 4.45Å
150	V	95.6	Very high	92.6	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.4	170.3	179.3	0	0	0	0	108.8	A86 V88 A147 L152 F167 P177 R178 I179 M180	A86-V150 CarbonylContact O-C 3.47Å; A86-V150 WeakPolarHBondContact O-CA 3.42Å; V88-V150 HydrophobicContact CB-CG1 4.1Å; V88-V150 HydrophobicContact CG2-CG1 3.83Å; A147-V150 HydrophobicContact CB-CG2 4.15Å; V150-L152 HydrophobicContact CG1-CB 4.45Å; V150-F167 HydrophobicContact CB-CE1 4.36Å; V150-F167 HydrophobicContact CG1-CD1 4.44Å; V150-F167 HydrophobicContact CG1-CE1 3.68Å; V150-F167 HydrophobicContact CG1-CZ 4.25Å; V150-F167 HydrophobicContact CG2-CE1 3.84Å; V150-F167 HydrophobicContact CG2-CZ 4.01Å; V150-P177 HydrophobicContact CG2-CB 4.46Å; V150-P177 HydrophobicContact CG2-CG 3.7Å; V150-R178 PolarHBondContact N-O 2.74Å; V150-I179 HydrophobicContact CB-CG1 4.23Å; V150-I179 HydrophobicContact CB-CG2 4.43Å; V150-I179 WeakPolarHBondContact O-CA 3.05Å; V150-M180 PolarHBondContact O-N 2.93Å
151	L	96.2	Very high	92.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	101.8	162.9	-54.9	-173	0	0	0	107.2	V85 A86 V87 V88 L98 L102 L149 L153 M180 I239	V85-L151 HydrophobicContact CG1-CD1 3.97Å; V85-L151 HydrophobicContact CG1-CD2 4.4Å; V85-L151 HydrophobicContact CG1-CG 3.79Å; A86-L151 PolarHBondContact O-N 3.39Å; V87-L151 HydrophobicContact CG2-CD1 4.28Å; V88-L151 PolarHBondContact N-O 3.2Å; L98-L151 HydrophobicContact CD2-CD1 4.23Å; L102-L151 HydrophobicContact CD1-CD1 3.86Å; L149-L151 HydrophobicContact CD2-CD2 4.24Å; L149-L151 HydrophobicContact CG-CD2 4.34Å; L151-L153 HydrophobicContact CB-CD1 4.39Å; L151-L153 WeakPolarHBondContact O-CD1 3.48Å; L151-M180 HydrophobicContact CD2-CB 3.86Å; L151-M180 HydrophobicContact CD2-CE 4.4Å; L151-M180 HydrophobicContact CD2-CG 4.37Å; L151-M180 HydrophobicContact CD2-SD 3.78Å; L151-I239 HydrophobicContact CD1-CD1 4.02Å; L151-I239 HydrophobicContact CD2-CD1 4.21Å; L151-I239 HydrophobicContact CD2-CG1 4.44Å
152	L	95.7	Very high	92.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	104.1	179.2	-168.9	84.2	0	0	0	109.6	V88 V150 I154 F167 L168 I179 M180 G181 V182 F206	V88-L152 HydrophobicContact CG1-CD1 4.48Å; V88-L152 CarbonylContact O-C 3.56Å; V88-L152 WeakPolarHBondContact O-CA 3.22Å; V150-L152 HydrophobicContact CG1-CB 4.45Å; L152-I154 HydrophobicContact CD2-CD1 4.24Å; L152-I154 HydrophobicContact CD2-CG1 4.28Å; L152-F167 HydrophobicContact CD1-CD1 4.42Å; L152-L168 HydrophobicContact CD2-CD1 4.16Å; L152-L168 HydrophobicContact CD2-CD2 4.36Å; L152-L168 HydrophobicContact CD2-CG 4.38Å; L152-I179 HydrophobicContact CB-CG2 4.08Å; L152-M180 PolarHBondContact N-O 2.98Å; L152-G181 CarbonylContact O-C 3.54Å; L152-G181 WeakPolarHBondContact O-CA 3.42Å; L152-V182 PolarHBondContact O-N 2.72Å; L152-F206 HydrophobicContact CD2-CE2 4.03Å
153	L	95.2	Very high	92.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	134.4	175.4	-75.4	71.5	0	0	0	109.9	V87 V88 P90 V93 K95 L98 L151 V182 T184	V87-L153 HydrophobicContact CG1-CD1 3.64Å; V88-L153 PolarHBondContact O-N 2.73Å; P90-L153 WeakPolarHBondContact CD-O 3.12Å; V93-L153 HydrophobicContact CB-CB 4.37Å; V93-L153 HydrophobicContact CG2-CB 3.63Å; V93-L153 HydrophobicContact CG2-CD2 3.91Å; V93-L153 HydrophobicContact CG2-CG 4.43Å; K95-L153 HydrophobicContact CG-CD2 4.15Å; L98-L153 HydrophobicContact CB-CD2 4.47Å; L98-L153 HydrophobicContact CD2-CD1 3.77Å; L98-L153 HydrophobicContact CD2-CD2 4.21Å; L98-L153 HydrophobicContact CD2-CG 4.24Å; L151-L153 HydrophobicContact CB-CD1 4.39Å; L151-L153 WeakPolarHBondContact O-CD1 3.48Å; L153-V182 WeakPolarHBondContact CA-O 3.45Å; L153-V182 HydrophobicContact CG-CB 4.3Å; L153-T184 HydrophobicContact CD2-CG2 4.33Å
154	I	94.3	Very high	92.2	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	127.2	178.1	-55.9	156.8	0	0	0	107.4	L152 A156 G159 F160 V182 L183 T184 F206	L152-I154 HydrophobicContact CD2-CD1 4.24Å; L152-I154 HydrophobicContact CD2-CG1 4.28Å; I154-A156 PolarHBondContact O-N 2.99Å; I154-G159 WeakPolarHBondContact CG2-O 3.29Å; I154-F160 HydrophobicContact CD1-CD1 4.23Å; I154-F160 HydrophobicContact CD1-CE1 3.49Å; I154-F160 VanDerWaalsContact CD1-CE1 3.49Å; I154-F160 HydrophobicContact CD1-CE2 4.49Å; I154-F160 HydrophobicContact CD1-CZ 3.65Å; I154-F160 HydrophobicContact CG1-CD1 4.41Å; I154-F160 HydrophobicContact CG1-CE1 4.14Å; I154-F160 HydrophobicContact CG2-CG 4.45Å; I154-V182 PolarHBondContact N-O 3.37Å; I154-L183 HydrophobicContact CB-CD2 3.74Å; I154-L183 HydrophobicContact CD1-CD2 4.08Å; I154-L183 HydrophobicContact CG2-CD2 4.04Å; I154-L183 WeakPolarHBondContact O-CA 3.36Å; I154-T184 PolarHBondContact O-N 2.99Å; I154-T184 PolarHBondContact O-OG1 3.35Å; I154-F206 HydrophobicContact CD1-CD2 3.91Å; I154-F206 HydrophobicContact CD1-CE2 4.25Å
155	D	93.5	Very high	92.2	Very high	19 Å²	19	23.3 Å²	23.3	10%	0.102	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	124.3	172.7	-170.8	-56.4	0	0	0	109.8	V93 S157 F158 G159 H185	V93-D155 HydrophobicContact CG1-CB 4.14Å; D155-S157 VanDerWaalsContact OD1-CA 3.29Å; D155-S157 WeakPolarHBondContact OD1-CA 3.27Å; D155-S157 VanDerWaalsContact OD1-CB 3.28Å; D155-S157 WeakPolarHBondContact OD1-CB 3.42Å; D155-S157 PolarHBondContact OD1-N 2.99Å; D155-S157 PolarHBondContact OD1-OG 2.97Å; D155-F158 HydrophobicContact CB-CB 4.18Å; D155-F158 PolarHBondContact OD1-N 2.75Å; D155-G159 WeakPolarHBondContact O-CA 3.21Å; D155-G159 PolarHBondContact O-N 3.06Å; D155-H185 IonicContact OD2-CE1 3.48Å; D155-H185 IonicContact OD2-CG 3.35Å; D155-H185 IonicContact OD2-ND1 2.65Å; D155-H185 PolarHBondContact OD2-ND1 2.65Å
156	A	92.9	Very high	92.2	Very high	4 Å²	4	23 Å²	23	3%	0.033	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-20.7	179.3	0	0	0	0	0	113.8	I154 L183 T184 L186 I189 V198 L202	I154-A156 PolarHBondContact O-N 2.99Å; A156-L183 HydrophobicContact CB-CB 4.46Å; A156-L183 HydrophobicContact CB-CD1 4.47Å; A156-T184 WeakPolarHBondContact CB-O 3.48Å; A156-T184 PolarHBondContact N-O 2.84Å; A156-L186 HydrophobicContact CB-CD2 3.4Å; A156-L186 VanDerWaalsContact CB-CD2 3.4Å; A156-L186 HydrophobicContact CB-CG 3.86Å; A156-I189 HydrophobicContact CB-CD1 4.39Å; A156-V198 WeakPolarHBondContact O-CG1 3.45Å; A156-L202 HydrophobicContact CB-CD1 4.33Å
157	S	89.4	Confident	92.3	Very high	69 Å²	69	23 Å²	23	48%	0.483	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-40.4	178.3	80.7	0	0	0	0	111.9	D155	D155-S157 VanDerWaalsContact OD1-CA 3.29Å; D155-S157 WeakPolarHBondContact OD1-CA 3.27Å; D155-S157 VanDerWaalsContact OD1-CB 3.28Å; D155-S157 WeakPolarHBondContact OD1-CB 3.42Å; D155-S157 PolarHBondContact OD1-N 2.99Å; D155-S157 PolarHBondContact OD1-OG 2.97Å
158	F	90	Very high	92.3	Very high	149 Å²	149	23.1 Å²	23.1	65%	0.654	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-41.5	177	-169.5	-85.1	0	0	0	112.6	D155 E161	D155-F158 HydrophobicContact CB-CB 4.18Å; D155-F158 PolarHBondContact OD1-N 2.75Å; F158-E161 HydrophobicContact CD1-CG 3.63Å; F158-E161 HydrophobicContact CE1-CG 3.56Å
159	G	90.6	Very high	92.4	Very high	7 Å²	7	22.7 Å²	22.7	7%	0.072	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	97	-149.3	-174	0	0	0	0	0	113.3	I154 D155	I154-G159 WeakPolarHBondContact CG2-O 3.29Å; D155-G159 WeakPolarHBondContact O-CA 3.21Å; D155-G159 PolarHBondContact O-N 3.06Å
160	F	89.9	Confident	92.4	Very high	32 Å²	32	22.7 Å²	22.7	14%	0.14	12%	0.116	C	C	.	.			trans	-80.2	120.7	-178	-75	-94	0	0	0	112.3	I154 F165 L202 R205 F206	I154-F160 HydrophobicContact CD1-CD1 4.23Å; I154-F160 HydrophobicContact CD1-CE1 3.49Å; I154-F160 VanDerWaalsContact CD1-CE1 3.49Å; I154-F160 HydrophobicContact CD1-CE2 4.49Å; I154-F160 HydrophobicContact CD1-CZ 3.65Å; I154-F160 HydrophobicContact CG1-CD1 4.41Å; I154-F160 HydrophobicContact CG1-CE1 4.14Å; I154-F160 HydrophobicContact CG2-CG 4.45Å; F160-F165 HydrophobicContact CB-CD2 4.31Å; F160-F165 HydrophobicContact CB-CE2 3.41Å; F160-F165 VanDerWaalsContact CB-CE2 3.41Å; F160-F165 HydrophobicContact CB-CZ 3.53Å; F160-F165 HydrophobicContact CD1-CE1 4.37Å; F160-F165 HydrophobicContact CD1-CZ 4.13Å; F160-F165 HydrophobicContact CG-CE2 4.27Å; F160-F165 AromaticContact CG-CZ 3.91Å; F160-F165 HydrophobicContact CG-CZ 3.91Å; F160-L202 HydrophobicContact CD2-CD2 3.6Å; F160-L202 HydrophobicContact CE2-CB 4.23Å; F160-L202 HydrophobicContact CE2-CD2 3.66Å; F160-R205 HydrophobicContact CD2-CB 4.41Å; F160-R205 HydrophobicContact CD2-CG 4.18Å; F160-R205 HydrophobicContact CE2-CB 3.82Å; F160-R205 HydrophobicContact CE2-CG 3.96Å; F160-R205 HydrophobicContact CZ-CB 4.39Å; F160-R205 HydrophobicContact CZ-CG 4.45Å; F160-F206 HydrophobicContact CE1-CD2 4.37Å; F160-F206 HydrophobicContact CZ-CB 4.04Å; F160-F206 HydrophobicContact CZ-CD2 4.21Å
161	E	89.1	Confident	92.3	Very high	44 Å²	44	22.7 Å²	22.7	21%	0.206	12%	0.116	C	C	.	.			trans	-87.8	157.4	171	-71.7	-169.6	-132.7	0	0	113.2	P90 F158 E163 T164 F165	P90-E161 HydrophobicContact CB-CB 4.05Å; P90-E161 HydrophobicContact CB-CG 4.08Å; P90-E161 WeakPolarHBondContact CB-OE1 3.24Å; P90-E161 WeakPolarHBondContact CB-OE2 3.28Å; P90-E161 HydrophobicContact CG-CB 4.01Å; P90-E161 HydrophobicContact CG-CG 4.08Å; F158-E161 HydrophobicContact CD1-CG 3.63Å; F158-E161 HydrophobicContact CE1-CG 3.56Å; E161-E163 PolarHBondContact O-N 3.39Å; E161-T164 PolarHBondContact O-N 2.84Å; E161-T164 VanDerWaalsContact O-N 3.08Å; E161-T164 PolarHBondContact O-OG1 3.09Å; E161-F165 WeakPolarHBondContact O-CD2 3.38Å; E161-F165 PolarHBondContact O-N 3.13Å
162	M	87.8	Confident	92.1	Very high	82 Å²	82	27.3 Å²	27.3	40%	0.404	14%	0.137	S	C	.	.	H	α-helix	trans	-55.6	-35	179.2	-63.7	-65.6	-80.4	0	0	112.4	T164 F165 E166 F864	M162-T164 VanDerWaalsContact C-N 3.34Å; M162-T164 PolarHBondContact O-N 3.37Å; M162-F165 WeakPolarHBondContact O-CB 3.39Å; M162-F165 PolarHBondContact O-N 3.44Å; M162-E166 VanDerWaalsContact O-CG 3.29Å; M162-E166 WeakPolarHBondContact O-CG 3.36Å; M162-E166 PolarHBondContact O-N 2.72Å; M162-F864 HydrophobicContact CE-CB 3.74Å; M162-F864 HydrophobicContact CE-CD2 3.92Å; M162-F864 HydrophobicContact CE-CG 4.32Å
163	E	87.8	Confident	92	Very high	26 Å²	26	28.7 Å²	28.7	12%	0.121	15%	0.146	C	C	.	.	H	α-helix	trans	-62.6	-39.4	178.7	-50.1	-147.3	111.7	0	0	112.3	P91 N135 M140 E161 F165 E166 F167 R865	P91-E163 WeakPolarHBondContact CD-OE2 3.47Å; N135-E163 PolarHBondContact ND2-OE2 3.16Å; M140-E163 HydrophobicContact CE-CB 3.93Å; E161-E163 PolarHBondContact O-N 3.39Å; E163-F165 VanDerWaalsContact C-N 3.34Å; E163-F165 PolarHBondContact O-N 3.45Å; E163-E166 PolarHBondContact O-N 3.48Å; E163-F167 PolarHBondContact O-N 3.07Å; E163-R865 IonicContact OE1-CZ 2.81Å; E163-R865 IonicContact OE1-NH1 2.78Å; E163-R865 PolarHBondContact OE1-NH1 3.35Å; E163-R865 IonicContact OE1-NH2 3.17Å; E163-R865 PolarHBondContact OE1-NH2 2.95Å
164	T	92	Very high	91.8	Very high	2 Å²	2	30 Å²	30	1%	0.012	15%	0.152	C	C	.	.	H	α-helix	trans	-65.5	-40	176.4	68.8	0	0	0	0	111.3	P90 E161 M162 L168	P90-T164 HydrophobicContact CG-CG2 4.05Å; E161-T164 PolarHBondContact O-N 2.84Å; E161-T164 VanDerWaalsContact O-N 3.08Å; E161-T164 PolarHBondContact O-OG1 3.09Å; M162-T164 VanDerWaalsContact C-N 3.34Å; M162-T164 PolarHBondContact O-N 3.37Å; T164-L168 WeakPolarHBondContact O-CB 3.11Å; T164-L168 VanDerWaalsContact O-CG 3.26Å; T164-L168 WeakPolarHBondContact O-CG 3.45Å; T164-L168 PolarHBondContact O-N 3.41Å; T164-L168 VanDerWaalsContact O-N 3.1Å
165	F	92	Very high	91.6	Very high	22 Å²	22	31 Å²	31	10%	0.096	16%	0.163	C	C	.	.	H	α-helix	trans	-67.5	-36	175.1	-74.5	-59.7	0	0	0	112.3	F160 E161 M162 E163 N169 E209 W784 F864	F160-F165 HydrophobicContact CB-CD2 4.31Å; F160-F165 HydrophobicContact CB-CE2 3.41Å; F160-F165 VanDerWaalsContact CB-CE2 3.41Å; F160-F165 HydrophobicContact CB-CZ 3.53Å; F160-F165 HydrophobicContact CD1-CE1 4.37Å; F160-F165 HydrophobicContact CD1-CZ 4.13Å; F160-F165 HydrophobicContact CG-CE2 4.27Å; F160-F165 AromaticContact CG-CZ 3.91Å; F160-F165 HydrophobicContact CG-CZ 3.91Å; E161-F165 WeakPolarHBondContact O-CD2 3.38Å; E161-F165 PolarHBondContact O-N 3.13Å; M162-F165 WeakPolarHBondContact O-CB 3.39Å; M162-F165 PolarHBondContact O-N 3.44Å; E163-F165 VanDerWaalsContact C-N 3.34Å; E163-F165 PolarHBondContact O-N 3.45Å; F165-N169 PolarHBondContact O-N 2.7Å; F165-N169 PolarHBondContact O-ND2 3.23Å; F165-E209 HydrophobicContact CD1-CG 4.49Å; F165-E209 HydrophobicContact CE1-CG 3.95Å; F165-E209 WeakPolarHBondContact CE1-OE1 3.26Å; F165-W784 HydrophobicContact CB-CE3 4.4Å; F165-W784 HydrophobicContact CB-CZ3 3.76Å; F165-W784 AromaticContact CD1-CH2 3.71Å; F165-W784 HydrophobicContact CD1-CH2 3.71Å; F165-W784 AromaticContact CD1-CZ3 3.83Å; F165-W784 HydrophobicContact CD1-CZ3 3.83Å; F165-W784 HydrophobicContact CE1-CH2 4.28Å; F165-W784 HydrophobicContact CG-CH2 4.34Å; F165-W784 HydrophobicContact CG-CZ3 4.03Å; F165-F864 HydrophobicContact CB-CE2 4.21Å
166	E	91.8	Very high	91.4	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.019	18%	0.178	C	C	.	.	H	α-helix	trans	-67.1	-50.6	176.6	-73.9	167.3	171.4	0	0	111	M162 E163 L168 N169 I170 F864 R865 I866	M162-E166 VanDerWaalsContact O-CG 3.29Å; M162-E166 WeakPolarHBondContact O-CG 3.36Å; M162-E166 PolarHBondContact O-N 2.72Å; E163-E166 PolarHBondContact O-N 3.48Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 2.82Å; E166-N169 PolarHBondContact O-N 2.86Å; E166-N169 VanDerWaalsContact O-N 3.09Å; E166-I170 WeakPolarHBondContact O-CG1 3.32Å; E166-I170 PolarHBondContact O-N 3.49Å; E166-F864 HydrophobicContact CB-CE2 4.24Å; E166-F864 HydrophobicContact CG-CD2 3.57Å; E166-F864 HydrophobicContact CG-CE2 3.29Å; E166-F864 HydrophobicContact CG-CG 4.4Å; E166-F864 HydrophobicContact CG-CZ 3.91Å; E166-R865 WeakPolarHBondContact OE1-CB 3.33Å; E166-R865 PolarHBondContact OE1-N 2.88Å; E166-R865 IonicContact OE1-NE 3.69Å; E166-R865 IonicContact OE2-CZ 3.44Å; E166-R865 IonicContact OE2-NE 2.7Å; E166-R865 PolarHBondContact OE2-NE 3.07Å; E166-R865 IonicContact OE2-NH2 2.69Å; E166-R865 PolarHBondContact OE2-NH2 2.96Å; E166-I866 HydrophobicContact CB-CD1 3.79Å; E166-I866 HydrophobicContact CG-CD1 4.06Å; E166-I866 HydrophobicContact CG-CG1 4.43Å; E166-I866 VanDerWaalsContact O-CD1 3.24Å; E166-I866 WeakPolarHBondContact O-CD1 3.45Å
167	F	93.9	Very high	91.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57	-44	176.7	-173.2	-88	0	0	0	112.5	V88 M140 V143 A144 V150 L152 E163 N169 I170 C171	V88-F167 HydrophobicContact CG1-CB 4.23Å; V88-F167 HydrophobicContact CG1-CD1 4.02Å; V88-F167 HydrophobicContact CG1-CD2 3.65Å; V88-F167 HydrophobicContact CG1-CE1 4.36Å; V88-F167 HydrophobicContact CG1-CE2 4.01Å; V88-F167 HydrophobicContact CG1-CG 3.67Å; V88-F167 HydrophobicContact CG1-CZ 4.36Å; V88-F167 HydrophobicContact CG2-CD2 4.4Å; V88-F167 HydrophobicContact CG2-CE1 4.17Å; V88-F167 HydrophobicContact CG2-CE2 3.89Å; V88-F167 HydrophobicContact CG2-CZ 3.77Å; M140-F167 HydrophobicContact CB-CD2 3.87Å; M140-F167 HydrophobicContact CG-CD2 4.05Å; M140-F167 WeakPolarHBondContact O-CE2 3.48Å; M140-F167 HydrophobicContact SD-CB 4.49Å; V143-F167 HydrophobicContact CG1-CE2 4.4Å; A144-F167 HydrophobicContact CB-CE2 3.95Å; A144-F167 HydrophobicContact CB-CZ 4.01Å; V150-F167 HydrophobicContact CB-CE1 4.36Å; V150-F167 HydrophobicContact CG1-CD1 4.44Å; V150-F167 HydrophobicContact CG1-CE1 3.68Å; V150-F167 HydrophobicContact CG1-CZ 4.25Å; V150-F167 HydrophobicContact CG2-CE1 3.84Å; V150-F167 HydrophobicContact CG2-CZ 4.01Å; L152-F167 HydrophobicContact CD1-CD1 4.42Å; E163-F167 PolarHBondContact O-N 3.07Å; F167-N169 VanDerWaalsContact C-N 3.31Å; F167-N169 PolarHBondContact O-N 2.86Å; F167-I170 WeakPolarHBondContact O-CB 3.31Å; F167-I170 PolarHBondContact O-N 3.36Å; F167-I170 VanDerWaalsContact O-N 3.15Å; F167-C171 WeakPolarHBondContact CE1-SG 3.38Å; F167-C171 PolarHBondContact O-N 2.93Å
168	L	94.1	Very high	91.6	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-37.7	176.5	-73	174.8	0	0	0	112.9	L152 T164 E166 Q172 I179 E209 I210	L152-L168 HydrophobicContact CD2-CD1 4.16Å; L152-L168 HydrophobicContact CD2-CD2 4.36Å; L152-L168 HydrophobicContact CD2-CG 4.38Å; T164-L168 WeakPolarHBondContact O-CB 3.11Å; T164-L168 VanDerWaalsContact O-CG 3.26Å; T164-L168 WeakPolarHBondContact O-CG 3.45Å; T164-L168 PolarHBondContact O-N 3.41Å; T164-L168 VanDerWaalsContact O-N 3.1Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 2.82Å; L168-Q172 WeakPolarHBondContact O-CG 3.24Å; L168-Q172 PolarHBondContact O-N 3.28Å; L168-I179 HydrophobicContact CD2-CD1 3.53Å; L168-E209 HydrophobicContact CD1-CB 4.19Å; L168-I210 HydrophobicContact CD1-CD1 4.32Å; L168-I210 HydrophobicContact CD1-CG1 4.3Å; L168-I210 HydrophobicContact CD2-CD1 3.86Å; L168-I210 HydrophobicContact CD2-CG1 3.78Å
169	N	93.7	Very high	91.8	Very high	14 Å²	14	29.8 Å²	29.8	8%	0.075	15%	0.147	C	C	.	.	H	α-helix	trans	-72.6	-31.7	175.8	-80.4	-81.7	0	0	0	112.8	F165 E166 F167 Q172 V173 H782 W784 F864 I866	F165-N169 PolarHBondContact O-N 2.7Å; F165-N169 PolarHBondContact O-ND2 3.23Å; E166-N169 PolarHBondContact O-N 2.86Å; E166-N169 VanDerWaalsContact O-N 3.09Å; F167-N169 VanDerWaalsContact C-N 3.31Å; F167-N169 PolarHBondContact O-N 2.86Å; N169-Q172 PolarHBondContact O-N 2.8Å; N169-V173 WeakPolarHBondContact O-CG2 3.28Å; N169-V173 PolarHBondContact O-N 2.91Å; N169-H782 PolarHBondContact OD1-NE2 3.4Å; N169-W784 WeakPolarHBondContact ND2-CZ3 3.38Å; N169-F864 HydrophobicContact CB-CZ 4.39Å; N169-I866 HydrophobicContact CB-CD1 4.12Å
170	I	94.3	Very high	92	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-48.1	172.3	-66.3	163.7	0	0	0	109.9	I137 M140 I141 A144 E166 F167 Q172 V173 H174 L847 I866	I137-I170 HydrophobicContact CG1-CD1 4.34Å; M140-I170 HydrophobicContact CB-CD1 4Å; I141-I170 HydrophobicContact CG1-CD1 3.84Å; I141-I170 HydrophobicContact CG1-CG1 4.27Å; I141-I170 HydrophobicContact CG1-CG2 4.18Å; A144-I170 HydrophobicContact CB-CB 4.41Å; A144-I170 HydrophobicContact CB-CG2 3.46Å; A144-I170 VanDerWaalsContact CB-CG2 3.46Å; E166-I170 WeakPolarHBondContact O-CG1 3.32Å; E166-I170 PolarHBondContact O-N 3.49Å; F167-I170 WeakPolarHBondContact O-CB 3.31Å; F167-I170 PolarHBondContact O-N 3.36Å; F167-I170 VanDerWaalsContact O-N 3.15Å; I170-Q172 VanDerWaalsContact C-N 3.34Å; I170-Q172 PolarHBondContact O-N 3.17Å; I170-V173 PolarHBondContact O-N 2.9Å; I170-V173 VanDerWaalsContact O-N 3.08Å; I170-H174 PolarHBondContact O-N 3.35Å; I170-L847 HydrophobicContact CG1-CD1 3.98Å; I170-L847 HydrophobicContact CG1-CD2 3.91Å; I170-I866 HydrophobicContact CD1-CD1 4.14Å; I170-I866 HydrophobicContact CG1-CD1 3.73Å
171	C	94	Very high	92.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59	-40.7	174.6	-75.5	0	0	0	0	113	F167 V173 G175 M176 P177	F167-C171 WeakPolarHBondContact CE1-SG 3.38Å; F167-C171 PolarHBondContact O-N 2.93Å; C171-V173 PolarHBondContact O-N 2.8Å; C171-G175 CarbonylContact O-C 3.11Å; C171-G175 WeakPolarHBondContact O-CA 3.5Å; C171-G175 PolarHBondContact O-N 2.71Å; C171-M176 HydrophobicContact CB-SD 4.22Å; C171-M176 PolarHBondContact O-N 3.24Å; C171-M176 VanDerWaalsContact O-N 3.16Å; C171-P177 HydrophobicContact CB-CG 4.48Å
172	Q	92.6	Very high	92.5	Very high	97 Å²	97	25.8 Å²	25.8	45%	0.453	13%	0.127	S	C	.	.	H	α-helix	trans	-61.3	-24.9	175.9	-75.3	176.4	16.6	0	0	113.5	L168 N169 I170 M176 E209	L168-Q172 WeakPolarHBondContact O-CG 3.24Å; L168-Q172 PolarHBondContact O-N 3.28Å; N169-Q172 PolarHBondContact O-N 2.8Å; I170-Q172 VanDerWaalsContact C-N 3.34Å; I170-Q172 PolarHBondContact O-N 3.17Å; Q172-M176 HydrophobicContact CG-CE 3.51Å; Q172-E209 PolarHBondContact NE2-O 2.63Å
173	V	92.9	Very high	92.9	Very high	29 Å²	29	21.9 Å²	21.9	18%	0.176	11%	0.108	C	C	.	.	H	α-helix	trans	-94	-44.4	-176.9	171.1	0	0	0	0	113	N169 I170 C171 F846 L847 T869	N169-V173 WeakPolarHBondContact O-CG2 3.28Å; N169-V173 PolarHBondContact O-N 2.91Å; I170-V173 PolarHBondContact O-N 2.9Å; I170-V173 VanDerWaalsContact O-N 3.08Å; C171-V173 PolarHBondContact O-N 2.8Å; V173-F846 WeakPolarHBondContact CG1-O 3.12Å; V173-L847 HydrophobicContact CG1-CB 4.4Å; V173-L847 HydrophobicContact CG2-CD1 4.4Å; V173-T869 HydrophobicContact CG2-CG2 3.56Å
174	H	91.2	Very high	93.1	Very high	28 Å²	28	20.7 Å²	20.7	13%	0.13	10%	0.102	C	C	.	.	H	α-helix	trans	-86.6	-12.8	-179.3	-69.3	-42.2	0	0	0	113.6	K145 I170 S798 G845	K145-H174 HydrophobicContact CG-CB 4.38Å; I170-H174 PolarHBondContact O-N 3.35Å; H174-S798 PolarHBondContact CE1-O 3.37Å; H174-S798 PolarHBondContact CE1-OG 2.98Å; H174-S798 PolarHBondContact NE2-OG 2.93Å; H174-G845 PolarHBondContact ND1-O 3.05Å
175	G	89.5	Confident	93.2	Very high	22 Å²	22	22.3 Å²	22.3	23%	0.227	11%	0.11	C	C	.	.			trans	127.3	118	176.4	0	0	0	0	0	111.1	C171 P177	C171-G175 CarbonylContact O-C 3.11Å; C171-G175 WeakPolarHBondContact O-CA 3.5Å; C171-G175 PolarHBondContact O-N 2.71Å; G175-P177 VanDerWaalsContact O-CD 3.28Å; G175-P177 WeakPolarHBondContact O-CD 3.46Å
176	M	90.4	Very high	93.1	Very high	85 Å²	85	21.7 Å²	21.7	42%	0.419	11%	0.107	S	C	.	.			trans	-67.1	115.7	-172.5	-178.9	65.8	82.2	0	0	111.7	C171 Q172 I179	C171-M176 HydrophobicContact CB-SD 4.22Å; C171-M176 PolarHBondContact O-N 3.24Å; C171-M176 VanDerWaalsContact O-N 3.16Å; Q172-M176 HydrophobicContact CG-CE 3.51Å; M176-I179 HydrophobicContact SD-CD1 3.55Å; M176-I179 VanDerWaalsContact SD-CD1 3.55Å; M176-I179 HydrophobicContact SD-CG1 4.19Å
177	P	92.6	Very high	93.1	Very high	13 Å²	13	25.1 Å²	25.1	8%	0.084	13%	0.126	C	C	.	.			trans	-79.2	-175.8	175.4	36.1	-35.6	0	0	0	111.1	A147 V150 C171 G175 I179	A147-P177 WeakPolarHBondContact O-CB 3.41Å; V150-P177 HydrophobicContact CG2-CB 4.46Å; V150-P177 HydrophobicContact CG2-CG 3.7Å; C171-P177 HydrophobicContact CB-CG 4.48Å; G175-P177 VanDerWaalsContact O-CD 3.28Å; G175-P177 WeakPolarHBondContact O-CD 3.46Å; P177-I179 HydrophobicContact CG-CG1 4.21Å
178	R	93.5	Very high	92.9	Very high	109 Å²	109	32.8 Å²	32.8	41%	0.411	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	134.9	165	-64.1	-55.2	-167.9	-163.9	-1.8	108.8	D148 L149 V150 K243 F244	D148-R178 PolarHBondContact O-N 2.99Å; L149-R178 CarbonylContact C-O 3.58Å; L149-R178 WeakPolarHBondContact CA-O 3.45Å; L149-R178 HydrophobicContact CD1-CB 3.7Å; V150-R178 PolarHBondContact N-O 2.74Å; R178-K243 PolarHBondContact NE-O 2.91Å; R178-K243 PolarHBondContact NH2-O 3.05Å; R178-F244 HydrophobicContact CB-CD1 4.27Å; R178-F244 HydrophobicContact CG-CD1 3.84Å; R178-F244 HydrophobicContact CG-CE1 4.42Å
179	I	94.1	Very high	92.7	Very high	7 Å²	7	33.7 Å²	33.7	4%	0.036	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.4	178.9	-51.3	-169.4	0	0	0	109.9	V150 L152 L168 M176 P177 F206 I210	V150-I179 HydrophobicContact CB-CG1 4.23Å; V150-I179 HydrophobicContact CB-CG2 4.43Å; V150-I179 WeakPolarHBondContact O-CA 3.05Å; L152-I179 HydrophobicContact CB-CG2 4.08Å; L168-I179 HydrophobicContact CD2-CD1 3.53Å; M176-I179 HydrophobicContact SD-CD1 3.55Å; M176-I179 VanDerWaalsContact SD-CD1 3.55Å; M176-I179 HydrophobicContact SD-CG1 4.19Å; P177-I179 HydrophobicContact CG-CG1 4.21Å; I179-F206 HydrophobicContact CG2-CZ 4.43Å; I179-I210 HydrophobicContact CB-CD1 4.46Å; I179-I210 HydrophobicContact CG2-CD1 3.95Å
180	M	94.5	Very high	92.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.8	170	-67.5	167.4	72.9	0	0	108.3	L149 V150 L151 L152 F217 L235 F238 I239 M242	L149-M180 HydrophobicContact CD1-CG 4.04Å; L149-M180 HydrophobicContact CD1-SD 3.85Å; L149-M180 HydrophobicContact CD2-SD 3.94Å; L149-M180 HydrophobicContact CG-SD 4.38Å; V150-M180 PolarHBondContact O-N 2.93Å; L151-M180 HydrophobicContact CD2-CB 3.86Å; L151-M180 HydrophobicContact CD2-CE 4.4Å; L151-M180 HydrophobicContact CD2-CG 4.37Å; L151-M180 HydrophobicContact CD2-SD 3.78Å; L152-M180 PolarHBondContact N-O 2.98Å; M180-F217 HydrophobicContact CE-CD2 4.05Å; M180-F217 HydrophobicContact CE-CE2 3.28Å; M180-F217 HydrophobicContact CE-CZ 3.68Å; M180-L235 HydrophobicContact CE-CD1 3.52Å; M180-F238 HydrophobicContact CE-CB 3.87Å; M180-I239 HydrophobicContact CE-CG1 3.97Å; M180-I239 HydrophobicContact SD-CG1 3.99Å; M180-M242 HydrophobicContact CE-CE 4.03Å; M180-M242 HydrophobicContact CG-CE 3.51Å; M180-M242 HydrophobicContact CG-SD 4.08Å; M180-M242 HydrophobicContact SD-CE 3.4Å; M180-M242 WeakPolarHBondContact SD-CE 3.47Å; M180-M242 HydrophobicContact SD-SD 3.71Å
181	G	94.6	Very high	92.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	143.6	172.6	0	0	0	0	0	110.6	L152 F206 K215 L216 F217	L152-G181 CarbonylContact O-C 3.54Å; L152-G181 WeakPolarHBondContact O-CA 3.42Å; G181-F206 VanDerWaalsContact CA-CZ 3.41Å; G181-K215 PolarHBondContact N-O 3.24Å; G181-L216 CarbonylContact O-C 3.51Å; G181-L216 WeakPolarHBondContact O-CA 3.37Å; G181-F217 PolarHBondContact O-N 2.89Å
182	V	95.5	Very high	92.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	113.8	173	-177.8	0	0	0	0	108.1	L98 L152 L153 I154 T184 F217 L219 L235	L98-V182 HydrophobicContact CD2-CG2 4.49Å; L152-V182 PolarHBondContact O-N 2.72Å; L153-V182 WeakPolarHBondContact CA-O 3.45Å; L153-V182 HydrophobicContact CG-CB 4.3Å; I154-V182 PolarHBondContact N-O 3.37Å; V182-T184 HydrophobicContact CG1-CG2 4.42Å; V182-F217 HydrophobicContact CG2-CB 4.49Å; V182-L219 HydrophobicContact CG1-CD1 3.44Å; V182-L219 VanDerWaalsContact CG1-CD1 3.44Å; V182-L219 HydrophobicContact CG1-CG 3.78Å; V182-L235 HydrophobicContact CG2-CD1 4.25Å; V182-L235 HydrophobicContact CG2-CD2 4.47Å
183	L	95	Very high	92.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	123.9	170.5	-62.4	-161.9	0	0	0	110.3	I154 A156 L186 K199 L202 L216 F217 Y218 L219	I154-L183 HydrophobicContact CB-CD2 3.74Å; I154-L183 HydrophobicContact CD1-CD2 4.08Å; I154-L183 HydrophobicContact CG2-CD2 4.04Å; I154-L183 WeakPolarHBondContact O-CA 3.36Å; A156-L183 HydrophobicContact CB-CB 4.46Å; A156-L183 HydrophobicContact CB-CD1 4.47Å; L183-L186 HydrophobicContact CB-CD1 4.42Å; L183-K199 HydrophobicContact CD1-CG 4.37Å; L183-L202 HydrophobicContact CD1-CB 4.25Å; L183-L202 HydrophobicContact CD1-CD1 3.85Å; L183-L202 HydrophobicContact CD2-CB 4.5Å; L183-L202 HydrophobicContact CD2-CD1 4.14Å; L183-L216 HydrophobicContact CD1-CD2 4.17Å; L183-L216 HydrophobicContact CD2-CD1 3.83Å; L183-L216 HydrophobicContact CD2-CD2 4.34Å; L183-L216 HydrophobicContact CD2-CG 4.46Å; L183-L216 HydrophobicContact CG-CD1 3.89Å; L183-L216 HydrophobicContact CG-CD2 4.06Å; L183-L216 HydrophobicContact CG-CG 4.07Å; L183-F217 PolarHBondContact N-O 2.75Å; L183-Y218 HydrophobicContact CB-CD1 4.06Å; L183-Y218 HydrophobicContact CD1-CD1 3.86Å; L183-Y218 HydrophobicContact CD1-CE1 3.78Å; L183-Y218 HydrophobicContact CG-CD1 4.1Å; L183-Y218 HydrophobicContact CG-CE1 4.24Å; L183-L219 PolarHBondContact O-N 2.89Å
184	T	93.6	Very high	92.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	177.6	171.9	56.7	0	0	0	0	110.8	L153 I154 A156 V182 L186 L219 Y227	L153-T184 HydrophobicContact CD2-CG2 4.33Å; I154-T184 PolarHBondContact O-N 2.99Å; I154-T184 PolarHBondContact O-OG1 3.35Å; A156-T184 WeakPolarHBondContact CB-O 3.48Å; A156-T184 PolarHBondContact N-O 2.84Å; V182-T184 HydrophobicContact CG1-CG2 4.42Å; T184-L186 PolarHBondContact O-N 2.73Å; T184-L219 HydrophobicContact CG2-CD1 4.28Å; T184-Y227 WeakPolarHBondContact CG2-OH 3.45Å
185	H	92.6	Very high	92.4	Very high	36 Å²	36	60 Å²	60	17%	0.167	29%	0.287	C	S	.	.			trans	56.5	44.5	170.7	-58.7	156.6	0	0	0	114.9	D155 D187 Y188	D155-H185 IonicContact OD2-CE1 3.48Å; D155-H185 IonicContact OD2-CG 3.35Å; D155-H185 IonicContact OD2-ND1 2.65Å; D155-H185 PolarHBondContact OD2-ND1 2.65Å; H185-D187 VanDerWaalsContact C-OD1 3.22Å; H185-D187 VanDerWaalsContact CA-OD1 3.28Å; H185-D187 WeakPolarHBondContact CA-OD1 3.25Å; H185-Y188 HydrophobicContact CB-CD2 3.69Å; H185-Y188 HydrophobicContact CB-CE2 4.02Å; H185-Y188 AromaticContact CD2-CE2 3.78Å; H185-Y188 AromaticContact CG-CE2 3.91Å
186	L	91.2	Very high	92.5	Very high	9 Å²	9	68.3 Å²	68.3	5%	0.047	31%	0.312	C	S	.	.			trans	-86.4	-26.7	178.5	-74	165.7	0	0	0	113.4	A156 L183 T184 I189 V195 K199 Y218	A156-L186 HydrophobicContact CB-CD2 3.4Å; A156-L186 VanDerWaalsContact CB-CD2 3.4Å; A156-L186 HydrophobicContact CB-CG 3.86Å; L183-L186 HydrophobicContact CB-CD1 4.42Å; T184-L186 PolarHBondContact O-N 2.73Å; L186-I189 PolarHBondContact O-N 2.74Å; L186-V195 HydrophobicContact CD2-CG1 4.37Å; L186-K199 HydrophobicContact CD2-CD 4.39Å; L186-K199 VanDerWaalsContact CD2-CE 3.41Å; L186-K199 HydrophobicContact CD2-CG 4.07Å; L186-Y218 HydrophobicContact CD1-CD1 4.27Å; L186-Y218 HydrophobicContact CD1-CG 4.44Å
187	D	90.5	Very high	92.7	Very high	76 Å²	76	70.6 Å²	70.6	41%	0.406	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-40.8	169.9	44.4	4	0	0	0	113.6	H185 I189 S220 G221	H185-D187 VanDerWaalsContact C-OD1 3.22Å; H185-D187 VanDerWaalsContact CA-OD1 3.28Å; H185-D187 WeakPolarHBondContact CA-OD1 3.25Å; D187-I189 PolarHBondContact O-N 3.24Å; D187-S220 PolarHBondContact N-O 3.09Å; D187-G221 WeakPolarHBondContact OD2-CA 3.3Å
188	Y	90.2	Very high	92.8	Very high	162 Å²	162	71.2 Å²	71.2	64%	0.635	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-21.7	175	-71.8	-90.4	0	0	0	113.7	H185 K190	H185-Y188 HydrophobicContact CB-CD2 3.69Å; H185-Y188 HydrophobicContact CB-CE2 4.02Å; H185-Y188 AromaticContact CD2-CE2 3.78Å; H185-Y188 AromaticContact CG-CE2 3.91Å; Y188-K190 PolarHBondContact O-N 3.07Å
189	I	89.3	Confident	92.8	Very high	20 Å²	20	68.1 Å²	68.1	10%	0.103	31%	0.314	C	S	.	.			trans	-94.7	75.9	-175.7	-47.4	177.7	0	0	0	110.6	A156 L186 D187 Q191 K194 V195 V198	A156-I189 HydrophobicContact CB-CD1 4.39Å; L186-I189 PolarHBondContact O-N 2.74Å; D187-I189 PolarHBondContact O-N 3.24Å; I189-Q191 PolarHBondContact O-N 2.66Å; I189-K194 HydrophobicContact CG2-CB 3.95Å; I189-K194 HydrophobicContact CG2-CD 3.98Å; I189-K194 HydrophobicContact CG2-CG 3.88Å; I189-V195 HydrophobicContact CB-CG2 3.75Å; I189-V195 HydrophobicContact CG2-CG2 3.72Å; I189-V195 WeakPolarHBondContact O-CG2 3.33Å; I189-V198 HydrophobicContact CD1-CB 4.4Å; I189-V198 HydrophobicContact CD1-CG1 4.14Å; I189-V198 HydrophobicContact CD1-CG2 4.45Å
190	K	88.9	Confident	92.9	Very high	207 Å²	207	74.2 Å²	74.2	90%	0.9	34%	0.34	S	S	*	.			trans	-46.6	-28	-178.1	-60.5	-172.5	178.3	-173.6	0	116.2	Y188	Y188-K190 PolarHBondContact O-N 3.07Å
191	Q	92.3	Very high	92.9	Very high	134 Å²	134	79.3 Å²	79.3	63%	0.626	37%	0.365	S	S	*	.			trans	-91.9	108.3	-179.7	-72	-177	-5.6	0	0	112.6	I189 K193 K194 V195	I189-Q191 PolarHBondContact O-N 2.66Å; Q191-K193 PolarHBondContact O-N 2.84Å; Q191-K193 VanDerWaalsContact O-N 3.12Å; Q191-K194 HydrophobicContact CB-CB 3.83Å; Q191-K194 WeakPolarHBondContact O-CA 3.32Å; Q191-K194 WeakPolarHBondContact O-CB 3.49Å; Q191-K194 PolarHBondContact O-N 3.44Å; Q191-V195 PolarHBondContact O-N 3.04Å
192	A	92.2	Very high	92.9	Very high	70 Å²	70	79.4 Å²	79.4	58%	0.579	37%	0.366	S	S	*	.	H	α-helix	trans	-56.1	-31.6	178.6	0	0	0	0	0	114.7	R196	A192-R196 WeakPolarHBondContact O-CG 3.33Å; A192-R196 PolarHBondContact O-N 3.37Å; A192-R196 VanDerWaalsContact O-N 3.17Å
193	K	94.4	Very high	92.8	Very high	176 Å²	176	83 Å²	83	77%	0.765	38%	0.382	S	S	*	.	H	α-helix	trans	-64.1	-44.5	172.1	-70.6	-178.2	-179.8	175.9	0	111.4	Q191 R196 Q197	Q191-K193 PolarHBondContact O-N 2.84Å; Q191-K193 VanDerWaalsContact O-N 3.12Å; K193-R196 PolarHBondContact O-N 2.78Å; K193-Q197 WeakPolarHBondContact O-CG 3.39Å; K193-Q197 PolarHBondContact O-N 2.92Å; K193-Q197 VanDerWaalsContact O-N 3.14Å
194	K	92.5	Very high	92.8	Very high	108 Å²	108	87.6 Å²	87.6	47%	0.47	40%	0.403	S	S	.	.	H	α-helix	trans	-65	-41.6	176.1	-169	177	177.7	-176.2	0	111.3	I189 Q191 R196 Q197 V198	I189-K194 HydrophobicContact CG2-CB 3.95Å; I189-K194 HydrophobicContact CG2-CD 3.98Å; I189-K194 HydrophobicContact CG2-CG 3.88Å; Q191-K194 HydrophobicContact CB-CB 3.83Å; Q191-K194 WeakPolarHBondContact O-CA 3.32Å; Q191-K194 WeakPolarHBondContact O-CB 3.49Å; Q191-K194 PolarHBondContact O-N 3.44Å; K194-R196 VanDerWaalsContact C-N 3.35Å; K194-R196 PolarHBondContact O-N 3.46Å; K194-Q197 PolarHBondContact O-N 2.76Å; K194-V198 HydrophobicContact CG-CG2 4.28Å; K194-V198 WeakPolarHBondContact O-CB 3.43Å; K194-V198 WeakPolarHBondContact O-CG2 3.46Å; K194-V198 PolarHBondContact O-N 3.42Å
195	V	92.2	Very high	92.8	Very high	25 Å²	25	92.6 Å²	92.6	15%	0.152	42%	0.422	C	S	.	.	H	α-helix	trans	-53.4	-49.7	172.5	175.7	0	0	0	0	111.3	L186 I189 Q191 Q197 V198 K199	L186-V195 HydrophobicContact CD2-CG1 4.37Å; I189-V195 HydrophobicContact CB-CG2 3.75Å; I189-V195 HydrophobicContact CG2-CG2 3.72Å; I189-V195 WeakPolarHBondContact O-CG2 3.33Å; Q191-V195 PolarHBondContact O-N 3.04Å; V195-Q197 VanDerWaalsContact C-N 3.35Å; V195-Q197 PolarHBondContact O-N 3.37Å; V195-V198 PolarHBondContact O-N 2.65Å; V195-K199 HydrophobicContact CG1-CD 4.03Å; V195-K199 HydrophobicContact CG1-CG 4.29Å; V195-K199 WeakPolarHBondContact O-CB 3.46Å; V195-K199 WeakPolarHBondContact O-CG 3.11Å; V195-K199 PolarHBondContact O-N 3.36Å
196	R	93.4	Very high	92.9	Very high	198 Å²	198	90.9 Å²	90.9	75%	0.747	41%	0.414	S	S	*	.	H	α-helix	trans	-63.2	-39.3	-180	-68.6	176.4	-173.4	-169.7	2.7	112.1	A192 K193 K194 K200	A192-R196 WeakPolarHBondContact O-CG 3.33Å; A192-R196 PolarHBondContact O-N 3.37Å; A192-R196 VanDerWaalsContact O-N 3.17Å; K193-R196 PolarHBondContact O-N 2.78Å; K194-R196 VanDerWaalsContact C-N 3.35Å; K194-R196 PolarHBondContact O-N 3.46Å; R196-K200 WeakPolarHBondContact O-CB 3.5Å; R196-K200 PolarHBondContact O-N 3.35Å; R196-K200 VanDerWaalsContact O-N 3.11Å
197	Q	94.4	Very high	93.1	Very high	133 Å²	133	93.8 Å²	93.8	62%	0.621	42%	0.424	S	S	*	.	H	α-helix	trans	-66.4	-47.8	175.7	-71.1	171	-19.8	0	0	112.1	K193 K194 V195 K200 M201	K193-Q197 WeakPolarHBondContact O-CG 3.39Å; K193-Q197 PolarHBondContact O-N 2.92Å; K193-Q197 VanDerWaalsContact O-N 3.14Å; K194-Q197 PolarHBondContact O-N 2.76Å; V195-Q197 VanDerWaalsContact C-N 3.35Å; V195-Q197 PolarHBondContact O-N 3.37Å; Q197-K200 PolarHBondContact O-N 2.83Å; Q197-M201 WeakPolarHBondContact O-CB 3.27Å; Q197-M201 PolarHBondContact O-N 3.46Å
198	V	93.8	Very high	93.2	Very high	25 Å²	25	95 Å²	95	15%	0.152	44%	0.435	C	S	.	.	H	α-helix	trans	-63.1	-47.7	178.6	170.2	0	0	0	0	111	A156 I189 K194 V195 K200 M201 L202	A156-V198 WeakPolarHBondContact O-CG1 3.45Å; I189-V198 HydrophobicContact CD1-CB 4.4Å; I189-V198 HydrophobicContact CD1-CG1 4.14Å; I189-V198 HydrophobicContact CD1-CG2 4.45Å; K194-V198 HydrophobicContact CG-CG2 4.28Å; K194-V198 WeakPolarHBondContact O-CB 3.43Å; K194-V198 WeakPolarHBondContact O-CG2 3.46Å; K194-V198 PolarHBondContact O-N 3.42Å; V195-V198 PolarHBondContact O-N 2.65Å; V198-K200 VanDerWaalsContact C-N 3.28Å; V198-K200 PolarHBondContact O-N 2.92Å; V198-M201 PolarHBondContact O-N 3.27Å; V198-M201 VanDerWaalsContact O-N 3.16Å; V198-L202 HydrophobicContact CG1-CD1 3.64Å; V198-L202 HydrophobicContact CG1-CG 4.14Å; V198-L202 WeakPolarHBondContact O-CB 3.48Å; V198-L202 WeakPolarHBondContact O-CG 3.47Å; V198-L202 PolarHBondContact O-N 2.84Å
199	K	94.7	Very high	93.2	Very high	45 Å²	45	88.7 Å²	88.7	20%	0.196	41%	0.411	C	S	.	.	H	α-helix	trans	-55.4	-41.9	173.7	-74	-173.2	179.1	-168	0	111.6	L183 L186 V195 K203 Y218	L183-K199 HydrophobicContact CD1-CG 4.37Å; L186-K199 HydrophobicContact CD2-CD 4.39Å; L186-K199 VanDerWaalsContact CD2-CE 3.41Å; L186-K199 HydrophobicContact CD2-CG 4.07Å; V195-K199 HydrophobicContact CG1-CD 4.03Å; V195-K199 HydrophobicContact CG1-CG 4.29Å; V195-K199 WeakPolarHBondContact O-CB 3.46Å; V195-K199 WeakPolarHBondContact O-CG 3.11Å; V195-K199 PolarHBondContact O-N 3.36Å; K199-K203 WeakPolarHBondContact O-CB 3.34Å; K199-K203 PolarHBondContact O-N 3.15Å; K199-K203 VanDerWaalsContact O-N 3.09Å; K199-Y218 HydrophobicContact CB-CE1 3.98Å; K199-Y218 HydrophobicContact CD-CD1 3.6Å; K199-Y218 HydrophobicContact CD-CE1 3.66Å; K199-Y218 HydrophobicContact CD-CG 4.09Å; K199-Y218 HydrophobicContact CG-CD1 3.89Å; K199-Y218 HydrophobicContact CG-CE1 3.69Å
200	K	94.3	Very high	93.3	Very high	134 Å²	134	89 Å²	89	58%	0.583	41%	0.413	S	S	*	.	H	α-helix	trans	-66.5	-45.3	176.1	-178.1	173.9	178.7	-176.5	0	112.3	R196 Q197 V198 H204	R196-K200 WeakPolarHBondContact O-CB 3.5Å; R196-K200 PolarHBondContact O-N 3.35Å; R196-K200 VanDerWaalsContact O-N 3.11Å; Q197-K200 PolarHBondContact O-N 2.83Å; V198-K200 VanDerWaalsContact C-N 3.28Å; V198-K200 PolarHBondContact O-N 2.92Å; K200-H204 VanDerWaalsContact CE-NE2 3.28Å; K200-H204 WeakPolarHBondContact CE-NE2 3.4Å; K200-H204 PolarHBondContact O-CD2 3.41Å; K200-H204 PolarHBondContact O-N 2.86Å
201	M	94.5	Very high	93.4	Very high	107 Å²	107	84.7 Å²	84.7	53%	0.527	39%	0.391	S	S	.	.	H	α-helix	trans	-62.8	-53	-179.8	-178.2	-79.9	-71.1	0	0	111.6	Q197 V198 K203 H204 R205	Q197-M201 WeakPolarHBondContact O-CB 3.27Å; Q197-M201 PolarHBondContact O-N 3.46Å; V198-M201 PolarHBondContact O-N 3.27Å; V198-M201 VanDerWaalsContact O-N 3.16Å; M201-K203 VanDerWaalsContact C-N 3.32Å; M201-K203 PolarHBondContact O-N 3.47Å; M201-H204 PolarHBondContact O-N 3.08Å; M201-R205 PolarHBondContact O-N 2.61Å
202	L	94.4	Very high	93.5	Very high	2 Å²	2	86.9 Å²	86.9	1%	0.01	40%	0.402	C	S	.	.	H	α-helix	trans	-61.8	-40	179.1	-65.9	175.1	0	0	0	111.4	A156 F160 L183 V198 R205 F206	A156-L202 HydrophobicContact CB-CD1 4.33Å; F160-L202 HydrophobicContact CD2-CD2 3.6Å; F160-L202 HydrophobicContact CE2-CB 4.23Å; F160-L202 HydrophobicContact CE2-CD2 3.66Å; L183-L202 HydrophobicContact CD1-CB 4.25Å; L183-L202 HydrophobicContact CD1-CD1 3.85Å; L183-L202 HydrophobicContact CD2-CB 4.5Å; L183-L202 HydrophobicContact CD2-CD1 4.14Å; V198-L202 HydrophobicContact CG1-CD1 3.64Å; V198-L202 HydrophobicContact CG1-CG 4.14Å; V198-L202 WeakPolarHBondContact O-CB 3.48Å; V198-L202 WeakPolarHBondContact O-CG 3.47Å; V198-L202 PolarHBondContact O-N 2.84Å; L202-R205 PolarHBondContact O-N 3.43Å; L202-F206 WeakPolarHBondContact O-CB 3.18Å; L202-F206 PolarHBondContact O-N 3.22Å
203	K	94.9	Very high	93.4	Very high	76 Å²	76	85.3 Å²	85.3	33%	0.33	39%	0.392	S	S	.	.	H	α-helix	trans	-61.6	-44	174.6	-178.7	176.7	173.2	-178.1	0	113.1	K199 M201 R205 F206 W207 L216	K199-K203 WeakPolarHBondContact O-CB 3.34Å; K199-K203 PolarHBondContact O-N 3.15Å; K199-K203 VanDerWaalsContact O-N 3.09Å; M201-K203 VanDerWaalsContact C-N 3.32Å; M201-K203 PolarHBondContact O-N 3.47Å; K203-R205 VanDerWaalsContact C-N 3.34Å; K203-F206 PolarHBondContact O-N 2.94Å; K203-W207 HydrophobicContact CD-CZ2 4.31Å; K203-W207 VanDerWaalsContact CE-CH2 3.47Å; K203-W207 HydrophobicContact CG-CD2 4.33Å; K203-W207 HydrophobicContact CG-CZ2 4.24Å; K203-W207 WeakPolarHBondContact O-CB 3.38Å; K203-W207 VanDerWaalsContact O-CG 3.28Å; K203-W207 PolarHBondContact O-N 3Å; K203-L216 HydrophobicContact CB-CD2 3.79Å; K203-L216 HydrophobicContact CG-CD2 4.28Å
204	H	95.3	Very high	93.3	Very high	96 Å²	96	77.1 Å²	77.1	44%	0.444	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-39	175	-78.4	-65	0	0	0	111.7	K200 M201 W207 T208	K200-H204 VanDerWaalsContact CE-NE2 3.28Å; K200-H204 WeakPolarHBondContact CE-NE2 3.4Å; K200-H204 PolarHBondContact O-CD2 3.41Å; K200-H204 PolarHBondContact O-N 2.86Å; M201-H204 PolarHBondContact O-N 3.08Å; H204-W207 PolarHBondContact O-N 3.27Å; H204-T208 PolarHBondContact O-N 3.19Å
205	R	93	Very high	93.3	Very high	106 Å²	106	77 Å²	77	40%	0.4	36%	0.357	S	S	.	.	H	α-helix	trans	-67.2	-44.6	176.3	-169.6	68.1	-168.6	-121	-0.3	112.2	F160 M201 L202 K203 W207 T208 E209	F160-R205 HydrophobicContact CD2-CB 4.41Å; F160-R205 HydrophobicContact CD2-CG 4.18Å; F160-R205 HydrophobicContact CE2-CB 3.82Å; F160-R205 HydrophobicContact CE2-CG 3.96Å; F160-R205 HydrophobicContact CZ-CB 4.39Å; F160-R205 HydrophobicContact CZ-CG 4.45Å; M201-R205 PolarHBondContact O-N 2.61Å; L202-R205 PolarHBondContact O-N 3.43Å; K203-R205 VanDerWaalsContact C-N 3.34Å; R205-W207 PolarHBondContact O-N 3.35Å; R205-T208 WeakPolarHBondContact CA-OG1 3.4Å; R205-T208 PolarHBondContact O-N 3.01Å; R205-T208 PolarHBondContact O-OG1 2.82Å; R205-E209 IonicContact CZ-OE1 3.7Å; R205-E209 IonicContact NE-OE1 2.6Å; R205-E209 PolarHBondContact NE-OE1 2.94Å; R205-E209 IonicContact NH2-OE1 2.67Å; R205-E209 PolarHBondContact NH2-OE1 3.12Å; R205-E209 PolarHBondContact O-N 3.37Å
206	F	94.4	Very high	93.4	Very high	0 Å²	0	76.9 Å²	76.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-53.3	-42.1	173.8	-168.2	-105.6	0	0	0	111.8	L152 I154 F160 I179 G181 L202 K203 T208 E209 I210 A214 K215 L216	L152-F206 HydrophobicContact CD2-CE2 4.03Å; I154-F206 HydrophobicContact CD1-CD2 3.91Å; I154-F206 HydrophobicContact CD1-CE2 4.25Å; F160-F206 HydrophobicContact CE1-CD2 4.37Å; F160-F206 HydrophobicContact CZ-CB 4.04Å; F160-F206 HydrophobicContact CZ-CD2 4.21Å; I179-F206 HydrophobicContact CG2-CZ 4.43Å; G181-F206 VanDerWaalsContact CA-CZ 3.41Å; L202-F206 WeakPolarHBondContact O-CB 3.18Å; L202-F206 PolarHBondContact O-N 3.22Å; K203-F206 PolarHBondContact O-N 2.94Å; F206-T208 VanDerWaalsContact C-N 3.34Å; F206-T208 PolarHBondContact O-N 3.06Å; F206-E209 PolarHBondContact O-N 2.86Å; F206-I210 HydrophobicContact CD1-CD1 4.42Å; F206-I210 HydrophobicContact CD2-CD1 3.74Å; F206-I210 HydrophobicContact CE1-CD1 4.02Å; F206-I210 HydrophobicContact CE2-CD1 3.26Å; F206-I210 HydrophobicContact CG-CD1 4.28Å; F206-I210 HydrophobicContact CZ-CD1 3.39Å; F206-I210 PolarHBondContact O-N 3.16Å; F206-A214 HydrophobicContact CD1-CB 3.96Å; F206-A214 HydrophobicContact CE1-CB 3.62Å; F206-K215 WeakPolarHBondContact CE1-O 3.37Å; F206-L216 HydrophobicContact CD1-CB 4.41Å; F206-L216 HydrophobicContact CG-CD1 4.46Å
207	W	95.2	Very high	93.5	Very high	70 Å²	70	68.8 Å²	68.8	27%	0.265	33%	0.325	S	S	.	.	H	α-helix	trans	-68.4	-24.8	175.4	-72.6	-5.7	0	0	0	115	K203 H204 R205 Y211 Q212 A214	K203-W207 HydrophobicContact CD-CZ2 4.31Å; K203-W207 VanDerWaalsContact CE-CH2 3.47Å; K203-W207 HydrophobicContact CG-CD2 4.33Å; K203-W207 HydrophobicContact CG-CZ2 4.24Å; K203-W207 WeakPolarHBondContact O-CB 3.38Å; K203-W207 VanDerWaalsContact O-CG 3.28Å; K203-W207 PolarHBondContact O-N 3Å; H204-W207 PolarHBondContact O-N 3.27Å; R205-W207 PolarHBondContact O-N 3.35Å; W207-Y211 WeakPolarHBondContact CA-O 3.14Å; W207-Y211 CarbonylContact O-C 3.55Å; W207-Y211 VanDerWaalsContact O-C 3.25Å; W207-Q212 PolarHBondContact O-N 3.34Å; W207-A214 PolarHBondContact NE1-O 3.2Å
208	T	93.3	Very high	93.5	Very high	101 Å²	101	65.7 Å²	65.7	62%	0.62	31%	0.309	S	S	*	.	H	α-helix	trans	-83.2	-22.7	175.9	51.3	0	0	0	0	114.3	H204 R205 F206	H204-T208 PolarHBondContact O-N 3.19Å; R205-T208 WeakPolarHBondContact CA-OG1 3.4Å; R205-T208 PolarHBondContact O-N 3.01Å; R205-T208 PolarHBondContact O-OG1 2.82Å; F206-T208 VanDerWaalsContact C-N 3.34Å; F206-T208 PolarHBondContact O-N 3.06Å
209	E	90	Very high	93.5	Very high	29 Å²	29	64.6 Å²	64.6	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-94.4	-25.8	-178.6	-56.6	-63.5	169.8	0	0	113.6	F165 L168 Q172 R205 F206	F165-E209 HydrophobicContact CD1-CG 4.49Å; F165-E209 HydrophobicContact CE1-CG 3.95Å; F165-E209 WeakPolarHBondContact CE1-OE1 3.26Å; L168-E209 HydrophobicContact CD1-CB 4.19Å; Q172-E209 PolarHBondContact NE2-O 2.63Å; R205-E209 IonicContact CZ-OE1 3.7Å; R205-E209 IonicContact NE-OE1 2.6Å; R205-E209 PolarHBondContact NE-OE1 2.94Å; R205-E209 IonicContact NH2-OE1 2.67Å; R205-E209 PolarHBondContact NH2-OE1 3.12Å; R205-E209 PolarHBondContact O-N 3.37Å; F206-E209 PolarHBondContact O-N 2.86Å
210	I	91.1	Very high	93.1	Very high	28 Å²	28	65 Å²	65	14%	0.144	31%	0.31	C	S	.	.	S	Bend	trans	-114.1	-79.4	-173.7	-64.5	160.5	0	0	0	110.2	L168 I179 F206 A214	L168-I210 HydrophobicContact CD1-CD1 4.32Å; L168-I210 HydrophobicContact CD1-CG1 4.3Å; L168-I210 HydrophobicContact CD2-CD1 3.86Å; L168-I210 HydrophobicContact CD2-CG1 3.78Å; I179-I210 HydrophobicContact CB-CD1 4.46Å; I179-I210 HydrophobicContact CG2-CD1 3.95Å; F206-I210 HydrophobicContact CD1-CD1 4.42Å; F206-I210 HydrophobicContact CD2-CD1 3.74Å; F206-I210 HydrophobicContact CE1-CD1 4.02Å; F206-I210 HydrophobicContact CE2-CD1 3.26Å; F206-I210 HydrophobicContact CG-CD1 4.28Å; F206-I210 HydrophobicContact CZ-CD1 3.39Å; F206-I210 PolarHBondContact O-N 3.16Å; I210-A214 HydrophobicContact CG2-CB 4.2Å
211	Y	91.3	Very high	92.6	Very high	116 Å²	116	59.5 Å²	59.5	46%	0.455	29%	0.291	S	S	.	.			trans	-163.3	157.4	167.2	61.4	-92.9	0	0	0	111	W207 G213 A214	W207-Y211 WeakPolarHBondContact CA-O 3.14Å; W207-Y211 CarbonylContact O-C 3.55Å; W207-Y211 VanDerWaalsContact O-C 3.25Å; Y211-G213 PolarHBondContact O-N 3.05Å; Y211-A214 HydrophobicContact CD1-CB 4.27Å; Y211-A214 HydrophobicContact CD2-CB 4.12Å; Y211-A214 HydrophobicContact CE1-CB 4Å; Y211-A214 HydrophobicContact CE2-CB 3.88Å; Y211-A214 HydrophobicContact CG-CB 4.29Å; Y211-A214 WeakPolarHBondContact O-CB 3.31Å; Y211-A214 PolarHBondContact O-N 3.17Å
212	Q	93.2	Very high	92.3	Very high	180 Å²	180	58.3 Å²	58.3	84%	0.841	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	124.7	178.4	-62.4	-170.9	16.9	0	0	111.1	W207	W207-Q212 PolarHBondContact O-N 3.34Å
213	G	91.4	Very high	91.9	Very high	37 Å²	37	62.2 Å²	62.2	38%	0.381	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	6.5	-177.3	0	0	0	0	0	115.1	Y211	Y211-G213 PolarHBondContact O-N 3.05Å
214	A	91.8	Very high	91.4	Very high	4 Å²	4	64.7 Å²	64.7	3%	0.033	33%	0.328	C	S	.	.			trans	-53.3	146.8	170.6	0	0	0	0	0	112	F206 W207 I210 Y211	F206-A214 HydrophobicContact CD1-CB 3.96Å; F206-A214 HydrophobicContact CE1-CB 3.62Å; W207-A214 PolarHBondContact NE1-O 3.2Å; I210-A214 HydrophobicContact CG2-CB 4.2Å; Y211-A214 HydrophobicContact CD1-CB 4.27Å; Y211-A214 HydrophobicContact CD2-CB 4.12Å; Y211-A214 HydrophobicContact CE1-CB 4Å; Y211-A214 HydrophobicContact CE2-CB 3.88Å; Y211-A214 HydrophobicContact CG-CB 4.29Å; Y211-A214 WeakPolarHBondContact O-CB 3.31Å; Y211-A214 PolarHBondContact O-N 3.17Å
215	K	93.2	Very high	90.9	Very high	106 Å²	106	66.5 Å²	66.5	46%	0.461	34%	0.34	S	S	.	.			trans	-82.5	130	-172.5	-60	-61.3	-174.6	179.3	0	110.8	G181 F206 F217	G181-K215 PolarHBondContact N-O 3.24Å; F206-K215 WeakPolarHBondContact CE1-O 3.37Å; K215-F217 HydrophobicContact CB-CE2 4.07Å
216	L	94.3	Very high	90.6	Very high	22 Å²	22	66.1 Å²	66.1	12%	0.115	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	121	179	-174.9	65.1	0	0	0	108.5	G181 L183 K203 F206 Y218	G181-L216 CarbonylContact O-C 3.51Å; G181-L216 WeakPolarHBondContact O-CA 3.37Å; L183-L216 HydrophobicContact CD1-CD2 4.17Å; L183-L216 HydrophobicContact CD2-CD1 3.83Å; L183-L216 HydrophobicContact CD2-CD2 4.34Å; L183-L216 HydrophobicContact CD2-CG 4.46Å; L183-L216 HydrophobicContact CG-CD1 3.89Å; L183-L216 HydrophobicContact CG-CD2 4.06Å; L183-L216 HydrophobicContact CG-CG 4.07Å; K203-L216 HydrophobicContact CB-CD2 3.79Å; K203-L216 HydrophobicContact CG-CD2 4.28Å; F206-L216 HydrophobicContact CD1-CB 4.41Å; F206-L216 HydrophobicContact CG-CD1 4.46Å; L216-Y218 HydrophobicContact CD2-CE1 4.19Å; L216-Y218 HydrophobicContact CG-CE1 4.3Å
217	F	95.2	Very high	90.6	Very high	27 Å²	27	66.9 Å²	66.9	12%	0.118	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	163	176.5	-66.5	-94.4	0	0	0	110.3	M180 G181 V182 L183 K215 L235 F238	M180-F217 HydrophobicContact CE-CD2 4.05Å; M180-F217 HydrophobicContact CE-CE2 3.28Å; M180-F217 HydrophobicContact CE-CZ 3.68Å; G181-F217 PolarHBondContact O-N 2.89Å; V182-F217 HydrophobicContact CG2-CB 4.49Å; L183-F217 PolarHBondContact N-O 2.75Å; K215-F217 HydrophobicContact CB-CE2 4.07Å; F217-L235 HydrophobicContact CB-CD1 4.35Å; F217-L235 HydrophobicContact CD1-CB 4.36Å; F217-L235 HydrophobicContact CD1-CD1 3.98Å; F217-L235 HydrophobicContact CD2-CD1 3.69Å; F217-L235 HydrophobicContact CE1-CD1 4.25Å; F217-L235 HydrophobicContact CE2-CD1 4.01Å; F217-L235 HydrophobicContact CG-CD1 3.71Å; F217-L235 HydrophobicContact CZ-CD1 4.27Å; F217-F238 HydrophobicContact CE1-CB 4.48Å; F217-F238 AromaticContact CE1-CD2 3.51Å; F217-F238 HydrophobicContact CE1-CD2 3.51Å; F217-F238 HydrophobicContact CE1-CE2 4.05Å; F217-F238 HydrophobicContact CE1-CG 4.25Å; F217-F238 HydrophobicContact CZ-CB 3.81Å; F217-F238 AromaticContact CZ-CD2 3.41Å; F217-F238 HydrophobicContact CZ-CD2 3.41Å; F217-F238 VanDerWaalsContact CZ-CD2 3.41Å; F217-F238 HydrophobicContact CZ-CE2 4.09Å; F217-F238 AromaticContact CZ-CG 3.7Å; F217-F238 HydrophobicContact CZ-CG 3.7Å
218	Y	95	Very high	90.5	Very high	69 Å²	69	67.4 Å²	67.4	27%	0.271	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	128.4	177.3	-50.4	-70.9	0	0	0	107	L183 L186 K199 L216	L183-Y218 HydrophobicContact CB-CD1 4.06Å; L183-Y218 HydrophobicContact CD1-CD1 3.86Å; L183-Y218 HydrophobicContact CD1-CE1 3.78Å; L183-Y218 HydrophobicContact CG-CD1 4.1Å; L183-Y218 HydrophobicContact CG-CE1 4.24Å; L186-Y218 HydrophobicContact CD1-CD1 4.27Å; L186-Y218 HydrophobicContact CD1-CG 4.44Å; K199-Y218 HydrophobicContact CB-CE1 3.98Å; K199-Y218 HydrophobicContact CD-CD1 3.6Å; K199-Y218 HydrophobicContact CD-CE1 3.66Å; K199-Y218 HydrophobicContact CD-CG 4.09Å; K199-Y218 HydrophobicContact CG-CD1 3.89Å; K199-Y218 HydrophobicContact CG-CE1 3.69Å; L216-Y218 HydrophobicContact CD2-CE1 4.19Å; L216-Y218 HydrophobicContact CG-CE1 4.3Å
219	L	93.2	Very high	90.4	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.01	34%	0.343	C	S	.	.			trans	-110.1	112.4	170	-60.6	178.4	0	0	0	106.7	L98 V182 L183 T184 Y227 E231	L98-L219 HydrophobicContact CD1-CD1 3.76Å; V182-L219 HydrophobicContact CG1-CD1 3.44Å; V182-L219 VanDerWaalsContact CG1-CD1 3.44Å; V182-L219 HydrophobicContact CG1-CG 3.78Å; L183-L219 PolarHBondContact O-N 2.89Å; T184-L219 HydrophobicContact CG2-CD1 4.28Å; L219-Y227 HydrophobicContact CB-CD1 3.81Å; L219-Y227 HydrophobicContact CB-CE1 3.94Å; L219-Y227 HydrophobicContact CB-CG 4.42Å; L219-Y227 HydrophobicContact CD1-CD1 3.91Å; L219-Y227 HydrophobicContact CD1-CD2 3.78Å; L219-Y227 HydrophobicContact CD1-CE1 3.89Å; L219-Y227 HydrophobicContact CD1-CE2 3.75Å; L219-Y227 HydrophobicContact CD1-CG 3.86Å; L219-Y227 HydrophobicContact CG-CD1 4.34Å; L219-Y227 HydrophobicContact CG-CG 4.5Å; L219-E231 WeakPolarHBondContact CA-OE2 3.36Å; L219-E231 HydrophobicContact CD2-CB 3.83Å
220	S	85.7	Confident	90.6	Very high	53 Å²	53	68.6 Å²	68.6	37%	0.371	36%	0.364	S	S	.	.			trans	-77.1	-28.6	-161	-66.5	0	0	0	0	113.7	D187 E231	D187-S220 PolarHBondContact N-O 3.09Å; S220-E231 WeakPolarHBondContact CB-OE1 3.42Å; S220-E231 PolarHBondContact N-OE1 2.75Å; S220-E231 PolarHBondContact N-OE2 3.05Å; S220-E231 PolarHBondContact OG-OE1 3.36Å
221	G	84.7	Confident	90.7	Very high	18 Å²	18	69.1 Å²	69.1	19%	0.186	37%	0.366	C	S	.	.			trans	173.5	-171.1	178	0	0	0	0	0	111.2	D187	D187-G221 WeakPolarHBondContact OD2-CA 3.3Å
222	L	88.2	Confident	90.9	Very high	82 Å²	82	63.8 Å²	63.8	43%	0.429	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	146.4	177.1	-63	173	0	0	0	111.9	L97 R226 Y227	L97-L222 HydrophobicContact CD1-CD1 4.25Å; L97-L222 HydrophobicContact CD1-CD2 3.94Å; L97-L222 HydrophobicContact CD2-CD2 3.64Å; L97-L222 HydrophobicContact CG-CD2 4.5Å; L222-R226 CarbonylContact C-O 3.55Å; L222-R226 WeakPolarHBondContact CA-O 3.28Å; L222-Y227 HydrophobicContact CD2-CD1 3.72Å; L222-Y227 HydrophobicContact CD2-CE1 3.8Å; L222-Y227 HydrophobicContact CD2-CG 4.3Å
223	V	86.5	Confident	90.9	Very high	84 Å²	84	61.2 Å²	61.2	51%	0.509	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	129.1	170.1	-176.6	0	0	0	0	106.8	D225 R226	V223-D225 VanDerWaalsContact C-N 3.25Å; V223-D225 PolarHBondContact O-N 2.9Å; V223-R226 PolarHBondContact N-O 3.48Å; V223-R226 CarbonylContact O-C 3.6Å; V223-R226 WeakPolarHBondContact O-CA 3.41Å; V223-R226 PolarHBondContact O-N 2.76Å
224	D	83.7	Confident	91.1	Very high	129 Å²	129	62.8 Å²	62.8	69%	0.69	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	47	-175.1	-47.2	-29.8	0	0	0	113	R226	D224-R226 PolarHBondContact O-N 3.14Å; D224-R226 VanDerWaalsContact O-N 3.14Å; D224-R226 PolarHBondContact O-NE 3.48Å; D224-R226 PolarHBondContact O-NH2 2.76Å
225	D	83.9	Confident	91.3	Very high	133 Å²	133	62.6 Å²	62.6	71%	0.711	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	24.3	-173.2	-62.8	-42.3	0	0	0	115.4	L97 V223	L97-D225 WeakPolarHBondContact CD1-O 3.04Å; V223-D225 VanDerWaalsContact C-N 3.25Å; V223-D225 PolarHBondContact O-N 2.9Å
226	R	88.2	Confident	91.3	Very high	99 Å²	99	57.6 Å²	57.6	37%	0.374	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.1	-176.2	-77.4	168.2	-93	-135.5	-0.6	112	L222 V223 D224	L222-R226 CarbonylContact C-O 3.55Å; L222-R226 WeakPolarHBondContact CA-O 3.28Å; V223-R226 PolarHBondContact N-O 3.48Å; V223-R226 CarbonylContact O-C 3.6Å; V223-R226 WeakPolarHBondContact O-CA 3.41Å; V223-R226 PolarHBondContact O-N 2.76Å; D224-R226 PolarHBondContact O-N 3.14Å; D224-R226 VanDerWaalsContact O-N 3.14Å; D224-R226 PolarHBondContact O-NE 3.48Å; D224-R226 PolarHBondContact O-NH2 2.76Å
227	Y	93.5	Very high	91.2	Very high	16 Å²	16	63 Å²	63	6%	0.063	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	146.6	172	-67	-58.3	0	0	0	111.2	L97 L98 C101 T184 L219 L222 G229	L97-Y227 HydrophobicContact CD2-CD1 4.42Å; L97-Y227 HydrophobicContact CD2-CD2 3.44Å; L97-Y227 VanDerWaalsContact CD2-CD2 3.44Å; L97-Y227 HydrophobicContact CD2-CE1 4.38Å; L97-Y227 HydrophobicContact CD2-CE2 3.4Å; L97-Y227 HydrophobicContact CD2-CG 3.98Å; L98-Y227 HydrophobicContact CB-CD2 4.49Å; L98-Y227 HydrophobicContact CB-CE2 3.97Å; L98-Y227 HydrophobicContact CD1-CD2 3.96Å; L98-Y227 HydrophobicContact CD1-CE2 4.06Å; C101-Y227 HydrophobicContact CB-CD2 4.41Å; C101-Y227 PolarHBondContact SG-N 2.98Å; C101-Y227 VanDerWaalsContact SG-N 3.36Å; T184-Y227 WeakPolarHBondContact CG2-OH 3.45Å; L219-Y227 HydrophobicContact CB-CD1 3.81Å; L219-Y227 HydrophobicContact CB-CE1 3.94Å; L219-Y227 HydrophobicContact CB-CG 4.42Å; L219-Y227 HydrophobicContact CD1-CD1 3.91Å; L219-Y227 HydrophobicContact CD1-CD2 3.78Å; L219-Y227 HydrophobicContact CD1-CE1 3.89Å; L219-Y227 HydrophobicContact CD1-CE2 3.75Å; L219-Y227 HydrophobicContact CD1-CG 3.86Å; L219-Y227 HydrophobicContact CG-CD1 4.34Å; L219-Y227 HydrophobicContact CG-CG 4.5Å; L222-Y227 HydrophobicContact CD2-CD1 3.72Å; L222-Y227 HydrophobicContact CD2-CE1 3.8Å; L222-Y227 HydrophobicContact CD2-CG 4.3Å; Y227-G229 PolarHBondContact O-N 3.01Å; Y227-G229 VanDerWaalsContact O-N 3.16Å
228	L	93.2	Very high	91.1	Very high	81 Å²	81	65.2 Å²	65.2	42%	0.424	34%	0.336	S	S	.	.			trans	-55.7	120	-177.7	-176.2	63.7	0	0	0	111.5	N230 E231 V232	L228-N230 PolarHBondContact O-N 2.88Å; L228-E231 HydrophobicContact CB-CG 4.34Å; L228-E231 HydrophobicContact CD2-CG 4.33Å; L228-E231 PolarHBondContact O-N 3.13Å; L228-V232 PolarHBondContact O-N 2.91Å
229	G	91.2	Very high	91.1	Very high	46 Å²	46	62 Å²	62	47%	0.474	32%	0.324	S	S	.	.	H	α-helix	trans	-55.2	-29.5	-170.8	0	0	0	0	0	114.9	Y227 K233	Y227-G229 PolarHBondContact O-N 3.01Å; Y227-G229 VanDerWaalsContact O-N 3.16Å; G229-K233 WeakPolarHBondContact O-CB 3.21Å; G229-K233 PolarHBondContact O-N 2.77Å
230	N	93.8	Very high	90.9	Very high	109 Å²	109	63.6 Å²	63.6	58%	0.583	34%	0.335	S	S	*	.	H	α-helix	trans	-69.5	-34	174.8	-75.5	-29.9	0	0	0	113.5	L228 N234	L228-N230 PolarHBondContact O-N 2.88Å; N230-N234 PolarHBondContact O-N 3.44Å; N230-N234 PolarHBondContact O-ND2 3.44Å
231	E	94.3	Very high	91.1	Very high	39 Å²	39	66 Å²	66	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-74.3	-42.2	176	-60.9	-176.5	140.1	0	0	110.1	L219 S220 L228 N234 L235	L219-E231 WeakPolarHBondContact CA-OE2 3.36Å; L219-E231 HydrophobicContact CD2-CB 3.83Å; S220-E231 WeakPolarHBondContact CB-OE1 3.42Å; S220-E231 PolarHBondContact N-OE1 2.75Å; S220-E231 PolarHBondContact N-OE2 3.05Å; S220-E231 PolarHBondContact OG-OE1 3.36Å; L228-E231 HydrophobicContact CB-CG 4.34Å; L228-E231 HydrophobicContact CD2-CG 4.33Å; L228-E231 PolarHBondContact O-N 3.13Å; E231-N234 WeakPolarHBondContact O-CB 3.43Å; E231-N234 PolarHBondContact O-N 2.85Å; E231-L235 PolarHBondContact O-N 2.81Å
232	V	94.7	Very high	91.3	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.018	35%	0.347	C	S	.	.	H	α-helix	trans	-62.1	-45.7	174.7	-177.6	0	0	0	0	111.6	C101 L102 H105 L228 N234 L235 A236	C101-V232 HydrophobicContact CB-CG1 4.15Å; C101-V232 HydrophobicContact CB-CG2 3.99Å; L102-V232 HydrophobicContact CD2-CG1 4.14Å; H105-V232 HydrophobicContact CB-CG1 4.07Å; L228-V232 PolarHBondContact O-N 2.91Å; V232-N234 VanDerWaalsContact C-N 3.31Å; V232-N234 PolarHBondContact O-N 3.26Å; V232-L235 WeakPolarHBondContact O-CB 3.36Å; V232-L235 PolarHBondContact O-N 3.29Å; V232-L235 VanDerWaalsContact O-N 3.14Å; V232-A236 WeakPolarHBondContact O-CB 3.42Å; V232-A236 PolarHBondContact O-N 3.13Å
233	K	94.1	Very high	91.3	Very high	127 Å²	127	71 Å²	71	55%	0.552	36%	0.362	S	S	*	.	H	α-helix	trans	-60.1	-37.9	175	179.1	170.9	-177.5	175.2	0	112.6	H105 G229 R237	H105-K233 WeakPolarHBondContact NE2-CA 3.4Å; G229-K233 WeakPolarHBondContact O-CB 3.21Å; G229-K233 PolarHBondContact O-N 2.77Å; K233-R237 WeakPolarHBondContact O-CB 3.44Å; K233-R237 PolarHBondContact O-N 2.91Å
234	N	95.1	Very high	91.3	Very high	70 Å²	70	68.8 Å²	68.8	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-66.8	-43.9	173.2	-86.5	-68.8	0	0	0	111.7	N230 E231 V232 R237 F238	N230-N234 PolarHBondContact O-N 3.44Å; N230-N234 PolarHBondContact O-ND2 3.44Å; E231-N234 WeakPolarHBondContact O-CB 3.43Å; E231-N234 PolarHBondContact O-N 2.85Å; V232-N234 VanDerWaalsContact C-N 3.31Å; V232-N234 PolarHBondContact O-N 3.26Å; N234-R237 PolarHBondContact OD1-NH2 2.95Å; N234-F238 VanDerWaalsContact O-CD2 3.3Å; N234-F238 WeakPolarHBondContact O-CD2 3.45Å; N234-F238 PolarHBondContact O-N 2.96Å
235	L	94.7	Very high	91.3	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-60	-53.1	175.9	179.9	67.5	0	0	0	111.1	L98 L102 M180 V182 F217 E231 V232 R237 F238 I239	L98-L235 HydrophobicContact CD1-CD2 3.91Å; L98-L235 HydrophobicContact CD2-CD2 4.41Å; L102-L235 HydrophobicContact CD2-CD2 4.26Å; M180-L235 HydrophobicContact CE-CD1 3.52Å; V182-L235 HydrophobicContact CG2-CD1 4.25Å; V182-L235 HydrophobicContact CG2-CD2 4.47Å; F217-L235 HydrophobicContact CB-CD1 4.35Å; F217-L235 HydrophobicContact CD1-CB 4.36Å; F217-L235 HydrophobicContact CD1-CD1 3.98Å; F217-L235 HydrophobicContact CD2-CD1 3.69Å; F217-L235 HydrophobicContact CE1-CD1 4.25Å; F217-L235 HydrophobicContact CE2-CD1 4.01Å; F217-L235 HydrophobicContact CG-CD1 3.71Å; F217-L235 HydrophobicContact CZ-CD1 4.27Å; E231-L235 PolarHBondContact O-N 2.81Å; V232-L235 WeakPolarHBondContact O-CB 3.36Å; V232-L235 PolarHBondContact O-N 3.29Å; V232-L235 VanDerWaalsContact O-N 3.14Å; L235-R237 PolarHBondContact O-N 2.95Å; L235-F238 PolarHBondContact O-N 2.75Å; L235-I239 HydrophobicContact CG-CD1 4.22Å; L235-I239 WeakPolarHBondContact O-CG1 3.14Å; L235-I239 PolarHBondContact O-N 2.83Å; L235-I239 VanDerWaalsContact O-N 3.1Å
236	A	94.1	Very high	91.1	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-53.1	-49.6	177.8	0	0	0	0	0	112.2	L102 H105 V232 F238 I239 S240	L102-A236 HydrophobicContact CD2-CB 4.25Å; H105-A236 WeakPolarHBondContact ND1-CB 3.45Å; V232-A236 WeakPolarHBondContact O-CB 3.42Å; V232-A236 PolarHBondContact O-N 3.13Å; A236-F238 PolarHBondContact O-N 3.07Å; A236-I239 WeakPolarHBondContact O-CB 3.29Å; A236-I239 PolarHBondContact O-N 2.83Å; A236-S240 PolarHBondContact O-N 2.69Å; A236-S240 PolarHBondContact O-OG 2.92Å
237	R	93.2	Very high	90.9	Very high	135 Å²	135	61.7 Å²	61.7	51%	0.509	31%	0.309	S	S	.	.	H	α-helix	trans	-54.9	-37.7	176.5	-175	-171.2	64.6	-147.3	-16.3	112.7	K233 N234 L235 V241	K233-R237 WeakPolarHBondContact O-CB 3.44Å; K233-R237 PolarHBondContact O-N 2.91Å; N234-R237 PolarHBondContact OD1-NH2 2.95Å; L235-R237 PolarHBondContact O-N 2.95Å; R237-V241 VanDerWaalsContact O-CG2 3.29Å; R237-V241 WeakPolarHBondContact O-CG2 3.26Å; R237-V241 PolarHBondContact O-N 3.21Å
238	F	93	Very high	90.7	Very high	74 Å²	74	67.6 Å²	67.6	33%	0.325	34%	0.34	S	S	.	.	H	α-helix	trans	-70.6	-41.4	176.1	-85.2	-75.8	0	0	0	112	M180 F217 N234 L235 A236 V241 M242	M180-F238 HydrophobicContact CE-CB 3.87Å; F217-F238 HydrophobicContact CE1-CB 4.48Å; F217-F238 AromaticContact CE1-CD2 3.51Å; F217-F238 HydrophobicContact CE1-CD2 3.51Å; F217-F238 HydrophobicContact CE1-CE2 4.05Å; F217-F238 HydrophobicContact CE1-CG 4.25Å; F217-F238 HydrophobicContact CZ-CB 3.81Å; F217-F238 AromaticContact CZ-CD2 3.41Å; F217-F238 HydrophobicContact CZ-CD2 3.41Å; F217-F238 VanDerWaalsContact CZ-CD2 3.41Å; F217-F238 HydrophobicContact CZ-CE2 4.09Å; F217-F238 AromaticContact CZ-CG 3.7Å; F217-F238 HydrophobicContact CZ-CG 3.7Å; N234-F238 VanDerWaalsContact O-CD2 3.3Å; N234-F238 WeakPolarHBondContact O-CD2 3.45Å; N234-F238 PolarHBondContact O-N 2.96Å; L235-F238 PolarHBondContact O-N 2.75Å; A236-F238 PolarHBondContact O-N 3.07Å; F238-V241 PolarHBondContact O-N 2.7Å; F238-M242 WeakPolarHBondContact O-CG 3.14Å; F238-M242 PolarHBondContact O-N 3.1Å
239	I	93.5	Very high	90.6	Very high	2 Å²	2	65.2 Å²	65.2	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-57.4	-50.6	174.8	-59.2	171.3	0	0	0	110.1	V85 L102 L128 L149 L151 M180 L235 A236 V241 M242	V85-I239 HydrophobicContact CG2-CG2 4.38Å; L102-I239 HydrophobicContact CD1-CD1 4.39Å; L102-I239 HydrophobicContact CD2-CD1 4.22Å; L128-I239 HydrophobicContact CD1-CG2 3.51Å; L128-I239 HydrophobicContact CD2-CG2 4.34Å; L149-I239 HydrophobicContact CD2-CB 4.34Å; L149-I239 HydrophobicContact CD2-CG1 4.06Å; L149-I239 HydrophobicContact CD2-CG2 3.76Å; L151-I239 HydrophobicContact CD1-CD1 4.02Å; L151-I239 HydrophobicContact CD2-CD1 4.21Å; L151-I239 HydrophobicContact CD2-CG1 4.44Å; M180-I239 HydrophobicContact CE-CG1 3.97Å; M180-I239 HydrophobicContact SD-CG1 3.99Å; L235-I239 HydrophobicContact CG-CD1 4.22Å; L235-I239 WeakPolarHBondContact O-CG1 3.14Å; L235-I239 PolarHBondContact O-N 2.83Å; L235-I239 VanDerWaalsContact O-N 3.1Å; A236-I239 WeakPolarHBondContact O-CB 3.29Å; A236-I239 PolarHBondContact O-N 2.83Å; I239-V241 PolarHBondContact O-N 3.24Å; I239-V241 VanDerWaalsContact O-N 3.08Å; I239-M242 PolarHBondContact O-N 2.78Å
240	S	89.6	Confident	90.5	Very high	35 Å²	35	63.4 Å²	63.4	25%	0.245	30%	0.304	C	S	.	.	H	α-helix	trans	-57.2	-26.8	-179.2	-50.3	0	0	0	0	114.2	T122 R126 A236	T122-S240 WeakPolarHBondContact CG2-OG 3.18Å; R126-S240 WeakPolarHBondContact CD-O 3.45Å; R126-S240 PolarHBondContact NH1-O 3.13Å; A236-S240 PolarHBondContact O-N 2.69Å; A236-S240 PolarHBondContact O-OG 2.92Å
241	V	89.9	Confident	90.2	Very high	105 Å²	105	59.2 Å²	59.2	64%	0.636	28%	0.284	S	S	*	.	H	α-helix	trans	-97.3	-12	-175.1	173.5	0	0	0	0	113.2	R237 F238 I239	R237-V241 VanDerWaalsContact O-CG2 3.29Å; R237-V241 WeakPolarHBondContact O-CG2 3.26Å; R237-V241 PolarHBondContact O-N 3.21Å; F238-V241 PolarHBondContact O-N 2.7Å; I239-V241 PolarHBondContact O-N 3.24Å; I239-V241 VanDerWaalsContact O-N 3.08Å
242	M	88.8	Confident	90	Very high	35 Å²	35	59.8 Å²	59.8	17%	0.172	29%	0.29	C	S	.	.			trans	-66.8	146.3	-172.4	-83.4	-167	-174.1	0	0	114.8	R126 L149 M180 F238 I239 F244	R126-M242 VanDerWaalsContact CZ-O 3.27Å; R126-M242 PolarHBondContact NH1-O 2.88Å; R126-M242 PolarHBondContact NH2-O 3.35Å; L149-M242 HydrophobicContact CD1-SD 3.83Å; M180-M242 HydrophobicContact CE-CE 4.03Å; M180-M242 HydrophobicContact CG-CE 3.51Å; M180-M242 HydrophobicContact CG-SD 4.08Å; M180-M242 HydrophobicContact SD-CE 3.4Å; M180-M242 WeakPolarHBondContact SD-CE 3.47Å; M180-M242 HydrophobicContact SD-SD 3.71Å; F238-M242 WeakPolarHBondContact O-CG 3.14Å; F238-M242 PolarHBondContact O-N 3.1Å; I239-M242 PolarHBondContact O-N 2.78Å; M242-F244 HydrophobicContact CB-CE1 3.97Å; M242-F244 HydrophobicContact CB-CZ 4.02Å
243	K	88.3	Confident	89.8	Confident	170 Å²	170	59.7 Å²	59.7	74%	0.739	29%	0.289	S	S	*	.			trans	-106.4	114.9	169.6	-67.2	-164.2	175.4	-163.8	0	110	R178	R178-K243 PolarHBondContact NE-O 2.91Å; R178-K243 PolarHBondContact NH2-O 3.05Å
244	F	86.9	Confident	89.8	Confident	36 Å²	36	54.3 Å²	54.3	16%	0.158	27%	0.267	C	S	.	.			trans	-77.7	163.9	174.7	-48.6	-63.2	0	0	0	109.9	F83 D148 L149 R178 M242	F83-F244 HydrophobicContact CB-CD2 4.27Å; F83-F244 HydrophobicContact CB-CE2 3.85Å; F83-F244 HydrophobicContact CB-CZ 4.44Å; F83-F244 AromaticContact CD1-CD2 3.44Å; F83-F244 HydrophobicContact CD1-CD2 3.44Å; F83-F244 VanDerWaalsContact CD1-CD2 3.44Å; F83-F244 AromaticContact CD1-CE2 3.8Å; F83-F244 HydrophobicContact CD1-CE2 3.8Å; F83-F244 HydrophobicContact CD1-CG 4.36Å; F83-F244 HydrophobicContact CD2-CD2 4.15Å; F83-F244 AromaticContact CD2-CE2 3.73Å; F83-F244 HydrophobicContact CD2-CE2 3.73Å; F83-F244 AromaticContact CE1-CD2 3.69Å; F83-F244 HydrophobicContact CE1-CD2 3.69Å; F83-F244 HydrophobicContact CE1-CE2 4.27Å; F83-F244 HydrophobicContact CE2-CD2 4.35Å; F83-F244 HydrophobicContact CE2-CE2 4.21Å; F83-F244 AromaticContact CG-CD2 3.69Å; F83-F244 HydrophobicContact CG-CD2 3.69Å; F83-F244 AromaticContact CG-CE2 3.51Å; F83-F244 HydrophobicContact CG-CE2 3.51Å; F83-F244 HydrophobicContact CZ-CD2 4.14Å; F83-F244 HydrophobicContact CZ-CE2 4.46Å; D148-F244 HydrophobicContact CB-CD1 4.17Å; D148-F244 HydrophobicContact CB-CG 4.21Å; L149-F244 HydrophobicContact CB-CE1 3.85Å; L149-F244 HydrophobicContact CB-CZ 4.49Å; L149-F244 HydrophobicContact CD1-CE1 4.4Å; L149-F244 HydrophobicContact CD2-CE1 4.41Å; L149-F244 HydrophobicContact CG-CE1 4.45Å; R178-F244 HydrophobicContact CB-CD1 4.27Å; R178-F244 HydrophobicContact CG-CD1 3.84Å; R178-F244 HydrophobicContact CG-CE1 4.42Å; M242-F244 HydrophobicContact CB-CE1 3.97Å; M242-F244 HydrophobicContact CB-CZ 4.02Å
245	R	83.4	Confident	89.7	Confident	136 Å²	136	51.3 Å²	51.3	51%	0.513	25%	0.251	S	S	.	.			trans	-135	120.3	166.9	178.7	-179.7	-177.3	163	7.4	104.8	A70	A70-R245 PolarHBondContact O-NH2 3.42Å; A70-R245 VanDerWaalsContact O-NH2 3.12Å
246	P	79.3	Confident	89.5	Confident	54 Å²	54	51.3 Å²	51.3	35%	0.351	25%	0.251	S	S	.	.			trans	-61.6	146.3	178.2	25.7	-33.2	0	0	0	110.2
247	S	85.1	Confident	89.5	Confident	22 Å²	22	51.3 Å²	51.3	15%	0.154	25%	0.251	C	S	.	.			trans	-77.6	153.8	167.9	68.7	0	0	0	0	109.7	W249 R250 S251	S247-W249 PolarHBondContact O-N 2.95Å; S247-W249 VanDerWaalsContact O-N 3.13Å; S247-R250 PolarHBondContact O-N 3.04Å; S247-R250 WeakPolarHBondContact OG-CG 3.19Å; S247-R250 PolarHBondContact OG-N 3.27Å; S247-S251 PolarHBondContact O-N 2.79Å; S247-S251 PolarHBondContact O-OG 3.42Å
248	I	89	Confident	89.4	Confident	140 Å²	140	45.2 Å²	45.2	72%	0.718	23%	0.228	S	C	*	.	H	α-helix	trans	-54.6	-36.4	-180	-60	171.9	0	0	0	111.1	S251 T252	I248-S251 WeakPolarHBondContact CA-OG 3.17Å; I248-S251 PolarHBondContact O-N 2.84Å; I248-S251 PolarHBondContact O-OG 2.83Å; I248-S251 VanDerWaalsContact O-OG 3.13Å; I248-T252 HydrophobicContact CG2-CG2 4.39Å; I248-T252 WeakPolarHBondContact O-CB 3.45Å; I248-T252 VanDerWaalsContact O-CG2 3.32Å; I248-T252 WeakPolarHBondContact O-CG2 3.14Å; I248-T252 PolarHBondContact O-N 2.78Å; I248-T252 PolarHBondContact O-OG1 2.7Å
249	W	89.9	Confident	89.2	Confident	31 Å²	31	41.8 Å²	41.8	12%	0.117	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-49	175.6	-172.1	-94.5	0	0	0	112.3	S247 S251 T252 H253 E769 W801 T844	S247-W249 PolarHBondContact O-N 2.95Å; S247-W249 VanDerWaalsContact O-N 3.13Å; W249-S251 PolarHBondContact O-N 3.06Å; W249-T252 PolarHBondContact O-N 3.16Å; W249-T252 PolarHBondContact O-OG1 3Å; W249-T252 VanDerWaalsContact O-OG1 3.1Å; W249-H253 AromaticContact CD2-CE1 3.96Å; W249-H253 AromaticContact CD2-ND1 3.73Å; W249-H253 AromaticContact CE2-CG 3.96Å; W249-H253 AromaticContact CE2-ND1 3.74Å; W249-H253 AromaticContact CE3-CE1 3.62Å; W249-H253 AromaticContact CE3-ND1 3.86Å; W249-H253 AromaticContact CH2-CD2 3.88Å; W249-H253 AromaticContact CH2-CE1 3.43Å; W249-H253 VanDerWaalsContact CH2-CE1 3.43Å; W249-H253 WeakPolarHBondContact CH2-CE1 3.41Å; W249-H253 AromaticContact CH2-ND1 3.95Å; W249-H253 AromaticContact CH2-NE2 3.37Å; W249-H253 WeakPolarHBondContact CH2-NE2 3.39Å; W249-H253 AromaticContact CZ2-CD2 3.79Å; W249-H253 AromaticContact CZ2-CE1 3.81Å; W249-H253 AromaticContact CZ2-CG 3.85Å; W249-H253 AromaticContact CZ2-ND1 3.85Å; W249-H253 AromaticContact CZ2-NE2 3.78Å; W249-H253 AromaticContact CZ3-CE1 3.36Å; W249-H253 WeakPolarHBondContact CZ3-CE1 3.25Å; W249-H253 AromaticContact CZ3-ND1 3.98Å; W249-H253 AromaticContact CZ3-NE2 3.75Å; W249-H253 PolarHBondContact O-N 2.74Å; W249-H253 VanDerWaalsContact O-N 3.08Å; W249-H253 PolarHBondContact O-ND1 3.37Å; W249-H253 VanDerWaalsContact O-ND1 3.15Å; W249-E769 WeakPolarHBondContact CH2-OE1 3.13Å; W249-W801 AromaticContact CD1-CH2 3.99Å; W249-W801 AromaticContact CD1-CZ2 3.94Å; W249-W801 AromaticContact CZ2-CD1 3.88Å; W249-W801 HydrophobicContact CZ2-CD2 4.31Å; W249-W801 HydrophobicContact CZ2-CG 4.19Å; W249-W801 AromaticContact CZ2-NE1 3.79Å; W249-W801 AromaticContact NE1-CD2 3.8Å; W249-W801 AromaticContact NE1-CE2 3.37Å; W249-W801 AromaticContact NE1-CH2 3.55Å; W249-W801 AromaticContact NE1-CZ2 3.22Å; W249-W801 AromaticContact NE1-CZ3 3.97Å; W249-W801 AromaticContact NE1-NE1 3.97Å; W249-T844 HydrophobicContact CE3-CG2 4.21Å; W249-T844 HydrophobicContact CZ3-CG2 4.04Å
250	R	90	Very high	88.8	Confident	8 Å²	8	46.3 Å²	46.3	3%	0.03	23%	0.23	C	C	.	.	H	α-helix	trans	-69.2	-29.5	179.3	-66.9	175.4	-157.9	169.2	3.2	113.3	A144 K145 A147 D148 S247 T252 Y255 G288	A144-R250 PolarHBondContact O-NH2 3.37Å; A144-R250 VanDerWaalsContact O-NH2 3.11Å; K145-R250 PolarHBondContact O-NE 3.23Å; K145-R250 PolarHBondContact O-NH2 3.11Å; A147-R250 PolarHBondContact O-NH1 2.95Å; A147-R250 PolarHBondContact O-NH2 3.14Å; D148-R250 IonicContact OD1-CZ 2.59Å; D148-R250 IonicContact OD1-NH1 3.22Å; D148-R250 PolarHBondContact OD1-NH1 2.61Å; S247-R250 PolarHBondContact O-N 3.04Å; S247-R250 WeakPolarHBondContact OG-CG 3.19Å; S247-R250 PolarHBondContact OG-N 3.27Å; R250-T252 VanDerWaalsContact C-N 3.3Å; R250-Y255 HydrophobicContact CB-CE1 3.96Å; R250-Y255 HydrophobicContact CG-CE1 3.93Å; R250-G288 WeakPolarHBondContact O-CA 3.39Å
251	S	88.3	Confident	88.7	Confident	22 Å²	22	45.7 Å²	45.7	15%	0.154	22%	0.224	C	C	.	.	H	α-helix	trans	-81.8	-6.9	176	65.4	0	0	0	0	113.4	R75 S247 I248 W249 C289	R75-S251 WeakPolarHBondContact CD-O 3.3Å; R75-S251 PolarHBondContact NH1-O 2.67Å; S247-S251 PolarHBondContact O-N 2.79Å; S247-S251 PolarHBondContact O-OG 3.42Å; I248-S251 WeakPolarHBondContact CA-OG 3.17Å; I248-S251 PolarHBondContact O-N 2.84Å; I248-S251 PolarHBondContact O-OG 2.83Å; I248-S251 VanDerWaalsContact O-OG 3.13Å; W249-S251 PolarHBondContact O-N 3.06Å; S251-C289 PolarHBondContact O-SG 3.16Å
252	T	89.7	Confident	88.6	Confident	50 Å²	50	43 Å²	43	31%	0.307	20%	0.204	S	C	.	.	H	α-helix	trans	-114.5	-19.7	-178.3	48.3	0	0	0	0	114.4	I248 W249 R250	I248-T252 HydrophobicContact CG2-CG2 4.39Å; I248-T252 WeakPolarHBondContact O-CB 3.45Å; I248-T252 VanDerWaalsContact O-CG2 3.32Å; I248-T252 WeakPolarHBondContact O-CG2 3.14Å; I248-T252 PolarHBondContact O-N 2.78Å; I248-T252 PolarHBondContact O-OG1 2.7Å; W249-T252 PolarHBondContact O-N 3.16Å; W249-T252 PolarHBondContact O-OG1 3Å; W249-T252 VanDerWaalsContact O-OG1 3.1Å; R250-T252 VanDerWaalsContact C-N 3.3Å
253	H	91	Very high	88.5	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	21%	0.211	C	C	.	.	S	Bend	trans	-119.4	135.9	-179.5	-60.3	75.2	0	0	0	110.1	W249 C289 L766 E769 W801	W249-H253 AromaticContact CD2-CE1 3.96Å; W249-H253 AromaticContact CD2-ND1 3.73Å; W249-H253 AromaticContact CE2-CG 3.96Å; W249-H253 AromaticContact CE2-ND1 3.74Å; W249-H253 AromaticContact CE3-CE1 3.62Å; W249-H253 AromaticContact CE3-ND1 3.86Å; W249-H253 AromaticContact CH2-CD2 3.88Å; W249-H253 AromaticContact CH2-CE1 3.43Å; W249-H253 VanDerWaalsContact CH2-CE1 3.43Å; W249-H253 WeakPolarHBondContact CH2-CE1 3.41Å; W249-H253 AromaticContact CH2-ND1 3.95Å; W249-H253 AromaticContact CH2-NE2 3.37Å; W249-H253 WeakPolarHBondContact CH2-NE2 3.39Å; W249-H253 AromaticContact CZ2-CD2 3.79Å; W249-H253 AromaticContact CZ2-CE1 3.81Å; W249-H253 AromaticContact CZ2-CG 3.85Å; W249-H253 AromaticContact CZ2-ND1 3.85Å; W249-H253 AromaticContact CZ2-NE2 3.78Å; W249-H253 AromaticContact CZ3-CE1 3.36Å; W249-H253 WeakPolarHBondContact CZ3-CE1 3.25Å; W249-H253 AromaticContact CZ3-ND1 3.98Å; W249-H253 AromaticContact CZ3-NE2 3.75Å; W249-H253 PolarHBondContact O-N 2.74Å; W249-H253 VanDerWaalsContact O-N 3.08Å; W249-H253 PolarHBondContact O-ND1 3.37Å; W249-H253 VanDerWaalsContact O-ND1 3.15Å; H253-C289 PolarHBondContact O-N 3.13Å; H253-L766 WeakPolarHBondContact NE2-CD1 3.4Å; H253-E769 IonicContact NE2-OE1 3.5Å; H253-E769 IonicContact NE2-OE2 3.91Å; H253-W801 HydrophobicContact CB-CZ2 3.99Å
254	P	92.4	Very high	88.4	Confident	14 Å²	14	39 Å²	39	9%	0.091	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	141.5	168	32.3	-31.9	0	0	0	109.7	C289 P290 F291 G764	P254-C289 HydrophobicContact CB-CB 4.15Å; P254-C289 WeakPolarHBondContact CB-O 3.44Å; P254-P290 WeakPolarHBondContact CB-O 3.38Å; P254-F291 HydrophobicContact CB-CD1 3.91Å; P254-F291 HydrophobicContact CB-CD2 3.85Å; P254-F291 HydrophobicContact CB-CE1 3.93Å; P254-F291 HydrophobicContact CB-CE2 3.87Å; P254-F291 HydrophobicContact CB-CG 3.86Å; P254-F291 HydrophobicContact CB-CZ 3.9Å; P254-F291 HydrophobicContact CG-CD1 3.91Å; P254-F291 HydrophobicContact CG-CE1 3.92Å; P254-F291 HydrophobicContact CG-CG 4.32Å; P254-F291 HydrophobicContact CG-CZ 4.33Å; P254-G764 PolarHBondContact O-N 2.98Å
255	Y	92.9	Very high	88.4	Confident	7 Å²	7	38.2 Å²	38.2	3%	0.027	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.8	176.1	65.7	-77.7	0	0	0	112	I146 R250 R287 I762 W801	I146-Y255 HydrophobicContact CB-CD2 4.35Å; I146-Y255 HydrophobicContact CB-CE2 3.94Å; I146-Y255 HydrophobicContact CG2-CD2 3.61Å; I146-Y255 HydrophobicContact CG2-CE2 3.69Å; R250-Y255 HydrophobicContact CB-CE1 3.96Å; R250-Y255 HydrophobicContact CG-CE1 3.93Å; Y255-R287 HydrophobicContact CD1-CB 4.29Å; Y255-R287 VanDerWaalsContact CD1-O 3.22Å; Y255-R287 WeakPolarHBondContact CD1-O 3.39Å; Y255-R287 HydrophobicContact CD2-CB 4.08Å; Y255-R287 HydrophobicContact CE1-CB 3.85Å; Y255-R287 HydrophobicContact CE2-CB 3.63Å; Y255-R287 HydrophobicContact CE2-CG 4.43Å; Y255-R287 HydrophobicContact CG-CB 4.39Å; Y255-R287 VanDerWaalsContact CZ-CB 3.48Å; Y255-R287 PolarHBondContact N-O 3.4Å; Y255-R287 PolarHBondContact O-N 3.14Å; Y255-R287 VanDerWaalsContact O-O 3.11Å; Y255-I762 CarbonylContact C-O 3.54Å; Y255-I762 VanDerWaalsContact CA-O 3.26Å; Y255-I762 WeakPolarHBondContact CA-O 3.28Å; Y255-W801 HydrophobicContact CD1-CH2 4.06Å; Y255-W801 HydrophobicContact CD1-CZ2 4.21Å; Y255-W801 HydrophobicContact CD2-CH2 4.29Å; Y255-W801 AromaticContact CG-CH2 3.74Å; Y255-W801 HydrophobicContact CG-CH2 3.74Å; Y255-W801 HydrophobicContact CG-CZ2 4.09Å
256	L	91.8	Very high	88.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.1	179.4	-178.3	149.3	0	0	0	108.1	I258 G284 F291 V741 I762	L256-I258 HydrophobicContact CD2-CB 4.44Å; L256-I258 HydrophobicContact CD2-CG1 3.65Å; L256-G284 WeakPolarHBondContact CD1-O 3.12Å; L256-F291 HydrophobicContact CB-CE2 4.07Å; L256-F291 HydrophobicContact CB-CZ 4.47Å; L256-V741 HydrophobicContact CD1-CG2 4.1Å; L256-I762 HydrophobicContact CB-CB 4.21Å; L256-I762 HydrophobicContact CB-CG2 4.13Å; L256-I762 HydrophobicContact CD2-CD1 4.48Å; L256-I762 PolarHBondContact N-O 3.46Å; L256-I762 PolarHBondContact O-N 3.1Å
257	L	92.5	Very high	88.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.8	163	175.5	64.3	0	0	0	106.6	L84 P117 T129 L131 I146 D259 P759 I761	L84-L257 HydrophobicContact CD1-CD2 3.64Å; L84-L257 HydrophobicContact CD2-CD2 4.13Å; P117-L257 HydrophobicContact CB-CD2 4.08Å; T129-L257 HydrophobicContact CG2-CD2 4.19Å; L131-L257 HydrophobicContact CD2-CD1 4.46Å; L131-L257 HydrophobicContact CD2-CD2 4.23Å; I146-L257 HydrophobicContact CD1-CD1 3.99Å; I146-L257 HydrophobicContact CD1-CD2 4.48Å; L257-D259 PolarHBondContact O-N 3.5Å; L257-P759 HydrophobicContact CD1-CB 3.9Å; L257-I761 HydrophobicContact CD1-CG1 4.36Å
258	I	91.1	Very high	89	Confident	7 Å²	7	41 Å²	41	4%	0.036	22%	0.221	C	C	.	.			trans	-77.8	117.2	-175.6	-67.8	161.8	0	0	0	108.6	L256 R260 F282 Y760 I762	L256-I258 HydrophobicContact CD2-CB 4.44Å; L256-I258 HydrophobicContact CD2-CG1 3.65Å; I258-R260 WeakPolarHBondContact CG2-O 3.45Å; I258-F282 HydrophobicContact CD1-CB 4.35Å; I258-F282 HydrophobicContact CD1-CD1 3.27Å; I258-F282 HydrophobicContact CD1-CE1 3.63Å; I258-F282 HydrophobicContact CD1-CG 3.96Å; I258-F282 HydrophobicContact CG1-CB 4.18Å; I258-F282 HydrophobicContact CG1-CD1 3.84Å; I258-F282 HydrophobicContact CG1-CG 4.32Å; I258-F282 HydrophobicContact CG2-CD1 3.88Å; I258-Y760 WeakPolarHBondContact CB-O 3.44Å; I258-Y760 VanDerWaalsContact CD1-CB 3.49Å; I258-Y760 PolarHBondContact N-O 2.84Å; I258-Y760 VanDerWaalsContact N-O 3.07Å; I258-I762 HydrophobicContact CD1-CD1 3.9Å; I258-I762 HydrophobicContact CD1-CG1 3.97Å; I258-I762 HydrophobicContact CG1-CD1 4.22Å; I258-I762 HydrophobicContact CG1-CG1 4.5Å
259	D	89.4	Confident	88.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	20%	0.204	C	C	.	.	S	Bend	trans	-91.2	-38.2	177.6	-60.8	-51.4	0	0	0	111.2	P117 L257 Y283 G284 Y285 Y356 P358 F359	P117-D259 HydrophobicContact CG-CB 4.24Å; P117-D259 WeakPolarHBondContact CG-OD1 3.17Å; L257-D259 PolarHBondContact O-N 3.5Å; D259-Y283 PolarHBondContact N-O 2.85Å; D259-G284 WeakPolarHBondContact OD2-CA 3.48Å; D259-Y285 WeakPolarHBondContact OD2-CD2 3.15Å; D259-Y356 HydrophobicContact CB-CE1 4.04Å; D259-P358 WeakPolarHBondContact O-CG 3.28Å; D259-F359 WeakPolarHBondContact O-CE2 3.28Å
260	R	86.3	Confident	88.6	Confident	98 Å²	98	37.5 Å²	37.5	37%	0.37	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	149.2	172	-168.6	-173.1	-173.8	-173.5	5.8	111.1	I258 E262 Y283 P358	I258-R260 WeakPolarHBondContact CG2-O 3.45Å; R260-E262 WeakPolarHBondContact CD-OE1 3.43Å; R260-E262 IonicContact CZ-OE1 3.86Å; R260-E262 IonicContact NE-OE1 2.67Å; R260-E262 PolarHBondContact NE-OE1 2.97Å; R260-E262 IonicContact NH1-OE1 2.63Å; R260-E262 PolarHBondContact NH1-OE1 3.33Å; R260-E262 IonicContact NH2-OE1 2.65Å; R260-Y283 HydrophobicContact CB-CD2 4.12Å; R260-Y283 HydrophobicContact CB-CG 4.38Å; R260-Y283 HydrophobicContact CG-CD2 4.44Å; R260-Y283 PolarHBondContact N-O 3.2Å; R260-Y283 PolarHBondContact O-N 3.03Å; R260-P358 HydrophobicContact CB-CG 4.15Å
261	M	86.8	Confident	88.4	Confident	22 Å²	22	44.5 Å²	44.5	11%	0.108	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.6	169.3	177.8	-165.8	-85	0	0	108.7	V280 F282 F754 Y760	M261-V280 HydrophobicContact CE-CG1 4.48Å; M261-V280 HydrophobicContact CG-CG1 3.62Å; M261-V280 HydrophobicContact SD-CG1 4.28Å; M261-F282 HydrophobicContact CE-CD1 4.5Å; M261-F282 HydrophobicContact CE-CE1 3.59Å; M261-F282 HydrophobicContact CE-CZ 4.23Å; M261-F282 HydrophobicContact CG-CD1 4.5Å; M261-F282 HydrophobicContact CG-CE1 4.31Å; M261-F754 HydrophobicContact CB-CE2 4.39Å; M261-F754 HydrophobicContact CB-CZ 4.41Å; M261-F754 HydrophobicContact CE-CD2 3.48Å; M261-F754 VanDerWaalsContact CE-CD2 3.48Å; M261-F754 HydrophobicContact CE-CE2 3.7Å; M261-F754 HydrophobicContact CE-CG 4.41Å; M261-F754 HydrophobicContact SD-CD2 3.64Å; M261-F754 HydrophobicContact SD-CE2 3.98Å; M261-F754 HydrophobicContact SD-CG 4.04Å; M261-Y760 HydrophobicContact CE-CD1 4.35Å; M261-Y760 HydrophobicContact CE-CE1 4.31Å
262	E	87.2	Confident	88.4	Confident	48 Å²	48	47 Å²	47	22%	0.224	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	146.2	171.6	-70.1	168.7	-165.6	0	0	110.2	R260 V280 A281 Y283	R260-E262 WeakPolarHBondContact CD-OE1 3.43Å; R260-E262 IonicContact CZ-OE1 3.86Å; R260-E262 IonicContact NE-OE1 2.67Å; R260-E262 PolarHBondContact NE-OE1 2.97Å; R260-E262 IonicContact NH1-OE1 2.63Å; R260-E262 PolarHBondContact NH1-OE1 3.33Å; R260-E262 IonicContact NH2-OE1 2.65Å; E262-V280 WeakPolarHBondContact O-CA 3.5Å; E262-V280 WeakPolarHBondContact O-CG1 3.39Å; E262-A281 HydrophobicContact CB-CB 4.46Å; E262-A281 PolarHBondContact N-O 3.4Å; E262-A281 PolarHBondContact O-N 3.05Å; E262-Y283 HydrophobicContact CB-CE2 4.11Å; E262-Y283 VanDerWaalsContact CD-OH 3.25Å; E262-Y283 HydrophobicContact CG-CE2 3.77Å; E262-Y283 WeakPolarHBondContact OE1-CE2 3.17Å; E262-Y283 PolarHBondContact OE1-OH 3.05Å; E262-Y283 VanDerWaalsContact OE2-CE2 3.26Å; E262-Y283 WeakPolarHBondContact OE2-CE2 3.39Å; E262-Y283 VanDerWaalsContact OE2-CZ 3.24Å; E262-Y283 PolarHBondContact OE2-OH 2.83Å
263	Q	87	Confident	88.1	Confident	67 Å²	67	49.7 Å²	49.7	31%	0.313	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	120.7	173.8	-171.8	175.4	-61.2	0	0	109.5	T265 R278 V751	Q263-T265 WeakPolarHBondContact CG-OG1 3.5Å; Q263-R278 VanDerWaalsContact OE1-CD 3.25Å; Q263-R278 VanDerWaalsContact OE1-NH1 3.08Å; Q263-V751 VanDerWaalsContact OE1-CG1 3.32Å
264	V	87.2	Confident	87.7	Confident	53 Å²	53	57.1 Å²	57.1	32%	0.321	31%	0.309	S	S	.	.			trans	-113.5	50.3	-178.4	-165.8	0	0	0	0	108.8	N279 A281	V264-N279 CarbonylContact C-O 3.47Å; V264-N279 PolarHBondContact N-O 2.93Å; V264-N279 VanDerWaalsContact O-CB 3.25Å; V264-N279 WeakPolarHBondContact O-CB 3.22Å; V264-A281 HydrophobicContact CG2-CB 3.64Å
265	T	85.2	Confident	87.2	Confident	21 Å²	21	64.2 Å²	64.2	13%	0.129	34%	0.341	C	S	.	.	S	Bend	trans	-117.6	132.1	-177.5	-45.6	0	0	0	0	108.6	Q263 I270 R278 N279	Q263-T265 WeakPolarHBondContact CG-OG1 3.5Å; T265-I270 HydrophobicContact CG2-CG1 4.26Å; T265-R278 WeakPolarHBondContact OG1-CB 3.19Å; T265-N279 PolarHBondContact OG1-N 3.34Å; T265-N279 PolarHBondContact OG1-O 2.97Å
266	D	87	Confident	86.6	Confident	102 Å²	102	66.4 Å²	66.4	55%	0.545	36%	0.357	S	S	.	.			trans	-59.1	131.1	-177.2	-41.1	-74.1	0	0	0	110.6	S268 S269 I270	D266-S268 VanDerWaalsContact C-N 3.28Å; D266-S268 PolarHBondContact O-N 2.99Å; D266-S269 WeakPolarHBondContact O-CB 3.37Å; D266-S269 PolarHBondContact O-N 3.28Å; D266-I270 PolarHBondContact O-N 3.41Å
267	P	86.1	Confident	86.3	Confident	87 Å²	87	70.2 Å²	70.2	57%	0.565	38%	0.377	S	S	*	.	H	α-helix	trans	-58.9	-40.7	-174.5	21.4	-32	0	0	0	112	S269 I270 E271	P267-S269 PolarHBondContact O-N 3.3Å; P267-I270 WeakPolarHBondContact O-CA 3.37Å; P267-I270 WeakPolarHBondContact O-CB 3.43Å; P267-I270 PolarHBondContact O-N 2.92Å; P267-E271 PolarHBondContact O-N 2.95Å
268	S	88.5	Confident	85.9	Confident	82 Å²	82	70.9 Å²	70.9	57%	0.573	38%	0.38	S	S	*	.	H	α-helix	trans	-56.4	-33.7	176.9	-34.5	0	0	0	0	113.1	D266 A272	D266-S268 VanDerWaalsContact C-N 3.28Å; D266-S268 PolarHBondContact O-N 2.99Å; S268-A272 VanDerWaalsContact O-CB 3.29Å; S268-A272 WeakPolarHBondContact O-CB 3.34Å; S268-A272 PolarHBondContact O-N 2.91Å
269	S	85.3	Confident	85.8	Confident	50 Å²	50	72.8 Å²	72.8	35%	0.35	39%	0.39	S	S	.	.	H	α-helix	trans	-71.1	-30.7	176.5	-63.8	0	0	0	0	112.4	D266 P267 N273	D266-S269 WeakPolarHBondContact O-CB 3.37Å; D266-S269 PolarHBondContact O-N 3.28Å; P267-S269 PolarHBondContact O-N 3.3Å; S269-N273 PolarHBondContact O-N 3.14Å; S269-N273 VanDerWaalsContact O-N 3.09Å
270	I	84.2	Confident	85.8	Confident	46 Å²	46	72.8 Å²	72.8	24%	0.236	39%	0.39	C	S	.	.	H	α-helix	trans	-76.5	-40	176.1	-45.8	164	0	0	0	110.5	T265 D266 P267 N273 K274	T265-I270 HydrophobicContact CG2-CG1 4.26Å; D266-I270 PolarHBondContact O-N 3.41Å; P267-I270 WeakPolarHBondContact O-CA 3.37Å; P267-I270 WeakPolarHBondContact O-CB 3.43Å; P267-I270 PolarHBondContact O-N 2.92Å; I270-N273 CarbonylContact O-C 3.48Å; I270-N273 PolarHBondContact O-N 3.46Å; I270-K274 WeakPolarHBondContact O-CA 3.44Å; I270-K274 WeakPolarHBondContact O-CG 3.46Å; I270-K274 PolarHBondContact O-N 3.4Å; I270-K274 VanDerWaalsContact O-N 3.09Å
271	E	85.8	Confident	86.1	Confident	155 Å²	155	68.1 Å²	68.1	72%	0.724	37%	0.372	S	S	*	.	H	α-helix	trans	-64.7	-45.8	176.3	-69.3	-177.7	165.1	0	0	111.3	P267	P267-E271 PolarHBondContact O-N 2.95Å
272	A	88.2	Confident	86.3	Confident	75 Å²	75	67 Å²	67	62%	0.62	37%	0.367	S	S	*	.	H	α-helix	trans	-63.2	-41.8	174.8	0	0	0	0	0	112.6	S268	S268-A272 VanDerWaalsContact O-CB 3.29Å; S268-A272 WeakPolarHBondContact O-CB 3.34Å; S268-A272 PolarHBondContact O-N 2.91Å
273	N	85.1	Confident	86.6	Confident	107 Å²	107	65.9 Å²	65.9	57%	0.572	36%	0.361	S	S	*	.			trans	-144.1	96.1	179.8	-81.2	-68.3	0	0	0	112.2	S269 I270 H275 C276	S269-N273 PolarHBondContact O-N 3.14Å; S269-N273 VanDerWaalsContact O-N 3.09Å; I270-N273 CarbonylContact O-C 3.48Å; I270-N273 PolarHBondContact O-N 3.46Å; N273-H275 PolarHBondContact O-N 3.05Å; N273-C276 HydrophobicContact CB-CB 4.03Å; N273-C276 WeakPolarHBondContact O-CB 3.36Å; N273-C276 PolarHBondContact O-N 3.02Å
274	K	82.3	Confident	86.9	Confident	156 Å²	156	62.7 Å²	62.7	68%	0.678	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-25.5	179.2	-63.2	-176.6	-179.8	-178.3	0	114.3	I270	I270-K274 WeakPolarHBondContact O-CA 3.44Å; I270-K274 WeakPolarHBondContact O-CG 3.46Å; I270-K274 PolarHBondContact O-N 3.4Å; I270-K274 VanDerWaalsContact O-N 3.09Å
275	H	81.6	Confident	87.2	Confident	163 Å²	163	60.2 Å²	60.2	76%	0.755	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	5	177.4	-63.4	-60.6	0	0	0	114.4	N273	N273-H275 PolarHBondContact O-N 3.05Å
276	C	81	Confident	87.6	Confident	54 Å²	54	59.2 Å²	59.2	37%	0.365	32%	0.324	S	S	.	.	S	Bend	trans	-57.5	145.5	177.8	-164	0	0	0	0	111.5	N273 R278	N273-C276 HydrophobicContact CB-CB 4.03Å; N273-C276 WeakPolarHBondContact O-CB 3.36Å; N273-C276 PolarHBondContact O-N 3.02Å; C276-R278 PolarHBondContact O-N 2.81Å
277	D	84.3	Confident	87.8	Confident	80 Å²	80	54.5 Å²	54.5	43%	0.428	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-65.8	132.9	168.5	-91.1	-19.3	0	0	0	108.8	K302 L746	D277-K302 IonicContact OD1-NZ 2.97Å; D277-K302 PolarHBondContact OD1-NZ 2.96Å; D277-K302 IonicContact OD2-NZ 3.3Å; D277-L746 CarbonylContact C-O 3.2Å; D277-L746 WeakPolarHBondContact CA-O 3.34Å; D277-L746 WeakPolarHBondContact CB-O 3.5Å
278	R	84.9	Confident	87.9	Confident	15 Å²	15	51.2 Å²	51.2	6%	0.057	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	158.8	-170.6	-57.9	-168.5	-174.6	162.1	13.4	112.3	Q263 T265 C276 V280 G745 L746 D752	Q263-R278 VanDerWaalsContact OE1-CD 3.25Å; Q263-R278 VanDerWaalsContact OE1-NH1 3.08Å; T265-R278 WeakPolarHBondContact OG1-CB 3.19Å; C276-R278 PolarHBondContact O-N 2.81Å; R278-V280 HydrophobicContact CB-CG2 4.4Å; R278-G745 PolarHBondContact O-N 3.04Å; R278-L746 PolarHBondContact N-O 2.96Å; R278-L746 WeakPolarHBondContact O-CA 2.97Å; R278-L746 PolarHBondContact O-N 3.46Å; R278-D752 IonicContact CZ-OD1 3.13Å; R278-D752 VanDerWaalsContact CZ-OD1 3.3Å; R278-D752 IonicContact CZ-OD2 2.78Å; R278-D752 IonicContact NH1-OD1 2.71Å; R278-D752 PolarHBondContact NH1-OD1 2.86Å; R278-D752 IonicContact NH1-OD2 3.8Å; R278-D752 VanDerWaalsContact NH2-CG 3.25Å; R278-D752 IonicContact NH2-OD1 2.69Å; R278-D752 PolarHBondContact NH2-OD1 2.83Å; R278-D752 IonicContact NH2-OD2 3.86Å; R278-D752 PolarHBondContact NH2-OD2 2.99Å
279	N	89.4	Confident	87.9	Confident	46 Å²	46	48.1 Å²	48.1	25%	0.246	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	130.4	165.3	-66.8	-20.9	0	0	0	108.3	V264 T265 N744	V264-N279 CarbonylContact C-O 3.47Å; V264-N279 PolarHBondContact N-O 2.93Å; V264-N279 VanDerWaalsContact O-CB 3.25Å; V264-N279 WeakPolarHBondContact O-CB 3.22Å; T265-N279 PolarHBondContact OG1-N 3.34Å; T265-N279 PolarHBondContact OG1-O 2.97Å; N279-N744 VanDerWaalsContact OD1-CA 3.25Å; N279-N744 WeakPolarHBondContact OD1-CA 3.32Å; N279-N744 WeakPolarHBondContact OD1-CB 3.41Å; N279-N744 PolarHBondContact OD1-OD1 3.08Å
280	V	88.6	Confident	88.1	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	130.9	-172.5	179.2	0	0	0	0	109.7	M261 E262 R278 F282 I743 L746 V751	M261-V280 HydrophobicContact CE-CG1 4.48Å; M261-V280 HydrophobicContact CG-CG1 3.62Å; M261-V280 HydrophobicContact SD-CG1 4.28Å; E262-V280 WeakPolarHBondContact O-CA 3.5Å; E262-V280 WeakPolarHBondContact O-CG1 3.39Å; R278-V280 HydrophobicContact CB-CG2 4.4Å; V280-F282 HydrophobicContact CB-CE2 4.15Å; V280-F282 HydrophobicContact CB-CZ 4.31Å; V280-F282 HydrophobicContact CG1-CD1 4.4Å; V280-F282 HydrophobicContact CG1-CD2 4.27Å; V280-F282 HydrophobicContact CG1-CE1 3.98Å; V280-F282 HydrophobicContact CG1-CE2 3.81Å; V280-F282 HydrophobicContact CG1-CZ 3.67Å; V280-I743 PolarHBondContact N-O 3.3Å; V280-I743 VanDerWaalsContact N-O 3.14Å; V280-I743 PolarHBondContact O-N 3.36Å; V280-L746 HydrophobicContact CB-CB 4.5Å; V280-L746 HydrophobicContact CB-CD1 4.13Å; V280-L746 HydrophobicContact CG2-CB 3.98Å; V280-L746 HydrophobicContact CG2-CD1 4.46Å; V280-V751 HydrophobicContact CG2-CG2 3.74Å
281	A	92	Very high	88.4	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.9	171.4	0	0	0	0	0	110.2	E262 V264 Y283 R740	E262-A281 HydrophobicContact CB-CB 4.46Å; E262-A281 PolarHBondContact N-O 3.4Å; E262-A281 PolarHBondContact O-N 3.05Å; V264-A281 HydrophobicContact CG2-CB 3.64Å; A281-Y283 HydrophobicContact CB-CE2 3.93Å; A281-R740 HydrophobicContact CB-CG 4.31Å
282	F	91.8	Very high	88.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.1	177.2	-65.2	-78.4	0	0	0	109.9	I258 M261 V280 I299 R740 V741 I743 L746 I762	I258-F282 HydrophobicContact CD1-CB 4.35Å; I258-F282 HydrophobicContact CD1-CD1 3.27Å; I258-F282 HydrophobicContact CD1-CE1 3.63Å; I258-F282 HydrophobicContact CD1-CG 3.96Å; I258-F282 HydrophobicContact CG1-CB 4.18Å; I258-F282 HydrophobicContact CG1-CD1 3.84Å; I258-F282 HydrophobicContact CG1-CG 4.32Å; I258-F282 HydrophobicContact CG2-CD1 3.88Å; M261-F282 HydrophobicContact CE-CD1 4.5Å; M261-F282 HydrophobicContact CE-CE1 3.59Å; M261-F282 HydrophobicContact CE-CZ 4.23Å; M261-F282 HydrophobicContact CG-CD1 4.5Å; M261-F282 HydrophobicContact CG-CE1 4.31Å; V280-F282 HydrophobicContact CB-CE2 4.15Å; V280-F282 HydrophobicContact CB-CZ 4.31Å; V280-F282 HydrophobicContact CG1-CD1 4.4Å; V280-F282 HydrophobicContact CG1-CD2 4.27Å; V280-F282 HydrophobicContact CG1-CE1 3.98Å; V280-F282 HydrophobicContact CG1-CE2 3.81Å; V280-F282 HydrophobicContact CG1-CZ 3.67Å; F282-I299 HydrophobicContact CE2-CD1 4.1Å; F282-I299 HydrophobicContact CZ-CD1 4.26Å; F282-R740 CarbonylContact O-C 3.32Å; F282-R740 WeakPolarHBondContact O-CA 3.32Å; F282-V741 PolarHBondContact N-O 3.16Å; F282-V741 PolarHBondContact O-N 3Å; F282-I743 HydrophobicContact CD2-CD1 4.03Å; F282-I743 HydrophobicContact CD2-CG1 4.26Å; F282-I743 HydrophobicContact CE2-CB 4.27Å; F282-I743 HydrophobicContact CE2-CD1 4.07Å; F282-I743 HydrophobicContact CE2-CG1 4.38Å; F282-L746 HydrophobicContact CE2-CD1 3.51Å; F282-L746 HydrophobicContact CZ-CD1 3.84Å; F282-I762 HydrophobicContact CB-CD1 3.77Å; F282-I762 HydrophobicContact CD1-CD1 4.42Å; F282-I762 HydrophobicContact CD2-CD1 3.77Å; F282-I762 HydrophobicContact CE2-CD1 4.44Å; F282-I762 HydrophobicContact CG-CD1 3.75Å
283	Y	93.5	Very high	88.3	Confident	24 Å²	24	44.5 Å²	44.5	9%	0.094	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.8	179.1	-57.9	-102.2	0	0	0	110.4	D259 R260 E262 A281 L333 Y738 V739 R740	D259-Y283 PolarHBondContact N-O 2.85Å; R260-Y283 HydrophobicContact CB-CD2 4.12Å; R260-Y283 HydrophobicContact CB-CG 4.38Å; R260-Y283 HydrophobicContact CG-CD2 4.44Å; R260-Y283 PolarHBondContact N-O 3.2Å; R260-Y283 PolarHBondContact O-N 3.03Å; E262-Y283 HydrophobicContact CB-CE2 4.11Å; E262-Y283 VanDerWaalsContact CD-OH 3.25Å; E262-Y283 HydrophobicContact CG-CE2 3.77Å; E262-Y283 WeakPolarHBondContact OE1-CE2 3.17Å; E262-Y283 PolarHBondContact OE1-OH 3.05Å; E262-Y283 VanDerWaalsContact OE2-CE2 3.26Å; E262-Y283 WeakPolarHBondContact OE2-CE2 3.39Å; E262-Y283 VanDerWaalsContact OE2-CZ 3.24Å; E262-Y283 PolarHBondContact OE2-OH 2.83Å; A281-Y283 HydrophobicContact CB-CE2 3.93Å; Y283-L333 HydrophobicContact CD1-CD1 3.65Å; Y283-L333 HydrophobicContact CE1-CD1 3.62Å; Y283-Y738 WeakPolarHBondContact CB-OH 3.27Å; Y283-Y738 HydrophobicContact CD1-CE1 4.44Å; Y283-V739 WeakPolarHBondContact CA-O 3.05Å; Y283-R740 HydrophobicContact CD1-CB 3.96Å; Y283-R740 HydrophobicContact CD1-CG 4.14Å; Y283-R740 HydrophobicContact CE1-CB 3.78Å; Y283-R740 HydrophobicContact CE1-CG 3.58Å; Y283-R740 HydrophobicContact CE2-CG 4.49Å; Y283-R740 PolarHBondContact OH-NE 2.85Å
284	G	92.6	Very high	88.2	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.7	172.9	173	0	0	0	0	0	114.2	L256 D259 V739	L256-G284 WeakPolarHBondContact CD1-O 3.12Å; D259-G284 WeakPolarHBondContact OD2-CA 3.48Å; G284-V739 PolarHBondContact N-O 3.46Å; G284-V739 PolarHBondContact O-N 3.27Å
285	Y	94.1	Very high	88.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	131.8	174.4	-62.8	-88.6	0	0	0	112.7	P82 T119 R127 D259 R287 D335 P336 C337 M737 Y738	P82-Y285 HydrophobicContact CG-CD1 4.25Å; P82-Y285 HydrophobicContact CG-CD2 3.56Å; P82-Y285 HydrophobicContact CG-CE2 3.87Å; P82-Y285 HydrophobicContact CG-CG 3.76Å; T119-Y285 HydrophobicContact CG2-CE2 4.21Å; R127-Y285 VanDerWaalsContact NH1-CE1 3.28Å; R127-Y285 PolarHBondContact NH1-OH 2.92Å; D259-Y285 WeakPolarHBondContact OD2-CD2 3.15Å; Y285-R287 PolarHBondContact O-NH1 3.37Å; Y285-D335 PolarHBondContact OH-OD1 3.16Å; Y285-P336 WeakPolarHBondContact OH-CD 3.37Å; Y285-P336 WeakPolarHBondContact OH-CG 3.22Å; Y285-C337 PolarHBondContact OH-N 3Å; Y285-M737 WeakPolarHBondContact CA-O 3.45Å; Y285-Y738 AromaticContact CD1-CD2 3.95Å; Y285-Y738 HydrophobicContact CD1-CD2 3.95Å; Y285-Y738 AromaticContact CD2-CD2 3.79Å; Y285-Y738 HydrophobicContact CD2-CD2 3.79Å; Y285-Y738 HydrophobicContact CD2-CE2 4.1Å; Y285-Y738 AromaticContact CE1-CD2 3.86Å; Y285-Y738 HydrophobicContact CE1-CD2 3.86Å; Y285-Y738 HydrophobicContact CE1-CG 4.4Å; Y285-Y738 AromaticContact CE2-CD2 3.69Å; Y285-Y738 HydrophobicContact CE2-CD2 3.69Å; Y285-Y738 AromaticContact CE2-CE2 3.95Å; Y285-Y738 HydrophobicContact CE2-CE2 3.95Å; Y285-Y738 AromaticContact CG-CD2 3.92Å; Y285-Y738 HydrophobicContact CG-CD2 3.92Å; Y285-Y738 AromaticContact CZ-CD2 3.75Å
286	V	92.9	Very high	88.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	134.5	169.4	-179.2	0	0	0	0	110.4	F291 P735 G736 M737 V739	V286-F291 HydrophobicContact CB-CD2 4.35Å; V286-F291 HydrophobicContact CG1-CD2 3.63Å; V286-F291 HydrophobicContact CG1-CE2 4.15Å; V286-F291 HydrophobicContact CG2-CD2 3.91Å; V286-P735 WeakPolarHBondContact O-CA 3.18Å; V286-G736 PolarHBondContact O-N 3.38Å; V286-M737 PolarHBondContact N-O 3.14Å; V286-V739 HydrophobicContact CG2-CB 4.11Å; V286-V739 HydrophobicContact CG2-CG2 3.64Å
287	R	91.5	Very high	88.9	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.015	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	148.7	-179.6	-62.3	174.5	-178.1	91.8	-18.4	110	P81 P82 T129 Y255 Y285	P81-R287 HydrophobicContact CB-CG 3.88Å; P81-R287 HydrophobicContact CG-CG 4.23Å; P82-R287 PolarHBondContact O-NE 2.83Å; T129-R287 PolarHBondContact OG1-NH2 3.07Å; T129-R287 VanDerWaalsContact OG1-NH2 3.13Å; Y255-R287 HydrophobicContact CD1-CB 4.29Å; Y255-R287 VanDerWaalsContact CD1-O 3.22Å; Y255-R287 WeakPolarHBondContact CD1-O 3.39Å; Y255-R287 HydrophobicContact CD2-CB 4.08Å; Y255-R287 HydrophobicContact CE1-CB 3.85Å; Y255-R287 HydrophobicContact CE2-CB 3.63Å; Y255-R287 HydrophobicContact CE2-CG 4.43Å; Y255-R287 HydrophobicContact CG-CB 4.39Å; Y255-R287 VanDerWaalsContact CZ-CB 3.48Å; Y255-R287 PolarHBondContact N-O 3.4Å; Y255-R287 PolarHBondContact O-N 3.14Å; Y255-R287 VanDerWaalsContact O-O 3.11Å; Y285-R287 PolarHBondContact O-NH1 3.37Å
288	G	88.5	Confident	89.1	Confident	18 Å²	18	27.2 Å²	27.2	19%	0.186	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88	-124.9	-178.7	0	0	0	0	0	112.7	R250 P735	R250-G288 WeakPolarHBondContact O-CA 3.39Å; G288-P735 WeakPolarHBondContact O-CG 3.42Å
289	C	88.5	Confident	88.9	Confident	17 Å²	17	26.6 Å²	26.6	12%	0.115	15%	0.146	C	C	.	.	S	Bend	trans	-74.2	167.6	168.9	-77.3	0	0	0	0	112.2	R75 S251 H253 P254	R75-C289 PolarHBondContact NH1-SG 3.09Å; S251-C289 PolarHBondContact O-SG 3.16Å; H253-C289 PolarHBondContact O-N 3.13Å; P254-C289 HydrophobicContact CB-CB 4.15Å; P254-C289 WeakPolarHBondContact CB-O 3.44Å
290	P	89.8	Confident	87.7	Confident	44 Å²	44	24.9 Å²	24.9	29%	0.286	14%	0.137	S	C	.	.	P	Polyproline II helix	trans	-61.5	150.3	162.9	-20.6	33.2	0	0	0	112.5	P254 E731 F733	P254-P290 WeakPolarHBondContact CB-O 3.38Å; P290-E731 WeakPolarHBondContact CB-O 3.5Å; P290-E731 WeakPolarHBondContact CG-O 3.42Å; P290-F733 CarbonylContact C-O 3.42Å; P290-F733 WeakPolarHBondContact CA-O 3.48Å
291	F	89	Confident	85.8	Confident	6 Å²	6	24.9 Å²	24.9	3%	0.026	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-88	139.4	167.4	-88.4	-77.9	0	0	0	111	P254 L256 V286 V297 I327 I330 G732 F733 I762	P254-F291 HydrophobicContact CB-CD1 3.91Å; P254-F291 HydrophobicContact CB-CD2 3.85Å; P254-F291 HydrophobicContact CB-CE1 3.93Å; P254-F291 HydrophobicContact CB-CE2 3.87Å; P254-F291 HydrophobicContact CB-CG 3.86Å; P254-F291 HydrophobicContact CB-CZ 3.9Å; P254-F291 HydrophobicContact CG-CD1 3.91Å; P254-F291 HydrophobicContact CG-CE1 3.92Å; P254-F291 HydrophobicContact CG-CG 4.32Å; P254-F291 HydrophobicContact CG-CZ 4.33Å; L256-F291 HydrophobicContact CB-CE2 4.07Å; L256-F291 HydrophobicContact CB-CZ 4.47Å; V286-F291 HydrophobicContact CB-CD2 4.35Å; V286-F291 HydrophobicContact CG1-CD2 3.63Å; V286-F291 HydrophobicContact CG1-CE2 4.15Å; V286-F291 HydrophobicContact CG2-CD2 3.91Å; F291-V297 HydrophobicContact CE1-CG2 4.11Å; F291-I327 HydrophobicContact CD1-CD1 4.48Å; F291-I330 HydrophobicContact CB-CD1 4.48Å; F291-G732 CarbonylContact O-C 3.53Å; F291-G732 VanDerWaalsContact O-CA 3.26Å; F291-G732 WeakPolarHBondContact O-CA 3.24Å; F291-F733 HydrophobicContact CB-CB 4.32Å; F291-F733 PolarHBondContact N-O 3.49Å; F291-F733 PolarHBondContact O-N 3.06Å; F291-I762 HydrophobicContact CE1-CG2 4.29Å; F291-I762 HydrophobicContact CZ-CG2 3.86Å
292	L	88.4	Confident	83.3	Confident	109 Å²	109	25.7 Å²	25.7	57%	0.571	14%	0.141	S	C	*	.	P	Polyproline II helix	trans	-94	142.7	171.7	-54.8	175.7	0	0	0	109.9	N294 S295	L292-N294 VanDerWaalsContact C-N 3.32Å; L292-N294 PolarHBondContact O-N 2.98Å; L292-S295 VanDerWaalsContact O-CB 3.29Å; L292-S295 WeakPolarHBondContact O-CB 3.29Å; L292-S295 PolarHBondContact O-N 3.19Å; L292-S295 PolarHBondContact O-OG 3.46Å
293	K	84.3	Confident	80.3	Confident	90 Å²	90	30.2 Å²	30.2	39%	0.391	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.3	-53.8	-179.9	-72.3	178.9	178.8	177.5	0	112.2	S295 D729 F733	K293-S295 PolarHBondContact O-N 2.73Å; K293-D729 VanDerWaalsContact CE-OD1 3.28Å; K293-D729 WeakPolarHBondContact CE-OD1 3.41Å; K293-D729 IonicContact NZ-OD1 2.75Å; K293-D729 PolarHBondContact NZ-OD1 3.2Å; K293-D729 IonicContact NZ-OD2 2.91Å; K293-D729 PolarHBondContact NZ-OD2 2.87Å; K293-F733 HydrophobicContact CG-CE2 3.85Å
294	N	83	Confident	77.4	Confident	159 Å²	159	31.8 Å²	31.8	85%	0.85	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	26.3	-175.7	-61.4	-7.4	0	0	0	114	L292	L292-N294 VanDerWaalsContact C-N 3.32Å; L292-N294 PolarHBondContact O-N 2.98Å
295	S	83.6	Confident	74.4	Confident	19 Å²	19	35.4 Å²	35.4	13%	0.133	20%	0.202	C	C	.	.			trans	-75.5	147.8	-178.1	59.1	0	0	0	0	113.4	L292 K293 I327	L292-S295 VanDerWaalsContact O-CB 3.29Å; L292-S295 WeakPolarHBondContact O-CB 3.29Å; L292-S295 PolarHBondContact O-N 3.19Å; L292-S295 PolarHBondContact O-OG 3.46Å; K293-S295 PolarHBondContact O-N 2.73Å; S295-I327 WeakPolarHBondContact O-CG1 3.42Å; S295-I327 PolarHBondContact O-N 2.8Å; S295-I327 WeakPolarHBondContact OG-CD1 2.92Å
296	S	87.4	Confident	71.5	Confident	16 Å²	16	42.3 Å²	42.3	11%	0.112	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.5	173	59	0	0	0	0	111.1	Y325 L765 Q770	S296-Y325 CarbonylContact C-O 3.58Å; S296-Y325 WeakPolarHBondContact CA-O 3.23Å; S296-L765 PolarHBondContact O-N 3.27Å; S296-Q770 PolarHBondContact OG-NE2 3.45Å
297	V	88.8	Confident	68.5	Low	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.3	-177.9	159.3	0	0	0	0	111.1	F291 I299 D324 Y325 I327 I743 I762	F291-V297 HydrophobicContact CE1-CG2 4.11Å; V297-I299 HydrophobicContact CG1-CG1 4.01Å; V297-D324 CarbonylContact O-C 3.57Å; V297-D324 WeakPolarHBondContact O-CA 3.44Å; V297-Y325 PolarHBondContact N-O 2.78Å; V297-Y325 PolarHBondContact O-N 3.24Å; V297-I327 HydrophobicContact CB-CG1 4.38Å; V297-I327 HydrophobicContact CG2-CD1 3.7Å; V297-I327 HydrophobicContact CG2-CG1 3.7Å; V297-I743 HydrophobicContact CG1-CD1 4.18Å; V297-I762 HydrophobicContact CB-CG2 4.41Å; V297-I762 HydrophobicContact CG1-CB 4.07Å; V297-I762 HydrophobicContact CG1-CG1 3.87Å; V297-I762 HydrophobicContact CG1-CG2 3.64Å; V297-I762 HydrophobicContact CG2-CG2 3.82Å
298	H	88.5	Confident	65.6	Low	3 Å²	3	57.3 Å²	57.3	1%	0.014	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115	160.1	-170	65.1	0	0	0	109.4	G323 D324 G763 L765 W801	H298-G323 PolarHBondContact ND1-O 3.01Å; H298-D324 IonicContact CE1-OD1 3.85Å; H298-D324 IonicContact CG-OD1 3.61Å; H298-D324 IonicContact ND1-OD1 2.71Å; H298-D324 PolarHBondContact ND1-OD1 2.85Å; H298-G763 PolarHBondContact N-O 2.96Å; H298-G763 PolarHBondContact O-N 2.92Å; H298-G763 VanDerWaalsContact O-N 3.13Å; H298-L765 HydrophobicContact CB-CD1 4.09Å; H298-L765 HydrophobicContact CB-CD2 4.12Å; H298-L765 HydrophobicContact CB-CG 4.09Å; H298-W801 HydrophobicContact CB-CB 4.29Å
299	I	81.5	Confident	62.8	Low	3 Å²	3	63.5 Å²	63.5	2%	0.015	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.8	161.3	-54.4	173.8	0	0	0	106.4	F282 V297 G301 G323 Y325 I743 L746 I762	F282-I299 HydrophobicContact CE2-CD1 4.1Å; F282-I299 HydrophobicContact CZ-CD1 4.26Å; V297-I299 HydrophobicContact CG1-CG1 4.01Å; I299-G301 PolarHBondContact O-N 3.22Å; I299-G323 PolarHBondContact N-O 3.45Å; I299-Y325 HydrophobicContact CD1-CD2 4.1Å; I299-Y325 HydrophobicContact CD1-CE2 4.48Å; I299-Y325 HydrophobicContact CG1-CD2 4.39Å; I299-I743 HydrophobicContact CD1-CD1 3.82Å; I299-I743 HydrophobicContact CD1-CG2 4.29Å; I299-I743 HydrophobicContact CG1-CD1 4.22Å; I299-L746 HydrophobicContact CD1-CD1 3.61Å; I299-L746 HydrophobicContact CD1-CD2 3.82Å; I299-L746 HydrophobicContact CD1-CG 4.41Å; I299-I762 HydrophobicContact CG1-CG1 4.31Å
300	V	63.7	Low	60.1	Low	9 Å²	9	71.2 Å²	71.2	6%	0.055	38%	0.378	C	S	.	.	S	Bend	trans	-76.1	57.5	-175.1	-176.6	0	0	0	0	111.2	R803 L974	V300-R803 VanDerWaalsContact CG1-NH2 3.27Å; V300-L974 WeakPolarHBondContact O-CD1 3.48Å
301	G	49.2	Very low	57.3	Low	2 Å²	2	79.3 Å²	79.3	2%	0.021	41%	0.409	C	S	.	.			trans	-137.9	-82.5	-155.5	0	0	0	0	0	118.5	I299 T972	I299-G301 PolarHBondContact O-N 3.22Å; G301-T972 WeakPolarHBondContact O-CA 3.14Å
302	K	39.1	Very low	54.5	Low	17 Å²	17	83.9 Å²	83.9	7%	0.074	44%	0.437	C	S	.	.			trans	-97.3	150.5	-157.3	172.3	158.6	168.3	177.3	0	117.2	D277 V322 Y325 P747 L975	D277-K302 IonicContact OD1-NZ 2.97Å; D277-K302 PolarHBondContact OD1-NZ 2.96Å; D277-K302 IonicContact OD2-NZ 3.3Å; K302-V322 CarbonylContact O-C 3.58Å; K302-V322 VanDerWaalsContact O-O 3.1Å; K302-Y325 WeakPolarHBondContact CD-OH 3.44Å; K302-P747 HydrophobicContact CB-CG 3.9Å; K302-P747 HydrophobicContact CD-CB 3.71Å; K302-P747 HydrophobicContact CD-CG 3.43Å; K302-P747 VanDerWaalsContact CD-CG 3.43Å; K302-P747 HydrophobicContact CG-CG 4.21Å; K302-L975 HydrophobicContact CB-CD1 4.02Å; K302-L975 HydrophobicContact CB-CD2 4.33Å; K302-L975 HydrophobicContact CG-CD1 4.09Å
303	M	28	Very low	51.7	Low	94 Å²	94	88.5 Å²	88.5	46%	0.463	45%	0.453	S	S	.	.			trans	-131.9	133.4	141.6	171.5	169.5	166.8	0	0	106.4	V322 T972	M303-V322 HydrophobicContact CB-CG1 3.42Å; M303-V322 VanDerWaalsContact CB-CG1 3.42Å; M303-V322 HydrophobicContact CG-CG1 3.46Å; M303-V322 VanDerWaalsContact CG-CG1 3.46Å; M303-V322 HydrophobicContact SD-CG1 4.17Å; M303-T972 HydrophobicContact CB-CG2 3.6Å
304	P	33.2	Very low	48.9	Very low	57 Å²	57	93.6 Å²	93.6	37%	0.37	48%	0.475	S	S	.	.			trans	-67.9	155.5	-179.9	27.9	-34.4	0	0	0	112.6
305	S	30.2	Very low	46.3	Very low	77 Å²	77	92 Å²	92	54%	0.538	47%	0.474	S	S	.	.			trans	-100	15.9	-161.4	-49.2	0	0	0	0	114.2	V307 E749	S305-V307 PolarHBondContact O-N 3.06Å; S305-E749 PolarHBondContact OG-OE1 2.88Å
306	D	31.9	Very low	43.8	Very low	145 Å²	145	100.5 Å²	100.5	78%	0.775	51%	0.51	S	S	*	.			trans	-93.5	43.7	-162.1	-54.7	-62.4	0	0	0	116.3
307	V	31.2	Very low	40.8	Very low	129 Å²	129	107.4 Å²	107.4	78%	0.782	54%	0.544	S	S	*	.			trans	-144.1	57.3	169.5	-156.2	0	0	0	0	114.3	S305	S305-V307 PolarHBondContact O-N 3.06Å
308	E	30.5	Very low	38	Very low	189 Å²	189	114.3 Å²	114.3	88%	0.883	58%	0.575	S	S	*	*	S	Bend	trans	-98.8	47.6	157.8	-70.7	-141.2	141.2	0	0	112.5
309	N	28.8	Very low	35	Very low	149 Å²	149	123.1 Å²	123.1	80%	0.797	61%	0.613	S	S	*	*			trans	-177.7	99.6	155.1	-98.7	-41.8	0	0	0	112.9
310	F	32.3	Very low	32.5	Very low	179 Å²	179	132.6 Å²	132.6	79%	0.785	65%	0.654	S	S	*	*				-175.6	140.8	128.7	-125.3	-117.8	0	0	0	114.2	T312	F310-T312 WeakPolarHBondContact CD1-OG1 3.45Å; F310-T312 WeakPolarHBondContact CE1-OG1 3.5Å; F310-T312 PolarHBondContact O-N 2.9Å
311	K	31.2	Very low	30.9	Very low	214 Å²	214	134 Å²	134	93%	0.93	67%	0.67	S	S	*	*			trans	-92.3	41.1	174.2	-72.3	179	178.2	165.2	0	113.4
312	T	30.8	Very low	30.9	Very low	101 Å²	101	135.3 Å²	135.3	62%	0.62	68%	0.678	S	S	*	*	S	Bend	trans	-144.1	149.2	-179.8	-15.1	0	0	0	0	116.4	F310 K314	F310-T312 WeakPolarHBondContact CD1-OG1 3.45Å; F310-T312 WeakPolarHBondContact CE1-OG1 3.5Å; F310-T312 PolarHBondContact O-N 2.9Å; T312-K314 PolarHBondContact O-N 3.05Å
313	K	28.5	Very low	32	Very low	207 Å²	207	134.6 Å²	134.6	90%	0.9	68%	0.675	S	S	*	*	S	Bend	trans	-61.7	86.8	-169.4	-55.1	162.4	-178.1	169.4	0	115
314	K	26.7	Very low	34.5	Very low	196 Å²	196	131.6 Å²	131.6	85%	0.852	66%	0.661	S	S	*	*			trans	-157.1	55.1	164	-130.8	176.3	-174.7	-177.3	0	117.8	T312 F316	T312-K314 PolarHBondContact O-N 3.05Å; K314-F316 PolarHBondContact O-N 2.82Å; K314-F316 VanDerWaalsContact O-N 3.16Å
315	C	28.3	Very low	37	Very low	125 Å²	125	130.2 Å²	130.2	85%	0.845	65%	0.648	S	S	*	*			trans	-84	82.6	169.4	-60	0	0	0	0	111.8
316	F	29.3	Very low	39.7	Very low	199 Å²	199	131.1 Å²	131.1	87%	0.873	65%	0.652	S	S	*	*			trans	-134.5	8.7	174.3	-127.7	-88.1	0	0	0	114.3	K314	K314-F316 PolarHBondContact O-N 2.82Å; K314-F316 VanDerWaalsContact O-N 3.16Å
317	L	25	Very low	42.3	Very low	160 Å²	160	124.9 Å²	124.9	84%	0.838	62%	0.619	S	S	*	*			trans	-100.3	40.2	-176.7	-149	75.5	0	0	0	113.4	K319	L317-K319 VanDerWaalsContact C-N 3.26Å; L317-K319 PolarHBondContact O-N 3.06Å
318	F	29.3	Very low	44.9	Very low	146 Å²	146	121.1 Å²	121.1	64%	0.64	61%	0.607	S	S	*	*			trans	-75.7	80.1	166	-91.6	-88.4	0	0	0	109.4	V322	F318-V322 HydrophobicContact CD1-CG2 4.45Å; F318-V322 HydrophobicContact CE1-CG2 4.21Å
319	K	27.1	Very low	47.7	Very low	187 Å²	187	116.4 Å²	116.4	81%	0.813	58%	0.584	S	S	*	*			trans	-126.1	142.5	167.8	-83.7	-171.3	171.7	-174.1	0	109.4	L317	L317-K319 VanDerWaalsContact C-N 3.26Å; L317-K319 PolarHBondContact O-N 3.06Å
320	K	28.2	Very low	50.7	Low	203 Å²	203	110.4 Å²	110.4	88%	0.883	55%	0.552	S	S	*	*	S	Bend	trans	64.9	142.9	-159.9	-60.4	-171.7	176.3	-177.2	0	113.2
321	G	30.1	Very low	53.5	Low	37 Å²	37	103.4 Å²	103.4	38%	0.381	53%	0.525	S	S	.	.	B	Isolated β-bridge	trans	-77.9	134	-173.1	0	0	0	0	0	111.5	G323 D324	G321-G323 VanDerWaalsContact C-N 3.29Å; G321-G323 PolarHBondContact O-N 2.94Å; G321-D324 PolarHBondContact O-N 3.24Å
322	V	48.2	Very low	56.2	Low	31 Å²	31	97.7 Å²	97.7	19%	0.188	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	77.1	-172.3	-178.6	0	0	0	0	109.9	K302 M303 F318 I970	K302-V322 CarbonylContact O-C 3.58Å; K302-V322 VanDerWaalsContact O-O 3.1Å; M303-V322 HydrophobicContact CB-CG1 3.42Å; M303-V322 VanDerWaalsContact CB-CG1 3.42Å; M303-V322 HydrophobicContact CG-CG1 3.46Å; M303-V322 VanDerWaalsContact CG-CG1 3.46Å; M303-V322 HydrophobicContact SD-CG1 4.17Å; F318-V322 HydrophobicContact CD1-CG2 4.45Å; F318-V322 HydrophobicContact CE1-CG2 4.21Å; V322-I970 HydrophobicContact CB-CD1 4.23Å; V322-I970 WeakPolarHBondContact O-CD1 3.13Å
323	G	63.5	Low	59.1	Low	2 Å²	2	96 Å²	96	2%	0.021	49%	0.487	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.4	6.2	-170.8	0	0	0	0	0	114.9	H298 I299 G321	H298-G323 PolarHBondContact ND1-O 3.01Å; I299-G323 PolarHBondContact N-O 3.45Å; G321-G323 VanDerWaalsContact C-N 3.29Å; G321-G323 PolarHBondContact O-N 2.94Å
324	D	80.5	Confident	62.1	Low	30 Å²	30	91.8 Å²	91.8	16%	0.16	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.6	169	-51.9	-34	0	0	0	108.3	V297 H298 G321 L765 R802	V297-D324 CarbonylContact O-C 3.57Å; V297-D324 WeakPolarHBondContact O-CA 3.44Å; H298-D324 IonicContact CE1-OD1 3.85Å; H298-D324 IonicContact CG-OD1 3.61Å; H298-D324 IonicContact ND1-OD1 2.71Å; H298-D324 PolarHBondContact ND1-OD1 2.85Å; G321-D324 PolarHBondContact O-N 3.24Å; D324-L765 HydrophobicContact CB-CD1 3.97Å; D324-R802 IonicContact OD1-CZ 3.61Å; D324-R802 IonicContact OD1-NE 2.65Å; D324-R802 PolarHBondContact OD1-NE 2.82Å; D324-R802 IonicContact OD1-NH2 2.73Å; D324-R802 IonicContact OD2-CZ 2.92Å; D324-R802 IonicContact OD2-NE 2.63Å; D324-R802 PolarHBondContact OD2-NE 3.47Å; D324-R802 IonicContact OD2-NH2 3.37Å; D324-R802 PolarHBondContact OD2-NH2 2.6Å
325	Y	84.4	Confident	65.1	Low	29 Å²	29	84.4 Å²	84.4	11%	0.114	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	142.1	-173.8	-69.5	-91.1	0	0	0	111.2	S296 V297 I299 K302 I743 G745 L746	S296-Y325 CarbonylContact C-O 3.58Å; S296-Y325 WeakPolarHBondContact CA-O 3.23Å; V297-Y325 PolarHBondContact N-O 2.78Å; V297-Y325 PolarHBondContact O-N 3.24Å; I299-Y325 HydrophobicContact CD1-CD2 4.1Å; I299-Y325 HydrophobicContact CD1-CE2 4.48Å; I299-Y325 HydrophobicContact CG1-CD2 4.39Å; K302-Y325 WeakPolarHBondContact CD-OH 3.44Å; Y325-I743 HydrophobicContact CD1-CG2 4.04Å; Y325-I743 HydrophobicContact CG-CG2 3.9Å; Y325-G745 VanDerWaalsContact CE1-O 3.27Å; Y325-G745 WeakPolarHBondContact CE1-O 3.45Å; Y325-G745 PolarHBondContact OH-O 2.94Å; Y325-L746 HydrophobicContact CD1-CD2 3.99Å; Y325-L746 HydrophobicContact CD2-CD2 4.05Å; Y325-L746 HydrophobicContact CE1-CD2 3.51Å; Y325-L746 HydrophobicContact CE2-CD2 3.57Å; Y325-L746 HydrophobicContact CG-CD2 4.24Å
326	P	87.3	Confident	67.9	Low	95 Å²	95	80.2 Å²	80.2	62%	0.617	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	146.5	156.1	32.5	-32.7	0	0	0	108.5
327	I	87.8	Confident	70.8	Confident	14 Å²	14	70.7 Å²	70.7	7%	0.072	38%	0.381	C	S	.	.			trans	-70.8	142.2	164.9	-60.2	168.3	0	0	0	108.4	F291 S295 V297 E329 I330 V741	F291-I327 HydrophobicContact CD1-CD1 4.48Å; S295-I327 WeakPolarHBondContact O-CG1 3.42Å; S295-I327 PolarHBondContact O-N 2.8Å; S295-I327 WeakPolarHBondContact OG-CD1 2.92Å; V297-I327 HydrophobicContact CB-CG1 4.38Å; V297-I327 HydrophobicContact CG2-CD1 3.7Å; V297-I327 HydrophobicContact CG2-CG1 3.7Å; I327-E329 VanDerWaalsContact CG2-O 3.29Å; I327-E329 WeakPolarHBondContact CG2-O 3.26Å; I327-I330 HydrophobicContact CB-CG1 4.48Å; I327-I330 HydrophobicContact CD1-CD1 3.65Å; I327-I330 HydrophobicContact CD1-CG1 4.14Å; I327-I330 HydrophobicContact CG2-CD1 4.23Å; I327-I330 HydrophobicContact CG2-CG1 3.54Å; I327-V741 HydrophobicContact CB-CG1 4.49Å; I327-V741 HydrophobicContact CD1-CG1 4.17Å; I327-V741 HydrophobicContact CG1-CG1 4.03Å; I327-V741 HydrophobicContact CG2-CG1 3.68Å
328	G	85	Confident	73.8	Confident	51 Å²	51	66.2 Å²	66.2	53%	0.526	36%	0.361	S	S	.	.	S	Bend	trans	-87	-49.8	175	0	0	0	0	0	112.2	Q742	G328-Q742 PolarHBondContact N-O 3.31Å
329	E	89.9	Confident	76.4	Confident	90 Å²	90	60.5 Å²	60.5	42%	0.421	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	148.2	176.1	-163.6	-156.2	117.1	0	0	109.7	I327 S331 Q742	I327-E329 VanDerWaalsContact CG2-O 3.29Å; I327-E329 WeakPolarHBondContact CG2-O 3.26Å; E329-S331 PolarHBondContact OE1-OG 3.32Å; E329-Q742 HydrophobicContact CB-CB 4.13Å; E329-Q742 PolarHBondContact N-O 2.78Å; E329-Q742 PolarHBondContact O-N 3.17Å
330	I	91.1	Very high	79	Confident	23 Å²	23	52.8 Å²	52.8	12%	0.118	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.3	165.8	-50.3	178.5	0	0	0	108.6	F291 I327 F733 V739 R740	F291-I330 HydrophobicContact CB-CD1 4.48Å; I327-I330 HydrophobicContact CB-CG1 4.48Å; I327-I330 HydrophobicContact CD1-CD1 3.65Å; I327-I330 HydrophobicContact CD1-CG1 4.14Å; I327-I330 HydrophobicContact CG2-CD1 4.23Å; I327-I330 HydrophobicContact CG2-CG1 3.54Å; I330-F733 HydrophobicContact CB-CD2 4.17Å; I330-F733 HydrophobicContact CB-CE1 4.38Å; I330-F733 HydrophobicContact CB-CE2 3.5Å; I330-F733 HydrophobicContact CB-CZ 3.62Å; I330-F733 HydrophobicContact CD1-CD2 3.93Å; I330-F733 HydrophobicContact CD1-CE2 3.84Å; I330-F733 HydrophobicContact CG1-CE2 4.23Å; I330-F733 HydrophobicContact CG2-CD1 3.97Å; I330-F733 HydrophobicContact CG2-CD2 3.67Å; I330-F733 HydrophobicContact CG2-CE1 3.72Å; I330-F733 HydrophobicContact CG2-CE2 3.41Å; I330-F733 VanDerWaalsContact CG2-CE2 3.41Å; I330-F733 HydrophobicContact CG2-CG 3.95Å; I330-F733 HydrophobicContact CG2-CZ 3.43Å; I330-F733 VanDerWaalsContact CG2-CZ 3.43Å; I330-F733 WeakPolarHBondContact O-CZ 3.34Å; I330-V739 HydrophobicContact CG2-CG1 3.24Å; I330-R740 WeakPolarHBondContact CA-O 3.36Å
331	S	90.7	Very high	81	Confident	32 Å²	32	47.5 Å²	47.5	22%	0.224	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137	169.1	25.9	0	0	0	0	110.3	E329 R740	E329-S331 PolarHBondContact OE1-OG 3.32Å; S331-R740 PolarHBondContact N-O 3.49Å; S331-R740 PolarHBondContact O-N 3.46Å
332	F	89.2	Confident	82.4	Confident	94 Å²	94	54.2 Å²	54.2	41%	0.412	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	154	170.6	70.6	-91.1	0	0	0	110.2	I728 F733 M737	F332-I728 HydrophobicContact CD1-CD1 3.55Å; F332-I728 HydrophobicContact CE1-CD1 3.85Å; F332-I728 HydrophobicContact CG-CD1 4.3Å; F332-F733 HydrophobicContact CB-CD1 4.26Å; F332-F733 HydrophobicContact CB-CE1 4.18Å; F332-F733 HydrophobicContact CD1-CE1 4.37Å; F332-M737 HydrophobicContact CB-CE 3.64Å; F332-M737 HydrophobicContact CD1-CE 4.43Å; F332-M737 HydrophobicContact CD2-CE 3.89Å; F332-M737 HydrophobicContact CG-CE 3.75Å
333	L	91.1	Very high	83.1	Confident	65 Å²	65	57.3 Å²	57.3	34%	0.34	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	156.3	-178.3	-76.2	169.7	0	0	0	111.3	Y283 Y738 R740	Y283-L333 HydrophobicContact CD1-CD1 3.65Å; Y283-L333 HydrophobicContact CE1-CD1 3.62Å; L333-Y738 HydrophobicContact CB-CD1 4.08Å; L333-Y738 HydrophobicContact CD1-CD1 4.49Å; L333-Y738 PolarHBondContact N-O 3.37Å; L333-R740 HydrophobicContact CD1-CB 3.91Å
334	P	90.8	Very high	83.2	Confident	118 Å²	118	67.6 Å²	67.6	77%	0.766	37%	0.372	S	S	*	.			trans	-52.1	142.2	167.7	-26.1	35.5	0	0	0	111.8	P336	P334-P336 WeakPolarHBondContact O-CD 3.28Å
335	D	89.6	Confident	82.7	Confident	41 Å²	41	72 Å²	72	22%	0.219	39%	0.387	C	S	.	.			trans	-74.9	119.7	-173.2	-167.9	-44.5	0	0	0	111.4	R127 Y285 C337 P338	R127-D335 IonicContact CZ-OD1 3.83Å; R127-D335 IonicContact CZ-OD2 3.3Å; R127-D335 IonicContact NH1-OD1 2.91Å; R127-D335 PolarHBondContact NH1-OD1 3.06Å; R127-D335 IonicContact NH1-OD2 3.18Å; R127-D335 PolarHBondContact NH1-OD2 2.69Å; R127-D335 IonicContact NH2-OD2 2.67Å; R127-D335 PolarHBondContact NH2-OD2 3.42Å; Y285-D335 PolarHBondContact OH-OD1 3.16Å; D335-C337 VanDerWaalsContact C-N 3.27Å; D335-C337 PolarHBondContact O-N 2.86Å; D335-C337 PolarHBondContact OD1-N 3.27Å; D335-P338 WeakPolarHBondContact O-CD 3.33Å
336	P	88.6	Confident	82.4	Confident	37 Å²	37	83.1 Å²	83.1	24%	0.24	43%	0.428	C	S	.	.	S	Bend	trans	-78.6	-4.3	-177.9	30.8	-33.8	0	0	0	114	Y285 P334 Y356 Y738	Y285-P336 WeakPolarHBondContact OH-CD 3.37Å; Y285-P336 WeakPolarHBondContact OH-CG 3.22Å; P334-P336 WeakPolarHBondContact O-CD 3.28Å; P336-Y356 HydrophobicContact CB-CD1 4.44Å; P336-Y356 HydrophobicContact CB-CD2 3.74Å; P336-Y356 HydrophobicContact CB-CE2 4.03Å; P336-Y356 HydrophobicContact CB-CG 3.96Å; P336-Y356 HydrophobicContact CG-CD1 4.11Å; P336-Y356 HydrophobicContact CG-CD2 4.27Å; P336-Y356 HydrophobicContact CG-CE1 4.25Å; P336-Y356 HydrophobicContact CG-CE2 4.41Å; P336-Y356 HydrophobicContact CG-CG 4.13Å; P336-Y738 HydrophobicContact CG-CD1 4.02Å; P336-Y738 HydrophobicContact CG-CD2 3.99Å; P336-Y738 HydrophobicContact CG-CE1 4.03Å; P336-Y738 HydrophobicContact CG-CE2 3.99Å; P336-Y738 HydrophobicContact CG-CG 4.01Å
337	C	88.9	Confident	82.2	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	42%	0.423	C	S	.	.	S	Bend	trans	-138.8	69.2	170.7	-83.7	0	0	0	0	110.1	T119 V121 R127 Y285 D335 Y356	T119-C337 HydrophobicContact CG2-CB 4.05Å; V121-C337 HydrophobicContact CG2-CB 4.25Å; R127-C337 PolarHBondContact NH1-O 3.42Å; Y285-C337 PolarHBondContact OH-N 3Å; D335-C337 VanDerWaalsContact C-N 3.27Å; D335-C337 PolarHBondContact O-N 2.86Å; D335-C337 PolarHBondContact OD1-N 3.27Å; C337-Y356 WeakPolarHBondContact SG-CB 3.18Å
338	P	88.2	Confident	82	Confident	66 Å²	66	82.3 Å²	82.3	43%	0.429	43%	0.427	S	S	.	.			trans	-64.5	150.4	-176	28.8	-34.9	0	0	0	111.3	D335 I354	D335-P338 WeakPolarHBondContact O-CD 3.33Å; P338-I354 HydrophobicContact CG-CD1 4.16Å
339	L	84.7	Confident	82	Confident	25 Å²	25	82.6 Å²	82.6	13%	0.131	42%	0.416	C	S	.	.			trans	-92	128.7	176.8	-73.3	176.4	0	0	0	110.2	L79 P80 R127 S341	L79-L339 HydrophobicContact CD1-CB 4.37Å; L79-L339 HydrophobicContact CD1-CD1 4.01Å; P80-L339 HydrophobicContact CG-CD1 4.35Å; R127-L339 HydrophobicContact CB-CD2 4.23Å; R127-L339 HydrophobicContact CG-CD1 4.47Å; R127-L339 HydrophobicContact CG-CD2 4.03Å; R127-L339 HydrophobicContact CG-CG 4.38Å; L339-S341 PolarHBondContact O-N 2.79Å; L339-S341 VanDerWaalsContact O-N 3.1Å
340	P	82.2	Confident	81.7	Confident	26 Å²	26	84 Å²	84	17%	0.169	42%	0.423	C	S	.	.			trans	-74.4	105.4	-175.5	28.5	-34.7	0	0	0	112.1	K124 L348 E352	K124-P340 HydrophobicContact CB-CG 4.29Å; K124-P340 HydrophobicContact CG-CG 4.09Å; P340-L348 HydrophobicContact CG-CD1 3.96Å; P340-E352 HydrophobicContact CB-CG 4.06Å; P340-E352 WeakPolarHBondContact CB-OE1 3.37Å; P340-E352 HydrophobicContact CG-CB 4.36Å; P340-E352 HydrophobicContact CG-CG 4.17Å; P340-E352 WeakPolarHBondContact CG-OE1 3.08Å
341	S	68.2	Low	81.4	Confident	91 Å²	91	94.3 Å²	94.3	64%	0.636	46%	0.46	S	S	*	.			trans	-83.4	-33	-174.5	40.9	0	0	0	0	115.2	L339	L339-S341 PolarHBondContact O-N 2.79Å; L339-S341 VanDerWaalsContact O-N 3.1Å
342	H	59.6	Low	81.1	Confident	178 Å²	178	94.5 Å²	94.5	82%	0.824	46%	0.458	S	S	*	.	S	Bend	trans	-91	-5.5	-155.7	-71	-75.5	0	0	0	117.9
343	E	63.4	Low	81.1	Confident	97 Å²	97	92.2 Å²	92.2	45%	0.453	45%	0.448	S	S	.	.			trans	-128.8	126.5	-175.4	-78.1	-146.3	-124.6	0	0	115.5	K124 R345	K124-E343 WeakPolarHBondContact CE-O 3.4Å; E343-R345 HydrophobicContact CB-CG 4.41Å; E343-R345 VanDerWaalsContact CD-NH2 3.29Å; E343-R345 PolarHBondContact O-N 3.44Å; E343-R345 IonicContact OE1-CZ 3.72Å; E343-R345 IonicContact OE1-NE 2.64Å; E343-R345 IonicContact OE1-NH2 2.66Å; E343-R345 PolarHBondContact OE1-NH2 3.45Å; E343-R345 IonicContact OE2-CZ 2.82Å; E343-R345 VanDerWaalsContact OE2-CZ 3.23Å; E343-R345 IonicContact OE2-NE 3.22Å; E343-R345 PolarHBondContact OE2-NE 2.94Å; E343-R345 IonicContact OE2-NH2 3.9Å; E343-R345 PolarHBondContact OE2-NH2 3.21Å
344	K	65.2	Low	81	Confident	218 Å²	218	92 Å²	92	95%	0.948	45%	0.447	S	S	*	.			trans	-70	18.8	179.5	-65.7	178.5	179.3	170.9	0	114.9
345	R	71.7	Confident	81	Confident	123 Å²	123	87.7 Å²	87.7	46%	0.464	42%	0.417	S	S	.	.			trans	-67.4	148	175.2	-61.6	-176.4	-163.1	-169	3.4	110.8	K124 E343 D349	K124-R345 VanDerWaalsContact CE-O 3.28Å; K124-R345 WeakPolarHBondContact CE-O 3.23Å; E343-R345 HydrophobicContact CB-CG 4.41Å; E343-R345 VanDerWaalsContact CD-NH2 3.29Å; E343-R345 PolarHBondContact O-N 3.44Å; E343-R345 IonicContact OE1-CZ 3.72Å; E343-R345 IonicContact OE1-NE 2.64Å; E343-R345 IonicContact OE1-NH2 2.66Å; E343-R345 PolarHBondContact OE1-NH2 3.45Å; E343-R345 IonicContact OE2-CZ 2.82Å; E343-R345 VanDerWaalsContact OE2-CZ 3.23Å; E343-R345 IonicContact OE2-NE 3.22Å; E343-R345 PolarHBondContact OE2-NE 2.94Å; E343-R345 IonicContact OE2-NH2 3.9Å; E343-R345 PolarHBondContact OE2-NH2 3.21Å; R345-D349 IonicContact CZ-OD2 2.74Å; R345-D349 IonicContact NE-OD2 3.29Å; R345-D349 IonicContact NH1-OD2 3.05Å; R345-D349 PolarHBondContact NH1-OD2 2.86Å
346	R	77.6	Confident	81.1	Confident	262 Å²	262	88.1 Å²	88.1	99%	0.989	42%	0.416	S	S	*	.	S	Bend	trans	-83.1	-23	174	-68.7	-175.7	179.8	174.1	1.8	113.8
347	A	82.2	Confident	81.1	Confident	60 Å²	60	86.8 Å²	86.8	50%	0.496	41%	0.407	S	S	.	.	S	Bend	trans	-89.7	166.5	177	0	0	0	0	0	111.3	K124	K124-A347 WeakPolarHBondContact CE-O 3.35Å
348	L	83.7	Confident	80.9	Confident	31 Å²	31	87.7 Å²	87.7	16%	0.162	41%	0.414	C	S	.	.			trans	-105.1	123.5	166	-170.9	81.8	0	0	0	106.8	V121 K124 P340 E352 K353	V121-L348 HydrophobicContact CG1-CD1 4.16Å; V121-L348 HydrophobicContact CG1-CD2 4.16Å; K124-L348 HydrophobicContact CG-CD1 4.31Å; P340-L348 HydrophobicContact CG-CD1 3.96Å; L348-E352 VanDerWaalsContact CA-OE2 3.27Å; L348-E352 WeakPolarHBondContact CA-OE2 3.36Å; L348-E352 HydrophobicContact CD1-CB 3.72Å; L348-E352 HydrophobicContact CD1-CG 4.48Å; L348-E352 VanDerWaalsContact CD1-OE2 3.3Å; L348-E352 WeakPolarHBondContact CD1-OE2 3.33Å; L348-E352 HydrophobicContact CG-CB 3.85Å; L348-K353 HydrophobicContact CD2-CG 3.72Å; L348-K353 HydrophobicContact CG-CG 4.35Å; L348-K353 WeakPolarHBondContact O-CE 3.49Å; L348-K353 PolarHBondContact O-NZ 2.85Å
349	D	84.5	Confident	80.6	Confident	57 Å²	57	85.6 Å²	85.6	31%	0.305	40%	0.398	S	S	.	.			trans	-76.3	171.6	-175.8	-75.4	-0.2	0	0	0	111	R345 E352 K353	R345-D349 IonicContact CZ-OD2 2.74Å; R345-D349 IonicContact NE-OD2 3.29Å; R345-D349 IonicContact NH1-OD2 3.05Å; R345-D349 PolarHBondContact NH1-OD2 2.86Å; D349-E352 HydrophobicContact CB-CG 4.26Å; D349-E352 PolarHBondContact N-OE2 3.2Å; D349-E352 PolarHBondContact O-N 2.88Å; D349-K353 WeakPolarHBondContact O-CE 3.44Å; D349-K353 WeakPolarHBondContact O-CG 3.17Å; D349-K353 PolarHBondContact O-NZ 2.87Å
350	E	83.9	Confident	80.5	Confident	120 Å²	120	84.5 Å²	84.5	56%	0.561	39%	0.392	S	S	*	.	S	Bend	trans	-73.1	-36.7	-169.4	-56.2	-102.1	127	0	0	111.9	K108 E352 K353	K108-E350 VanDerWaalsContact CE-OE1 3.23Å; K108-E350 WeakPolarHBondContact CE-OE1 3.19Å; K108-E350 WeakPolarHBondContact CE-OE2 3.29Å; K108-E350 IonicContact NZ-OE1 3.07Å; K108-E350 PolarHBondContact NZ-OE1 2.94Å; K108-E350 IonicContact NZ-OE2 2.97Å; K108-E350 PolarHBondContact NZ-OE2 3.07Å; E350-E352 VanDerWaalsContact C-N 3.29Å; E350-E352 PolarHBondContact O-N 2.98Å; E350-K353 PolarHBondContact O-N 3.3Å; E350-K353 IonicContact OE1-NZ 3.12Å
351	R	85.3	Confident	80.1	Confident	239 Å²	239	83.4 Å²	83.4	90%	0.902	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-26.4	175	-61.4	179.6	-179.5	178.8	-1.2	113	K353	R351-K353 VanDerWaalsContact C-N 3.27Å; R351-K353 PolarHBondContact O-N 3.13Å
352	E	85.4	Confident	80.6	Confident	37 Å²	37	80.8 Å²	80.8	17%	0.173	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.9	179.3	-60.4	178.4	140.4	0	0	113.1	V121 K124 P340 L348 D349 E350 I354	V121-E352 WeakPolarHBondContact CB-O 3.48Å; V121-E352 WeakPolarHBondContact CG1-O 3.38Å; K124-E352 IonicContact NZ-OE1 2.73Å; K124-E352 PolarHBondContact NZ-OE1 3.41Å; K124-E352 IonicContact NZ-OE2 3.91Å; K124-E352 PolarHBondContact NZ-OE2 2.75Å; P340-E352 HydrophobicContact CB-CG 4.06Å; P340-E352 WeakPolarHBondContact CB-OE1 3.37Å; P340-E352 HydrophobicContact CG-CB 4.36Å; P340-E352 HydrophobicContact CG-CG 4.17Å; P340-E352 WeakPolarHBondContact CG-OE1 3.08Å; L348-E352 VanDerWaalsContact CA-OE2 3.27Å; L348-E352 WeakPolarHBondContact CA-OE2 3.36Å; L348-E352 HydrophobicContact CD1-CB 3.72Å; L348-E352 HydrophobicContact CD1-CG 4.48Å; L348-E352 VanDerWaalsContact CD1-OE2 3.3Å; L348-E352 WeakPolarHBondContact CD1-OE2 3.33Å; L348-E352 HydrophobicContact CG-CB 3.85Å; D349-E352 HydrophobicContact CB-CG 4.26Å; D349-E352 PolarHBondContact N-OE2 3.2Å; D349-E352 PolarHBondContact O-N 2.88Å; E350-E352 VanDerWaalsContact C-N 3.29Å; E350-E352 PolarHBondContact O-N 2.98Å; E352-I354 PolarHBondContact O-N 2.88Å
353	K	87.4	Confident	81.2	Confident	45 Å²	45	75.9 Å²	75.9	20%	0.196	36%	0.363	C	S	.	.			trans	-87.9	51.3	-174.5	-70.3	168.9	-171.2	110.3	0	112.8	H106 L348 D349 E350 R351	H106-K353 WeakPolarHBondContact O-CD 3.11Å; L348-K353 HydrophobicContact CD2-CG 3.72Å; L348-K353 HydrophobicContact CG-CG 4.35Å; L348-K353 WeakPolarHBondContact O-CE 3.49Å; L348-K353 PolarHBondContact O-NZ 2.85Å; D349-K353 WeakPolarHBondContact O-CE 3.44Å; D349-K353 WeakPolarHBondContact O-CG 3.17Å; D349-K353 PolarHBondContact O-NZ 2.87Å; E350-K353 PolarHBondContact O-N 3.3Å; E350-K353 IonicContact OE1-NZ 3.12Å; R351-K353 VanDerWaalsContact C-N 3.27Å; R351-K353 PolarHBondContact O-N 3.13Å
354	I	89.6	Confident	81.8	Confident	62 Å²	62	72 Å²	72	32%	0.318	35%	0.349	S	S	.	.			trans	-68.9	144.4	-175	-54.6	171.5	0	0	0	111	V121 P338 E352	V121-I354 HydrophobicContact CG2-CB 4.14Å; V121-I354 PolarHBondContact N-O 2.93Å; V121-I354 VanDerWaalsContact N-O 3.13Å; P338-I354 HydrophobicContact CG-CD1 4.16Å; E352-I354 PolarHBondContact O-N 2.88Å
355	I	91.2	Very high	82.5	Confident	27 Å²	27	64.8 Å²	64.8	14%	0.138	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140	171.1	-176	173.2	0	0	0	109.5	V103 T107 V111 I118 T119 V120 A357 V362	V103-I355 HydrophobicContact CG1-CD1 3.67Å; T107-I355 HydrophobicContact CG2-CB 3.94Å; T107-I355 HydrophobicContact CG2-CD1 4.43Å; V111-I355 HydrophobicContact CG2-CD1 4.28Å; I118-I355 HydrophobicContact CG2-CD1 3.98Å; I118-I355 HydrophobicContact CG2-CG1 4.1Å; T119-I355 WeakPolarHBondContact O-CA 3.47Å; V120-I355 HydrophobicContact CG2-CG1 4.3Å; I355-A357 HydrophobicContact CD1-CB 4.5Å; I355-A357 HydrophobicContact CG1-CB 4.35Å; I355-V362 HydrophobicContact CD1-CG2 4.28Å; I355-V362 HydrophobicContact CG2-CG1 4.06Å
356	Y	91	Very high	82.8	Confident	50 Å²	50	60.7 Å²	60.7	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	115.9	169.1	-178.7	-105.6	0	0	0	109.7	T119 D259 P336 C337 P358 Y738	T119-Y356 PolarHBondContact N-O 3.17Å; T119-Y356 PolarHBondContact O-N 3.33Å; D259-Y356 HydrophobicContact CB-CE1 4.04Å; P336-Y356 HydrophobicContact CB-CD1 4.44Å; P336-Y356 HydrophobicContact CB-CD2 3.74Å; P336-Y356 HydrophobicContact CB-CE2 4.03Å; P336-Y356 HydrophobicContact CB-CG 3.96Å; P336-Y356 HydrophobicContact CG-CD1 4.11Å; P336-Y356 HydrophobicContact CG-CD2 4.27Å; P336-Y356 HydrophobicContact CG-CE1 4.25Å; P336-Y356 HydrophobicContact CG-CE2 4.41Å; P336-Y356 HydrophobicContact CG-CG 4.13Å; C337-Y356 WeakPolarHBondContact SG-CB 3.18Å; Y356-P358 HydrophobicContact CE1-CG 4.15Å; Y356-Y738 HydrophobicContact CE1-CE2 4.33Å; Y356-Y738 WeakPolarHBondContact CE1-OH 3.34Å; Y356-Y738 PolarHBondContact OH-OH 2.91Å
357	A	88.6	Confident	82.8	Confident	8 Å²	8	53.7 Å²	53.7	7%	0.066	28%	0.281	C	S	.	.			trans	-156.8	74.5	-173.6	0	0	0	0	0	111	I118 I355 F359 C360 V362	I118-A357 HydrophobicContact CB-CB 4.19Å; I118-A357 HydrophobicContact CG1-CB 3.93Å; I118-A357 HydrophobicContact CG2-CB 3.99Å; I355-A357 HydrophobicContact CD1-CB 4.5Å; I355-A357 HydrophobicContact CG1-CB 4.35Å; A357-F359 VanDerWaalsContact C-N 3.29Å; A357-F359 PolarHBondContact O-N 2.71Å; A357-C360 HydrophobicContact CB-CB 3.81Å; A357-C360 PolarHBondContact O-N 2.89Å; A357-V362 HydrophobicContact CB-CG2 4.07Å
358	P	84.4	Confident	82.3	Confident	20 Å²	20	53.8 Å²	53.8	13%	0.13	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.8	-165.1	25.7	-36.1	0	0	0	114.6	D259 R260 Y356	D259-P358 WeakPolarHBondContact O-CG 3.28Å; R260-P358 HydrophobicContact CB-CG 4.15Å; Y356-P358 HydrophobicContact CE1-CG 4.15Å
359	F	82.6	Confident	81.8	Confident	22 Å²	22	57.5 Å²	57.5	10%	0.096	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	0.1	176.9	-58.9	-59.9	0	0	0	114.2	K115 D259 A357 L366 F754 P756	K115-F359 HydrophobicContact CB-CB 4.12Å; K115-F359 WeakPolarHBondContact CB-O 3.29Å; D259-F359 WeakPolarHBondContact O-CE2 3.28Å; A357-F359 VanDerWaalsContact C-N 3.29Å; A357-F359 PolarHBondContact O-N 2.71Å; F359-L366 VanDerWaalsContact O-CD1 3.3Å; F359-L366 WeakPolarHBondContact O-CD1 3.36Å; F359-F754 HydrophobicContact CD1-CE1 4.46Å; F359-F754 AromaticContact CE1-CE1 3.73Å; F359-F754 HydrophobicContact CE1-CE1 3.73Å; F359-F754 HydrophobicContact CE1-CZ 4.11Å; F359-F754 HydrophobicContact CE2-CE1 4.38Å; F359-F754 AromaticContact CE2-CZ 3.99Å; F359-F754 HydrophobicContact CE2-CZ 3.99Å; F359-F754 AromaticContact CZ-CE1 3.67Å; F359-F754 HydrophobicContact CZ-CE1 3.67Å; F359-F754 AromaticContact CZ-CZ 3.55Å; F359-F754 HydrophobicContact CZ-CZ 3.55Å; F359-P756 HydrophobicContact CB-CB 3.93Å; F359-P756 HydrophobicContact CB-CG 4.39Å; F359-P756 HydrophobicContact CD1-CB 4.23Å; F359-P756 HydrophobicContact CD2-CB 3.85Å; F359-P756 HydrophobicContact CE2-CB 4.39Å; F359-P756 HydrophobicContact CG-CB 3.75Å; F359-P756 HydrophobicContact CG-CG 4.43Å
360	C	82.5	Confident	81.5	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.014	32%	0.315	C	S	.	.	S	Bend	trans	-100.2	150	-178.1	-75.8	0	0	0	0	111.9	V111 K115 A357 V362	V111-C360 HydrophobicContact CG1-CB 3.83Å; K115-C360 PolarHBondContact N-SG 3.28Å; K115-C360 VanDerWaalsContact N-SG 3.39Å; K115-C360 PolarHBondContact O-SG 3.35Å; A357-C360 HydrophobicContact CB-CB 3.81Å; A357-C360 PolarHBondContact O-N 2.89Å; C360-V362 VanDerWaalsContact C-N 3.27Å; C360-V362 HydrophobicContact CB-CG2 4.14Å; C360-V362 PolarHBondContact O-N 2.84Å
361	G	75	Confident	81.3	Confident	2 Å²	2	58.7 Å²	58.7	2%	0.021	30%	0.304	C	S	.	.			trans	-71.8	74.7	172.5	0	0	0	0	0	112.4	A113 I365	A113-G361 PolarHBondContact O-N 3.17Å; G361-I365 WeakPolarHBondContact CA-O 3.1Å
362	V	78	Confident	81.2	Confident	37 Å²	37	51.1 Å²	51.1	22%	0.224	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-87	124	178.8	-176.3	0	0	0	0	108.9	V111 I355 A357 C360 G364 I365	V111-V362 HydrophobicContact CG2-CG2 4.38Å; I355-V362 HydrophobicContact CD1-CG2 4.28Å; I355-V362 HydrophobicContact CG2-CG1 4.06Å; A357-V362 HydrophobicContact CB-CG2 4.07Å; C360-V362 VanDerWaalsContact C-N 3.27Å; C360-V362 HydrophobicContact CB-CG2 4.14Å; C360-V362 PolarHBondContact O-N 2.84Å; V362-G364 PolarHBondContact O-N 2.89Å; V362-G364 VanDerWaalsContact O-N 3.08Å; V362-I365 PolarHBondContact N-O 2.89Å; V362-I365 PolarHBondContact O-N 3.02Å; V362-I365 VanDerWaalsContact O-N 3.08Å
363	G	73.1	Confident	81	Confident	75 Å²	75	55.8 Å²	55.8	77%	0.773	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	7.9	-177.8	0	0	0	0	0	115.2
364	G	74.4	Confident	80.8	Confident	15 Å²	15	57.9 Å²	57.9	16%	0.155	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.2	-7.3	-173.2	0	0	0	0	0	114.4	V362 V374 D375	V362-G364 PolarHBondContact O-N 2.89Å; V362-G364 VanDerWaalsContact O-N 3.08Å; G364-V374 WeakPolarHBondContact O-CA 3.35Å; G364-D375 PolarHBondContact O-N 2.77Å
365	I	81.5	Confident	79.9	Confident	67 Å²	67	60.4 Å²	60.4	34%	0.344	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.5	179.2	-53	176.7	0	0	0	109.5	G361 V362 Y367 V372	G361-I365 WeakPolarHBondContact CA-O 3.1Å; V362-I365 PolarHBondContact N-O 2.89Å; V362-I365 PolarHBondContact O-N 3.02Å; V362-I365 VanDerWaalsContact O-N 3.08Å; I365-Y367 HydrophobicContact CG2-CD2 4.3Å; I365-Y367 HydrophobicContact CG2-CE2 3.68Å; I365-V372 HydrophobicContact CG2-CG1 3.59Å
366	L	78	Confident	78.9	Confident	36 Å²	36	64.7 Å²	64.7	19%	0.188	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	117.1	176	172.6	69.1	0	0	0	109.8	F359 Y373	F359-L366 VanDerWaalsContact O-CD1 3.3Å; F359-L366 WeakPolarHBondContact O-CD1 3.36Å; L366-Y373 PolarHBondContact N-O 2.72Å; L366-Y373 PolarHBondContact O-N 3.37Å
367	Y	76.5	Confident	77.6	Confident	115 Å²	115	67.7 Å²	67.7	45%	0.451	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.8	171.5	-59.6	-90	0	0	0	110.2	I365 V372	I365-Y367 HydrophobicContact CG2-CD2 4.3Å; I365-Y367 HydrophobicContact CG2-CE2 3.68Å; Y367-V372 HydrophobicContact CD1-CG1 4.36Å; Y367-V372 HydrophobicContact CD1-CG2 3.73Å; Y367-V372 HydrophobicContact CE1-CG1 4.12Å; Y367-V372 HydrophobicContact CE1-CG2 3.74Å
368	D	72	Confident	76.2	Confident	62 Å²	62	77.8 Å²	77.8	33%	0.332	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	106	170.6	-158.4	-10.2	0	0	0	110	D370 A371 Y373	D368-D370 PolarHBondContact O-N 2.85Å; D368-A371 PolarHBondContact N-O 3.48Å; D368-A371 PolarHBondContact O-N 2.77Å; D368-Y373 HydrophobicContact CB-CD2 4.48Å; D368-Y373 HydrophobicContact CB-CE2 4.06Å
369	K	72.7	Confident	74.9	Confident	110 Å²	110	80.8 Å²	80.8	48%	0.478	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	-102.1	-165.5	-52.6	-171.7	-173	-167.2	0	110.8	V751	K369-V751 PolarHBondContact NZ-O 2.96Å
370	D	77.5	Confident	73.5	Confident	160 Å²	160	89.2 Å²	89.2	86%	0.856	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-8.6	-175.7	-41.5	-66.9	0	0	0	112.3	D368	D368-D370 PolarHBondContact O-N 2.85Å
371	A	80	Confident	71.8	Confident	41 Å²	41	96.5 Å²	96.5	34%	0.339	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	142.3	179.1	0	0	0	0	0	111.9	D368 Y373	D368-A371 PolarHBondContact N-O 3.48Å; D368-A371 PolarHBondContact O-N 2.77Å; A371-Y373 HydrophobicContact CB-CE2 3.91Å
372	V	83.7	Confident	70.7	Confident	80 Å²	80	101.4 Å²	101.4	49%	0.485	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	112.2	176.6	-170.6	0	0	0	0	109.4	I365 Y367 V374	I365-V372 HydrophobicContact CG2-CG1 3.59Å; Y367-V372 HydrophobicContact CD1-CG1 4.36Å; Y367-V372 HydrophobicContact CD1-CG2 3.73Å; Y367-V372 HydrophobicContact CE1-CG1 4.12Å; Y367-V372 HydrophobicContact CE1-CG2 3.74Å; V372-V374 HydrophobicContact CG1-CG2 4.22Å
373	Y	81.5	Confident	69.4	Low	136 Å²	136	102.3 Å²	102.3	53%	0.533	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.9	174.5	-60.2	-92.4	0	0	0	109.4	L366 D368 A371	L366-Y373 PolarHBondContact N-O 2.72Å; L366-Y373 PolarHBondContact O-N 3.37Å; D368-Y373 HydrophobicContact CB-CD2 4.48Å; D368-Y373 HydrophobicContact CB-CE2 4.06Å; A371-Y373 HydrophobicContact CB-CE2 3.91Å
374	V	82.2	Confident	68	Low	88 Å²	88	106.6 Å²	106.6	53%	0.533	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	102.5	-178.4	-174.3	0	0	0	0	110.3	G364 V372 M376	G364-V374 WeakPolarHBondContact O-CA 3.35Å; V372-V374 HydrophobicContact CG1-CG2 4.22Å; V374-M376 VanDerWaalsContact C-N 3.34Å; V374-M376 HydrophobicContact CG1-CG 4.07Å; V374-M376 PolarHBondContact O-N 3.17Å
375	D	71.4	Confident	66.6	Low	116 Å²	116	114.6 Å²	114.6	62%	0.62	56%	0.564	S	S	*	*			trans	-74.5	80.8	174.8	-85.1	-27.2	0	0	0	110.6	G364	G364-D375 PolarHBondContact O-N 2.77Å
376	M	70.2	Confident	64.6	Low	116 Å²	116	117.7 Å²	117.7	57%	0.571	59%	0.586	S	S	*	*			trans	-69.7	129.5	170.4	-69	-163.4	-74.1	0	0	111.1	V374	V374-M376 VanDerWaalsContact C-N 3.34Å; V374-M376 HydrophobicContact CG1-CG 4.07Å; V374-M376 PolarHBondContact O-N 3.17Å
377	P	63.5	Low	62.6	Low	113 Å²	113	121.3 Å²	121.3	73%	0.734	61%	0.614	S	S	*	*			trans	-62.8	152.5	173	26.8	-33.3	0	0	0	110.9	S379	P377-S379 PolarHBondContact O-N 2.9Å
378	R	59.2	Low	60.7	Low	220 Å²	220	120.5 Å²	120.5	83%	0.83	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-6.9	-155.2	-82.2	-176.2	173.1	-177.8	-2.6	119.5
379	S	58.7	Low	59	Low	83 Å²	83	121 Å²	121	58%	0.58	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-3.2	-175.8	-62	0	0	0	0	115.7	P377	P377-S379 PolarHBondContact O-N 2.9Å
380	R	52	Low	57	Low	200 Å²	200	126.1 Å²	126.1	76%	0.755	67%	0.674	S	S	*	*			trans	-138	86.7	174.8	-71.4	-173.6	174.5	176.2	-5.4	110.7
381	R	47.9	Very low	54.9	Low	154 Å²	154	124 Å²	124	58%	0.581	67%	0.671	S	S	*	*			trans	-117.9	63	179.3	-82.9	-168.6	165.3	-151.3	-6.4	111.8	G383	R381-G383 PolarHBondContact O-N 2.85Å
382	H	51.1	Low	52.6	Low	105 Å²	105	128.7 Å²	128.7	49%	0.486	69%	0.689	S	S	.	*			trans	-51.1	129.3	147.6	-80.4	18	0	0	0	108	D406 V409	H382-D406 IonicContact CE1-OD1 2.75Å; H382-D406 PolarHBondContact CE1-OD1 2.93Å; H382-D406 IonicContact CE1-OD2 3.38Å; H382-D406 PolarHBondContact CE1-OD2 2.61Å; H382-D406 IonicContact CG-OD2 2.72Å; H382-D406 IonicContact ND1-OD1 3.76Å; H382-D406 PolarHBondContact ND1-OD1 2.73Å; H382-D406 IonicContact ND1-OD2 2.74Å; H382-D406 PolarHBondContact ND1-OD2 2.82Å; H382-V409 WeakPolarHBondContact NE2-CG1 3.21Å
383	G	50.9	Low	50.3	Low	56 Å²	56	132.8 Å²	132.8	58%	0.577	70%	0.702	S	S	*	*	S	Bend	trans	144	105.5	178.4	0	0	0	0	0	112.8	R381 R385	R381-G383 PolarHBondContact O-N 2.85Å; G383-R385 WeakPolarHBondContact O-CG 3.36Å; G383-R385 PolarHBondContact O-N 3.04Å; G383-R385 VanDerWaalsContact O-N 3.16Å
384	N	44.2	Very low	48.4	Very low	165 Å²	165	134.5 Å²	134.5	88%	0.882	72%	0.72	S	S	*	*			trans	-33.5	105.5	-171.6	-63.8	-8.3	0	0	0	115.6
385	R	44.2	Very low	46.2	Very low	184 Å²	184	136.3 Å²	136.3	69%	0.694	72%	0.721	S	S	*	*			trans	-100.5	77	175.9	-69.7	177.8	94.5	178.7	0.5	111.7	G383	G383-R385 WeakPolarHBondContact O-CG 3.36Å; G383-R385 PolarHBondContact O-N 3.04Å; G383-R385 VanDerWaalsContact O-N 3.16Å
386	V	39.7	Very low	44.9	Very low	131 Å²	131	135.3 Å²	135.3	79%	0.794	71%	0.714	S	S	*	*			trans	-87.6	131.5	165.7	-177.4	0	0	0	0	109.6
387	S	35.3	Very low	43.7	Very low	113 Å²	113	137 Å²	137	79%	0.79	72%	0.724	S	S	*	*	S	Bend	trans	78.2	156.6	172.2	82.1	0	0	0	0	119.8
388	A	36.8	Very low	42.4	Very low	98 Å²	98	137.8 Å²	137.8	81%	0.81	72%	0.716	S	S	*	*			trans	72.4	65.1	165.7	0	0	0	0	0	120.4
389	G	36.1	Very low	41.8	Very low	72 Å²	72	130.9 Å²	130.9	74%	0.742	70%	0.695	S	S	*	*				64.5	139.3	112	0	0	0	0	0	122.9
390	F	30.8	Very low	41.2	Very low	217 Å²	217	133 Å²	133	95%	0.952	70%	0.699	S	S	*	*			trans	59.7	94.7	162.9	-79.2	-92.3	0	0	0	119.1
391	C	33.3	Very low	41	Very low	117 Å²	117	130.2 Å²	130.2	79%	0.791	70%	0.697	S	S	*	*				-174.8	107.1	99.8	-167.3	0	0	0	0	110.8
392	L	32	Very low	41.1	Very low	138 Å²	138	126.3 Å²	126.3	72%	0.723	69%	0.688	S	S	*	*			trans	-102.8	113	-174.9	-84.1	138.9	0	0	0	112.1
393	H	35.3	Very low	41.2	Very low	166 Å²	166	129 Å²	129	77%	0.769	70%	0.695	S	S	*	*	S	Bend	trans	-163.3	-47.9	139.7	-117.1	64.8	0	0	0	113.5	F395	H393-F395 VanDerWaalsContact C-N 3.26Å; H393-F395 PolarHBondContact O-N 3.28Å
394	L	41.9	Very low	41.3	Very low	172 Å²	172	134.1 Å²	134.1	90%	0.901	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-2	-179.8	-106.5	69.9	0	0	0	114.7
395	F	36.2	Very low	41.9	Very low	126 Å²	126	132.3 Å²	132.3	55%	0.553	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-13.7	-170	-143.3	-96.3	0	0	0	114	H393 I399	H393-F395 VanDerWaalsContact C-N 3.26Å; H393-F395 PolarHBondContact O-N 3.28Å; F395-I399 HydrophobicContact CD1-CD1 3.67Å; F395-I399 HydrophobicContact CD1-CG1 4.11Å; F395-I399 HydrophobicContact CE1-CD1 4.05Å; F395-I399 HydrophobicContact CE1-CG1 4.27Å
396	I	43	Very low	42.5	Very low	95 Å²	95	126.9 Å²	126.9	49%	0.487	68%	0.679	S	S	.	*	H	α-helix	trans	-74.6	-39.1	-170.7	-63.8	170.7	0	0	0	112	F398 I399 I400	I396-F398 VanDerWaalsContact C-N 3.32Å; I396-F398 PolarHBondContact O-N 2.62Å; I396-I399 PolarHBondContact O-N 2.9Å; I396-I400 HydrophobicContact CG2-CD1 4.48Å
397	I	45.6	Very low	43.7	Very low	151 Å²	151	127 Å²	127	77%	0.774	67%	0.671	S	S	*	*	H	α-helix	trans	-69.8	-28.7	-175.5	-63.5	174.8	0	0	0	112.2
398	F	36.6	Very low	45.2	Very low	130 Å²	130	130.7 Å²	130.7	57%	0.57	67%	0.668	S	S	*	*	H	α-helix	trans	-85	-15.5	178.5	-145.5	-82.3	0	0	0	113	I396	I396-F398 VanDerWaalsContact C-N 3.32Å; I396-F398 PolarHBondContact O-N 2.62Å
399	I	47.5	Very low	46.7	Very low	76 Å²	76	129.5 Å²	129.5	39%	0.39	65%	0.65	S	S	.	*	H	α-helix	trans	-75.8	-23.5	-179.5	-90.1	177.4	0	0	0	112.7	F395 I396 I401 Y403	F395-I399 HydrophobicContact CD1-CD1 3.67Å; F395-I399 HydrophobicContact CD1-CG1 4.11Å; F395-I399 HydrophobicContact CE1-CD1 4.05Å; F395-I399 HydrophobicContact CE1-CG1 4.27Å; I396-I399 PolarHBondContact O-N 2.9Å; I399-I401 PolarHBondContact O-N 2.73Å; I399-Y403 HydrophobicContact CG2-CD2 4.33Å; I399-Y403 HydrophobicContact CG2-CE2 3.96Å; I399-Y403 VanDerWaalsContact O-CD2 3.25Å; I399-Y403 WeakPolarHBondContact O-CD2 3.04Å
400	I	44.6	Very low	48.2	Very low	127 Å²	127	128.9 Å²	128.9	65%	0.651	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-10.4	-165.2	-65.8	168.7	0	0	0	113.5	I396	I396-I400 HydrophobicContact CG2-CD1 4.48Å
401	I	49	Very low	50	Low	142 Å²	142	126 Å²	126	73%	0.728	63%	0.627	S	S	*	*	S	Bend	trans	-102	-30	-173.6	-63.2	177	0	0	0	113	I399	I399-I401 PolarHBondContact O-N 2.73Å
402	D	48.3	Very low	51.9	Low	71 Å²	71	126.3 Å²	126.3	38%	0.38	62%	0.621	S	S	.	*	S	Bend	trans	-100.6	19.2	-168.4	-56.9	-30.2	0	0	0	113.6
403	Y	53.5	Low	53.7	Low	161 Å²	161	123 Å²	123	63%	0.631	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-25.4	-168.4	-112.7	-104.7	0	0	0	116.5	I399	I399-Y403 HydrophobicContact CG2-CD2 4.33Å; I399-Y403 HydrophobicContact CG2-CE2 3.96Å; I399-Y403 VanDerWaalsContact O-CD2 3.25Å; I399-Y403 WeakPolarHBondContact O-CD2 3.04Å
404	E	53.3	Low	55.6	Low	164 Å²	164	122.7 Å²	122.7	77%	0.766	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-41.1	179.8	-67.3	-177.5	145.5	0	0	111.8	D406 W408	E404-D406 PolarHBondContact O-N 3.33Å; E404-W408 VanDerWaalsContact O-CD1 3.23Å
405	D	56.7	Low	56.8	Low	128 Å²	128	118 Å²	118	68%	0.684	59%	0.588	S	S	*	*	H	α-helix	trans	-64.4	-37.2	-179.7	-76.9	-14.4	0	0	0	113.3	E407 V409	D405-E407 PolarHBondContact O-N 3.48Å; D405-V409 WeakPolarHBondContact O-CG2 3.33Å; D405-V409 PolarHBondContact O-N 3.04Å
406	D	58.2	Low	58.5	Low	69 Å²	69	121.6 Å²	121.6	37%	0.369	61%	0.606	S	S	.	*	H	α-helix	trans	-65.6	-32.3	-175.7	-95.2	51.5	0	0	0	112.7	H382 E404 A410	H382-D406 IonicContact CE1-OD1 2.75Å; H382-D406 PolarHBondContact CE1-OD1 2.93Å; H382-D406 IonicContact CE1-OD2 3.38Å; H382-D406 PolarHBondContact CE1-OD2 2.61Å; H382-D406 IonicContact CG-OD2 2.72Å; H382-D406 IonicContact ND1-OD1 3.76Å; H382-D406 PolarHBondContact ND1-OD1 2.73Å; H382-D406 IonicContact ND1-OD2 2.74Å; H382-D406 PolarHBondContact ND1-OD2 2.82Å; E404-D406 PolarHBondContact O-N 3.33Å; D406-A410 PolarHBondContact O-N 2.87Å
407	E	63.4	Low	59.9	Low	135 Å²	135	121.5 Å²	121.5	63%	0.631	60%	0.602	S	S	*	*	H	α-helix	trans	-74.1	-43.6	178.7	-69.1	-166.3	148	0	0	112.2	D405 V409 A410 E411	D405-E407 PolarHBondContact O-N 3.48Å; E407-V409 VanDerWaalsContact C-N 3.32Å; E407-V409 PolarHBondContact O-N 3.48Å; E407-A410 WeakPolarHBondContact O-CB 3.49Å; E407-A410 PolarHBondContact O-N 2.78Å; E407-A410 VanDerWaalsContact O-N 3.09Å; E407-E411 PolarHBondContact O-N 3.37Å
408	W	67.2	Low	61.4	Low	190 Å²	190	118.5 Å²	118.5	72%	0.72	59%	0.591	S	S	*	*	H	α-helix	trans	-63.5	-37.8	179.3	-72.5	64.2	0	0	0	111.8	E404 A410 L412	E404-W408 VanDerWaalsContact O-CD1 3.23Å; W408-A410 VanDerWaalsContact C-N 3.35Å; W408-L412 VanDerWaalsContact O-CB 3.29Å; W408-L412 WeakPolarHBondContact O-CB 3.42Å; W408-L412 WeakPolarHBondContact O-CD1 3.44Å; W408-L412 VanDerWaalsContact O-CG 3.22Å; W408-L412 WeakPolarHBondContact O-CG 3.44Å; W408-L412 PolarHBondContact O-N 3.31Å
409	V	67.5	Low	63.3	Low	73 Å²	73	118.4 Å²	118.4	44%	0.442	60%	0.595	S	S	.	*	H	α-helix	trans	-69	-33.8	174.9	178	0	0	0	0	111.6	H382 D405 E407 S413	H382-V409 WeakPolarHBondContact NE2-CG1 3.21Å; D405-V409 WeakPolarHBondContact O-CG2 3.33Å; D405-V409 PolarHBondContact O-N 3.04Å; E407-V409 VanDerWaalsContact C-N 3.32Å; E407-V409 PolarHBondContact O-N 3.48Å; V409-S413 WeakPolarHBondContact O-CB 3.4Å; V409-S413 PolarHBondContact O-N 2.83Å; V409-S413 VanDerWaalsContact O-N 3.1Å
410	A	67.9	Low	64.7	Low	58 Å²	58	120.1 Å²	120.1	48%	0.479	61%	0.605	S	S	.	*	H	α-helix	trans	-64.9	-48.7	175.1	0	0	0	0	0	111.6	D406 E407 W408 S413	D406-A410 PolarHBondContact O-N 2.87Å; E407-A410 WeakPolarHBondContact O-CB 3.49Å; E407-A410 PolarHBondContact O-N 2.78Å; E407-A410 VanDerWaalsContact O-N 3.09Å; W408-A410 VanDerWaalsContact C-N 3.35Å; A410-S413 PolarHBondContact O-N 3.3Å; A410-S413 PolarHBondContact O-OG 3.18Å
411	E	69.9	Low	66.3	Low	156 Å²	156	115.4 Å²	115.4	73%	0.729	59%	0.585	S	S	*	*	H	α-helix	trans	-62.7	-43.5	176.3	-66.7	-163.9	160.8	0	0	112.4	E407 S413 H414	E407-E411 PolarHBondContact O-N 3.37Å; E411-S413 PolarHBondContact O-N 2.77Å; E411-H414 CarbonylContact O-C 3.57Å; E411-H414 PolarHBondContact O-N 3.43Å
412	L	72.1	Confident	67.3	Low	125 Å²	125	114.6 Å²	114.6	65%	0.654	58%	0.576	S	S	*	*	H	α-helix	trans	-67	-16.5	177.7	-73	170.8	0	0	0	113.9	W408 P415	W408-L412 VanDerWaalsContact O-CB 3.29Å; W408-L412 WeakPolarHBondContact O-CB 3.42Å; W408-L412 WeakPolarHBondContact O-CD1 3.44Å; W408-L412 VanDerWaalsContact O-CG 3.22Å; W408-L412 WeakPolarHBondContact O-CG 3.44Å; W408-L412 PolarHBondContact O-N 3.31Å; L412-P415 WeakPolarHBondContact O-CD 3.3Å
413	S	71.1	Confident	68.5	Low	69 Å²	69	115.3 Å²	115.3	48%	0.483	58%	0.58	S	S	.	*	H	α-helix	trans	-79.2	-25.1	175.4	77.7	0	0	0	0	113.5	V409 A410 E411 P415	V409-S413 WeakPolarHBondContact O-CB 3.4Å; V409-S413 PolarHBondContact O-N 2.83Å; V409-S413 VanDerWaalsContact O-N 3.1Å; A410-S413 PolarHBondContact O-N 3.3Å; A410-S413 PolarHBondContact O-OG 3.18Å; E411-S413 PolarHBondContact O-N 2.77Å; S413-P415 VanDerWaalsContact C-CD 3.5Å
414	H	73.2	Confident	69.3	Low	159 Å²	159	110.9 Å²	110.9	74%	0.736	57%	0.569	S	S	*	*	S	Bend	trans	-134.8	55.3	-176.7	-64.6	-24.5	0	0	0	112.8	E411 E416	E411-H414 CarbonylContact O-C 3.57Å; E411-H414 PolarHBondContact O-N 3.43Å; H414-E416 PolarHBondContact O-N 2.72Å
415	P	69	Low	70.2	Confident	74 Å²	74	108.9 Å²	108.9	48%	0.481	56%	0.56	S	S	.	*			trans	-71.1	117.9	178.4	30.8	-34.9	0	0	0	110.6	L412 S413 K417	L412-P415 WeakPolarHBondContact O-CD 3.3Å; S413-P415 VanDerWaalsContact C-CD 3.5Å; P415-K417 PolarHBondContact O-N 2.81Å; P415-K417 VanDerWaalsContact O-N 3.09Å
416	E	71.4	Confident	70.9	Confident	200 Å²	200	105.7 Å²	105.7	94%	0.935	55%	0.548	S	S	*	.	S	Bend	trans	-61.6	-18.9	-179.1	-61.7	-170.2	143.3	0	0	114.2	H414	H414-E416 PolarHBondContact O-N 2.72Å
417	K	72.3	Confident	71.5	Confident	93 Å²	93	105.9 Å²	105.9	40%	0.404	55%	0.554	S	S	.	*	S	Bend	trans	-133.3	142.7	173.3	-58.2	-169.8	-172.9	-171.5	0	109.5	P415 A421 K422 E425	P415-K417 PolarHBondContact O-N 2.81Å; P415-K417 VanDerWaalsContact O-N 3.09Å; K417-A421 HydrophobicContact CB-CB 4.35Å; K417-K422 HydrophobicContact CB-CG 4.11Å; K417-E425 IonicContact NZ-OE1 2.64Å; K417-E425 PolarHBondContact NZ-OE1 2.96Å; K417-E425 IonicContact NZ-OE2 2.66Å; K417-E425 PolarHBondContact NZ-OE2 3.34Å
418	T	77.6	Confident	71.9	Confident	88 Å²	88	105.3 Å²	105.3	54%	0.54	56%	0.555	S	S	.	*			trans	-60.8	156.9	170.5	55.1	0	0	0	0	110.9	D420 A421 K422	T418-D420 PolarHBondContact O-N 3.26Å; T418-A421 PolarHBondContact O-N 3.15Å; T418-A421 VanDerWaalsContact OG1-CB 3.28Å; T418-A421 WeakPolarHBondContact OG1-CB 3.41Å; T418-A421 PolarHBondContact OG1-N 3.46Å; T418-K422 PolarHBondContact O-N 3.07Å
419	I	75.9	Confident	72.2	Confident	128 Å²	128	99.4 Å²	99.4	66%	0.656	54%	0.543	S	S	*	.	H	α-helix	trans	-59.8	-40.5	177.4	-59.7	174.1	0	0	0	109.7	A421 K422 L423	I419-A421 PolarHBondContact O-N 2.74Å; I419-K422 WeakPolarHBondContact O-CB 3.47Å; I419-K422 PolarHBondContact O-N 3.38Å; I419-K422 VanDerWaalsContact O-N 3.12Å; I419-L423 HydrophobicContact CG2-CD1 4.07Å; I419-L423 WeakPolarHBondContact O-CG 3.49Å; I419-L423 PolarHBondContact O-N 2.94Å
420	D	77	Confident	72.3	Confident	112 Å²	112	102.3 Å²	102.3	60%	0.599	55%	0.553	S	S	*	*	H	α-helix	trans	-62.9	-39.9	177.3	-43.6	-57	0	0	0	112	T418 K422 L423 T424	T418-D420 PolarHBondContact O-N 3.26Å; D420-K422 VanDerWaalsContact C-N 3.32Å; D420-K422 PolarHBondContact O-N 2.75Å; D420-L423 PolarHBondContact O-N 2.83Å; D420-L423 VanDerWaalsContact O-N 3.13Å; D420-T424 PolarHBondContact O-N 3.1Å; D420-T424 PolarHBondContact O-OG1 3.11Å
421	A	77.4	Confident	72.5	Confident	29 Å²	29	107 Å²	107	24%	0.24	56%	0.563	C	S	.	*	H	α-helix	trans	-68.5	-29.2	174.9	0	0	0	0	0	112.9	K417 T418 I419 T424 E425	K417-A421 HydrophobicContact CB-CB 4.35Å; T418-A421 PolarHBondContact O-N 3.15Å; T418-A421 VanDerWaalsContact OG1-CB 3.28Å; T418-A421 WeakPolarHBondContact OG1-CB 3.41Å; T418-A421 PolarHBondContact OG1-N 3.46Å; I419-A421 PolarHBondContact O-N 2.74Å; A421-T424 PolarHBondContact O-OG1 2.72Å; A421-E425 WeakPolarHBondContact O-CB 3.37Å; A421-E425 VanDerWaalsContact O-CG 3.25Å; A421-E425 WeakPolarHBondContact O-CG 3.5Å; A421-E425 PolarHBondContact O-N 3.19Å
422	K	71.5	Confident	72.7	Confident	125 Å²	125	106.2 Å²	106.2	54%	0.543	58%	0.575	S	S	.	*	H	α-helix	trans	-73.5	-29.8	169.9	-68.5	-174.6	179.2	-176.6	0	112.1	K417 T418 I419 D420 S426	K417-K422 HydrophobicContact CB-CG 4.11Å; T418-K422 PolarHBondContact O-N 3.07Å; I419-K422 WeakPolarHBondContact O-CB 3.47Å; I419-K422 PolarHBondContact O-N 3.38Å; I419-K422 VanDerWaalsContact O-N 3.12Å; D420-K422 VanDerWaalsContact C-N 3.32Å; D420-K422 PolarHBondContact O-N 2.75Å; K422-S426 WeakPolarHBondContact O-CB 3.29Å; K422-S426 PolarHBondContact O-N 3.44Å
423	L	71.9	Confident	72.5	Confident	86 Å²	86	105 Å²	105	45%	0.45	58%	0.583	S	S	.	*	H	α-helix	trans	-75.3	-42.3	176.7	-75.7	166.3	0	0	0	112.2	I419 D420 E425 S426	I419-L423 HydrophobicContact CG2-CD1 4.07Å; I419-L423 WeakPolarHBondContact O-CG 3.49Å; I419-L423 PolarHBondContact O-N 2.94Å; D420-L423 PolarHBondContact O-N 2.83Å; D420-L423 VanDerWaalsContact O-N 3.13Å; L423-E425 VanDerWaalsContact C-N 3.33Å; L423-E425 PolarHBondContact O-N 3.03Å; L423-S426 PolarHBondContact O-N 3.39Å; L423-S426 PolarHBondContact O-OG 3.01Å
424	T	71.1	Confident	72.5	Confident	67 Å²	67	103.6 Å²	103.6	41%	0.411	57%	0.573	S	S	.	*	H	α-helix	trans	-68.1	-31.9	175.3	55.3	0	0	0	0	112.7	D420 A421 S426 F439	D420-T424 PolarHBondContact O-N 3.1Å; D420-T424 PolarHBondContact O-OG1 3.11Å; A421-T424 PolarHBondContact O-OG1 2.72Å; T424-S426 VanDerWaalsContact C-N 3.25Å; T424-S426 PolarHBondContact O-N 3.03Å; T424-F439 HydrophobicContact CG2-CB 4.3Å; T424-F439 HydrophobicContact CG2-CD1 3.88Å; T424-F439 HydrophobicContact CG2-CG 4.23Å
425	E	72.4	Confident	72.3	Confident	122 Å²	122	103.3 Å²	103.3	57%	0.57	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-16.9	169.5	-75.1	177	-176	0	0	113.6	K417 A421 L423	K417-E425 IonicContact NZ-OE1 2.64Å; K417-E425 PolarHBondContact NZ-OE1 2.96Å; K417-E425 IonicContact NZ-OE2 2.66Å; K417-E425 PolarHBondContact NZ-OE2 3.34Å; A421-E425 WeakPolarHBondContact O-CB 3.37Å; A421-E425 VanDerWaalsContact O-CG 3.25Å; A421-E425 WeakPolarHBondContact O-CG 3.5Å; A421-E425 PolarHBondContact O-N 3.19Å; L423-E425 VanDerWaalsContact C-N 3.33Å; L423-E425 PolarHBondContact O-N 3.03Å
426	S	70.9	Confident	72.2	Confident	61 Å²	61	102.8 Å²	102.8	43%	0.427	57%	0.566	S	S	.	*			trans	-87.9	121.9	-179.2	75.9	0	0	0	0	111.7	K422 L423 T424	K422-S426 WeakPolarHBondContact O-CB 3.29Å; K422-S426 PolarHBondContact O-N 3.44Å; L423-S426 PolarHBondContact O-N 3.39Å; L423-S426 PolarHBondContact O-OG 3.01Å; T424-S426 VanDerWaalsContact C-N 3.25Å; T424-S426 PolarHBondContact O-N 3.03Å
427	S	71.7	Confident	71.9	Confident	73 Å²	73	96.1 Å²	96.1	51%	0.51	54%	0.536	S	S	.	.			trans	-112.2	131.7	175.8	65.5	0	0	0	0	110.6	I437	S427-I437 CarbonylContact C-O 3.56Å; S427-I437 VanDerWaalsContact CA-O 3.26Å; S427-I437 WeakPolarHBondContact CA-O 3.44Å
428	L	70.8	Confident	71.5	Confident	123 Å²	123	93.9 Å²	93.9	64%	0.644	53%	0.533	S	S	*	.	B	Isolated β-bridge	trans	-116.7	118.1	-166.8	-150	165.1	0	0	0	110.7	I437	L428-I437 PolarHBondContact N-O 3.27Å; L428-I437 PolarHBondContact O-N 2.89Å
429	S	74.6	Confident	70.7	Confident	66 Å²	66	95.1 Å²	95.1	46%	0.462	53%	0.53	S	S	.	.			trans	-92	113	174.2	57.7	0	0	0	0	110.8	F431	S429-F431 VanDerWaalsContact C-N 3.28Å; S429-F431 PolarHBondContact O-N 2.92Å
430	M	69.3	Low	70.1	Confident	135 Å²	135	94.2 Å²	94.2	67%	0.665	53%	0.527	S	S	*	.	S	Bend	trans	-68.7	-24.1	178.7	-72.3	-164	-77	0	0	113.8	S434 I437	M430-S434 PolarHBondContact N-OG 3.39Å; M430-I437 HydrophobicContact CE-CD1 3.83Å
431	F	72.5	Confident	69.3	Low	156 Å²	156	93.4 Å²	93.4	68%	0.684	52%	0.52	S	S	*	.	S	Bend	trans	-134.2	155.2	176.1	-59.3	-83	0	0	0	110.4	S429 A433 S434	S429-F431 VanDerWaalsContact C-N 3.28Å; S429-F431 PolarHBondContact O-N 2.92Å; F431-A433 PolarHBondContact O-N 3.16Å; F431-S434 PolarHBondContact N-OG 2.91Å; F431-S434 PolarHBondContact O-N 3.04Å; F431-S434 PolarHBondContact O-OG 3.12Å
432	S	72.6	Confident	68.4	Low	139 Å²	139	97 Å²	97	97%	0.972	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-9.3	-178.6	53.1	0	0	0	0	115.3
433	A	69.5	Low	67.6	Low	101 Å²	101	94.7 Å²	94.7	84%	0.835	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.1	7.5	175	0	0	0	0	0	113.7	F431	F431-A433 PolarHBondContact O-N 3.16Å
434	S	71	Confident	66.5	Low	39 Å²	39	98 Å²	98	27%	0.273	55%	0.553	S	S	.	*	S	Bend	trans	-83.9	138.2	176.6	62.4	0	0	0	0	111.4	M430 F431	M430-S434 PolarHBondContact N-OG 3.39Å; F431-S434 PolarHBondContact N-OG 2.91Å; F431-S434 PolarHBondContact O-N 3.04Å; F431-S434 PolarHBondContact O-OG 3.12Å
435	K	67.1	Low	65.3	Low	153 Å²	153	103.8 Å²	103.8	67%	0.665	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-50	129.6	165	-174.1	-168.4	173.2	-131	0	108.8	E441	K435-E441 IonicContact NZ-OE1 2.76Å; K435-E441 PolarHBondContact NZ-OE1 3.49Å
436	P	68.2	Low	63.8	Low	62 Å²	62	106.7 Å²	106.7	40%	0.403	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-71.1	135.9	-177.8	30.4	-35.4	0	0	0	110.1
437	I	65.3	Low	62.2	Low	61 Å²	61	111.6 Å²	111.6	31%	0.313	61%	0.611	S	S	.	*	B	Isolated β-bridge	trans	-87	126.7	-177.4	-58.7	171.2	0	0	0	108.7	S427 L428 M430 E441 V442	S427-I437 CarbonylContact C-O 3.56Å; S427-I437 VanDerWaalsContact CA-O 3.26Å; S427-I437 WeakPolarHBondContact CA-O 3.44Å; L428-I437 PolarHBondContact N-O 3.27Å; L428-I437 PolarHBondContact O-N 2.89Å; M430-I437 HydrophobicContact CE-CD1 3.83Å; I437-E441 HydrophobicContact CG2-CB 4.27Å; I437-V442 HydrophobicContact CG2-CG2 3.66Å
438	S	62.7	Low	60.8	Low	46 Å²	46	116.3 Å²	116.3	32%	0.322	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-91.4	149.5	172	46.2	0	0	0	0	111.4	D440 E441	S438-D440 VanDerWaalsContact C-N 3.26Å; S438-D440 PolarHBondContact O-N 3.34Å; S438-D440 VanDerWaalsContact O-N 3.15Å; S438-E441 PolarHBondContact N-OE2 2.86Å; S438-E441 WeakPolarHBondContact O-CB 3.29Å; S438-E441 PolarHBondContact O-N 2.73Å
439	F	62.3	Low	59.3	Low	113 Å²	113	115.6 Å²	115.6	50%	0.496	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-52	-40	-175.9	-171.2	-96.2	0	0	0	113.9	T424 E441 V442	T424-F439 HydrophobicContact CG2-CB 4.3Å; T424-F439 HydrophobicContact CG2-CD1 3.88Å; T424-F439 HydrophobicContact CG2-CG 4.23Å; F439-E441 PolarHBondContact O-N 2.82Å; F439-V442 PolarHBondContact O-N 3.08Å
440	D	61.8	Low	57.4	Low	110 Å²	110	117.6 Å²	117.6	59%	0.588	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-62.9	-23.5	178.7	-65.8	-1.8	0	0	0	113.8	S438 V442 S443	S438-D440 VanDerWaalsContact C-N 3.26Å; S438-D440 PolarHBondContact O-N 3.34Å; S438-D440 VanDerWaalsContact O-N 3.15Å; D440-V442 VanDerWaalsContact C-N 3.3Å; D440-S443 PolarHBondContact O-OG 3.49Å
441	E	61.6	Low	55.9	Low	94 Å²	94	117.8 Å²	117.8	44%	0.439	66%	0.661	S	S	.	*	G	3₁₀ helix	trans	-76.2	-16.9	174.9	-67	178.8	143.5	0	0	112.1	K435 I437 S438 F439	K435-E441 IonicContact NZ-OE1 2.76Å; K435-E441 PolarHBondContact NZ-OE1 3.49Å; I437-E441 HydrophobicContact CG2-CB 4.27Å; S438-E441 PolarHBondContact N-OE2 2.86Å; S438-E441 WeakPolarHBondContact O-CB 3.29Å; S438-E441 PolarHBondContact O-N 2.73Å; F439-E441 PolarHBondContact O-N 2.82Å
442	V	58.4	Low	54.1	Low	106 Å²	106	113.5 Å²	113.5	64%	0.642	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-21.6	-176.2	-172.2	0	0	0	0	112.4	I437 F439 D440	I437-V442 HydrophobicContact CG2-CG2 3.66Å; F439-V442 PolarHBondContact O-N 3.08Å; D440-V442 VanDerWaalsContact C-N 3.3Å
443	S	53.2	Low	52.4	Low	75 Å²	75	115.5 Å²	115.5	52%	0.524	65%	0.654	S	S	.	*	S	Bend	trans	-93.6	7.9	-173.8	49.1	0	0	0	0	115.6	D440	D440-S443 PolarHBondContact O-OG 3.49Å
444	M	49.2	Very low	50.7	Low	155 Å²	155	118 Å²	118	76%	0.764	65%	0.654	S	S	*	*	S	Bend	trans	-97.1	-4.7	-172.1	-75.6	-73.5	171.4	0	0	115.4
445	E	47	Very low	49.1	Very low	189 Å²	189	119.3 Å²	119.3	88%	0.883	67%	0.673	S	S	*	*	S	Bend	trans	-109.8	38.3	-173.1	-65.4	-160.3	140.2	0	0	115.4
446	E	40	Very low	47.6	Very low	183 Å²	183	119.5 Å²	119.5	86%	0.855	68%	0.682	S	S	*	*			trans	-145.8	58.1	172.1	-140	170.8	-127.6	0	0	114.2
447	N	36.9	Very low	46	Very low	165 Å²	165	125 Å²	125	88%	0.882	70%	0.702	S	S	*	*			trans	-148.7	83	172.6	-94.5	-71.7	0	0	0	113.1
448	L	43.8	Very low	44.6	Very low	172 Å²	172	126.5 Å²	126.5	90%	0.901	72%	0.716	S	S	*	*			trans	-135.2	152.4	164.2	-84.1	174.3	0	0	0	110.5
449	P	39.3	Very low	43.3	Very low	108 Å²	108	132 Å²	132	70%	0.701	74%	0.74	S	S	*	*			trans	-88.1	156.7	-151.1	33.7	-37.6	0	0	0	115.2	V451	P449-V451 PolarHBondContact O-N 3.28Å
450	A	33.8	Very low	41.8	Very low	108 Å²	108	132.9 Å²	132.9	89%	0.893	75%	0.749	S	S	*	*			trans	-68.5	113.8	177.9	0	0	0	0	0	112.7
451	V	37.6	Very low	40.4	Very low	139 Å²	139	136.6 Å²	136.6	84%	0.842	76%	0.761	S	S	*	*			trans	-124.5	127.2	160.9	-179.4	0	0	0	0	106	P449	P449-V451 PolarHBondContact O-N 3.28Å
452	G	35.8	Very low	39.2	Very low	66 Å²	66	138.6 Å²	138.6	68%	0.68	77%	0.77	S	S	*	*			trans	-102.8	169.6	-174.3	0	0	0	0	0	113.6
453	Q	36.9	Very low	37.9	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	77%	0.774	S	S	*	*			trans	-165	126.2	154	-113.4	168.8	-7.9	0	0	112.4
454	D	34	Very low	36.8	Very low	154 Å²	154	141.4 Å²	141.4	82%	0.824	78%	0.778	S	S	*	*			trans	30.3	141.4	134.7	-45.6	-27	0	0	0	122.4
455	G	36.3	Very low	35.8	Very low	66 Å²	66	141.3 Å²	141.3	68%	0.68	78%	0.78	S	S	*	*			trans	170.3	94.3	160.3	0	0	0	0	0	117.8
456	N	35.3	Very low	35	Very low	158 Å²	158	140.8 Å²	140.8	85%	0.845	78%	0.778	S	S	*	*			trans	64.4	130.1	162.3	-51.6	-32.2	0	0	0	117
457	H	34.5	Very low	34.4	Very low	177 Å²	177	138.7 Å²	138.7	82%	0.819	77%	0.772	S	S	*	*			cis	-155	132.5	39.5	-140.1	-61.1	0	0	0	112.1
458	P	36.8	Very low	34.1	Very low	93 Å²	93	137.5 Å²	137.5	60%	0.604	77%	0.771	S	S	*	*			trans	-106.6	164.4	172.3	38.4	-32.3	0	0	0	113.3
459	I	34.6	Very low	33.4	Very low	161 Å²	161	132.8 Å²	132.8	83%	0.826	76%	0.764	S	S	*	*			trans	-146.2	124	156.9	-59.2	-176.7	0	0	0	107.8
460	D	32	Very low	32.9	Very low	131 Å²	131	132 Å²	132	70%	0.701	77%	0.766	S	S	*	*			trans	-95.7	164.2	177.6	-69.4	-65.1	0	0	0	113.3
461	F	32.5	Very low	32.7	Very low	188 Å²	188	133.6 Å²	133.6	83%	0.825	76%	0.76	S	S	*	*			trans	-154	97.8	140.9	-103.4	-70.9	0	0	0	110.7
462	Q	35.7	Very low	32.8	Very low	137 Å²	137	136.5 Å²	136.5	64%	0.64	77%	0.765	S	S	*	*				31.1	141.2	129.3	-62.6	-169.1	-67	0	0	120.3
463	E	31	Very low	32.7	Very low	153 Å²	153	140.9 Å²	140.9	72%	0.715	77%	0.767	S	S	*	*			cis	-167.2	177.7	-6.7	-125.8	154.6	-145.7	0	0	110.9
464	S	29.3	Very low	32.9	Very low	87 Å²	87	137.8 Å²	137.8	61%	0.608	76%	0.757	S	S	*	*			trans	-29.5	167.3	161.4	54	0	0	0	0	118.6
465	D	29.2	Very low	33.4	Very low	153 Å²	153	137 Å²	137	82%	0.818	75%	0.752	S	S	*	*			cis	-171.1	-156.1	-24.5	-86.9	-49.9	0	0	0	104.6
466	E	29.4	Very low	34.1	Very low	178 Å²	178	140 Å²	140	83%	0.832	75%	0.748	S	S	*	*			cis	-159.3	155.7	6.4	-158.4	177.2	-140.8	0	0	109.9
467	D	28.6	Very low	34.6	Very low	138 Å²	138	136.8 Å²	136.8	74%	0.738	73%	0.73	S	S	*	*			trans	24.2	135.8	160.2	-89.6	-0.3	0	0	0	126.6
468	T	29.3	Very low	35.1	Very low	141 Å²	141	134.5 Å²	134.5	87%	0.865	72%	0.722	S	S	*	*			trans	78.2	145.1	144.4	61.8	0	0	0	0	123.6
469	G	30.2	Very low	35.9	Very low	72 Å²	72	136.7 Å²	136.7	74%	0.742	72%	0.722	S	S	*	*			trans	107.5	82.5	173.8	0	0	0	0	0	113.7
470	A	28.2	Very low	36.7	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	70%	0.7	S	S	*	*				78.5	118.6	66.2	0	0	0	0	0	115
471	D	30.5	Very low	37.7	Very low	143 Å²	143	128.7 Å²	128.7	77%	0.765	69%	0.685	S	S	*	*			trans	61.9	84	151	-50.5	-13.1	0	0	0	120.9
472	E	38.4	Very low	38.9	Very low	200 Å²	200	123.6 Å²	123.6	94%	0.935	67%	0.665	S	S	*	*			trans	-149.3	53.9	141.4	-128.7	174.1	-131.5	0	0	111.5	N474	E472-N474 PolarHBondContact O-N 2.78Å
473	E	34.9	Very low	39.8	Very low	157 Å²	157	121 Å²	121	73%	0.734	66%	0.655	S	S	*	*			trans	-78.2	118.1	-175.7	-57.3	-171.5	141.8	0	0	112.8
474	N	40.6	Very low	40.8	Very low	116 Å²	116	120.8 Å²	120.8	62%	0.62	65%	0.648	S	S	*	*	S	Bend		171.1	-48.4	129.7	-96.5	-74.4	0	0	0	111.9	E472 Q476 I477	E472-N474 PolarHBondContact O-N 2.78Å; N474-Q476 VanDerWaalsContact C-N 3.33Å; N474-Q476 PolarHBondContact O-N 3.2Å; N474-I477 VanDerWaalsContact O-CB 3.32Å; N474-I477 WeakPolarHBondContact O-CB 3.42Å; N474-I477 PolarHBondContact O-N 2.99Å
475	D	45.1	Very low	41.9	Very low	136 Å²	136	120.2 Å²	120.2	73%	0.727	64%	0.641	S	S	*	*	H	α-helix	trans	-68	-30.5	-172.7	-88	-7.2	0	0	0	113.7	I477 M478	D475-I477 VanDerWaalsContact C-N 3.28Å; D475-I477 PolarHBondContact O-N 3.1Å; D475-M478 PolarHBondContact O-N 3.28Å
476	Q	49.3	Very low	43	Very low	130 Å²	130	118.2 Å²	118.2	61%	0.607	63%	0.625	S	S	*	*	H	α-helix	trans	-60.5	-39.3	171	-118.7	70	-39.2	0	0	111.1	N474 M478 K479 D480	N474-Q476 VanDerWaalsContact C-N 3.33Å; N474-Q476 PolarHBondContact O-N 3.2Å; Q476-M478 VanDerWaalsContact C-N 3.28Å; Q476-M478 PolarHBondContact O-N 2.93Å; Q476-K479 PolarHBondContact O-N 3.36Å; Q476-K479 VanDerWaalsContact O-N 3.11Å; Q476-D480 WeakPolarHBondContact O-CB 3.42Å; Q476-D480 PolarHBondContact O-N 3.37Å
477	I	47	Very low	44.1	Very low	91 Å²	91	112.9 Å²	112.9	47%	0.467	61%	0.607	S	S	.	*	H	α-helix	trans	-63.6	-33.7	-174.9	-54.2	177.5	0	0	0	111.2	N474 D475 S481	N474-I477 VanDerWaalsContact O-CB 3.32Å; N474-I477 WeakPolarHBondContact O-CB 3.42Å; N474-I477 PolarHBondContact O-N 2.99Å; D475-I477 VanDerWaalsContact C-N 3.28Å; D475-I477 PolarHBondContact O-N 3.1Å; I477-S481 WeakPolarHBondContact O-CB 3.43Å; I477-S481 PolarHBondContact O-N 3.05Å; I477-S481 PolarHBondContact O-OG 2.8Å
478	M	43.8	Very low	45	Very low	129 Å²	129	110 Å²	110	64%	0.635	59%	0.592	S	S	*	*	H	α-helix	trans	-69.9	-40.8	174.2	-96	-75.4	-79.1	0	0	112.9	D475 Q476 S481 I482	D475-M478 PolarHBondContact O-N 3.28Å; Q476-M478 VanDerWaalsContact C-N 3.28Å; Q476-M478 PolarHBondContact O-N 2.93Å; M478-S481 PolarHBondContact O-N 3.48Å; M478-I482 WeakPolarHBondContact O-CB 3.34Å; M478-I482 VanDerWaalsContact O-CG1 3.28Å; M478-I482 WeakPolarHBondContact O-CG1 3.41Å; M478-I482 PolarHBondContact O-N 2.88Å
479	K	55	Low	45.8	Very low	138 Å²	138	111 Å²	111	60%	0.6	58%	0.584	S	S	*	*	H	α-helix	trans	-68.2	-46.1	174.2	-78.5	174.4	-178.3	161	0	111.6	Q476 S481 I482 D483	Q476-K479 PolarHBondContact O-N 3.36Å; Q476-K479 VanDerWaalsContact O-N 3.11Å; K479-S481 VanDerWaalsContact C-N 3.27Å; K479-S481 PolarHBondContact O-N 2.79Å; K479-I482 CarbonylContact O-C 3.49Å; K479-I482 PolarHBondContact O-N 3.2Å; K479-I482 VanDerWaalsContact O-N 3.1Å; K479-D483 PolarHBondContact O-N 3Å
480	D	50.4	Low	46.5	Very low	71 Å²	71	113.7 Å²	113.7	38%	0.38	58%	0.582	S	S	.	*	H	α-helix	trans	-59.6	-38.1	173.9	-109.5	53	0	0	0	111.4	Q476 D483 R484	Q476-D480 WeakPolarHBondContact O-CB 3.42Å; Q476-D480 PolarHBondContact O-N 3.37Å; D480-D483 PolarHBondContact O-N 3.01Å; D480-R484 WeakPolarHBondContact O-CA 3.4Å; D480-R484 WeakPolarHBondContact O-CB 3.42Å; D480-R484 VanDerWaalsContact O-CD 3.3Å; D480-R484 WeakPolarHBondContact O-CD 3.39Å; D480-R484 WeakPolarHBondContact O-CG 3.45Å; D480-R484 PolarHBondContact O-N 3.4Å; D480-R484 IonicContact OD2-CZ 2.83Å; D480-R484 VanDerWaalsContact OD2-CZ 3.3Å; D480-R484 IonicContact OD2-NE 3.45Å; D480-R484 PolarHBondContact OD2-NE 2.76Å; D480-R484 IonicContact OD2-NH2 3.86Å; D480-R484 PolarHBondContact OD2-NH2 2.96Å
481	S	53.8	Low	47	Very low	53 Å²	53	113.3 Å²	113.3	37%	0.371	57%	0.566	S	S	.	*	H	α-helix	trans	-67.5	-40	174.2	-63.2	0	0	0	0	111.8	I477 M478 K479 V485	I477-S481 WeakPolarHBondContact O-CB 3.43Å; I477-S481 PolarHBondContact O-N 3.05Å; I477-S481 PolarHBondContact O-OG 2.8Å; M478-S481 PolarHBondContact O-N 3.48Å; K479-S481 VanDerWaalsContact C-N 3.27Å; K479-S481 PolarHBondContact O-N 2.79Å; S481-V485 VanDerWaalsContact O-CB 3.29Å; S481-V485 WeakPolarHBondContact O-CB 3.48Å; S481-V485 WeakPolarHBondContact O-CG2 3.41Å; S481-V485 PolarHBondContact O-N 2.95Å
482	I	58	Low	47.5	Very low	82 Å²	82	112 Å²	112	42%	0.421	57%	0.565	S	S	.	*	H	α-helix	trans	-66.8	-38.8	175.8	-73.1	165.6	0	0	0	111.5	M478 K479 V485 K486	M478-I482 WeakPolarHBondContact O-CB 3.34Å; M478-I482 VanDerWaalsContact O-CG1 3.28Å; M478-I482 WeakPolarHBondContact O-CG1 3.41Å; M478-I482 PolarHBondContact O-N 2.88Å; K479-I482 CarbonylContact O-C 3.49Å; K479-I482 PolarHBondContact O-N 3.2Å; K479-I482 VanDerWaalsContact O-N 3.1Å; I482-V485 PolarHBondContact O-N 2.96Å; I482-K486 WeakPolarHBondContact O-CG 3.47Å; I482-K486 PolarHBondContact O-N 3.42Å
483	D	54.1	Low	47.7	Very low	81 Å²	81	109.5 Å²	109.5	43%	0.433	56%	0.559	S	S	.	*	H	α-helix	trans	-84.7	-25.1	-179.4	-71.8	-26.5	0	0	0	113	K479 D480 K486 S487	K479-D483 PolarHBondContact O-N 3Å; D480-D483 PolarHBondContact O-N 3.01Å; D483-K486 VanDerWaalsContact OD1-CD 3.31Å; D483-K486 WeakPolarHBondContact OD1-CD 3.3Å; D483-K486 WeakPolarHBondContact OD1-CE 3.43Å; D483-K486 IonicContact OD1-NZ 3.63Å; D483-K486 PolarHBondContact OD1-NZ 3.03Å; D483-S487 WeakPolarHBondContact O-CB 3.18Å; D483-S487 PolarHBondContact O-N 2.78Å; D483-S487 PolarHBondContact O-OG 2.78Å
484	R	51.8	Low	48.2	Very low	150 Å²	150	108 Å²	108	57%	0.566	56%	0.555	S	S	*	*	H	α-helix	trans	-64.7	-44.4	160.1	-71.4	164.7	-160.3	-162.7	4.5	110.3	D480 S487 L488	D480-R484 WeakPolarHBondContact O-CA 3.4Å; D480-R484 WeakPolarHBondContact O-CB 3.42Å; D480-R484 VanDerWaalsContact O-CD 3.3Å; D480-R484 WeakPolarHBondContact O-CD 3.39Å; D480-R484 WeakPolarHBondContact O-CG 3.45Å; D480-R484 PolarHBondContact O-N 3.4Å; D480-R484 IonicContact OD2-CZ 2.83Å; D480-R484 VanDerWaalsContact OD2-CZ 3.3Å; D480-R484 IonicContact OD2-NE 3.45Å; D480-R484 PolarHBondContact OD2-NE 2.76Å; D480-R484 IonicContact OD2-NH2 3.86Å; D480-R484 PolarHBondContact OD2-NH2 2.96Å; R484-S487 WeakPolarHBondContact CA-OG 3.2Å; R484-S487 PolarHBondContact O-N 2.76Å; R484-S487 PolarHBondContact O-OG 2.72Å; R484-S487 VanDerWaalsContact O-OG 3.09Å; R484-L488 WeakPolarHBondContact O-CB 3.44Å; R484-L488 WeakPolarHBondContact O-CG 3.43Å; R484-L488 PolarHBondContact O-N 3.06Å
485	V	51.8	Low	48.4	Very low	74 Å²	74	107.4 Å²	107.4	45%	0.448	56%	0.557	S	S	.	*	H	α-helix	trans	-61.5	-45.5	173	165.8	0	0	0	0	111.1	S481 I482 S487 L488 F489	S481-V485 VanDerWaalsContact O-CB 3.29Å; S481-V485 WeakPolarHBondContact O-CB 3.48Å; S481-V485 WeakPolarHBondContact O-CG2 3.41Å; S481-V485 PolarHBondContact O-N 2.95Å; I482-V485 PolarHBondContact O-N 2.96Å; V485-S487 PolarHBondContact O-N 2.75Å; V485-L488 CarbonylContact O-C 3.58Å; V485-L488 PolarHBondContact O-N 3.12Å; V485-F489 HydrophobicContact CG1-CD2 3.76Å; V485-F489 HydrophobicContact CG1-CE2 3.88Å; V485-F489 WeakPolarHBondContact O-CD2 3.41Å; V485-F489 PolarHBondContact O-N 3.15Å
486	K	53.2	Low	48.8	Very low	112 Å²	112	106.6 Å²	106.6	49%	0.487	56%	0.562	S	S	.	*	H	α-helix	trans	-62.2	-39	175.4	-72.6	178	-152	148.6	0	112.8	I482 D483 F489 N490	I482-K486 WeakPolarHBondContact O-CG 3.47Å; I482-K486 PolarHBondContact O-N 3.42Å; D483-K486 VanDerWaalsContact OD1-CD 3.31Å; D483-K486 WeakPolarHBondContact OD1-CD 3.3Å; D483-K486 WeakPolarHBondContact OD1-CE 3.43Å; D483-K486 IonicContact OD1-NZ 3.63Å; D483-K486 PolarHBondContact OD1-NZ 3.03Å; K486-F489 PolarHBondContact O-N 3.39Å; K486-N490 VanDerWaalsContact O-CB 3.26Å; K486-N490 WeakPolarHBondContact O-CB 3.17Å; K486-N490 PolarHBondContact O-N 2.96Å
487	S	51.4	Low	48.9	Very low	66 Å²	66	106.3 Å²	106.3	46%	0.462	56%	0.564	S	S	.	*	H	α-helix	trans	-75.1	-27.5	176.1	50.2	0	0	0	0	113.1	D483 R484 V485 F489 N490 L491	D483-S487 WeakPolarHBondContact O-CB 3.18Å; D483-S487 PolarHBondContact O-N 2.78Å; D483-S487 PolarHBondContact O-OG 2.78Å; R484-S487 WeakPolarHBondContact CA-OG 3.2Å; R484-S487 PolarHBondContact O-N 2.76Å; R484-S487 PolarHBondContact O-OG 2.72Å; R484-S487 VanDerWaalsContact O-OG 3.09Å; V485-S487 PolarHBondContact O-N 2.75Å; S487-F489 VanDerWaalsContact C-N 3.33Å; S487-N490 CarbonylContact O-C 3.5Å; S487-N490 VanDerWaalsContact O-C 3.32Å; S487-L491 PolarHBondContact O-N 3.22Å
488	L	49	Very low	49.7	Very low	78 Å²	78	104.4 Å²	104.4	41%	0.408	56%	0.559	S	S	.	*	H	α-helix	trans	-76.4	-14.8	169.6	-70.8	171.2	0	0	0	113.9	R484 V485 L491	R484-L488 WeakPolarHBondContact O-CB 3.44Å; R484-L488 WeakPolarHBondContact O-CG 3.43Å; R484-L488 PolarHBondContact O-N 3.06Å; V485-L488 CarbonylContact O-C 3.58Å; V485-L488 PolarHBondContact O-N 3.12Å; L488-L491 HydrophobicContact CD2-CD1 4.34Å
489	F	46.2	Very low	51	Low	162 Å²	162	104.8 Å²	104.8	71%	0.711	56%	0.563	S	S	*	*	H	α-helix	trans	-94.9	-32.4	166.4	-86.4	-73.1	0	0	0	112.4	V485 K486 S487 L491	V485-F489 HydrophobicContact CG1-CD2 3.76Å; V485-F489 HydrophobicContact CG1-CE2 3.88Å; V485-F489 WeakPolarHBondContact O-CD2 3.41Å; V485-F489 PolarHBondContact O-N 3.15Å; K486-F489 PolarHBondContact O-N 3.39Å; S487-F489 VanDerWaalsContact C-N 3.33Å; F489-L491 VanDerWaalsContact C-N 3.29Å; F489-L491 PolarHBondContact O-N 3.24Å
490	N	43.5	Very low	51.7	Low	128 Å²	128	99.6 Å²	99.6	68%	0.684	55%	0.546	S	S	*	.	S	Bend	trans	-91.3	39.3	172.2	-71.3	-19.9	0	0	0	112.3	K486 S487 P492	K486-N490 VanDerWaalsContact O-CB 3.26Å; K486-N490 WeakPolarHBondContact O-CB 3.17Å; K486-N490 PolarHBondContact O-N 2.96Å; S487-N490 CarbonylContact O-C 3.5Å; S487-N490 VanDerWaalsContact O-C 3.32Å; N490-P492 WeakPolarHBondContact O-CD 3.25Å; N490-P492 WeakPolarHBondContact O-CG 3.1Å
491	L	39.7	Very low	52.6	Low	82 Å²	82	99.9 Å²	99.9	43%	0.429	55%	0.551	S	S	.	*			trans	-73	105.5	169.8	-87.2	167.4	0	0	0	109	S487 L488 F489 N493 L494	S487-L491 PolarHBondContact O-N 3.22Å; L488-L491 HydrophobicContact CD2-CD1 4.34Å; F489-L491 VanDerWaalsContact C-N 3.29Å; F489-L491 PolarHBondContact O-N 3.24Å; L491-N493 PolarHBondContact O-N 2.88Å; L491-N493 VanDerWaalsContact O-N 3.16Å; L491-L494 HydrophobicContact CB-CD1 4.23Å; L491-L494 HydrophobicContact CD1-CD1 3.71Å; L491-L494 HydrophobicContact CD1-CG 4.36Å
492	P	40.8	Very low	53.3	Low	115 Å²	115	101.5 Å²	101.5	75%	0.747	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-7	-168	-14.4	32.1	0	0	0	113.9	N490	N490-P492 WeakPolarHBondContact O-CD 3.25Å; N490-P492 WeakPolarHBondContact O-CG 3.1Å
493	N	43.2	Very low	54.1	Low	148 Å²	148	102.1 Å²	102.1	79%	0.791	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.6	18.6	-163.9	-73.7	-44.4	0	0	0	113.9	L491 P495	L491-N493 PolarHBondContact O-N 2.88Å; L491-N493 VanDerWaalsContact O-N 3.16Å; N493-P495 WeakPolarHBondContact O-CD 3.3Å
494	L	44.5	Very low	55	Low	125 Å²	125	106.7 Å²	106.7	65%	0.654	57%	0.574	S	S	*	*			trans	-72.3	117.2	160	-90.2	168.6	0	0	0	107.5	L491 S496	L491-L494 HydrophobicContact CB-CD1 4.23Å; L491-L494 HydrophobicContact CD1-CD1 3.71Å; L491-L494 HydrophobicContact CD1-CG 4.36Å; L494-S496 PolarHBondContact O-N 2.81Å
495	P	45.7	Very low	55.6	Low	104 Å²	104	101.6 Å²	101.6	68%	0.675	56%	0.562	S	S	*	*			trans	-61	138.6	171.7	27.5	-33.6	0	0	0	108.1	N493 L497	N493-P495 WeakPolarHBondContact O-CD 3.3Å; P495-L497 PolarHBondContact O-N 3.47Å
496	S	51.6	Low	56	Low	119 Å²	119	105.6 Å²	105.6	83%	0.832	58%	0.576	S	S	*	*			trans	-67.7	84.3	174.5	40.2	0	0	0	0	109.7	L494 S498	L494-S496 PolarHBondContact O-N 2.81Å; S496-S498 WeakPolarHBondContact O-CA 3.42Å; S496-S498 PolarHBondContact O-N 3.33Å
497	L	53.3	Low	55.9	Low	124 Å²	124	109.1 Å²	109.1	65%	0.649	59%	0.586	S	S	*	*			trans	-48.2	103.7	173.3	-89.5	167.1	0	0	0	108.4	P495 L499	P495-L497 PolarHBondContact O-N 3.47Å; L497-L499 PolarHBondContact O-N 3.32Å
498	S	63.1	Low	55.9	Low	52 Å²	52	110.4 Å²	110.4	36%	0.364	59%	0.587	S	S	.	*			trans	-66.6	141.9	-160.9	89.1	0	0	0	0	109.7	S496 A500 T501 L502	S496-S498 WeakPolarHBondContact O-CA 3.42Å; S496-S498 PolarHBondContact O-N 3.33Å; S498-A500 PolarHBondContact O-N 2.69Å; S498-A500 VanDerWaalsContact O-N 3.14Å; S498-T501 WeakPolarHBondContact O-CA 3.4Å; S498-T501 WeakPolarHBondContact O-CB 3.19Å; S498-T501 PolarHBondContact O-N 3.39Å; S498-T501 PolarHBondContact OG-N 2.82Å; S498-T501 PolarHBondContact OG-OG1 3.09Å; S498-L502 PolarHBondContact O-N 2.71Å
499	L	71.2	Confident	56	Low	136 Å²	136	112.6 Å²	112.6	71%	0.712	60%	0.599	S	S	*	*	H	α-helix	trans	-57.1	-31.8	177.3	-175.9	62.3	0	0	0	111	L497 L502 V503	L497-L499 PolarHBondContact O-N 3.32Å; L499-L502 PolarHBondContact O-N 3.28Å; L499-V503 HydrophobicContact CD1-CG2 4.17Å; L499-V503 HydrophobicContact CG-CG2 4.27Å; L499-V503 VanDerWaalsContact O-CB 3.3Å; L499-V503 WeakPolarHBondContact O-CB 3.31Å; L499-V503 WeakPolarHBondContact O-CG2 3.45Å; L499-V503 PolarHBondContact O-N 3.17Å
500	A	69.9	Low	56	Low	29 Å²	29	111.2 Å²	111.2	24%	0.24	60%	0.595	C	S	.	*	H	α-helix	trans	-63.3	-45.7	172.2	0	0	0	0	0	112.2	S498 L502 V503 Y504	S498-A500 PolarHBondContact O-N 2.69Å; S498-A500 VanDerWaalsContact O-N 3.14Å; A500-L502 VanDerWaalsContact C-N 3.32Å; A500-L502 PolarHBondContact O-N 2.67Å; A500-V503 PolarHBondContact O-N 2.91Å; A500-Y504 HydrophobicContact CB-CD2 4.21Å; A500-Y504 HydrophobicContact CB-CE2 4.29Å; A500-Y504 WeakPolarHBondContact O-CB 2.99Å; A500-Y504 WeakPolarHBondContact O-CD2 3.44Å; A500-Y504 PolarHBondContact O-N 3.42Å
501	T	68.1	Low	55.9	Low	78 Å²	78	112.5 Å²	112.5	48%	0.479	60%	0.595	S	S	.	*	H	α-helix	trans	-59.4	-43.3	176.1	-48.4	0	0	0	0	111	S498 S505	S498-T501 WeakPolarHBondContact O-CA 3.4Å; S498-T501 WeakPolarHBondContact O-CB 3.19Å; S498-T501 PolarHBondContact O-N 3.39Å; S498-T501 PolarHBondContact OG-N 2.82Å; S498-T501 PolarHBondContact OG-OG1 3.09Å; T501-S505 WeakPolarHBondContact O-CB 3.47Å; T501-S505 PolarHBondContact O-N 3.09Å; T501-S505 VanDerWaalsContact O-N 3.07Å; T501-S505 PolarHBondContact O-OG 3.16Å
502	L	68.6	Low	56	Low	86 Å²	86	116.4 Å²	116.4	45%	0.45	61%	0.611	S	S	.	*	H	α-helix	trans	-68.6	-37.2	177.5	-69	170	0	0	0	113.1	S498 L499 A500 L508	S498-L502 PolarHBondContact O-N 2.71Å; L499-L502 PolarHBondContact O-N 3.28Å; A500-L502 VanDerWaalsContact C-N 3.32Å; A500-L502 PolarHBondContact O-N 2.67Å; L502-L508 HydrophobicContact CD2-CD1 4.46Å
503	V	75.3	Confident	56.3	Low	96 Å²	96	115.6 Å²	115.6	58%	0.582	60%	0.603	S	S	*	*	H	α-helix	trans	-76.8	-26.9	-179.4	167.4	0	0	0	0	113.1	L499 A500	L499-V503 HydrophobicContact CD1-CG2 4.17Å; L499-V503 HydrophobicContact CG-CG2 4.27Å; L499-V503 VanDerWaalsContact O-CB 3.3Å; L499-V503 WeakPolarHBondContact O-CB 3.31Å; L499-V503 WeakPolarHBondContact O-CG2 3.45Å; L499-V503 PolarHBondContact O-N 3.17Å; A500-V503 PolarHBondContact O-N 2.91Å
504	Y	72.8	Confident	56.3	Low	176 Å²	176	111.9 Å²	111.9	69%	0.69	59%	0.594	S	S	*	*	H	α-helix	trans	-109.9	-1.5	-176.1	-59.8	-57.3	0	0	0	115	A500 Q506	A500-Y504 HydrophobicContact CB-CD2 4.21Å; A500-Y504 HydrophobicContact CB-CE2 4.29Å; A500-Y504 WeakPolarHBondContact O-CB 2.99Å; A500-Y504 WeakPolarHBondContact O-CD2 3.44Å; A500-Y504 PolarHBondContact O-N 3.42Å; Y504-Q506 PolarHBondContact O-N 3.22Å
505	S	65.6	Low	56.3	Low	43 Å²	43	113.1 Å²	113.1	30%	0.301	60%	0.601	S	S	.	*			trans	-83	96.8	178.5	49.2	0	0	0	0	112.5	T501 R507 L508	T501-S505 WeakPolarHBondContact O-CB 3.47Å; T501-S505 PolarHBondContact O-N 3.09Å; T501-S505 VanDerWaalsContact O-N 3.07Å; T501-S505 PolarHBondContact O-OG 3.16Å; S505-R507 PolarHBondContact O-N 3.03Å; S505-L508 PolarHBondContact O-N 3.35Å; S505-L508 VanDerWaalsContact O-N 3.15Å
506	Q	58.8	Low	56.2	Low	159 Å²	159	112.1 Å²	112.1	74%	0.743	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	-21.6	177.7	-62.2	-176.3	-57.6	0	0	114.5	Y504 L508 D509	Y504-Q506 PolarHBondContact O-N 3.22Å; Q506-L508 PolarHBondContact O-N 3.27Å; Q506-D509 WeakPolarHBondContact O-CB 3.21Å; Q506-D509 PolarHBondContact O-N 3.14Å; Q506-D509 VanDerWaalsContact O-N 3.07Å
507	R	52.5	Low	55.7	Low	185 Å²	185	113.2 Å²	113.2	70%	0.698	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-28	176.9	-72.7	-178.5	176.9	160.5	-1.1	113.8	S505 D509 E510 F511	S505-R507 PolarHBondContact O-N 3.03Å; R507-D509 PolarHBondContact O-N 3.29Å; R507-E510 PolarHBondContact O-N 2.89Å; R507-E510 VanDerWaalsContact O-N 3.12Å; R507-F511 WeakPolarHBondContact O-CD2 3.47Å; R507-F511 PolarHBondContact O-N 2.9Å
508	L	51.2	Low	55	Low	94 Å²	94	116.5 Å²	116.5	49%	0.492	61%	0.605	S	S	.	*	H	α-helix	trans	-64.9	-30.9	177.1	-68.8	173.8	0	0	0	111.9	L502 S505 Q506 E510	L502-L508 HydrophobicContact CD2-CD1 4.46Å; S505-L508 PolarHBondContact O-N 3.35Å; S505-L508 VanDerWaalsContact O-N 3.15Å; Q506-L508 PolarHBondContact O-N 3.27Å; L508-E510 VanDerWaalsContact C-N 3.29Å; L508-E510 PolarHBondContact O-N 2.89Å
509	D	49.7	Very low	53.6	Low	124 Å²	124	123.1 Å²	123.1	66%	0.663	63%	0.63	S	S	*	*	H	α-helix	trans	-75.7	-16.3	175.2	-59.7	-34.6	0	0	0	112.6	Q506 R507 V513	Q506-D509 WeakPolarHBondContact O-CB 3.21Å; Q506-D509 PolarHBondContact O-N 3.14Å; Q506-D509 VanDerWaalsContact O-N 3.07Å; R507-D509 PolarHBondContact O-N 3.29Å; D509-V513 WeakPolarHBondContact O-CG2 3.45Å
510	E	46.1	Very low	52	Low	132 Å²	132	121.6 Å²	121.6	62%	0.617	63%	0.631	S	S	*	*	H	α-helix	trans	-89.2	-33.2	-176.3	-65.1	-179.6	138.1	0	0	112.7	R507 L508	R507-E510 PolarHBondContact O-N 2.89Å; R507-E510 VanDerWaalsContact O-N 3.12Å; L508-E510 VanDerWaalsContact C-N 3.29Å; L508-E510 PolarHBondContact O-N 2.89Å
511	F	43	Very low	50.4	Low	156 Å²	156	129.5 Å²	129.5	68%	0.684	66%	0.663	S	S	*	*	H	α-helix	trans	-70.9	-40	178.5	-79.9	-79.8	0	0	0	113	R507 V513 A514	R507-F511 WeakPolarHBondContact O-CD2 3.47Å; R507-F511 PolarHBondContact O-N 2.9Å; F511-V513 PolarHBondContact O-N 3.26Å; F511-V513 VanDerWaalsContact O-N 3.11Å; F511-A514 PolarHBondContact O-N 3.22Å
512	E	42	Very low	49.1	Very low	163 Å²	163	134.4 Å²	134.4	76%	0.762	68%	0.681	S	S	*	*	H	α-helix	trans	-69.6	-6.7	-178.8	-67.1	-167.9	172.2	0	0	114.4
513	V	45.4	Very low	47.4	Very low	98 Å²	98	138.5 Å²	138.5	59%	0.594	70%	0.701	S	S	*	*	H	α-helix	trans	-98.1	-24.4	179.3	179.8	0	0	0	0	112.5	D509 F511 S516	D509-V513 WeakPolarHBondContact O-CG2 3.45Å; F511-V513 PolarHBondContact O-N 3.26Å; F511-V513 VanDerWaalsContact O-N 3.11Å; V513-S516 PolarHBondContact O-OG 3.44Å; V513-S516 VanDerWaalsContact O-OG 3.13Å
514	A	44.3	Very low	45.9	Very low	71 Å²	71	137.5 Å²	137.5	59%	0.587	71%	0.71	S	S	*	*	H	α-helix	trans	-71.9	-39	-176.1	0	0	0	0	0	112.9	F511 S516	F511-A514 PolarHBondContact O-N 3.22Å; A514-S516 PolarHBondContact O-N 2.83Å; A514-S516 VanDerWaalsContact O-N 3.09Å
515	D	44.6	Very low	44.2	Very low	151 Å²	151	132.8 Å²	132.8	81%	0.807	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	15.7	-171	-64.1	-14.2	0	0	0	114.1
516	S	43.8	Very low	43	Very low	83 Å²	83	138 Å²	138	58%	0.58	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	-2.5	-171.4	67.2	0	0	0	0	117.2	V513 A514	V513-S516 PolarHBondContact O-OG 3.44Å; V513-S516 VanDerWaalsContact O-OG 3.13Å; A514-S516 PolarHBondContact O-N 2.83Å; A514-S516 VanDerWaalsContact O-N 3.09Å
517	D	40.7	Very low	41.7	Very low	142 Å²	142	139.8 Å²	139.8	76%	0.759	74%	0.744	S	S	*	*			trans	-118.9	3.4	-173.6	-89.2	-37.4	0	0	0	115.5	Q519	D517-Q519 PolarHBondContact O-N 2.87Å
518	E	38.8	Very low	41	Very low	193 Å²	193	143 Å²	143	90%	0.902	76%	0.756	S	S	*	*			trans	-79.4	116	174.9	-70.4	-148.9	153	0	0	112.6	S520	E518-S520 PolarHBondContact O-N 2.89Å
519	Q	32.6	Very low	40.4	Very low	190 Å²	190	144.9 Å²	144.9	89%	0.888	77%	0.772	S	S	*	*			trans	-82.2	107.3	-175.3	-64.8	175.9	-1.9	0	0	111.9	D517 E521	D517-Q519 PolarHBondContact O-N 2.87Å; Q519-E521 PolarHBondContact O-N 2.77Å
520	S	37.5	Very low	39.7	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	78%	0.777	S	S	*	*			trans	-84.2	98.8	175.1	60.1	0	0	0	0	112.3	E518 E522	E518-S520 PolarHBondContact O-N 2.89Å; S520-E522 PolarHBondContact O-N 3.39Å
521	E	37.5	Very low	39.5	Very low	195 Å²	195	143.3 Å²	143.3	91%	0.911	79%	0.785	S	S	*	*			trans	-74.2	103.7	164.3	-69.8	-164.9	147.1	0	0	110.2	Q519	Q519-E521 PolarHBondContact O-N 2.77Å
522	E	39.7	Very low	38.9	Very low	181 Å²	181	147.9 Å²	147.9	85%	0.846	80%	0.798	S	S	*	*			trans	-84.1	114.2	176.6	-67.4	-167.8	132.8	0	0	112.4	S520	S520-E522 PolarHBondContact O-N 3.39Å
523	I	34.4	Very low	38.7	Very low	171 Å²	171	144.7 Å²	144.7	88%	0.877	80%	0.799	S	S	*	*			trans	-137.9	118.9	158.2	-55.5	-178.6	0	0	0	109.6
524	G	42.5	Very low	38.2	Very low	75 Å²	75	147.1 Å²	147.1	77%	0.773	81%	0.814	S	S	*	*			trans	82.5	60.9	163.7	0	0	0	0	0	116.6
525	G	38.6	Very low	37.6	Very low	77 Å²	77	147.1 Å²	147.1	79%	0.794	82%	0.822	S	S	*	*			trans	-69.7	130.2	172.8	0	0	0	0	0	113.6
526	L	39.9	Very low	37.2	Very low	153 Å²	153	151.2 Å²	151.2	80%	0.801	83%	0.826	S	S	*	*	S	Bend	trans	-165.3	-28.8	155.9	-114.6	160.7	0	0	0	113.3
527	F	31.8	Very low	36.6	Very low	197 Å²	197	153.8 Å²	153.8	86%	0.864	84%	0.841	S	S	*	*			trans	-143.4	136.5	175.3	-63.9	-83.5	0	0	0	112
528	R	37.4	Very low	36.5	Very low	251 Å²	251	150.8 Å²	150.8	95%	0.947	84%	0.843	S	S	*	*			trans	-141	123.7	163.5	-160.9	174.5	-170.6	-179.3	2.6	109.4
529	V	37.3	Very low	36.3	Very low	135 Å²	135	150.4 Å²	150.4	82%	0.818	84%	0.842	S	S	*	*			trans	-85.4	136.6	-174.8	178	0	0	0	0	110.4	S531	V529-S531 PolarHBondContact O-N 3.08Å
530	S	36.6	Very low	36.5	Very low	111 Å²	111	147.8 Å²	147.8	78%	0.776	84%	0.838	S	S	*	*			trans	-84.3	107.1	173.4	47.8	0	0	0	0	111.4	R532	S530-R532 PolarHBondContact O-N 3.19Å
531	S	40.3	Very low	36.3	Very low	111 Å²	111	148.2 Å²	148.2	78%	0.776	84%	0.838	S	S	*	*			trans	-74.5	102.5	174	54	0	0	0	0	111	V529 A533	V529-S531 PolarHBondContact O-N 3.08Å; S531-A533 PolarHBondContact O-N 2.7Å; S531-A533 VanDerWaalsContact O-N 3.08Å
532	R	30.3	Very low	36.4	Very low	252 Å²	252	147 Å²	147	95%	0.951	84%	0.837	S	S	*	*			trans	-64.4	104.8	166.8	-83.9	-179.4	166.4	167.4	-4.3	109.9	S530	S530-R532 PolarHBondContact O-N 3.19Å
533	A	38.1	Very low	36.1	Very low	97 Å²	97	147.7 Å²	147.7	80%	0.802	84%	0.838	S	S	*	*			trans	-102.2	148.4	165.7	0	0	0	0	0	110.1	S531	S531-A533 PolarHBondContact O-N 2.7Å; S531-A533 VanDerWaalsContact O-N 3.08Å
534	T	36.2	Very low	36.1	Very low	148 Å²	148	147 Å²	147	91%	0.908	84%	0.836	S	S	*	*			trans	-96.7	138.9	-164.4	39.1	0	0	0	0	114.5
535	G	31.9	Very low	35.9	Very low	72 Å²	72	151.7 Å²	151.7	74%	0.742	83%	0.83	S	S	*	*			trans	96.7	84	136.2	0	0	0	0	0	119.2
536	R	34.5	Very low	35.5	Very low	236 Å²	236	154.2 Å²	154.2	89%	0.891	83%	0.83	S	S	*	*			trans	-160.7	125.7	137.4	-107.1	166	-162.9	-163.4	4.2	110.4
537	P	31.7	Very low	35.1	Very low	138 Å²	138	154.2 Å²	154.2	90%	0.896	83%	0.831	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	122.7	176.4	32.1	-31.2	0	0	0	110.8
538	G	39.3	Very low	35.2	Very low	79 Å²	79	150.2 Å²	150.2	81%	0.814	83%	0.827	S	S	*	*	T	Hydrogen-bonded Turn	trans	158.2	-21.6	173	0	0	0	0	0	115.9
539	E	33.3	Very low	34.8	Very low	185 Å²	185	143.1 Å²	143.1	86%	0.864	82%	0.823	S	S	*	*			trans	-112.7	123.1	-173.1	-70.4	164.6	-174	0	0	110.8
540	V	37.6	Very low	34.4	Very low	134 Å²	134	145.2 Å²	145.2	81%	0.812	83%	0.825	S	S	*	*			trans	-134.6	120.2	174.4	-176.8	0	0	0	0	108
541	P	33.7	Very low	34.1	Very low	114 Å²	114	145.5 Å²	145.5	74%	0.74	82%	0.822	S	S	*	*			trans	-71	140.2	-177.3	28.4	-34.2	0	0	0	111.8	F543	P541-F543 PolarHBondContact O-N 2.92Å
542	L	38.7	Very low	33.7	Very low	169 Å²	169	149.6 Å²	149.6	89%	0.885	83%	0.826	S	S	*	*	S	Bend	trans	-84.8	49.3	-173.1	-161.8	75	0	0	0	113
543	F	34.5	Very low	33.7	Very low	196 Å²	196	141.1 Å²	141.1	86%	0.86	80%	0.803	S	S	*	*			trans	-133.7	58.2	-176.4	-103.5	-80	0	0	0	112.1	P541	P541-F543 PolarHBondContact O-N 2.92Å
544	D	33.9	Very low	33.4	Very low	158 Å²	158	142.2 Å²	142.2	85%	0.845	80%	0.802	S	S	*	*			trans	-166.2	67.8	161.2	-112.1	-19.3	0	0	0	113.5
545	R	37.5	Very low	33.3	Very low	173 Å²	173	139.8 Å²	139.8	65%	0.653	78%	0.779	S	S	*	*			trans	-144.1	102.8	156.8	-71.7	-160.2	-177.8	-177.1	4.2	111.2
546	V	31.1	Very low	33.5	Very low	130 Å²	130	140.6 Å²	140.6	79%	0.788	79%	0.786	S	S	*	*			trans	-68.4	172.6	161.1	-170.7	0	0	0	0	108.6
547	D	31.6	Very low	33.7	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	78%	0.781	S	S	*	*			trans	81.1	44.1	178.6	-58.8	-15.7	0	0	0	118
548	S	33.1	Very low	34.2	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	76%	0.762	S	S	*	*			trans	-158.1	112.9	139.5	-85.1	0	0	0	0	111.3	M550	S548-M550 PolarHBondContact O-N 2.86Å
549	A	29.5	Very low	34.1	Very low	103 Å²	103	136.4 Å²	136.4	85%	0.851	75%	0.75	S	S	*	*			trans	-77.8	48.1	-170.9	0	0	0	0	0	115.2
550	M	28.4	Very low	34.7	Very low	178 Å²	178	132.8 Å²	132.8	88%	0.877	74%	0.744	S	S	*	*			trans	-93.9	87.7	151.8	-87.1	-164.1	164.9	0	0	108.6	S548 K552	S548-M550 PolarHBondContact O-N 2.86Å; M550-K552 PolarHBondContact O-N 2.82Å
551	V	30.7	Very low	35.1	Very low	117 Å²	117	132.8 Å²	132.8	71%	0.709	74%	0.74	S	S	*	*			trans	-62.9	102.6	177.7	-178.8	0	0	0	0	109.5	T553	V551-T553 HydrophobicContact CG1-CG2 4.12Å; V551-T553 PolarHBondContact O-N 2.73Å; V551-T553 PolarHBondContact O-OG1 3.43Å
552	K	31.5	Very low	35.7	Very low	198 Å²	198	130 Å²	130	86%	0.861	72%	0.718	S	S	*	*			trans	-66.5	77.1	166.7	-72.1	-175.4	177	-178.5	0	109.7	M550	M550-K552 PolarHBondContact O-N 2.82Å
553	T	31.5	Very low	35.9	Very low	74 Å²	74	131.2 Å²	131.2	45%	0.454	72%	0.717	S	S	.	*			trans	-72.5	145.6	162.7	22	0	0	0	0	108.9	V551 F555	V551-T553 HydrophobicContact CG1-CG2 4.12Å; V551-T553 PolarHBondContact O-N 2.73Å; V551-T553 PolarHBondContact O-OG1 3.43Å; T553-F555 WeakPolarHBondContact O-CB 3.39Å; T553-F555 WeakPolarHBondContact O-CD2 3.41Å; T553-F555 PolarHBondContact O-N 3.47Å; T553-F555 WeakPolarHBondContact OG1-CD2 3.12Å; T553-F555 VanDerWaalsContact OG1-CE2 3.25Å; T553-F555 WeakPolarHBondContact OG1-CE2 3.28Å
554	P	31.9	Very low	36.4	Very low	120 Å²	120	129.5 Å²	129.5	78%	0.779	72%	0.716	S	S	*	*			trans	-66.3	106.9	-172	25.4	-34.4	0	0	0	110.9
555	F	34.4	Very low	36.9	Very low	97 Å²	97	130.2 Å²	130.2	43%	0.425	71%	0.707	S	S	.	*			trans	-131.5	60.3	-163.4	-95.8	-50.5	0	0	0	115.8	T553 K557 T558	T553-F555 WeakPolarHBondContact O-CB 3.39Å; T553-F555 WeakPolarHBondContact O-CD2 3.41Å; T553-F555 PolarHBondContact O-N 3.47Å; T553-F555 WeakPolarHBondContact OG1-CD2 3.12Å; T553-F555 VanDerWaalsContact OG1-CE2 3.25Å; T553-F555 WeakPolarHBondContact OG1-CE2 3.28Å; F555-K557 PolarHBondContact O-N 2.72Å; F555-T558 HydrophobicContact CB-CG2 4.2Å; F555-T558 HydrophobicContact CD1-CG2 3.77Å; F555-T558 VanDerWaalsContact CD1-N 3.32Å; F555-T558 HydrophobicContact CD2-CG2 3.9Å; F555-T558 HydrophobicContact CE1-CG2 4.03Å; F555-T558 HydrophobicContact CE2-CG2 4.15Å; F555-T558 HydrophobicContact CG-CG2 3.71Å; F555-T558 HydrophobicContact CZ-CG2 4.22Å; F555-T558 PolarHBondContact O-OG1 3.28Å
556	G	35.1	Very low	37.2	Very low	88 Å²	88	126.5 Å²	126.5	91%	0.907	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	7.6	150.8	0	0	0	0	0	114.4
557	K	38.8	Very low	37.7	Very low	178 Å²	178	127.8 Å²	127.8	77%	0.774	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.1	23.3	-173.3	-69.8	-175.9	-177.5	161.7	0	115.3	F555 N559	F555-K557 PolarHBondContact O-N 2.72Å; K557-N559 VanDerWaalsContact C-N 3.28Å; K557-N559 PolarHBondContact O-N 2.86Å
558	T	41.8	Very low	38.3	Very low	83 Å²	83	129.2 Å²	129.2	51%	0.509	71%	0.709	S	S	.	*			trans	-67.9	93.5	161	18.7	0	0	0	0	107.9	F555 C560 L562	F555-T558 HydrophobicContact CB-CG2 4.2Å; F555-T558 HydrophobicContact CD1-CG2 3.77Å; F555-T558 VanDerWaalsContact CD1-N 3.32Å; F555-T558 HydrophobicContact CD2-CG2 3.9Å; F555-T558 HydrophobicContact CE1-CG2 4.03Å; F555-T558 HydrophobicContact CE2-CG2 4.15Å; F555-T558 HydrophobicContact CG-CG2 3.71Å; F555-T558 HydrophobicContact CZ-CG2 4.22Å; F555-T558 PolarHBondContact O-OG1 3.28Å; T558-C560 PolarHBondContact O-N 3.43Å; T558-L562 HydrophobicContact CG2-CD1 4.04Å
559	N	37.2	Very low	38.9	Very low	105 Å²	105	129.6 Å²	129.6	56%	0.561	70%	0.703	S	S	*	*			trans	-48.3	132.9	174.5	-73.5	-54.7	0	0	0	109.9	K557 N561 L562	K557-N559 VanDerWaalsContact C-N 3.28Å; K557-N559 PolarHBondContact O-N 2.86Å; N559-N561 HydrophobicContact CB-CB 4.16Å; N559-N561 PolarHBondContact O-N 3.49Å; N559-L562 HydrophobicContact CB-CD1 4.35Å; N559-L562 HydrophobicContact CB-CG 4.32Å; N559-L562 VanDerWaalsContact O-CB 3.28Å; N559-L562 WeakPolarHBondContact O-CB 3.22Å; N559-L562 PolarHBondContact O-N 3.21Å
560	C	47.2	Very low	39.9	Very low	109 Å²	109	132.4 Å²	132.4	74%	0.736	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-5.9	167.8	53.1	0	0	0	0	113.6	T558 L562 F563	T558-C560 PolarHBondContact O-N 3.43Å; C560-L562 VanDerWaalsContact C-N 3.32Å; C560-F563 WeakPolarHBondContact O-CD2 3.37Å
561	N	45.1	Very low	40.9	Very low	133 Å²	133	128.7 Å²	128.7	71%	0.711	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	3	170.3	-52.1	-28.2	0	0	0	113.6	N559 F563	N559-N561 HydrophobicContact CB-CB 4.16Å; N559-N561 PolarHBondContact O-N 3.49Å; N561-F563 VanDerWaalsContact C-N 3.3Å; N561-F563 PolarHBondContact O-N 2.96Å
562	L	46	Very low	41.7	Very low	55 Å²	55	129.4 Å²	129.4	29%	0.288	68%	0.683	S	S	.	*			trans	-87.5	23.1	-177.9	-79.9	166	0	0	0	115	T558 N559 C560 N564 R565	T558-L562 HydrophobicContact CG2-CD1 4.04Å; N559-L562 HydrophobicContact CB-CD1 4.35Å; N559-L562 HydrophobicContact CB-CG 4.32Å; N559-L562 VanDerWaalsContact O-CB 3.28Å; N559-L562 WeakPolarHBondContact O-CB 3.22Å; N559-L562 PolarHBondContact O-N 3.21Å; C560-L562 VanDerWaalsContact C-N 3.32Å; L562-N564 PolarHBondContact O-N 3.1Å; L562-R565 HydrophobicContact CD2-CG 3.99Å; L562-R565 PolarHBondContact O-N 2.83Å
563	F	42.6	Very low	42.7	Very low	195 Å²	195	124 Å²	124	86%	0.855	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	3.2	170.2	-90.1	-84.4	0	0	0	115.1	C560 N561	C560-F563 WeakPolarHBondContact O-CD2 3.37Å; N561-F563 VanDerWaalsContact C-N 3.3Å; N561-F563 PolarHBondContact O-N 2.96Å
564	N	46.6	Very low	43.6	Very low	160 Å²	160	125.3 Å²	125.3	86%	0.856	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	24.8	177.2	-74.5	-3.3	0	0	0	113.3	L562	L562-N564 PolarHBondContact O-N 3.1Å
565	R	43.1	Very low	44.5	Very low	174 Å²	174	125.2 Å²	125.2	66%	0.657	66%	0.664	S	S	*	*			trans	-119.1	136.8	164.2	-77.9	-169.1	-174.7	160.2	-2.9	109.8	L562	L562-R565 HydrophobicContact CD2-CG 3.99Å; L562-R565 PolarHBondContact O-N 2.83Å
566	S	43.8	Very low	45.2	Very low	94 Å²	94	128.7 Å²	128.7	66%	0.657	68%	0.679	S	S	*	*			cis	-147.5	162.1	-7.1	39.2	0	0	0	0	108.6	F568	S566-F568 PolarHBondContact O-N 2.95Å; S566-F568 VanDerWaalsContact O-N 3.09Å
567	N	41.8	Very low	46.2	Very low	158 Å²	158	135.1 Å²	135.1	85%	0.845	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-51.4	121.7	174.4	-64.5	1.8	0	0	0	108.9	D569	N567-D569 PolarHBondContact O-N 2.87Å
568	F	45.2	Very low	47.1	Very low	181 Å²	181	128.4 Å²	128.4	79%	0.794	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-65	130	164.5	-77.9	-97.6	0	0	0	107.1	S566 E570	S566-F568 PolarHBondContact O-N 2.95Å; S566-F568 VanDerWaalsContact O-N 3.09Å; F568-E570 PolarHBondContact O-N 3.02Å
569	D	45	Very low	48	Very low	121 Å²	121	128.7 Å²	128.7	65%	0.647	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-60.1	123.8	175.2	-66.9	-55.1	0	0	0	109.4	N567 T571 M572	N567-D569 PolarHBondContact O-N 2.87Å; D569-T571 WeakPolarHBondContact CB-OG1 3.49Å; D569-T571 PolarHBondContact O-N 2.89Å; D569-M572 PolarHBondContact O-N 3.29Å
570	E	49.7	Very low	49.4	Very low	163 Å²	163	127.9 Å²	127.9	76%	0.762	65%	0.647	S	S	*	*	H	α-helix	trans	-60.5	-15.3	-178	-61.8	-178	122.9	0	0	112.1	F568 M572 V573 T574	F568-E570 PolarHBondContact O-N 3.02Å; E570-M572 VanDerWaalsContact C-N 3.32Å; E570-M572 PolarHBondContact O-N 3.26Å; E570-V573 PolarHBondContact O-N 3.12Å; E570-T574 WeakPolarHBondContact O-CB 3.18Å; E570-T574 WeakPolarHBondContact O-CG2 3.37Å; E570-T574 PolarHBondContact O-N 3.22Å; E570-T574 PolarHBondContact O-OG1 3.15Å
571	T	50.8	Low	50.5	Low	99 Å²	99	126.6 Å²	126.6	61%	0.607	64%	0.639	S	S	*	*	H	α-helix	trans	-64.9	-24.3	173.1	60.3	0	0	0	0	114.3	D569 T574	D569-T571 WeakPolarHBondContact CB-OG1 3.49Å; D569-T571 PolarHBondContact O-N 2.89Å; T571-T574 WeakPolarHBondContact CA-OG1 3.35Å; T571-T574 PolarHBondContact O-OG1 3.26Å
572	M	47.1	Very low	51.8	Low	132 Å²	132	124.3 Å²	124.3	65%	0.65	63%	0.626	S	S	*	*	H	α-helix	trans	-85.3	-38.2	171.2	-84.3	-162.4	165.6	0	0	112.2	D569 E570 T574 Q575	D569-M572 PolarHBondContact O-N 3.29Å; E570-M572 VanDerWaalsContact C-N 3.32Å; E570-M572 PolarHBondContact O-N 3.26Å; M572-T574 VanDerWaalsContact C-N 3.28Å; M572-T574 PolarHBondContact O-N 3Å; M572-Q575 PolarHBondContact O-N 3.09Å
573	V	51.1	Low	52.8	Low	84 Å²	84	127.1 Å²	127.1	51%	0.509	64%	0.636	S	S	.	*	H	α-helix	trans	-69.9	-27.7	-178.9	-172.9	0	0	0	0	111.8	E570 Q575	E570-V573 PolarHBondContact O-N 3.12Å; V573-Q575 VanDerWaalsContact C-N 3.29Å; V573-Q575 PolarHBondContact O-N 3.35Å
574	T	51.6	Low	53.9	Low	102 Å²	102	121.1 Å²	121.1	63%	0.626	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-8.7	176	42.9	0	0	0	0	114.4	E570 T571 M572 F576	E570-T574 WeakPolarHBondContact O-CB 3.18Å; E570-T574 WeakPolarHBondContact O-CG2 3.37Å; E570-T574 PolarHBondContact O-N 3.22Å; E570-T574 PolarHBondContact O-OG1 3.15Å; T571-T574 WeakPolarHBondContact CA-OG1 3.35Å; T571-T574 PolarHBondContact O-OG1 3.26Å; M572-T574 VanDerWaalsContact C-N 3.28Å; M572-T574 PolarHBondContact O-N 3Å; T574-F576 PolarHBondContact O-N 3.3Å
575	Q	49.5	Very low	54.8	Low	119 Å²	119	118.2 Å²	118.2	56%	0.556	61%	0.613	S	S	*	*			trans	-76.9	102.8	172.2	-62.7	-168	16	0	0	110.7	M572 V573 R577 A578	M572-Q575 PolarHBondContact O-N 3.09Å; V573-Q575 VanDerWaalsContact C-N 3.29Å; V573-Q575 PolarHBondContact O-N 3.35Å; Q575-R577 PolarHBondContact O-N 3.35Å; Q575-A578 WeakPolarHBondContact O-CB 3.4Å; Q575-A578 PolarHBondContact O-N 2.99Å
576	F	50.1	Low	55.8	Low	169 Å²	169	118 Å²	118	74%	0.741	62%	0.618	S	S	*	*	H	α-helix	trans	-46.6	-33.6	179.6	-100.2	-96.7	0	0	0	114.7	T574 A578 L579 D580	T574-F576 PolarHBondContact O-N 3.3Å; F576-A578 VanDerWaalsContact C-N 3.35Å; F576-A578 PolarHBondContact O-N 3.15Å; F576-L579 PolarHBondContact O-N 2.86Å; F576-D580 PolarHBondContact O-N 2.82Å
577	R	55.9	Low	56.1	Low	223 Å²	223	118.9 Å²	118.9	84%	0.842	62%	0.619	S	S	*	*	H	α-helix	trans	-64.2	-32.6	176.8	-71.9	-177.2	173.8	175.2	-1.8	113.9	Q575 S581	Q575-R577 PolarHBondContact O-N 3.35Å; R577-S581 PolarHBondContact O-N 3.21Å
578	A	58	Low	55.9	Low	37 Å²	37	115.7 Å²	115.7	31%	0.306	61%	0.609	S	S	.	*	H	α-helix	trans	-73.9	-34.8	177.5	0	0	0	0	0	111.7	Q575 F576 S581 I582	Q575-A578 WeakPolarHBondContact O-CB 3.4Å; Q575-A578 PolarHBondContact O-N 2.99Å; F576-A578 VanDerWaalsContact C-N 3.35Å; F576-A578 PolarHBondContact O-N 3.15Å; A578-S581 PolarHBondContact O-N 3.08Å; A578-S581 PolarHBondContact O-OG 3.41Å; A578-I582 WeakPolarHBondContact O-CG1 3.43Å; A578-I582 PolarHBondContact O-N 3.03Å
579	L	61.5	Low	55.5	Low	89 Å²	89	119.2 Å²	119.2	47%	0.466	62%	0.617	S	S	.	*	H	α-helix	trans	-65.4	-39.7	173.7	-65.8	174.5	0	0	0	111.4	F576 K583	F576-L579 PolarHBondContact O-N 2.86Å; L579-K583 WeakPolarHBondContact O-CB 3.42Å; L579-K583 PolarHBondContact O-N 3.11Å
580	D	65.7	Low	55	Low	89 Å²	89	118.1 Å²	118.1	48%	0.476	62%	0.624	S	S	.	*	H	α-helix	trans	-67.8	-31.2	177	-86.5	-20	0	0	0	113.9	F576 K583	F576-D580 PolarHBondContact O-N 2.82Å; D580-K583 WeakPolarHBondContact O-CB 3.36Å; D580-K583 WeakPolarHBondContact OD1-CD 3.45Å; D580-K583 WeakPolarHBondContact OD1-CE 3.26Å; D580-K583 IonicContact OD1-NZ 3.9Å; D580-K583 PolarHBondContact OD1-NZ 3.02Å
581	S	69.6	Low	54.4	Low	81 Å²	81	114 Å²	114	57%	0.566	63%	0.625	S	S	*	*	H	α-helix	trans	-72.8	-39.5	175.7	66.6	0	0	0	0	112.6	R577 A578 K583	R577-S581 PolarHBondContact O-N 3.21Å; A578-S581 PolarHBondContact O-N 3.08Å; A578-S581 PolarHBondContact O-OG 3.41Å; S581-K583 VanDerWaalsContact C-N 3.31Å
582	I	72.1	Confident	53.6	Low	85 Å²	85	119 Å²	119	44%	0.436	64%	0.642	S	S	.	*	H	α-helix	trans	-78.1	-19.5	177.7	-48.2	162.4	0	0	0	111.4	A578 A584 C585 F586	A578-I582 WeakPolarHBondContact O-CG1 3.43Å; A578-I582 PolarHBondContact O-N 3.03Å; I582-A584 PolarHBondContact O-N 2.87Å; I582-A584 VanDerWaalsContact O-N 3.12Å; I582-C585 HydrophobicContact CG2-CB 4.33Å; I582-C585 WeakPolarHBondContact O-CA 3.5Å; I582-C585 WeakPolarHBondContact O-CB 3.4Å; I582-C585 PolarHBondContact O-N 2.97Å; I582-F586 HydrophobicContact CB-CE2 4.3Å; I582-F586 HydrophobicContact CG2-CD2 4.08Å; I582-F586 HydrophobicContact CG2-CE2 3.59Å; I582-F586 HydrophobicContact CG2-CZ 4.26Å; I582-F586 WeakPolarHBondContact O-CD2 3.39Å; I582-F586 PolarHBondContact O-N 2.93Å
583	K	67.3	Low	53	Low	115 Å²	115	117.9 Å²	117.9	50%	0.5	65%	0.647	S	S	.	*	H	α-helix	trans	-50.2	-35.9	173.1	-145.7	166.4	-176.3	178.6	0	113.2	L579 D580 S581 C585 F586 V587	L579-K583 WeakPolarHBondContact O-CB 3.42Å; L579-K583 PolarHBondContact O-N 3.11Å; D580-K583 WeakPolarHBondContact O-CB 3.36Å; D580-K583 WeakPolarHBondContact OD1-CD 3.45Å; D580-K583 WeakPolarHBondContact OD1-CE 3.26Å; D580-K583 IonicContact OD1-NZ 3.9Å; D580-K583 PolarHBondContact OD1-NZ 3.02Å; S581-K583 VanDerWaalsContact C-N 3.31Å; K583-C585 VanDerWaalsContact C-N 3.25Å; K583-C585 PolarHBondContact O-N 2.92Å; K583-F586 PolarHBondContact O-N 3.1Å; K583-F586 VanDerWaalsContact O-N 3.12Å; K583-V587 WeakPolarHBondContact O-CG2 3.29Å; K583-V587 PolarHBondContact O-N 3.44Å
584	A	65.6	Low	52.2	Low	69 Å²	69	124.5 Å²	124.5	57%	0.57	67%	0.669	S	S	*	*	H	α-helix	trans	-62.3	-31	175.3	0	0	0	0	0	112.9	I582 S588	I582-A584 PolarHBondContact O-N 2.87Å; I582-A584 VanDerWaalsContact O-N 3.12Å; A584-S588 WeakPolarHBondContact O-CB 3.25Å
585	C	66.9	Low	51.2	Low	98 Å²	98	122.1 Å²	122.1	66%	0.662	67%	0.665	S	S	*	*	H	α-helix	trans	-79.8	-23.1	175	-58.5	0	0	0	0	112.8	I582 K583	I582-C585 HydrophobicContact CG2-CB 4.33Å; I582-C585 WeakPolarHBondContact O-CA 3.5Å; I582-C585 WeakPolarHBondContact O-CB 3.4Å; I582-C585 PolarHBondContact O-N 2.97Å; K583-C585 VanDerWaalsContact C-N 3.25Å; K583-C585 PolarHBondContact O-N 2.92Å
586	F	64.4	Low	50.3	Low	171 Å²	171	124.9 Å²	124.9	75%	0.75	68%	0.683	S	S	*	*	H	α-helix	trans	-88.7	-19.8	175.3	-66.6	-61	0	0	0	113.5	I582 K583	I582-F586 HydrophobicContact CB-CE2 4.3Å; I582-F586 HydrophobicContact CG2-CD2 4.08Å; I582-F586 HydrophobicContact CG2-CE2 3.59Å; I582-F586 HydrophobicContact CG2-CZ 4.26Å; I582-F586 WeakPolarHBondContact O-CD2 3.39Å; I582-F586 PolarHBondContact O-N 2.93Å; K583-F586 PolarHBondContact O-N 3.1Å; K583-F586 VanDerWaalsContact O-N 3.12Å
587	V	48.7	Very low	49.4	Very low	112 Å²	112	121.3 Å²	121.3	68%	0.679	69%	0.685	S	S	*	*	S	Bend	trans	-123.3	55.3	-174.9	-166.7	0	0	0	0	111.1	K583	K583-V587 WeakPolarHBondContact O-CG2 3.29Å; K583-V587 PolarHBondContact O-N 3.44Å
588	S	37.5	Very low	48.2	Very low	91 Å²	91	120.7 Å²	120.7	64%	0.636	69%	0.689	S	S	*	*			trans	-130.3	56	-177.9	62.5	0	0	0	0	114.1	A584	A584-S588 WeakPolarHBondContact O-CB 3.25Å
589	R	37.6	Very low	47	Very low	255 Å²	255	123.5 Å²	123.5	96%	0.962	71%	0.712	S	S	*	*	S	Bend	trans	-138.6	39.2	159.8	-156.1	-179.9	174	115.8	-0.7	112.6
590	A	34.9	Very low	45.9	Very low	98 Å²	98	126.2 Å²	126.2	81%	0.81	73%	0.732	S	S	*	*	S	Bend	trans	-143.1	107.8	175.5	0	0	0	0	0	109.9
591	G	36.5	Very low	44.3	Very low	76 Å²	76	127.5 Å²	127.5	78%	0.784	74%	0.743	S	S	*	*	S	Bend	trans	131.8	120.1	178.9	0	0	0	0	0	113.4
592	E	33.2	Very low	42.5	Very low	203 Å²	203	130.4 Å²	130.4	95%	0.949	75%	0.752	S	S	*	*			trans	87.1	71.9	168.5	-52	-148.6	154.3	0	0	119.6
593	S	35.1	Very low	40.8	Very low	109 Å²	109	134 Å²	134	76%	0.762	77%	0.773	S	S	*	*			trans	-146.5	114.9	144.5	52.5	0	0	0	0	111.5	G595	S593-G595 PolarHBondContact O-N 3.36Å
594	K	34.3	Very low	39.1	Very low	224 Å²	224	134.2 Å²	134.2	97%	0.974	79%	0.788	S	S	*	*			trans	-84.7	102.6	166.3	-75.1	178.9	-180	171.2	0	108.2
595	G	31.4	Very low	37.5	Very low	52 Å²	52	138.2 Å²	138.2	54%	0.536	80%	0.8	S	S	.	*	S	Bend	trans	139.3	105.9	172.8	0	0	0	0	0	114.2	S593	S593-G595 PolarHBondContact O-N 3.36Å
596	D	29.6	Very low	36	Very low	176 Å²	176	142.7 Å²	142.7	94%	0.941	81%	0.811	S	S	*	*			trans	52	64.2	145.7	-55	-18.4	0	0	0	119.3
597	A	30.6	Very low	34.6	Very low	95 Å²	95	137.7 Å²	137.7	79%	0.785	81%	0.808	S	S	*	*			trans	-128	81	162.5	0	0	0	0	0	112.1
598	K	30.6	Very low	34.1	Very low	209 Å²	209	143.7 Å²	143.7	91%	0.909	82%	0.82	S	S	*	*			trans	-117.1	140.4	161.9	-79.8	-173.8	176.6	179.1	0	109.8
599	A	34.6	Very low	33.9	Very low	96 Å²	96	144.9 Å²	144.9	79%	0.793	83%	0.829	S	S	*	*			trans	71.6	64.1	175.1	0	0	0	0	0	117.9
600	V	37.9	Very low	33.6	Very low	146 Å²	146	139.7 Å²	139.7	89%	0.885	82%	0.82	S	S	*	*				-132.2	107.6	129.4	-176.6	0	0	0	0	108.3
601	T	32.3	Very low	33.5	Very low	117 Å²	117	142.6 Å²	142.6	72%	0.718	82%	0.822	S	S	*	*			trans	-127.4	149.4	166.8	46.4	0	0	0	0	108.5
602	N	32.4	Very low	33.2	Very low	142 Å²	142	143.7 Å²	143.7	76%	0.759	82%	0.817	S	S	*	*	S	Bend	trans	91.2	127	176.3	-50.6	0.8	0	0	0	115.6
603	N	35.4	Very low	33.1	Very low	161 Å²	161	142.9 Å²	142.9	86%	0.861	81%	0.814	S	S	*	*			trans	81.9	83.8	157.2	-56	7.9	0	0	0	118.4
604	S	30.7	Very low	33.4	Very low	119 Å²	119	145.8 Å²	145.8	83%	0.832	82%	0.82	S	S	*	*			trans	-153.4	75.4	151.3	64.7	0	0	0	0	111.5
605	D	33.2	Very low	33.6	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	82%	0.818	S	S	*	*			trans	-158.3	155.9	153.5	-137.7	-29	0	0	0	111.7
606	E	35.6	Very low	33.7	Very low	192 Å²	192	151.7 Å²	151.7	90%	0.897	83%	0.834	S	S	*	*			trans	57	153.7	179.7	-56.6	-172.5	-137.9	0	0	116.5
607	G	33.7	Very low	34.2	Very low	67 Å²	67	149.9 Å²	149.9	69%	0.691	82%	0.824	S	S	*	*			cis	-166.6	179	-3.4	0	0	0	0	0	110.3
608	Y	39.8	Very low	34.2	Very low	238 Å²	238	155.7 Å²	155.7	93%	0.933	83%	0.832	S	S	*	*			trans	-80.7	162.1	177.2	-97.5	-107.7	0	0	0	112.9
609	S	32.7	Very low	34.6	Very low	116 Å²	116	152.7 Å²	152.7	81%	0.811	82%	0.821	S	S	*	*			trans	86.2	150.3	-176.6	79.2	0	0	0	0	115.2
610	D	31.5	Very low	34.8	Very low	145 Å²	145	153.5 Å²	153.5	78%	0.775	81%	0.812	S	S	*	*			cis	-142.4	167.8	1.1	-162.9	11.8	0	0	0	111.6	S612	D610-S612 PolarHBondContact O-N 3.46Å
611	D	33.5	Very low	35	Very low	160 Å²	160	154.7 Å²	154.7	86%	0.856	81%	0.813	S	S	*	*			trans	-76.5	94.8	178.6	-92.9	-42.3	0	0	0	112.6
612	S	29	Very low	35.1	Very low	98 Å²	98	157.7 Å²	157.7	69%	0.685	82%	0.819	S	S	*	*			trans	-165.5	161.6	159.5	37.2	0	0	0	0	115.7	D610	D610-S612 PolarHBondContact O-N 3.46Å
613	E	32.2	Very low	35.1	Very low	186 Å²	186	155.3 Å²	155.3	87%	0.869	80%	0.801	S	S	*	*			trans	54	78.4	157.6	-68.7	178.7	-161.6	0	0	120
614	L	39.5	Very low	34.9	Very low	171 Å²	171	156.2 Å²	156.2	90%	0.895	80%	0.801	S	S	*	*			trans	-145.4	71.1	143.5	-155.3	77.7	0	0	0	112.7
615	Y	39.2	Very low	34.9	Very low	236 Å²	236	155.1 Å²	155.1	93%	0.925	80%	0.798	S	S	*	*			trans	-133.3	30.5	177.3	-122.8	-69.7	0	0	0	113.6
616	D	32.9	Very low	34.7	Very low	163 Å²	163	155.4 Å²	155.4	87%	0.872	80%	0.8	S	S	*	*			trans	-131.3	157.7	177.3	-117.1	-37.8	0	0	0	113.7
617	D	40	Very low	34.4	Very low	139 Å²	139	154.6 Å²	154.6	74%	0.743	80%	0.802	S	S	*	*			trans	92.7	43.7	176.7	-147.3	16.5	0	0	0	119.5
618	F	32.4	Very low	34.4	Very low	216 Å²	216	158.2 Å²	158.2	95%	0.947	80%	0.801	S	S	*	*			trans	-101	30.5	164.7	-144.4	-89.8	0	0	0	112.8
619	E	37.2	Very low	34.1	Very low	146 Å²	146	153.9 Å²	153.9	68%	0.682	79%	0.787	S	S	*	*			trans	-133.5	28.1	-165.7	-97.7	-106.5	157.5	0	0	118.1
620	D	39.2	Very low	34.2	Very low	113 Å²	113	154.5 Å²	154.5	60%	0.604	79%	0.788	S	S	*	*	S	Bend	trans	-162.6	85.2	153.6	-124.3	5.2	0	0	0	117.1
621	L	42.8	Very low	34	Very low	171 Å²	171	156 Å²	156	90%	0.895	79%	0.79	S	S	*	*			trans	-154.6	8.5	158.7	-116.4	164.7	0	0	0	118.6	K623	L621-K623 PolarHBondContact O-N 2.86Å
622	E	34.1	Very low	33.8	Very low	181 Å²	181	152.8 Å²	152.8	85%	0.846	79%	0.787	S	S	*	*			trans	-96.9	74.7	170.1	-80.7	-147.5	151.1	0	0	113.5
623	K	33.2	Very low	33.9	Very low	91 Å²	91	154.6 Å²	154.6	40%	0.396	79%	0.789	S	S	.	*			trans	-143.3	143.1	160.2	-74.4	-160.8	178.7	-170.8	0	113.5	L621 Q1125	L621-K623 PolarHBondContact O-N 2.86Å; K623-Q1125 PolarHBondContact NZ-O 3.03Å
624	E	30.3	Very low	33.7	Very low	181 Å²	181	151.7 Å²	151.7	85%	0.846	78%	0.779	S	S	*	*	S	Bend	trans	68.5	67.5	167.8	-61.5	-174.5	-162.3	0	0	118.3
625	A	30.5	Very low	33.2	Very low	95 Å²	95	149.7 Å²	149.7	79%	0.785	77%	0.769	S	S	*	*				-175.4	82.6	126.2	0	0	0	0	0	113.3
626	N	30.1	Very low	32.7	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	76%	0.764	S	S	*	*			trans	-148	86	164.6	-109.2	-32.7	0	0	0	111
627	N	29.6	Very low	32.6	Very low	174 Å²	174	143.9 Å²	143.9	93%	0.93	75%	0.752	S	S	*	*			trans	-104.3	108.4	165.2	-94.2	3.7	0	0	0	108.1
628	E	32.7	Very low	32	Very low	143 Å²	143	145.6 Å²	145.6	67%	0.668	76%	0.755	S	S	*	*			trans	-127.9	131.6	163.3	-81	-148.7	136.6	0	0	110.7
629	K	33.4	Very low	31.9	Very low	147 Å²	147	142.7 Å²	142.7	64%	0.639	75%	0.75	S	S	*	*			trans	75.6	156.2	145.9	-73.3	162.1	-164.1	154.8	0	116.6
630	P	34	Very low	31.6	Very low	129 Å²	129	139.5 Å²	139.5	84%	0.838	75%	0.748	S	S	*	*			cis	-116.1	-176	23.7	42.6	-31.8	0	0	0	117.1
631	E	27.9	Very low	31.1	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.822	76%	0.755	S	S	*	*			trans	-89	145.7	-179	-59.3	149.5	160.6	0	0	111.5
632	A	30.4	Very low	30.6	Very low	94 Å²	94	135.8 Å²	135.8	78%	0.777	75%	0.745	S	S	*	*			trans	-164.1	128.3	157.2	0	0	0	0	0	112.4
633	N	29.5	Very low	30.4	Very low	136 Å²	136	134.8 Å²	134.8	73%	0.727	74%	0.741	S	S	*	*			trans	36.3	115.9	151	-65.3	54.6	0	0	0	123.3
634	D	28.1	Very low	30.1	Very low	125 Å²	125	137.4 Å²	137.4	67%	0.668	76%	0.759	S	S	*	*				73.9	132.4	115.6	-51.3	-22.6	0	0	0	125
635	N	29.3	Very low	30.1	Very low	129 Å²	129	131.7 Å²	131.7	69%	0.69	75%	0.749	S	S	*	*			trans	76.1	113.8	145.8	-69.3	-41.7	0	0	0	122.7
636	K	29	Very low	29.9	Very low	189 Å²	189	133.2 Å²	133.2	82%	0.822	75%	0.749	S	S	*	*			trans	64.9	148.5	131.4	-60	179.2	-174.3	-175.1	0	118.7
637	S	30	Very low	29.7	Very low	88 Å²	88	134.1 Å²	134.1	62%	0.615	75%	0.747	S	S	*	*			cis	-164.1	170	-4.6	36.5	0	0	0	0	110.3
638	E	28.5	Very low	29.6	Very low	174 Å²	174	129.5 Å²	129.5	81%	0.813	74%	0.741	S	S	*	*			trans	10.9	113.8	158.1	-63.2	104.4	-113.8	0	0	119.7
639	D	29.7	Very low	29.3	Very low	156 Å²	156	132.6 Å²	132.6	83%	0.834	75%	0.753	S	S	*	*				102.9	179.9	78	-118.7	69.1	0	0	0	111.7
640	A	30.4	Very low	29.3	Very low	78 Å²	78	132.1 Å²	132.1	65%	0.645	76%	0.757	S	S	*	*			cis	-156.8	-179.7	10.5	0	0	0	0	0	115.3
641	V	30.7	Very low	29.7	Very low	122 Å²	122	130.9 Å²	130.9	74%	0.739	75%	0.749	S	S	*	*			trans	3.7	133.5	148.4	-170.8	0	0	0	0	119
642	A	32.1	Very low	29.8	Very low	85 Å²	85	129.8 Å²	129.8	70%	0.702	75%	0.747	S	S	*	*				-161.8	159.4	71.2	0	0	0	0	0	111.6
643	Q	28.9	Very low	29.9	Very low	159 Å²	159	128.9 Å²	128.9	74%	0.743	75%	0.747	S	S	*	*			cis	66.5	139.5	46	-64.4	-166.6	3.9	0	0	114.6
644	N	26.8	Very low	30.1	Very low	147 Å²	147	130.2 Å²	130.2	79%	0.786	75%	0.749	S	S	*	*			cis	-162.5	174.3	-6.2	-103.4	-10.2	0	0	0	111.1
645	G	30.1	Very low	30.4	Very low	61 Å²	61	132.8 Å²	132.8	63%	0.629	76%	0.757	S	S	*	*			trans	128.3	120.5	171.2	0	0	0	0	0	112.7
646	T	27.8	Very low	30.5	Very low	127 Å²	127	134.5 Å²	134.5	78%	0.779	76%	0.763	S	S	*	*			cis	63.3	139	44.1	66	0	0	0	0	114.5
647	E	25.7	Very low	30.7	Very low	177 Å²	177	133.4 Å²	133.4	83%	0.827	76%	0.759	S	S	*	*			cis	-159.5	158.5	12	-132.3	150.5	-107.4	0	0	112.7
648	G	27	Very low	30.7	Very low	77 Å²	77	137.1 Å²	137.1	79%	0.794	76%	0.764	S	S	*	*			trans	69.9	167	167.3	0	0	0	0	0	117.9
649	F	25.5	Very low	30.7	Very low	208 Å²	208	137 Å²	137	91%	0.912	76%	0.761	S	S	*	*			cis	-158.7	131.4	-14.7	176.5	-109.1	0	0	0	108.4
650	D	34.9	Very low	31	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	76%	0.755	S	S	*	*			trans	-80.9	174.7	170.5	-74	-55.4	0	0	0	110.8
651	P	42.1	Very low	31.3	Very low	103 Å²	103	141 Å²	141	67%	0.669	76%	0.76	S	S	*	*			cis	-136.9	-157.6	-4.6	22.2	5.9	0	0	0	113.6
652	I	28.6	Very low	31.3	Very low	152 Å²	152	142.7 Å²	142.7	78%	0.779	76%	0.758	S	S	*	*			trans	79.8	120.9	155.4	-39.9	-175.4	0	0	0	117.7
653	G	34.2	Very low	31.4	Very low	76 Å²	76	145.2 Å²	145.2	78%	0.784	76%	0.759	S	S	*	*			trans	167.3	51.2	178.5	0	0	0	0	0	111
654	E	32	Very low	31.5	Very low	163 Å²	163	147 Å²	147	76%	0.762	76%	0.764	S	S	*	*			trans	-86	-175.5	-158.8	-64.5	-171.1	99.7	0	0	115.3	M656	E654-M656 PolarHBondContact O-N 3.15Å
655	E	34.5	Very low	31.7	Very low	180 Å²	180	144.8 Å²	144.8	84%	0.841	75%	0.748	S	S	*	*	S	Bend	trans	70.9	-65	167.6	-47.6	-152.4	120.2	0	0	117.6	F657 F658	E655-F657 PolarHBondContact O-N 2.99Å; E655-F658 PolarHBondContact O-N 3.1Å
656	M	32.8	Very low	31.8	Very low	165 Å²	165	145.5 Å²	145.5	81%	0.813	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-25.4	-163.6	-88.9	-62.5	-68.2	0	0	116.1	E654 F658	E654-M656 PolarHBondContact O-N 3.15Å; M656-F658 VanDerWaalsContact C-N 3.35Å; M656-F658 PolarHBondContact O-N 3.24Å
657	F	32	Very low	32.4	Very low	165 Å²	165	144.8 Å²	144.8	72%	0.724	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-7.6	-177.7	-147.2	-98.2	0	0	0	114.1	E655	E655-F657 PolarHBondContact O-N 2.99Å
658	F	29.9	Very low	33	Very low	167 Å²	167	138.4 Å²	138.4	73%	0.732	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-28.3	-173.1	-158.8	-107.7	0	0	0	113.3	E655 M656	E655-F658 PolarHBondContact O-N 3.1Å; M656-F658 VanDerWaalsContact C-N 3.35Å; M656-F658 PolarHBondContact O-N 3.24Å
659	F	30.1	Very low	33.6	Very low	172 Å²	172	135.2 Å²	135.2	75%	0.754	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-47.7	-173.1	-161.9	-107.5	0	0	0	113.1	R661	F659-R661 PolarHBondContact O-N 3.08Å
660	V	35.6	Very low	34.3	Very low	116 Å²	116	128.9 Å²	128.9	70%	0.703	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-76.3	-26.4	-169.2	-176.6	0	0	0	0	113.1	K662	V660-K662 VanDerWaalsContact C-N 3.26Å; V660-K662 PolarHBondContact O-N 3.13Å
661	R	35.3	Very low	34.7	Very low	200 Å²	200	124.4 Å²	124.4	76%	0.755	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-76.9	-10	-175.8	-147.1	171.9	-164	157.6	7.2	114	F659 L663	F659-R661 PolarHBondContact O-N 3.08Å; R661-L663 PolarHBondContact O-N 3.47Å
662	K	31.9	Very low	34.5	Very low	158 Å²	158	119.9 Å²	119.9	69%	0.687	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-76.9	-14.4	-170.8	-145.1	169.3	-174.7	177.1	0	114.7	V660	V660-K662 VanDerWaalsContact C-N 3.26Å; V660-K662 PolarHBondContact O-N 3.13Å
663	L	34.2	Very low	35.2	Very low	139 Å²	139	113.4 Å²	113.4	73%	0.728	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-109.7	3.6	-162	-77.8	164.6	0	0	0	117.2	R661	R661-L663 PolarHBondContact O-N 3.47Å
664	K	30	Very low	36	Very low	197 Å²	197	115.7 Å²	115.7	86%	0.857	57%	0.566	S	S	*	*	S	Bend	trans	-134.7	26.9	-169.1	-68.6	-174.5	177.6	174.2	0	116.9
665	F	31.1	Very low	36.6	Very low	100 Å²	100	110.7 Å²	110.7	44%	0.439	54%	0.542	S	S	.	.	S	Bend	trans	-130.4	6.9	-179.1	-140.7	-89.3	0	0	0	116.3	K23 L26	K23-F665 HydrophobicContact CG-CE1 4.32Å; L26-F665 HydrophobicContact CD1-CD1 3.72Å; L26-F665 HydrophobicContact CD1-CE1 3.34Å; L26-F665 HydrophobicContact CD1-CZ 4.1Å
666	T	33.6	Very low	37.2	Very low	75 Å²	75	106.4 Å²	106.4	46%	0.46	52%	0.518	S	S	.	.			trans	-106.8	19.5	-158.8	47.6	0	0	0	0	116.1
667	V	40.4	Very low	38.1	Very low	112 Å²	112	104.1 Å²	104.1	68%	0.679	51%	0.505	S	S	*	.	S	Bend	trans	-138.5	120.1	-177.5	-173.6	0	0	0	0	110.6	K23	K23-V667 WeakPolarHBondContact CE-O 3.45Å; K23-V667 PolarHBondContact NZ-O 2.64Å
668	A	37.6	Very low	39.3	Very low	43 Å²	43	98.5 Å²	98.5	36%	0.355	49%	0.487	S	S	.	.	S	Bend	trans	72.7	27.2	-169.5	0	0	0	0	0	115.9	K23 D670	K23-A668 WeakPolarHBondContact CB-O 3.36Å; K23-A668 WeakPolarHBondContact CD-O 3.24Å; K23-A668 VanDerWaalsContact CE-C 3.45Å; K23-A668 WeakPolarHBondContact CE-O 3.38Å; K23-A668 WeakPolarHBondContact CG-O 3.41Å; A668-D670 WeakPolarHBondContact CA-OD2 3.38Å; A668-D670 PolarHBondContact N-OD2 3.13Å
669	T	40	Very low	40.3	Very low	11 Å²	11	96.7 Å²	96.7	7%	0.067	48%	0.475	C	S	.	.	S	Bend	trans	-62	-35.2	142.3	46.7	0	0	0	0	108.8	K23 E27 E672 A673	K23-T669 HydrophobicContact CB-CG2 4.08Å; K23-T669 HydrophobicContact CG-CG2 3.52Å; K23-T669 WeakPolarHBondContact O-CB 3.5Å; K23-T669 WeakPolarHBondContact O-CG2 3.28Å; E27-T669 HydrophobicContact CG-CG2 4.41Å; E27-T669 WeakPolarHBondContact OE1-CB 3.31Å; E27-T669 PolarHBondContact OE1-OG1 2.63Å; E27-T669 WeakPolarHBondContact OE2-CB 3.45Å; T669-E672 CarbonylContact O-C 3.52Å; T669-E672 VanDerWaalsContact O-CA 3.31Å; T669-E672 WeakPolarHBondContact O-CA 3.48Å; T669-E672 WeakPolarHBondContact O-CB 3.48Å; T669-E672 PolarHBondContact O-N 3.47Å; T669-E672 VanDerWaalsContact O-N 3.07Å; T669-A673 PolarHBondContact O-N 2.88Å
670	D	40.1	Very low	41.5	Very low	74 Å²	74	94 Å²	94	40%	0.396	47%	0.468	S	S	.	.	H	α-helix	trans	-72.3	-52.1	-161.5	-26.6	-116.2	0	0	0	112.9	E27 A668 E672 A673 E674	E27-D670 WeakPolarHBondContact OE1-CA 3.29Å; E27-D670 PolarHBondContact OE1-N 3.21Å; A668-D670 WeakPolarHBondContact CA-OD2 3.38Å; A668-D670 PolarHBondContact N-OD2 3.13Å; D670-E672 CarbonylContact O-C 3.57Å; D670-E672 PolarHBondContact O-N 2.97Å; D670-A673 CarbonylContact O-C 3.59Å; D670-A673 WeakPolarHBondContact O-CA 3.27Å; D670-A673 WeakPolarHBondContact O-CB 3.32Å; D670-A673 PolarHBondContact O-N 3.15Å; D670-E674 WeakPolarHBondContact O-CG 3.45Å; D670-E674 PolarHBondContact O-N 2.77Å
671	A	42.1	Very low	42.9	Very low	45 Å²	45	92.6 Å²	92.6	37%	0.372	45%	0.454	S	S	.	.	H	α-helix	trans	-56.7	-20.7	172.2	0	0	0	0	0	112.3	Q675	A671-Q675 WeakPolarHBondContact O-CG 3.41Å
672	E	39.8	Very low	44.3	Very low	7 Å²	7	90.2 Å²	90.2	3%	0.033	45%	0.449	C	S	.	.	H	α-helix	trans	-88.4	-40.1	172.2	-121.3	-122.5	152.4	0	0	110.7	E20 K21 R24 T669 D670 E674 R676	E20-E672 HydrophobicContact CB-CG 3.64Å; E20-E672 WeakPolarHBondContact CB-OE1 3.47Å; E20-E672 HydrophobicContact CG-CG 3.93Å; K21-E672 VanDerWaalsContact CA-OE1 3.3Å; K21-E672 WeakPolarHBondContact CA-OE1 3.41Å; K21-E672 WeakPolarHBondContact CA-OE2 3.28Å; K21-E672 PolarHBondContact N-OE1 3.42Å; K21-E672 PolarHBondContact N-OE2 3.11Å; R24-E672 WeakPolarHBondContact CA-OE2 3.19Å; R24-E672 HydrophobicContact CB-CB 4.45Å; R24-E672 WeakPolarHBondContact CB-OE2 3.28Å; R24-E672 VanDerWaalsContact CD-OE1 3.24Å; R24-E672 WeakPolarHBondContact CD-OE1 3.32Å; R24-E672 WeakPolarHBondContact CD-OE2 3.35Å; R24-E672 HydrophobicContact CG-CB 3.77Å; R24-E672 VanDerWaalsContact CG-CD 3.41Å; R24-E672 HydrophobicContact CG-CG 4.04Å; R24-E672 WeakPolarHBondContact CG-O 3.41Å; R24-E672 WeakPolarHBondContact CG-OE2 3.45Å; R24-E672 VanDerWaalsContact CZ-CD 3.46Å; R24-E672 IonicContact CZ-OE1 3.55Å; R24-E672 PolarHBondContact N-OE2 3.28Å; R24-E672 PolarHBondContact NE-O 2.66Å; R24-E672 IonicContact NE-OE1 3.48Å; R24-E672 PolarHBondContact NE-OE1 3.45Å; R24-E672 IonicContact NE-OE2 3.48Å; R24-E672 IonicContact NH1-OE1 2.77Å; R24-E672 PolarHBondContact NH1-OE1 3.06Å; R24-E672 PolarHBondContact NH2-O 3.28Å; T669-E672 CarbonylContact O-C 3.52Å; T669-E672 VanDerWaalsContact O-CA 3.31Å; T669-E672 WeakPolarHBondContact O-CA 3.48Å; T669-E672 WeakPolarHBondContact O-CB 3.48Å; T669-E672 PolarHBondContact O-N 3.47Å; T669-E672 VanDerWaalsContact O-N 3.07Å; D670-E672 CarbonylContact O-C 3.57Å; D670-E672 PolarHBondContact O-N 2.97Å; E672-E674 VanDerWaalsContact C-N 3.3Å; E672-E674 PolarHBondContact O-N 3.03Å; E672-R676 WeakPolarHBondContact O-CB 3.24Å; E672-R676 PolarHBondContact O-N 3.33Å; E672-R676 VanDerWaalsContact O-N 3.12Å
673	A	42.3	Very low	45.8	Very low	17 Å²	17	89.4 Å²	89.4	14%	0.14	45%	0.445	C	S	.	.	H	α-helix	trans	-51.7	-45.7	163.3	0	0	0	0	0	112.8	E27 T669 D670 R676 Q677	E27-A673 VanDerWaalsContact OE2-CB 3.29Å; E27-A673 WeakPolarHBondContact OE2-CB 3.32Å; T669-A673 PolarHBondContact O-N 2.88Å; D670-A673 CarbonylContact O-C 3.59Å; D670-A673 WeakPolarHBondContact O-CA 3.27Å; D670-A673 WeakPolarHBondContact O-CB 3.32Å; D670-A673 PolarHBondContact O-N 3.15Å; A673-R676 CarbonylContact O-C 3.48Å; A673-R676 VanDerWaalsContact O-CA 3.27Å; A673-R676 WeakPolarHBondContact O-CA 3.33Å; A673-R676 WeakPolarHBondContact O-CB 3.31Å; A673-R676 PolarHBondContact O-N 3.31Å; A673-Q677 PolarHBondContact O-N 2.91Å
674	E	50.7	Low	47.3	Very low	124 Å²	124	90.6 Å²	90.6	58%	0.579	44%	0.44	S	S	*	.	H	α-helix	trans	-56	-60.9	179.7	-72.5	179.4	155.8	0	0	113.2	D670 E672 R676 Q677 S678	D670-E674 WeakPolarHBondContact O-CG 3.45Å; D670-E674 PolarHBondContact O-N 2.77Å; E672-E674 VanDerWaalsContact C-N 3.3Å; E672-E674 PolarHBondContact O-N 3.03Å; E674-R676 PolarHBondContact O-N 2.98Å; E674-Q677 CarbonylContact O-C 3.43Å; E674-Q677 WeakPolarHBondContact O-CA 3.43Å; E674-Q677 WeakPolarHBondContact O-CB 3.25Å; E674-Q677 PolarHBondContact O-N 2.82Å; E674-S678 PolarHBondContact O-N 3.05Å
675	Q	45.3	Very low	49	Very low	58 Å²	58	87.6 Å²	87.6	27%	0.271	42%	0.423	S	S	.	.	H	α-helix	trans	-72.8	8.1	173.5	23.6	111.4	-4.9	0	0	114.1	E20 R24 A671 S678 R679	E20-Q675 PolarHBondContact OE1-NE2 3.22Å; R24-Q675 PolarHBondContact NH2-O 2.77Å; A671-Q675 WeakPolarHBondContact O-CG 3.41Å; Q675-S678 WeakPolarHBondContact CA-OG 3.09Å; Q675-R679 WeakPolarHBondContact O-CB 3.45Å; Q675-R679 WeakPolarHBondContact O-CD 3.47Å; Q675-R679 WeakPolarHBondContact O-CG 3.37Å; Q675-R679 PolarHBondContact O-NE 2.69Å; Q675-R679 PolarHBondContact O-NH1 2.97Å
676	R	46.6	Very low	50.7	Low	90 Å²	90	88.4 Å²	88.4	34%	0.34	43%	0.432	S	S	.	.	H	α-helix	trans	-91.3	-45.2	159.2	-135.7	-171	-148	156.3	8.5	110.5	R24 E672 A673 E674 R679 L680	R24-R676 HydrophobicContact CG-CB 4.34Å; R24-R676 HydrophobicContact CG-CG 4.29Å; R24-R676 VanDerWaalsContact NH2-N 3.18Å; R24-R676 PolarHBondContact O-NH1 3.19Å; E672-R676 WeakPolarHBondContact O-CB 3.24Å; E672-R676 PolarHBondContact O-N 3.33Å; E672-R676 VanDerWaalsContact O-N 3.12Å; A673-R676 CarbonylContact O-C 3.48Å; A673-R676 VanDerWaalsContact O-CA 3.27Å; A673-R676 WeakPolarHBondContact O-CA 3.33Å; A673-R676 WeakPolarHBondContact O-CB 3.31Å; A673-R676 PolarHBondContact O-N 3.31Å; E674-R676 PolarHBondContact O-N 2.98Å; R676-R679 CarbonylContact O-C 3.54Å; R676-R679 PolarHBondContact O-N 2.96Å; R676-L680 WeakPolarHBondContact O-CB 3.43Å; R676-L680 PolarHBondContact O-N 3.37Å
677	Q	52.7	Low	52.3	Low	116 Å²	116	91.3 Å²	91.3	54%	0.542	44%	0.438	S	S	.	.	H	α-helix	trans	-58.5	-53.7	172	-69.8	177.4	-1	0	0	109.7	A673 E674 R679 L680 E681	A673-Q677 PolarHBondContact O-N 2.91Å; E674-Q677 CarbonylContact O-C 3.43Å; E674-Q677 WeakPolarHBondContact O-CA 3.43Å; E674-Q677 WeakPolarHBondContact O-CB 3.25Å; E674-Q677 PolarHBondContact O-N 2.82Å; Q677-R679 PolarHBondContact O-N 3.47Å; Q677-R679 VanDerWaalsContact O-N 3.09Å; Q677-L680 CarbonylContact O-C 3.53Å; Q677-L680 WeakPolarHBondContact O-CA 3.36Å; Q677-L680 WeakPolarHBondContact O-CB 3.15Å; Q677-L680 PolarHBondContact O-N 3.18Å; Q677-E681 VanDerWaalsContact O-CB 3.29Å; Q677-E681 WeakPolarHBondContact O-CB 3.13Å; Q677-E681 PolarHBondContact O-N 2.87Å
678	S	56.8	Low	53.5	Low	48 Å²	48	90 Å²	90	34%	0.336	43%	0.425	S	S	.	.	H	α-helix	trans	-65	-17.8	177.3	79.3	0	0	0	0	114.2	E674 Q675 K682	E674-S678 PolarHBondContact O-N 3.05Å; Q675-S678 WeakPolarHBondContact CA-OG 3.09Å; S678-K682 WeakPolarHBondContact O-CB 3.38Å; S678-K682 WeakPolarHBondContact O-CG 3.35Å; S678-K682 PolarHBondContact O-N 3.28Å
679	R	50.1	Low	54.6	Low	128 Å²	128	93.6 Å²	93.6	48%	0.483	44%	0.435	S	S	.	.	H	α-helix	trans	-86.7	-28.4	167.7	-74.1	-179.8	-163.7	130.5	6.3	113.5	R24 Q675 R676 Q677 K683	R24-R679 VanDerWaalsContact CZ-NH1 3.32Å; Q675-R679 WeakPolarHBondContact O-CB 3.45Å; Q675-R679 WeakPolarHBondContact O-CD 3.47Å; Q675-R679 WeakPolarHBondContact O-CG 3.37Å; Q675-R679 PolarHBondContact O-NE 2.69Å; Q675-R679 PolarHBondContact O-NH1 2.97Å; R676-R679 CarbonylContact O-C 3.54Å; R676-R679 PolarHBondContact O-N 2.96Å; Q677-R679 PolarHBondContact O-N 3.47Å; Q677-R679 VanDerWaalsContact O-N 3.09Å; R679-K683 WeakPolarHBondContact O-CB 3.47Å; R679-K683 VanDerWaalsContact O-CG 3.25Å; R679-K683 WeakPolarHBondContact O-CG 3.46Å; R679-K683 PolarHBondContact O-N 3.09Å; R679-K683 VanDerWaalsContact O-N 3.09Å
680	L	55.9	Low	55.5	Low	116 Å²	116	98.5 Å²	98.5	61%	0.607	46%	0.456	S	S	*	.	H	α-helix	trans	-71.7	-41.9	171.1	-122.3	163.4	0	0	0	109.6	R676 Q677 K683 R684	R676-L680 WeakPolarHBondContact O-CB 3.43Å; R676-L680 PolarHBondContact O-N 3.37Å; Q677-L680 CarbonylContact O-C 3.53Å; Q677-L680 WeakPolarHBondContact O-CA 3.36Å; Q677-L680 WeakPolarHBondContact O-CB 3.15Å; Q677-L680 PolarHBondContact O-N 3.18Å; L680-K683 CarbonylContact O-C 3.57Å; L680-K683 WeakPolarHBondContact O-CA 3.34Å; L680-K683 WeakPolarHBondContact O-CB 3.41Å; L680-K683 PolarHBondContact O-N 3Å; L680-R684 VanDerWaalsContact O-CB 3.3Å; L680-R684 WeakPolarHBondContact O-CB 3.49Å; L680-R684 PolarHBondContact O-N 3.28Å
681	E	65	Low	56.5	Low	87 Å²	87	98.4 Å²	98.4	41%	0.407	46%	0.455	S	S	.	.	H	α-helix	trans	-72	-42.1	175.5	-163.8	-174.2	173.7	0	0	111.3	Q677 K683 R684 R685	Q677-E681 VanDerWaalsContact O-CB 3.29Å; Q677-E681 WeakPolarHBondContact O-CB 3.13Å; Q677-E681 PolarHBondContact O-N 2.87Å; E681-K683 PolarHBondContact O-N 3.43Å; E681-R684 CarbonylContact O-C 3.52Å; E681-R684 PolarHBondContact O-N 3.2Å; E681-R684 VanDerWaalsContact O-N 3.12Å; E681-R685 VanDerWaalsContact O-CB 3.3Å; E681-R685 WeakPolarHBondContact O-CB 3.41Å; E681-R685 WeakPolarHBondContact O-CG 3.44Å; E681-R685 PolarHBondContact O-N 3.35Å; E681-R685 IonicContact OE1-CZ 3.35Å; E681-R685 IonicContact OE1-NE 3.66Å; E681-R685 PolarHBondContact OE1-NE 3.46Å; E681-R685 IonicContact OE1-NH2 2.71Å; E681-R685 PolarHBondContact OE1-NH2 3.2Å
682	K	64.7	Low	57.5	Low	150 Å²	150	97.3 Å²	97.3	65%	0.652	45%	0.447	S	S	*	.	H	α-helix	trans	-60.6	-30.5	167.2	-80	174.9	-179.3	-173.2	0	112.4	S678 L686	S678-K682 WeakPolarHBondContact O-CB 3.38Å; S678-K682 WeakPolarHBondContact O-CG 3.35Å; S678-K682 PolarHBondContact O-N 3.28Å; K682-L686 VanDerWaalsContact O-CB 3.26Å; K682-L686 WeakPolarHBondContact O-CB 3.45Å; K682-L686 PolarHBondContact O-N 3.36Å
683	K	63.2	Low	58.4	Low	141 Å²	141	103.3 Å²	103.3	61%	0.613	48%	0.475	S	S	*	.	H	α-helix	trans	-80	-29	171.9	-78.4	-179.2	175.5	-164.2	0	114	R679 L680 E681 K687	R679-K683 WeakPolarHBondContact O-CB 3.47Å; R679-K683 VanDerWaalsContact O-CG 3.25Å; R679-K683 WeakPolarHBondContact O-CG 3.46Å; R679-K683 PolarHBondContact O-N 3.09Å; R679-K683 VanDerWaalsContact O-N 3.09Å; L680-K683 CarbonylContact O-C 3.57Å; L680-K683 WeakPolarHBondContact O-CA 3.34Å; L680-K683 WeakPolarHBondContact O-CB 3.41Å; L680-K683 PolarHBondContact O-N 3Å; E681-K683 PolarHBondContact O-N 3.43Å; K683-K687 VanDerWaalsContact O-CB 3.29Å; K683-K687 WeakPolarHBondContact O-CB 3.37Å; K683-K687 PolarHBondContact O-N 3.44Å
684	R	65.2	Low	59.1	Low	163 Å²	163	106.2 Å²	106.2	62%	0.615	48%	0.482	S	S	*	.	H	α-helix	trans	-68.4	-54.1	173.6	-169	-168.7	147.2	172.8	-6.4	107.6	L680 E681 L686 K687 E688	L680-R684 VanDerWaalsContact O-CB 3.3Å; L680-R684 WeakPolarHBondContact O-CB 3.49Å; L680-R684 PolarHBondContact O-N 3.28Å; E681-R684 CarbonylContact O-C 3.52Å; E681-R684 PolarHBondContact O-N 3.2Å; E681-R684 VanDerWaalsContact O-N 3.12Å; R684-L686 PolarHBondContact O-N 3Å; R684-K687 CarbonylContact O-C 3.42Å; R684-K687 WeakPolarHBondContact O-CA 3.4Å; R684-K687 WeakPolarHBondContact O-CB 3.46Å; R684-K687 PolarHBondContact O-N 2.96Å; R684-E688 HydrophobicContact CG-CG 4.48Å; R684-E688 IonicContact CZ-OE1 2.85Å; R684-E688 VanDerWaalsContact CZ-OE1 3.29Å; R684-E688 IonicContact NE-OE1 3.53Å; R684-E688 PolarHBondContact NE-OE1 3.26Å; R684-E688 IonicContact NE-OE2 2.94Å; R684-E688 IonicContact NH2-OE1 3.29Å; R684-E688 PolarHBondContact NH2-OE1 3.41Å; R684-E688 WeakPolarHBondContact O-CB 3.34Å; R684-E688 WeakPolarHBondContact O-CG 3.4Å; R684-E688 PolarHBondContact O-N 2.95Å
685	R	66.3	Low	59.4	Low	134 Å²	134	103 Å²	103	51%	0.506	47%	0.469	S	S	.	.	H	α-helix	trans	-53.9	-43.6	167.7	-66.5	-174.4	-165.5	-158.4	5	112.2	E681 K687 E688 M689	E681-R685 VanDerWaalsContact O-CB 3.3Å; E681-R685 WeakPolarHBondContact O-CB 3.41Å; E681-R685 WeakPolarHBondContact O-CG 3.44Å; E681-R685 PolarHBondContact O-N 3.35Å; E681-R685 IonicContact OE1-CZ 3.35Å; E681-R685 IonicContact OE1-NE 3.66Å; E681-R685 PolarHBondContact OE1-NE 3.46Å; E681-R685 IonicContact OE1-NH2 2.71Å; E681-R685 PolarHBondContact OE1-NH2 3.2Å; R685-K687 VanDerWaalsContact C-N 3.3Å; R685-K687 PolarHBondContact O-N 2.86Å; R685-E688 WeakPolarHBondContact CA-OE2 3.36Å; R685-E688 PolarHBondContact N-OE2 3.05Å; R685-E688 PolarHBondContact O-N 3.44Å; R685-M689 HydrophobicContact CB-CE 4.46Å; R685-M689 WeakPolarHBondContact O-CB 3.46Å; R685-M689 WeakPolarHBondContact O-CG 3.42Å; R685-M689 PolarHBondContact O-N 3.45Å
686	L	65.8	Low	60.1	Low	118 Å²	118	105.6 Å²	105.6	62%	0.618	48%	0.482	S	S	*	.	H	α-helix	trans	-66.4	-30.4	175.5	-142.5	76.9	0	0	0	113.2	K682 R684 M689 F690	K682-L686 VanDerWaalsContact O-CB 3.26Å; K682-L686 WeakPolarHBondContact O-CB 3.45Å; K682-L686 PolarHBondContact O-N 3.36Å; R684-L686 PolarHBondContact O-N 3Å; L686-M689 HydrophobicContact CD1-SD 4.44Å; L686-F690 WeakPolarHBondContact O-CB 3.45Å; L686-F690 PolarHBondContact O-N 3.18Å
687	K	68.4	Low	60.7	Low	136 Å²	136	106.6 Å²	106.6	59%	0.591	50%	0.498	S	S	*	.	H	α-helix	trans	-80.7	-33.1	174.8	-171.4	-171.1	173.5	-161.8	0	111.7	K683 R684 R685 N691	K683-K687 VanDerWaalsContact O-CB 3.29Å; K683-K687 WeakPolarHBondContact O-CB 3.37Å; K683-K687 PolarHBondContact O-N 3.44Å; R684-K687 CarbonylContact O-C 3.42Å; R684-K687 WeakPolarHBondContact O-CA 3.4Å; R684-K687 WeakPolarHBondContact O-CB 3.46Å; R684-K687 PolarHBondContact O-N 2.96Å; R685-K687 VanDerWaalsContact C-N 3.3Å; R685-K687 PolarHBondContact O-N 2.86Å; K687-N691 WeakPolarHBondContact O-CB 3.49Å; K687-N691 VanDerWaalsContact O-CG 3.22Å; K687-N691 PolarHBondContact O-N 2.74Å; K687-N691 PolarHBondContact O-OD1 3.12Å
688	E	64.9	Low	61.4	Low	85 Å²	85	102.8 Å²	102.8	40%	0.397	48%	0.478	S	S	.	.	H	α-helix	trans	-69.8	-42.8	173.2	-73.7	162.2	153.1	0	0	109.4	R684 R685 A692	R684-E688 HydrophobicContact CG-CG 4.48Å; R684-E688 IonicContact CZ-OE1 2.85Å; R684-E688 VanDerWaalsContact CZ-OE1 3.29Å; R684-E688 IonicContact NE-OE1 3.53Å; R684-E688 PolarHBondContact NE-OE1 3.26Å; R684-E688 IonicContact NE-OE2 2.94Å; R684-E688 IonicContact NH2-OE1 3.29Å; R684-E688 PolarHBondContact NH2-OE1 3.41Å; R684-E688 WeakPolarHBondContact O-CB 3.34Å; R684-E688 WeakPolarHBondContact O-CG 3.4Å; R684-E688 PolarHBondContact O-N 2.95Å; R685-E688 WeakPolarHBondContact CA-OE2 3.36Å; R685-E688 PolarHBondContact N-OE2 3.05Å; R685-E688 PolarHBondContact O-N 3.44Å; E688-A692 WeakPolarHBondContact O-CA 3.36Å; E688-A692 WeakPolarHBondContact O-CB 3.38Å; E688-A692 PolarHBondContact O-N 2.95Å
689	M	61.9	Low	62.1	Low	117 Å²	117	105 Å²	105	58%	0.576	48%	0.482	S	S	*	.	H	α-helix	trans	-62.3	-47.8	169.6	-71.2	160.6	174.2	0	0	111.6	R685 L686 A692 E693	R685-M689 HydrophobicContact CB-CE 4.46Å; R685-M689 WeakPolarHBondContact O-CB 3.46Å; R685-M689 WeakPolarHBondContact O-CG 3.42Å; R685-M689 PolarHBondContact O-N 3.45Å; L686-M689 HydrophobicContact CD1-SD 4.44Å; M689-A692 PolarHBondContact O-N 2.9Å; M689-E693 VanDerWaalsContact O-CB 3.29Å; M689-E693 WeakPolarHBondContact O-CB 3.5Å; M689-E693 PolarHBondContact O-N 2.84Å
690	F	58.9	Low	63.5	Low	115 Å²	115	106.3 Å²	106.3	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-68.4	-37.7	179.1	-176.9	-95.4	0	0	0	112.7	L686 Y694	L686-F690 WeakPolarHBondContact O-CB 3.45Å; L686-F690 PolarHBondContact O-N 3.18Å; F690-Y694 WeakPolarHBondContact O-CB 3.32Å; F690-Y694 PolarHBondContact O-N 3.19Å
691	N	60.3	Low	64.7	Low	71 Å²	71	103.6 Å²	103.6	38%	0.38	48%	0.476	S	S	.	.	H	α-helix	trans	-70.8	-36.1	172.2	-78.1	18.4	0	0	0	111.1	K687 Y694 D695	K687-N691 WeakPolarHBondContact O-CB 3.49Å; K687-N691 VanDerWaalsContact O-CG 3.22Å; K687-N691 PolarHBondContact O-N 2.74Å; K687-N691 PolarHBondContact O-OD1 3.12Å; N691-Y694 PolarHBondContact O-N 3.38Å; N691-D695 VanDerWaalsContact O-CB 3.27Å; N691-D695 WeakPolarHBondContact O-CB 3.5Å; N691-D695 PolarHBondContact O-N 3.16Å
692	A	63	Low	65.5	Low	23 Å²	23	106.2 Å²	106.2	19%	0.19	48%	0.482	C	S	.	.	H	α-helix	trans	-64.1	-54.7	175.1	0	0	0	0	0	109.7	E688 M689 Y694 D695 E696	E688-A692 WeakPolarHBondContact O-CA 3.36Å; E688-A692 WeakPolarHBondContact O-CB 3.38Å; E688-A692 PolarHBondContact O-N 2.95Å; M689-A692 PolarHBondContact O-N 2.9Å; A692-Y694 PolarHBondContact O-N 3.17Å; A692-Y694 VanDerWaalsContact O-N 3.14Å; A692-D695 CarbonylContact O-C 3.58Å; A692-D695 PolarHBondContact O-N 2.87Å; A692-E696 VanDerWaalsContact C-CD 3.5Å; A692-E696 WeakPolarHBondContact CB-OE1 3.16Å; A692-E696 WeakPolarHBondContact O-CA 3.37Å; A692-E696 WeakPolarHBondContact O-CB 3.09Å; A692-E696 WeakPolarHBondContact O-CG 3.06Å; A692-E696 PolarHBondContact O-N 3.3Å
693	E	58.9	Low	66.6	Low	133 Å²	133	102.8 Å²	102.8	62%	0.621	47%	0.47	S	S	*	.	H	α-helix	trans	-52.9	-37.7	173.9	-173.2	-178.6	-160.7	0	0	112.4	M689	M689-E693 VanDerWaalsContact O-CB 3.29Å; M689-E693 WeakPolarHBondContact O-CB 3.5Å; M689-E693 PolarHBondContact O-N 2.84Å
694	Y	56	Low	67.7	Low	77 Å²	77	99 Å²	99	30%	0.302	46%	0.456	S	S	.	.	H	α-helix	trans	-76.6	-33.5	178.2	-167.7	-96.1	0	0	0	114.3	Q60 F690 N691 A692 T697	Q60-Y694 PolarHBondContact NE2-OH 3.34Å; F690-Y694 WeakPolarHBondContact O-CB 3.32Å; F690-Y694 PolarHBondContact O-N 3.19Å; N691-Y694 PolarHBondContact O-N 3.38Å; A692-Y694 PolarHBondContact O-N 3.17Å; A692-Y694 VanDerWaalsContact O-N 3.14Å; Y694-T697 PolarHBondContact O-OG1 2.88Å
695	D	58.3	Low	68.8	Low	57 Å²	57	93.2 Å²	93.2	31%	0.305	44%	0.438	S	S	.	.	H	α-helix	trans	-90.8	-33.7	179	-76.6	-41.3	0	0	0	112.8	N691 A692 T697 R698 K699	N691-D695 VanDerWaalsContact O-CB 3.27Å; N691-D695 WeakPolarHBondContact O-CB 3.5Å; N691-D695 PolarHBondContact O-N 3.16Å; A692-D695 CarbonylContact O-C 3.58Å; A692-D695 PolarHBondContact O-N 2.87Å; D695-T697 VanDerWaalsContact C-N 3.31Å; D695-T697 PolarHBondContact O-N 3.4Å; D695-R698 CarbonylContact O-C 3.49Å; D695-R698 WeakPolarHBondContact O-CA 3.18Å; D695-R698 PolarHBondContact O-N 3.09Å; D695-K699 HydrophobicContact CB-CD 4.48Å; D695-K699 HydrophobicContact CB-CG 4.31Å; D695-K699 WeakPolarHBondContact O-CG 3.2Å; D695-K699 PolarHBondContact O-N 3.26Å
696	E	59.2	Low	69.9	Low	113 Å²	113	89.6 Å²	89.6	53%	0.528	44%	0.437	S	S	.	.	H	α-helix	trans	-51.9	-45.6	-178.9	-85.1	163.1	-165.1	0	0	112.2	A692 R698 K699	A692-E696 VanDerWaalsContact C-CD 3.5Å; A692-E696 WeakPolarHBondContact CB-OE1 3.16Å; A692-E696 WeakPolarHBondContact O-CA 3.37Å; A692-E696 WeakPolarHBondContact O-CB 3.09Å; A692-E696 WeakPolarHBondContact O-CG 3.06Å; A692-E696 PolarHBondContact O-N 3.3Å; E696-R698 PolarHBondContact O-N 2.83Å; E696-K699 PolarHBondContact O-N 3.49Å
697	T	60	Low	71	Confident	111 Å²	111	89.9 Å²	89.9	68%	0.681	44%	0.435	S	S	*	.	H	α-helix	trans	-60.7	-9.3	176.2	59	0	0	0	0	114.1	Y694 D695	Y694-T697 PolarHBondContact O-OG1 2.88Å; D695-T697 VanDerWaalsContact C-N 3.31Å; D695-T697 PolarHBondContact O-N 3.4Å
698	R	66.5	Low	71.9	Confident	36 Å²	36	85.8 Å²	85.8	14%	0.136	42%	0.42	C	S	.	.	H	α-helix	trans	-134.1	-11.1	-178.7	-50.7	-170	96	-107.4	2.8	115	L64 D695 E696 R702	L64-R698 PolarHBondContact O-NE 3.37Å; L64-R698 PolarHBondContact O-NH2 3.25Å; D695-R698 CarbonylContact O-C 3.49Å; D695-R698 WeakPolarHBondContact O-CA 3.18Å; D695-R698 PolarHBondContact O-N 3.09Å; E696-R698 PolarHBondContact O-N 2.83Å; R698-R702 WeakPolarHBondContact O-CB 3.37Å; R698-R702 WeakPolarHBondContact O-CG 3.47Å; R698-R702 PolarHBondContact O-N 3.03Å
699	K	70.7	Confident	73	Confident	95 Å²	95	86.1 Å²	86.1	41%	0.413	42%	0.424	S	S	.	.	H	α-helix	trans	-54.9	-66.6	171	-85.2	177	-179.3	177	0	108.8	D695 E696 H701 R702 D703	D695-K699 HydrophobicContact CB-CD 4.48Å; D695-K699 HydrophobicContact CB-CG 4.31Å; D695-K699 WeakPolarHBondContact O-CG 3.2Å; D695-K699 PolarHBondContact O-N 3.26Å; E696-K699 PolarHBondContact O-N 3.49Å; K699-H701 CarbonylContact O-C 3.58Å; K699-H701 PolarHBondContact O-N 2.84Å; K699-R702 CarbonylContact O-C 3.39Å; K699-R702 WeakPolarHBondContact O-CA 3.27Å; K699-R702 WeakPolarHBondContact O-CB 3.46Å; K699-R702 PolarHBondContact O-N 2.89Å; K699-D703 WeakPolarHBondContact CA-OD2 3.25Å; K699-D703 WeakPolarHBondContact CB-OD2 3.38Å; K699-D703 WeakPolarHBondContact O-CB 3Å; K699-D703 PolarHBondContact O-N 2.78Å
700	F	79.6	Confident	74.4	Confident	154 Å²	154	88.1 Å²	88.1	68%	0.675	43%	0.426	S	S	*	.	H	α-helix	trans	-45.3	-41.3	177.8	-173.9	-102.6	0	0	0	115	D703 M704	F700-D703 PolarHBondContact N-OD2 3.23Å; F700-M704 HydrophobicContact CD1-SD 4.2Å; F700-M704 HydrophobicContact CE1-CG 4.42Å; F700-M704 HydrophobicContact CE1-SD 3.5Å; F700-M704 WeakPolarHBondContact CE1-SD 3.33Å; F700-M704 HydrophobicContact CE2-CG 4.3Å; F700-M704 HydrophobicContact CE2-SD 4.1Å; F700-M704 HydrophobicContact CZ-CG 4.22Å; F700-M704 HydrophobicContact CZ-SD 3.44Å; F700-M704 WeakPolarHBondContact CZ-SD 3.21Å; F700-M704 VanDerWaalsContact O-CB 3.31Å; F700-M704 WeakPolarHBondContact O-CB 3.35Å; F700-M704 VanDerWaalsContact O-CG 3.26Å; F700-M704 WeakPolarHBondContact O-CG 3.31Å; F700-M704 PolarHBondContact O-N 3.4Å; F700-M704 VanDerWaalsContact O-N 3.11Å
701	H	81.7	Confident	75.8	Confident	60 Å²	60	87.1 Å²	87.1	28%	0.278	42%	0.424	S	S	.	.	H	α-helix	trans	-69.1	-41.2	175.4	179.8	-80.2	0	0	0	113.4	T68 H69 K699 V705	T68-H701 HydrophobicContact CG2-CB 4.29Å; H69-H701 VanDerWaalsContact C-NE2 3.26Å; H69-H701 PolarHBondContact N-NE2 3.05Å; H69-H701 VanDerWaalsContact N-NE2 3.15Å; H69-H701 PolarHBondContact O-CD2 2.99Å; H69-H701 PolarHBondContact O-NE2 2.98Å; K699-H701 CarbonylContact O-C 3.58Å; K699-H701 PolarHBondContact O-N 2.84Å; H701-V705 WeakPolarHBondContact O-CB 3.47Å; H701-V705 VanDerWaalsContact O-CG2 3.22Å; H701-V705 WeakPolarHBondContact O-CG2 3.44Å; H701-V705 PolarHBondContact O-N 3.41Å
702	R	81.9	Confident	77	Confident	141 Å²	141	86.4 Å²	86.4	53%	0.532	42%	0.422	S	S	.	.	H	α-helix	trans	-69.8	-44.4	176.5	-79.4	171.9	153.9	166.9	-9.8	111.7	R698 K699 V705 A706	R698-R702 WeakPolarHBondContact O-CB 3.37Å; R698-R702 WeakPolarHBondContact O-CG 3.47Å; R698-R702 PolarHBondContact O-N 3.03Å; K699-R702 CarbonylContact O-C 3.39Å; K699-R702 WeakPolarHBondContact O-CA 3.27Å; K699-R702 WeakPolarHBondContact O-CB 3.46Å; K699-R702 PolarHBondContact O-N 2.89Å; R702-V705 CarbonylContact O-C 3.33Å; R702-V705 PolarHBondContact O-N 3.22Å; R702-V705 VanDerWaalsContact O-N 3.15Å; R702-A706 WeakPolarHBondContact O-CB 3.16Å; R702-A706 PolarHBondContact O-N 3.32Å
703	D	87.6	Confident	78.2	Confident	78 Å²	78	89.7 Å²	89.7	42%	0.417	44%	0.436	S	S	.	.	H	α-helix	trans	-66.7	-49	-174.2	-50.6	-22.6	0	0	0	108.7	K699 F700 V705 A706 E707	K699-D703 WeakPolarHBondContact CA-OD2 3.25Å; K699-D703 WeakPolarHBondContact CB-OD2 3.38Å; K699-D703 WeakPolarHBondContact O-CB 3Å; K699-D703 PolarHBondContact O-N 2.78Å; F700-D703 PolarHBondContact N-OD2 3.23Å; D703-V705 VanDerWaalsContact C-N 3.26Å; D703-V705 PolarHBondContact O-N 3.01Å; D703-A706 PolarHBondContact O-N 2.97Å; D703-A706 VanDerWaalsContact O-N 3.1Å; D703-E707 VanDerWaalsContact O-CG 3.32Å; D703-E707 WeakPolarHBondContact O-CG 3.47Å; D703-E707 PolarHBondContact O-N 2.65Å
704	M	86.2	Confident	79.7	Confident	63 Å²	63	86 Å²	86	31%	0.31	42%	0.42	S	S	.	.	H	α-helix	trans	-58.2	-31.5	170.8	-75	-166.3	82.7	0	0	114.4	P71 F700 L708	P71-M704 HydrophobicContact CG-CB 4.42Å; P71-M704 HydrophobicContact CG-CE 4.08Å; P71-M704 HydrophobicContact CG-SD 4.09Å; F700-M704 HydrophobicContact CD1-SD 4.2Å; F700-M704 HydrophobicContact CE1-CG 4.42Å; F700-M704 HydrophobicContact CE1-SD 3.5Å; F700-M704 WeakPolarHBondContact CE1-SD 3.33Å; F700-M704 HydrophobicContact CE2-CG 4.3Å; F700-M704 HydrophobicContact CE2-SD 4.1Å; F700-M704 HydrophobicContact CZ-CG 4.22Å; F700-M704 HydrophobicContact CZ-SD 3.44Å; F700-M704 WeakPolarHBondContact CZ-SD 3.21Å; F700-M704 VanDerWaalsContact O-CB 3.31Å; F700-M704 WeakPolarHBondContact O-CB 3.35Å; F700-M704 VanDerWaalsContact O-CG 3.26Å; F700-M704 WeakPolarHBondContact O-CG 3.31Å; F700-M704 PolarHBondContact O-N 3.4Å; F700-M704 VanDerWaalsContact O-N 3.11Å; M704-L708 VanDerWaalsContact O-CG 3.25Å; M704-L708 WeakPolarHBondContact O-CG 3.19Å; M704-L708 PolarHBondContact O-N 3.13Å
705	V	88.4	Confident	81.2	Confident	40 Å²	40	86.1 Å²	86.1	24%	0.242	43%	0.426	C	S	.	.	H	α-helix	trans	-77.2	-39.7	176	168	0	0	0	0	110.5	P71 H701 R702 D703 L708 D709	P71-V705 HydrophobicContact CB-CG2 4.12Å; H701-V705 WeakPolarHBondContact O-CB 3.47Å; H701-V705 VanDerWaalsContact O-CG2 3.22Å; H701-V705 WeakPolarHBondContact O-CG2 3.44Å; H701-V705 PolarHBondContact O-N 3.41Å; R702-V705 CarbonylContact O-C 3.33Å; R702-V705 PolarHBondContact O-N 3.22Å; R702-V705 VanDerWaalsContact O-N 3.15Å; D703-V705 VanDerWaalsContact C-N 3.26Å; D703-V705 PolarHBondContact O-N 3.01Å; V705-L708 PolarHBondContact O-N 3.16Å; V705-D709 WeakPolarHBondContact O-CB 3.37Å; V705-D709 VanDerWaalsContact O-CG 3.26Å; V705-D709 PolarHBondContact O-N 3.31Å
706	A	89.5	Confident	82.4	Confident	59 Å²	59	89 Å²	89	49%	0.488	43%	0.433	S	S	.	.	H	α-helix	trans	-65.7	-37.8	176.3	0	0	0	0	0	112.1	R702 D703 Y710	R702-A706 WeakPolarHBondContact O-CB 3.16Å; R702-A706 PolarHBondContact O-N 3.32Å; D703-A706 PolarHBondContact O-N 2.97Å; D703-A706 VanDerWaalsContact O-N 3.1Å; A706-Y710 WeakPolarHBondContact O-CB 3.39Å; A706-Y710 PolarHBondContact O-N 3.47Å
707	E	89.9	Confident	83.8	Confident	123 Å²	123	89 Å²	89	58%	0.575	44%	0.436	S	S	*	.	H	α-helix	trans	-60.2	-46.3	171.3	-73.1	165.5	-176.8	0	0	111.7	D703 Y710 Q711	D703-E707 VanDerWaalsContact O-CG 3.32Å; D703-E707 WeakPolarHBondContact O-CG 3.47Å; D703-E707 PolarHBondContact O-N 2.65Å; E707-Y710 PolarHBondContact O-N 3.35Å; E707-Q711 WeakPolarHBondContact O-CB 3.47Å; E707-Q711 PolarHBondContact O-N 2.88Å
708	L	86.5	Confident	85.1	Confident	51 Å²	51	89.5 Å²	89.5	27%	0.267	43%	0.43	S	S	.	.	H	α-helix	trans	-68.7	-40.9	178.2	-72	178.1	0	0	0	112.7	P71 V73 M704 V705 T712	P71-L708 HydrophobicContact CB-CD1 4.2Å; V73-L708 HydrophobicContact CG2-CD1 4.4Å; V73-L708 HydrophobicContact CG2-CD2 3.91Å; M704-L708 VanDerWaalsContact O-CG 3.25Å; M704-L708 WeakPolarHBondContact O-CG 3.19Å; M704-L708 PolarHBondContact O-N 3.13Å; V705-L708 PolarHBondContact O-N 3.16Å; L708-T712 WeakPolarHBondContact O-CB 3.49Å; L708-T712 PolarHBondContact O-N 2.88Å; L708-T712 PolarHBondContact O-OG1 3.11Å
709	D	87.7	Confident	86	Confident	91 Å²	91	90 Å²	90	49%	0.487	43%	0.433	S	S	.	.	H	α-helix	trans	-66.4	-40.2	175.4	-71.6	-15.6	0	0	0	110.3	V705 T712 N713	V705-D709 WeakPolarHBondContact O-CB 3.37Å; V705-D709 VanDerWaalsContact O-CG 3.26Å; V705-D709 PolarHBondContact O-N 3.31Å; D709-T712 PolarHBondContact O-N 2.94Å; D709-N713 WeakPolarHBondContact O-CB 3.47Å; D709-N713 PolarHBondContact O-N 3.31Å; D709-N713 PolarHBondContact O-ND2 3.32Å
710	Y	90.9	Very high	86.5	Confident	159 Å²	159	89.8 Å²	89.8	62%	0.624	43%	0.434	S	S	*	.	H	α-helix	trans	-61.5	-50.3	174.4	177	-98.4	0	0	0	111.6	A706 E707 T712 N713 L714	A706-Y710 WeakPolarHBondContact O-CB 3.39Å; A706-Y710 PolarHBondContact O-N 3.47Å; E707-Y710 PolarHBondContact O-N 3.35Å; Y710-T712 VanDerWaalsContact C-N 3.26Å; Y710-T712 PolarHBondContact O-N 3.31Å; Y710-N713 PolarHBondContact O-N 2.71Å; Y710-L714 HydrophobicContact CE1-CD1 4.02Å; Y710-L714 WeakPolarHBondContact O-CB 3.32Å; Y710-L714 PolarHBondContact O-N 2.9Å
711	Q	88.6	Confident	86.6	Confident	95 Å²	95	90.2 Å²	90.2	44%	0.444	44%	0.443	S	S	.	.	H	α-helix	trans	-60.3	-37.4	175.8	-172.6	68.1	66.5	0	0	112	E707 L714 N715	E707-Q711 WeakPolarHBondContact O-CB 3.47Å; E707-Q711 PolarHBondContact O-N 2.88Å; Q711-L714 PolarHBondContact O-N 3.02Å; Q711-N715 PolarHBondContact NE2-OD1 2.74Å; Q711-N715 WeakPolarHBondContact O-CB 3.32Å; Q711-N715 PolarHBondContact O-N 2.88Å; Q711-N715 PolarHBondContact O-OD1 3.43Å; Q711-N715 VanDerWaalsContact O-OD1 3.05Å
712	T	86.2	Confident	86.7	Confident	56 Å²	56	90.5 Å²	90.5	34%	0.344	45%	0.446	S	S	.	.	H	α-helix	trans	-68.1	-38.4	178.2	-56.1	0	0	0	0	111.5	L708 D709 Y710 R716	L708-T712 WeakPolarHBondContact O-CB 3.49Å; L708-T712 PolarHBondContact O-N 2.88Å; L708-T712 PolarHBondContact O-OG1 3.11Å; D709-T712 PolarHBondContact O-N 2.94Å; Y710-T712 VanDerWaalsContact C-N 3.26Å; Y710-T712 PolarHBondContact O-N 3.31Å; T712-R716 WeakPolarHBondContact O-CB 3.36Å; T712-R716 PolarHBondContact O-N 3.24Å; T712-R716 VanDerWaalsContact O-N 3.16Å
713	N	88	Confident	86.8	Confident	92 Å²	92	89.8 Å²	89.8	49%	0.492	45%	0.453	S	S	.	.	H	α-helix	trans	-70.9	-40.4	174.6	-68.5	-36.7	0	0	0	112.2	D709 Y710 R716 L717	D709-N713 WeakPolarHBondContact O-CB 3.47Å; D709-N713 PolarHBondContact O-N 3.31Å; D709-N713 PolarHBondContact O-ND2 3.32Å; Y710-N713 PolarHBondContact O-N 2.71Å; N713-R716 WeakPolarHBondContact O-CB 3.44Å; N713-R716 PolarHBondContact O-N 3.45Å; N713-L717 WeakPolarHBondContact O-CG 3.4Å; N713-L717 PolarHBondContact O-N 2.99Å
714	L	90.1	Very high	86.5	Confident	55 Å²	55	89.2 Å²	89.2	29%	0.288	45%	0.449	S	S	.	.	H	α-helix	trans	-58.7	-56.6	175	-171.7	163.2	0	0	0	109.9	Y710 Q711 R716 L717 E718	Y710-L714 HydrophobicContact CE1-CD1 4.02Å; Y710-L714 WeakPolarHBondContact O-CB 3.32Å; Y710-L714 PolarHBondContact O-N 2.9Å; Q711-L714 PolarHBondContact O-N 3.02Å; L714-R716 PolarHBondContact O-N 3.12Å; L714-R716 VanDerWaalsContact O-N 3.09Å; L714-L717 PolarHBondContact O-N 2.81Å; L714-E718 HydrophobicContact CD2-CG 3.95Å; L714-E718 WeakPolarHBondContact O-CG 3.1Å; L714-E718 PolarHBondContact O-N 3.12Å; L714-E718 VanDerWaalsContact O-N 3.14Å
715	N	87.3	Confident	86.4	Confident	80 Å²	80	89.5 Å²	89.5	43%	0.428	46%	0.458	S	S	.	.	H	α-helix	trans	-52.7	-36.5	176.4	-69.7	13.3	0	0	0	112.3	Q711 F719	Q711-N715 PolarHBondContact NE2-OD1 2.74Å; Q711-N715 WeakPolarHBondContact O-CB 3.32Å; Q711-N715 PolarHBondContact O-N 2.88Å; Q711-N715 PolarHBondContact O-OD1 3.43Å; Q711-N715 VanDerWaalsContact O-OD1 3.05Å; N715-F719 WeakPolarHBondContact O-CD2 3.45Å
716	R	84.1	Confident	86.2	Confident	118 Å²	118	92 Å²	92	45%	0.445	47%	0.469	S	S	.	.	H	α-helix	trans	-68.1	-46.2	178.4	175.9	178.2	168.5	166.3	-0.1	112	T712 N713 L714 F719 E720	T712-R716 WeakPolarHBondContact O-CB 3.36Å; T712-R716 PolarHBondContact O-N 3.24Å; T712-R716 VanDerWaalsContact O-N 3.16Å; N713-R716 WeakPolarHBondContact O-CB 3.44Å; N713-R716 PolarHBondContact O-N 3.45Å; L714-R716 PolarHBondContact O-N 3.12Å; L714-R716 VanDerWaalsContact O-N 3.09Å; R716-F719 PolarHBondContact O-N 2.92Å; R716-E720 HydrophobicContact CG-CG 4.27Å; R716-E720 IonicContact CZ-OE1 3.19Å; R716-E720 IonicContact NE-OE1 2.95Å; R716-E720 PolarHBondContact NE-OE1 3.02Å; R716-E720 IonicContact NH2-OE1 2.7Å; R716-E720 PolarHBondContact NH2-OE1 2.83Å; R716-E720 WeakPolarHBondContact O-CG 3.39Å; R716-E720 PolarHBondContact O-N 3.46Å; R716-E720 VanDerWaalsContact O-N 3.17Å
717	L	88.4	Confident	86.1	Confident	111 Å²	111	91.2 Å²	91.2	58%	0.581	45%	0.454	S	S	*	.	H	α-helix	trans	-63.2	-42.4	-177.9	-71.7	165.1	0	0	0	111.8	N713 L714 F719 E720	N713-L717 WeakPolarHBondContact O-CG 3.4Å; N713-L717 PolarHBondContact O-N 2.99Å; L714-L717 PolarHBondContact O-N 2.81Å; L717-F719 PolarHBondContact O-N 3.31Å; L717-E720 PolarHBondContact O-N 3.36Å
718	E	87	Confident	85.9	Confident	123 Å²	123	85.9 Å²	85.9	58%	0.575	43%	0.429	S	S	*	.	H	α-helix	trans	-56.3	-38.4	176.4	-61.2	-64.7	166.8	0	0	112.2	L714 M722	L714-E718 HydrophobicContact CD2-CG 3.95Å; L714-E718 WeakPolarHBondContact O-CG 3.1Å; L714-E718 PolarHBondContact O-N 3.12Å; L714-E718 VanDerWaalsContact O-N 3.14Å; E718-M722 WeakPolarHBondContact O-CE 3.43Å
719	F	84.5	Confident	85.9	Confident	45 Å²	45	88.4 Å²	88.4	20%	0.197	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	6.5	-179.4	-62.4	-62.1	0	0	0	114.7	N715 R716 L717 M722 R727 Y730 E731	N715-F719 WeakPolarHBondContact O-CD2 3.45Å; R716-F719 PolarHBondContact O-N 2.92Å; L717-F719 PolarHBondContact O-N 3.31Å; F719-M722 HydrophobicContact CD1-CE 3.52Å; F719-M722 HydrophobicContact CD1-SD 4.39Å; F719-M722 HydrophobicContact CE1-CE 3.91Å; F719-R727 HydrophobicContact CD1-CG 4.5Å; F719-R727 PolarHBondContact O-NH1 2.86Å; F719-Y730 HydrophobicContact CE1-CG 4.37Å; F719-E731 HydrophobicContact CZ-CB 4.45Å
720	E	81.3	Confident	85.8	Confident	92 Å²	92	90.2 Å²	90.2	43%	0.43	44%	0.444	S	S	.	.	S	Bend	trans	-79.5	-17.7	-179	-95.8	-178.7	162.3	0	0	114.2	R716 L717	R716-E720 HydrophobicContact CG-CG 4.27Å; R716-E720 IonicContact CZ-OE1 3.19Å; R716-E720 IonicContact NE-OE1 2.95Å; R716-E720 PolarHBondContact NE-OE1 3.02Å; R716-E720 IonicContact NH2-OE1 2.7Å; R716-E720 PolarHBondContact NH2-OE1 2.83Å; R716-E720 WeakPolarHBondContact O-CG 3.39Å; R716-E720 PolarHBondContact O-N 3.46Å; R716-E720 VanDerWaalsContact O-N 3.17Å; L717-E720 PolarHBondContact O-N 3.36Å
721	N	83	Confident	85.5	Confident	162 Å²	162	84.7 Å²	84.7	87%	0.866	42%	0.424	S	S	*	.	S	Bend	trans	-108.8	4.5	-178.5	-63.6	-26.4	0	0	0	114.6
722	M	82.6	Confident	85.5	Confident	66 Å²	66	80.3 Å²	80.3	33%	0.325	40%	0.404	S	S	.	.	S	Bend	trans	-100.9	142.1	179	-81.2	-176.5	-100	0	0	111.7	E718 F719 Y730	E718-M722 WeakPolarHBondContact O-CE 3.43Å; F719-M722 HydrophobicContact CD1-CE 3.52Å; F719-M722 HydrophobicContact CD1-SD 4.39Å; F719-M722 HydrophobicContact CE1-CE 3.91Å; M722-Y730 HydrophobicContact SD-CD2 3.79Å; M722-Y730 HydrophobicContact SD-CE2 3.76Å
723	D	85.1	Confident	85.7	Confident	127 Å²	127	77.8 Å²	77.8	68%	0.679	39%	0.389	S	S	*	.			trans	-62.1	149.9	173.4	-79.8	-33.7	0	0	0	111.9	S725 D726 R727	D723-S725 PolarHBondContact O-N 3.12Å; D723-S725 VanDerWaalsContact O-N 3.09Å; D723-D726 PolarHBondContact O-N 2.63Å; D723-R727 WeakPolarHBondContact O-CB 3.44Å; D723-R727 PolarHBondContact O-N 3.14Å
724	D	82.1	Confident	85.8	Confident	65 Å²	65	76.1 Å²	76.1	35%	0.348	38%	0.375	S	S	.	.	H	α-helix	trans	-59	-26.3	-176.5	-98	-3.7	0	0	0	113.1	I728 R734	D724-I728 VanDerWaalsContact O-CD1 3.24Å; D724-I728 WeakPolarHBondContact O-CD1 3.43Å; D724-I728 WeakPolarHBondContact O-CG1 3.45Å; D724-I728 PolarHBondContact O-N 2.83Å; D724-I728 VanDerWaalsContact O-N 3.13Å; D724-R734 IonicContact OD1-CZ 2.77Å; D724-R734 IonicContact OD1-NH1 3.96Å; D724-R734 PolarHBondContact OD1-NH1 2.95Å; D724-R734 IonicContact OD1-NH2 3.55Å; D724-R734 PolarHBondContact OD1-NH2 3.19Å; D724-R734 IonicContact OD2-CZ 2.61Å; D724-R734 IonicContact OD2-NH1 2.7Å; D724-R734 IonicContact OD2-NH2 3.61Å; D724-R734 PolarHBondContact OD2-NH2 2.89Å
725	S	83.2	Confident	85.8	Confident	70 Å²	70	74 Å²	74	49%	0.49	37%	0.365	S	S	.	.	H	α-helix	trans	-66.4	-60.5	175.2	-61.7	0	0	0	0	112	D723 R727 I728 D729	D723-S725 PolarHBondContact O-N 3.12Å; D723-S725 VanDerWaalsContact O-N 3.09Å; S725-R727 PolarHBondContact O-N 2.98Å; S725-I728 WeakPolarHBondContact O-CB 3.1Å; S725-I728 PolarHBondContact O-N 3.23Å; S725-D729 PolarHBondContact O-N 2.99Å
726	D	84.1	Confident	85.8	Confident	91 Å²	91	70.2 Å²	70.2	49%	0.487	35%	0.345	S	S	.	.	H	α-helix	trans	-60.6	-39.7	179.6	-63.7	-2.2	0	0	0	110.6	D723 I728 D729 Y730	D723-D726 PolarHBondContact O-N 2.63Å; D726-I728 VanDerWaalsContact C-N 3.29Å; D726-I728 PolarHBondContact O-N 3.11Å; D726-D729 PolarHBondContact O-N 3.39Å; D726-Y730 HydrophobicContact CB-CE2 4.38Å; D726-Y730 WeakPolarHBondContact O-CD2 3.21Å; D726-Y730 PolarHBondContact O-N 3.11Å; D726-Y730 VanDerWaalsContact O-N 3.14Å
727	R	87	Confident	86.1	Confident	43 Å²	43	65.6 Å²	65.6	16%	0.162	33%	0.328	C	S	.	.	H	α-helix	trans	-57.4	-38.1	174.8	-176.3	-178.4	177.2	108.6	32.2	112.7	F719 D723 S725 D729 Y730 E731 R734	F719-R727 HydrophobicContact CD1-CG 4.5Å; F719-R727 PolarHBondContact O-NH1 2.86Å; D723-R727 WeakPolarHBondContact O-CB 3.44Å; D723-R727 PolarHBondContact O-N 3.14Å; S725-R727 PolarHBondContact O-N 2.98Å; R727-D729 VanDerWaalsContact C-N 3.31Å; R727-D729 PolarHBondContact O-N 3Å; R727-Y730 PolarHBondContact O-N 2.67Å; R727-E731 HydrophobicContact CG-CG 4.26Å; R727-E731 IonicContact CZ-OE1 3.44Å; R727-E731 IonicContact CZ-OE2 2.69Å; R727-E731 VanDerWaalsContact NE-CD 3.33Å; R727-E731 IonicContact NE-OE1 3.91Å; R727-E731 PolarHBondContact NE-OE1 2.72Å; R727-E731 IonicContact NE-OE2 2.83Å; R727-E731 PolarHBondContact NE-OE2 3.27Å; R727-E731 IonicContact NH2-OE1 2.63Å; R727-E731 PolarHBondContact NH2-OE1 2.74Å; R727-E731 IonicContact NH2-OE2 3.57Å; R727-E731 PolarHBondContact NH2-OE2 3.39Å; R727-E731 WeakPolarHBondContact O-CG 3.44Å; R727-E731 PolarHBondContact O-N 3.44Å; R727-R734 VanDerWaalsContact NE-NH1 3.19Å
728	I	86.8	Confident	86.4	Confident	11 Å²	11	60.8 Å²	60.8	6%	0.056	30%	0.303	C	S	.	.	H	α-helix	trans	-67.8	-30.4	175.8	-75.1	161.5	0	0	0	111.7	F332 D724 S725 D726 G732 F733 M737	F332-I728 HydrophobicContact CD1-CD1 3.55Å; F332-I728 HydrophobicContact CE1-CD1 3.85Å; F332-I728 HydrophobicContact CG-CD1 4.3Å; D724-I728 VanDerWaalsContact O-CD1 3.24Å; D724-I728 WeakPolarHBondContact O-CD1 3.43Å; D724-I728 WeakPolarHBondContact O-CG1 3.45Å; D724-I728 PolarHBondContact O-N 2.83Å; D724-I728 VanDerWaalsContact O-N 3.13Å; S725-I728 WeakPolarHBondContact O-CB 3.1Å; S725-I728 PolarHBondContact O-N 3.23Å; D726-I728 VanDerWaalsContact C-N 3.29Å; D726-I728 PolarHBondContact O-N 3.11Å; I728-G732 WeakPolarHBondContact O-CA 3.5Å; I728-G732 PolarHBondContact O-N 3.21Å; I728-F733 HydrophobicContact CD1-CD1 4.21Å; I728-F733 HydrophobicContact CD1-CE1 4.11Å; I728-F733 HydrophobicContact CG1-CD1 4.42Å; I728-F733 HydrophobicContact CG2-CD1 4.14Å; I728-F733 HydrophobicContact CG2-CD2 4.14Å; I728-F733 HydrophobicContact CG2-CE1 3.86Å; I728-F733 HydrophobicContact CG2-CE2 3.84Å; I728-F733 HydrophobicContact CG2-CG 4.28Å; I728-F733 HydrophobicContact CG2-CZ 3.69Å; I728-M737 HydrophobicContact CD1-CE 4.13Å
729	D	85.3	Confident	86.7	Confident	105 Å²	105	55 Å²	55	56%	0.561	28%	0.276	S	S	*	.	H	α-helix	trans	-74.9	-32	175.8	-84.9	-58.7	0	0	0	112.9	K293 S725 D726 R727	K293-D729 VanDerWaalsContact CE-OD1 3.28Å; K293-D729 WeakPolarHBondContact CE-OD1 3.41Å; K293-D729 IonicContact NZ-OD1 2.75Å; K293-D729 PolarHBondContact NZ-OD1 3.2Å; K293-D729 IonicContact NZ-OD2 2.91Å; K293-D729 PolarHBondContact NZ-OD2 2.87Å; S725-D729 PolarHBondContact O-N 2.99Å; D726-D729 PolarHBondContact O-N 3.39Å; R727-D729 VanDerWaalsContact C-N 3.31Å; R727-D729 PolarHBondContact O-N 3Å
730	Y	86.1	Confident	87.2	Confident	129 Å²	129	55.5 Å²	55.5	51%	0.506	28%	0.276	S	S	.	.	H	α-helix	trans	-83.1	-49	173.9	-63.2	-65.3	0	0	0	114.5	F719 M722 D726 R727	F719-Y730 HydrophobicContact CE1-CG 4.37Å; M722-Y730 HydrophobicContact SD-CD2 3.79Å; M722-Y730 HydrophobicContact SD-CE2 3.76Å; D726-Y730 HydrophobicContact CB-CE2 4.38Å; D726-Y730 WeakPolarHBondContact O-CD2 3.21Å; D726-Y730 PolarHBondContact O-N 3.11Å; D726-Y730 VanDerWaalsContact O-N 3.14Å; R727-Y730 PolarHBondContact O-N 2.67Å
731	E	85.6	Confident	87.7	Confident	42 Å²	42	51.2 Å²	51.2	20%	0.196	26%	0.257	C	S	.	.	H	α-helix	trans	-96.9	-19.3	-173.9	97.5	-178.4	161.1	0	0	113.8	P290 F719 R727 R734	P290-E731 WeakPolarHBondContact CB-O 3.5Å; P290-E731 WeakPolarHBondContact CG-O 3.42Å; F719-E731 HydrophobicContact CZ-CB 4.45Å; R727-E731 HydrophobicContact CG-CG 4.26Å; R727-E731 IonicContact CZ-OE1 3.44Å; R727-E731 IonicContact CZ-OE2 2.69Å; R727-E731 VanDerWaalsContact NE-CD 3.33Å; R727-E731 IonicContact NE-OE1 3.91Å; R727-E731 PolarHBondContact NE-OE1 2.72Å; R727-E731 IonicContact NE-OE2 2.83Å; R727-E731 PolarHBondContact NE-OE2 3.27Å; R727-E731 IonicContact NH2-OE1 2.63Å; R727-E731 PolarHBondContact NH2-OE1 2.74Å; R727-E731 IonicContact NH2-OE2 3.57Å; R727-E731 PolarHBondContact NH2-OE2 3.39Å; R727-E731 WeakPolarHBondContact O-CG 3.44Å; R727-E731 PolarHBondContact O-N 3.44Å; E731-R734 WeakPolarHBondContact OE1-CB 3.17Å; E731-R734 WeakPolarHBondContact OE1-CD 3.26Å
732	G	88.5	Confident	88.1	Confident	3 Å²	3	45 Å²	45	3%	0.031	22%	0.222	C	C	.	.			trans	83.8	-178.3	-166.4	0	0	0	0	0	113.5	F291 I728 R734	F291-G732 CarbonylContact O-C 3.53Å; F291-G732 VanDerWaalsContact O-CA 3.26Å; F291-G732 WeakPolarHBondContact O-CA 3.24Å; I728-G732 WeakPolarHBondContact O-CA 3.5Å; I728-G732 PolarHBondContact O-N 3.21Å; G732-R734 PolarHBondContact O-N 3.22Å
733	F	90.2	Very high	88.4	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.018	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-70.1	97.2	174.4	-63.5	-89.8	0	0	0	109.9	P290 F291 K293 I330 F332 I728 V739	P290-F733 CarbonylContact C-O 3.42Å; P290-F733 WeakPolarHBondContact CA-O 3.48Å; F291-F733 HydrophobicContact CB-CB 4.32Å; F291-F733 PolarHBondContact N-O 3.49Å; F291-F733 PolarHBondContact O-N 3.06Å; K293-F733 HydrophobicContact CG-CE2 3.85Å; I330-F733 HydrophobicContact CB-CD2 4.17Å; I330-F733 HydrophobicContact CB-CE1 4.38Å; I330-F733 HydrophobicContact CB-CE2 3.5Å; I330-F733 HydrophobicContact CB-CZ 3.62Å; I330-F733 HydrophobicContact CD1-CD2 3.93Å; I330-F733 HydrophobicContact CD1-CE2 3.84Å; I330-F733 HydrophobicContact CG1-CE2 4.23Å; I330-F733 HydrophobicContact CG2-CD1 3.97Å; I330-F733 HydrophobicContact CG2-CD2 3.67Å; I330-F733 HydrophobicContact CG2-CE1 3.72Å; I330-F733 HydrophobicContact CG2-CE2 3.41Å; I330-F733 VanDerWaalsContact CG2-CE2 3.41Å; I330-F733 HydrophobicContact CG2-CG 3.95Å; I330-F733 HydrophobicContact CG2-CZ 3.43Å; I330-F733 VanDerWaalsContact CG2-CZ 3.43Å; I330-F733 WeakPolarHBondContact O-CZ 3.34Å; F332-F733 HydrophobicContact CB-CD1 4.26Å; F332-F733 HydrophobicContact CB-CE1 4.18Å; F332-F733 HydrophobicContact CD1-CE1 4.37Å; I728-F733 HydrophobicContact CD1-CD1 4.21Å; I728-F733 HydrophobicContact CD1-CE1 4.11Å; I728-F733 HydrophobicContact CG1-CD1 4.42Å; I728-F733 HydrophobicContact CG2-CD1 4.14Å; I728-F733 HydrophobicContact CG2-CD2 4.14Å; I728-F733 HydrophobicContact CG2-CE1 3.86Å; I728-F733 HydrophobicContact CG2-CE2 3.84Å; I728-F733 HydrophobicContact CG2-CG 4.28Å; I728-F733 HydrophobicContact CG2-CZ 3.69Å; F733-V739 HydrophobicContact CB-CG2 4.49Å; F733-V739 HydrophobicContact CD1-CG2 4.24Å
734	R	89.6	Confident	88.5	Confident	56 Å²	56	39.2 Å²	39.2	21%	0.211	19%	0.193	C	C	.	.			trans	-54.9	147.7	-178.6	59.6	-176.9	179.5	-137.6	-7.1	113.2	D724 R727 E731 G732 M737	D724-R734 IonicContact OD1-CZ 2.77Å; D724-R734 IonicContact OD1-NH1 3.96Å; D724-R734 PolarHBondContact OD1-NH1 2.95Å; D724-R734 IonicContact OD1-NH2 3.55Å; D724-R734 PolarHBondContact OD1-NH2 3.19Å; D724-R734 IonicContact OD2-CZ 2.61Å; D724-R734 IonicContact OD2-NH1 2.7Å; D724-R734 IonicContact OD2-NH2 3.61Å; D724-R734 PolarHBondContact OD2-NH2 2.89Å; R727-R734 VanDerWaalsContact NE-NH1 3.19Å; E731-R734 WeakPolarHBondContact OE1-CB 3.17Å; E731-R734 WeakPolarHBondContact OE1-CD 3.26Å; G732-R734 PolarHBondContact O-N 3.22Å; R734-M737 HydrophobicContact CG-CG 3.72Å; R734-M737 HydrophobicContact CG-SD 3.63Å; R734-M737 PolarHBondContact O-N 3.13Å
735	P	90.2	Very high	88.6	Confident	10 Å²	10	37.2 Å²	37.2	7%	0.065	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	149	168.2	24	-35	0	0	0	111.5	P77 P81 V286 G288 M737	P77-P735 HydrophobicContact CB-CG 4.33Å; P77-P735 HydrophobicContact CG-CB 4.23Å; P77-P735 HydrophobicContact CG-CG 3.9Å; P77-P735 WeakPolarHBondContact CG-O 3.33Å; P81-P735 HydrophobicContact CG-CB 4.46Å; V286-P735 WeakPolarHBondContact O-CA 3.18Å; G288-P735 WeakPolarHBondContact O-CG 3.42Å; P735-M737 VanDerWaalsContact C-N 3.34Å
736	G	88.1	Confident	88.5	Confident	1 Å²	1	34 Å²	34	1%	0.01	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	-23.2	-177.6	0	0	0	0	0	115.2	R127 V286	R127-G736 PolarHBondContact NH2-O 3.34Å; R127-G736 VanDerWaalsContact NH2-O 3.13Å; V286-G736 PolarHBondContact O-N 3.38Å
737	M	90.5	Very high	88.4	Confident	21 Å²	21	29.7 Å²	29.7	10%	0.103	14%	0.142	C	C	.	.			trans	-68.9	147	170.3	-65.9	-177	91.9	0	0	111.4	Y285 V286 F332 I728 R734 P735 V739	Y285-M737 WeakPolarHBondContact CA-O 3.45Å; V286-M737 PolarHBondContact N-O 3.14Å; F332-M737 HydrophobicContact CB-CE 3.64Å; F332-M737 HydrophobicContact CD1-CE 4.43Å; F332-M737 HydrophobicContact CD2-CE 3.89Å; F332-M737 HydrophobicContact CG-CE 3.75Å; I728-M737 HydrophobicContact CD1-CE 4.13Å; R734-M737 HydrophobicContact CG-CG 3.72Å; R734-M737 HydrophobicContact CG-SD 3.63Å; R734-M737 PolarHBondContact O-N 3.13Å; P735-M737 VanDerWaalsContact C-N 3.34Å; M737-V739 HydrophobicContact CB-CG2 4.05Å
738	Y	94	Very high	88.2	Confident	11 Å²	11	28 Å²	28	4%	0.043	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.9	167.4	-164.4	-109	0	0	0	108.8	Y283 Y285 L333 P336 Y356	Y283-Y738 WeakPolarHBondContact CB-OH 3.27Å; Y283-Y738 HydrophobicContact CD1-CE1 4.44Å; Y285-Y738 AromaticContact CD1-CD2 3.95Å; Y285-Y738 HydrophobicContact CD1-CD2 3.95Å; Y285-Y738 AromaticContact CD2-CD2 3.79Å; Y285-Y738 HydrophobicContact CD2-CD2 3.79Å; Y285-Y738 HydrophobicContact CD2-CE2 4.1Å; Y285-Y738 AromaticContact CE1-CD2 3.86Å; Y285-Y738 HydrophobicContact CE1-CD2 3.86Å; Y285-Y738 HydrophobicContact CE1-CG 4.4Å; Y285-Y738 AromaticContact CE2-CD2 3.69Å; Y285-Y738 HydrophobicContact CE2-CD2 3.69Å; Y285-Y738 AromaticContact CE2-CE2 3.95Å; Y285-Y738 HydrophobicContact CE2-CE2 3.95Å; Y285-Y738 AromaticContact CG-CD2 3.92Å; Y285-Y738 HydrophobicContact CG-CD2 3.92Å; Y285-Y738 AromaticContact CZ-CD2 3.75Å; L333-Y738 HydrophobicContact CB-CD1 4.08Å; L333-Y738 HydrophobicContact CD1-CD1 4.49Å; L333-Y738 PolarHBondContact N-O 3.37Å; P336-Y738 HydrophobicContact CG-CD1 4.02Å; P336-Y738 HydrophobicContact CG-CD2 3.99Å; P336-Y738 HydrophobicContact CG-CE1 4.03Å; P336-Y738 HydrophobicContact CG-CE2 3.99Å; P336-Y738 HydrophobicContact CG-CG 4.01Å; Y356-Y738 HydrophobicContact CE1-CE2 4.33Å; Y356-Y738 WeakPolarHBondContact CE1-OH 3.34Å; Y356-Y738 PolarHBondContact OH-OH 2.91Å
739	V	93.3	Very high	88	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	139.9	-163.4	173.6	0	0	0	0	111.1	Y283 G284 V286 I330 F733 M737 V741	Y283-V739 WeakPolarHBondContact CA-O 3.05Å; G284-V739 PolarHBondContact N-O 3.46Å; G284-V739 PolarHBondContact O-N 3.27Å; V286-V739 HydrophobicContact CG2-CB 4.11Å; V286-V739 HydrophobicContact CG2-CG2 3.64Å; I330-V739 HydrophobicContact CG2-CG1 3.24Å; F733-V739 HydrophobicContact CB-CG2 4.49Å; F733-V739 HydrophobicContact CD1-CG2 4.24Å; M737-V739 HydrophobicContact CB-CG2 4.05Å; V739-V741 HydrophobicContact CG1-CG2 3.81Å
740	R	94.1	Very high	87.9	Confident	54 Å²	54	25 Å²	25	20%	0.204	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.3	168.7	-178.3	-177.6	-167.9	-113.4	4	108.5	A281 F282 Y283 I330 S331 L333	A281-R740 HydrophobicContact CB-CG 4.31Å; F282-R740 CarbonylContact O-C 3.32Å; F282-R740 WeakPolarHBondContact O-CA 3.32Å; Y283-R740 HydrophobicContact CD1-CB 3.96Å; Y283-R740 HydrophobicContact CD1-CG 4.14Å; Y283-R740 HydrophobicContact CE1-CB 3.78Å; Y283-R740 HydrophobicContact CE1-CG 3.58Å; Y283-R740 HydrophobicContact CE2-CG 4.49Å; Y283-R740 PolarHBondContact OH-NE 2.85Å; I330-R740 WeakPolarHBondContact CA-O 3.36Å; S331-R740 PolarHBondContact N-O 3.49Å; S331-R740 PolarHBondContact O-N 3.46Å; L333-R740 HydrophobicContact CD1-CB 3.91Å
741	V	91.9	Very high	87.8	Confident	3 Å²	3	19.3 Å²	19.3	2%	0.018	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	109.2	178.9	-175.2	0	0	0	0	108.1	L256 F282 I327 V739 I743	L256-V741 HydrophobicContact CD1-CG2 4.1Å; F282-V741 PolarHBondContact N-O 3.16Å; F282-V741 PolarHBondContact O-N 3Å; I327-V741 HydrophobicContact CB-CG1 4.49Å; I327-V741 HydrophobicContact CD1-CG1 4.17Å; I327-V741 HydrophobicContact CG1-CG1 4.03Å; I327-V741 HydrophobicContact CG2-CG1 3.68Å; V739-V741 HydrophobicContact CG1-CG2 3.81Å; V741-I743 HydrophobicContact CG1-CD1 4.17Å; V741-I743 HydrophobicContact CG1-CG1 4.02Å
742	Q	92.5	Very high	87.8	Confident	30 Å²	30	21.1 Å²	21.1	14%	0.14	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.9	174.3	-176.7	168.3	-40.7	0	0	110.3	G328 E329 N744	G328-Q742 PolarHBondContact N-O 3.31Å; E329-Q742 HydrophobicContact CB-CB 4.13Å; E329-Q742 PolarHBondContact N-O 2.78Å; E329-Q742 PolarHBondContact O-N 3.17Å; Q742-N744 PolarHBondContact NE2-OD1 2.7Å; Q742-N744 VanDerWaalsContact NE2-OD1 3.09Å
743	I	88.9	Confident	87.5	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	122.7	177.4	-55.6	178.9	0	0	0	109.1	V280 F282 V297 I299 Y325 V741 L746 I762	V280-I743 PolarHBondContact N-O 3.3Å; V280-I743 VanDerWaalsContact N-O 3.14Å; V280-I743 PolarHBondContact O-N 3.36Å; F282-I743 HydrophobicContact CD2-CD1 4.03Å; F282-I743 HydrophobicContact CD2-CG1 4.26Å; F282-I743 HydrophobicContact CE2-CB 4.27Å; F282-I743 HydrophobicContact CE2-CD1 4.07Å; F282-I743 HydrophobicContact CE2-CG1 4.38Å; V297-I743 HydrophobicContact CG1-CD1 4.18Å; I299-I743 HydrophobicContact CD1-CD1 3.82Å; I299-I743 HydrophobicContact CD1-CG2 4.29Å; I299-I743 HydrophobicContact CG1-CD1 4.22Å; Y325-I743 HydrophobicContact CD1-CG2 4.04Å; Y325-I743 HydrophobicContact CG-CG2 3.9Å; V741-I743 HydrophobicContact CG1-CD1 4.17Å; V741-I743 HydrophobicContact CG1-CG1 4.02Å; I743-L746 HydrophobicContact CB-CD1 3.71Å; I743-L746 HydrophobicContact CB-CG 4.43Å; I743-L746 HydrophobicContact CG2-CD1 3.68Å; I743-L746 HydrophobicContact CG2-CD2 4.23Å; I743-L746 HydrophobicContact CG2-CG 3.97Å; I743-I762 HydrophobicContact CD1-CD1 3.93Å; I743-I762 HydrophobicContact CD1-CG1 4.49Å
744	N	87.3	Confident	87.2	Confident	73 Å²	73	24 Å²	24	39%	0.39	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	147.9	-178.4	-56.6	-15.3	0	0	0	109.7	N279 Q742	N279-N744 VanDerWaalsContact OD1-CA 3.25Å; N279-N744 WeakPolarHBondContact OD1-CA 3.32Å; N279-N744 WeakPolarHBondContact OD1-CB 3.41Å; N279-N744 PolarHBondContact OD1-OD1 3.08Å; Q742-N744 PolarHBondContact NE2-OD1 2.7Å; Q742-N744 VanDerWaalsContact NE2-OD1 3.09Å
745	G	83.5	Confident	86.9	Confident	23 Å²	23	22.2 Å²	22.2	24%	0.237	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.4	24.6	-172.6	0	0	0	0	0	114.6	R278 Y325	R278-G745 PolarHBondContact O-N 3.04Å; Y325-G745 VanDerWaalsContact CE1-O 3.27Å; Y325-G745 WeakPolarHBondContact CE1-O 3.45Å; Y325-G745 PolarHBondContact OH-O 2.94Å
746	L	81.9	Confident	86.5	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-47.3	129.8	173.5	-32.7	169.5	0	0	0	115.2	D277 R278 V280 F282 I299 Y325 I743 C748	D277-L746 CarbonylContact C-O 3.2Å; D277-L746 WeakPolarHBondContact CA-O 3.34Å; D277-L746 WeakPolarHBondContact CB-O 3.5Å; R278-L746 PolarHBondContact N-O 2.96Å; R278-L746 WeakPolarHBondContact O-CA 2.97Å; R278-L746 PolarHBondContact O-N 3.46Å; V280-L746 HydrophobicContact CB-CB 4.5Å; V280-L746 HydrophobicContact CB-CD1 4.13Å; V280-L746 HydrophobicContact CG2-CB 3.98Å; V280-L746 HydrophobicContact CG2-CD1 4.46Å; F282-L746 HydrophobicContact CE2-CD1 3.51Å; F282-L746 HydrophobicContact CZ-CD1 3.84Å; I299-L746 HydrophobicContact CD1-CD1 3.61Å; I299-L746 HydrophobicContact CD1-CD2 3.82Å; I299-L746 HydrophobicContact CD1-CG 4.41Å; Y325-L746 HydrophobicContact CD1-CD2 3.99Å; Y325-L746 HydrophobicContact CD2-CD2 4.05Å; Y325-L746 HydrophobicContact CE1-CD2 3.51Å; Y325-L746 HydrophobicContact CE2-CD2 3.57Å; Y325-L746 HydrophobicContact CG-CD2 4.24Å; I743-L746 HydrophobicContact CB-CD1 3.71Å; I743-L746 HydrophobicContact CB-CG 4.43Å; I743-L746 HydrophobicContact CG2-CD1 3.68Å; I743-L746 HydrophobicContact CG2-CD2 4.23Å; I743-L746 HydrophobicContact CG2-CG 3.97Å; L746-C748 PolarHBondContact O-N 2.71Å
747	P	82	Confident	86.1	Confident	1 Å²	1	26 Å²	26	1%	0.006	14%	0.137	C	C	.	.			trans	-69.3	135.1	168.7	-5.2	23.6	0	0	0	109.5	K302 E749 L750 L975	K302-P747 HydrophobicContact CB-CG 3.9Å; K302-P747 HydrophobicContact CD-CB 3.71Å; K302-P747 HydrophobicContact CD-CG 3.43Å; K302-P747 VanDerWaalsContact CD-CG 3.43Å; K302-P747 HydrophobicContact CG-CG 4.21Å; P747-E749 VanDerWaalsContact CB-OE2 3.22Å; P747-E749 WeakPolarHBondContact CB-OE2 3.36Å; P747-E749 PolarHBondContact O-N 2.87Å; P747-L750 HydrophobicContact CB-CB 3.78Å; P747-L750 HydrophobicContact CG-CB 3.55Å; P747-L750 HydrophobicContact CG-CD2 3.96Å; P747-L750 HydrophobicContact CG-CG 4.29Å; P747-L750 PolarHBondContact O-N 2.82Å; P747-L975 HydrophobicContact CB-CD2 3.64Å; P747-L975 HydrophobicContact CG-CD2 3.67Å
748	C	82.5	Confident	85.8	Confident	8 Å²	8	26.2 Å²	26.2	5%	0.054	14%	0.137	C	C	.	.	H	α-helix	trans	-56.2	-41.4	166.6	54	0	0	0	0	110.5	L746 L750 V751 D752	L746-C748 PolarHBondContact O-N 2.71Å; C748-L750 PolarHBondContact O-N 2.89Å; C748-L750 VanDerWaalsContact O-N 3.17Å; C748-V751 PolarHBondContact O-N 3.35Å; C748-D752 WeakPolarHBondContact O-CB 3.46Å; C748-D752 VanDerWaalsContact O-CG 3.25Å; C748-D752 PolarHBondContact O-N 2.89Å
749	E	83.1	Confident	85.4	Confident	51 Å²	51	26.1 Å²	26.1	24%	0.238	14%	0.138	C	C	.	.	H	α-helix	trans	-66.6	-22.1	-176.2	-42.6	95.1	140.9	0	0	113.7	S305 P747 N753 L975	S305-E749 PolarHBondContact OG-OE1 2.88Å; P747-E749 VanDerWaalsContact CB-OE2 3.22Å; P747-E749 WeakPolarHBondContact CB-OE2 3.36Å; P747-E749 PolarHBondContact O-N 2.87Å; E749-N753 VanDerWaalsContact O-CB 3.22Å; E749-N753 WeakPolarHBondContact O-CB 3.38Å; E749-N753 PolarHBondContact O-N 3.12Å; E749-N753 PolarHBondContact O-ND2 2.82Å; E749-L975 HydrophobicContact CB-CB 4.31Å; E749-L975 HydrophobicContact CB-CD2 4.45Å
750	L	82.5	Confident	85.1	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-77	-33.4	179.2	-170.9	75.1	0	0	0	112.4	P747 C748 F754 Y760 L974 L975	P747-L750 HydrophobicContact CB-CB 3.78Å; P747-L750 HydrophobicContact CG-CB 3.55Å; P747-L750 HydrophobicContact CG-CD2 3.96Å; P747-L750 HydrophobicContact CG-CG 4.29Å; P747-L750 PolarHBondContact O-N 2.82Å; C748-L750 PolarHBondContact O-N 2.89Å; C748-L750 VanDerWaalsContact O-N 3.17Å; L750-F754 PolarHBondContact O-N 2.82Å; L750-Y760 HydrophobicContact CD1-CE1 3.81Å; L750-Y760 HydrophobicContact CG-CE1 4.2Å; L750-L974 HydrophobicContact CD1-CB 3.98Å; L750-L975 HydrophobicContact CB-CD2 3.75Å; L750-L975 HydrophobicContact CD1-CD2 3.87Å; L750-L975 HydrophobicContact CG-CD2 4.42Å
751	V	84.3	Confident	84.9	Confident	9 Å²	9	24 Å²	24	6%	0.055	13%	0.13	C	C	.	.	H	α-helix	trans	-90.4	-35	-178.9	-171.5	0	0	0	0	110.5	Q263 V280 K369 C748 F754	Q263-V751 VanDerWaalsContact OE1-CG1 3.32Å; V280-V751 HydrophobicContact CG2-CG2 3.74Å; K369-V751 PolarHBondContact NZ-O 2.96Å; C748-V751 PolarHBondContact O-N 3.35Å; V751-F754 WeakPolarHBondContact O-CB 3.3Å; V751-F754 PolarHBondContact O-N 3.47Å
752	D	84.2	Confident	84.8	Confident	81 Å²	81	23.9 Å²	23.9	43%	0.433	13%	0.129	S	C	.	.	H	α-helix	trans	-69.1	-48.6	174.2	-65.4	-21.8	0	0	0	110.8	R278 C748 F754	R278-D752 IonicContact CZ-OD1 3.13Å; R278-D752 VanDerWaalsContact CZ-OD1 3.3Å; R278-D752 IonicContact CZ-OD2 2.78Å; R278-D752 IonicContact NH1-OD1 2.71Å; R278-D752 PolarHBondContact NH1-OD1 2.86Å; R278-D752 IonicContact NH1-OD2 3.8Å; R278-D752 VanDerWaalsContact NH2-CG 3.25Å; R278-D752 IonicContact NH2-OD1 2.69Å; R278-D752 PolarHBondContact NH2-OD1 2.83Å; R278-D752 IonicContact NH2-OD2 3.86Å; R278-D752 PolarHBondContact NH2-OD2 2.99Å; C748-D752 WeakPolarHBondContact O-CB 3.46Å; C748-D752 VanDerWaalsContact O-CG 3.25Å; C748-D752 PolarHBondContact O-N 2.89Å; D752-F754 VanDerWaalsContact C-N 3.26Å; D752-F754 PolarHBondContact O-N 2.79Å
753	N	84	Confident	84.7	Confident	42 Å²	42	22.5 Å²	22.5	23%	0.225	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	28.2	173.7	-53.6	-73.7	0	0	0	113.1	E749 D755 L975 S977 K981	E749-N753 VanDerWaalsContact O-CB 3.22Å; E749-N753 WeakPolarHBondContact O-CB 3.38Å; E749-N753 PolarHBondContact O-N 3.12Å; E749-N753 PolarHBondContact O-ND2 2.82Å; N753-D755 PolarHBondContact O-N 2.9Å; N753-L975 PolarHBondContact ND2-O 3.11Å; N753-L975 VanDerWaalsContact ND2-O 3.1Å; N753-S977 WeakPolarHBondContact OD1-CA 3.47Å; N753-S977 WeakPolarHBondContact OD1-CB 3.13Å; N753-K981 WeakPolarHBondContact O-CE 3.26Å; N753-K981 PolarHBondContact O-NZ 3Å
754	F	83.7	Confident	84.8	Confident	26 Å²	26	22.6 Å²	22.6	11%	0.114	12%	0.124	C	C	.	.			trans	-59.8	137.7	172.3	-177.2	-108.1	0	0	0	110.6	M261 F359 L750 V751 D752 P756 Y760	M261-F754 HydrophobicContact CB-CE2 4.39Å; M261-F754 HydrophobicContact CB-CZ 4.41Å; M261-F754 HydrophobicContact CE-CD2 3.48Å; M261-F754 VanDerWaalsContact CE-CD2 3.48Å; M261-F754 HydrophobicContact CE-CE2 3.7Å; M261-F754 HydrophobicContact CE-CG 4.41Å; M261-F754 HydrophobicContact SD-CD2 3.64Å; M261-F754 HydrophobicContact SD-CE2 3.98Å; M261-F754 HydrophobicContact SD-CG 4.04Å; F359-F754 HydrophobicContact CD1-CE1 4.46Å; F359-F754 AromaticContact CE1-CE1 3.73Å; F359-F754 HydrophobicContact CE1-CE1 3.73Å; F359-F754 HydrophobicContact CE1-CZ 4.11Å; F359-F754 HydrophobicContact CE2-CE1 4.38Å; F359-F754 AromaticContact CE2-CZ 3.99Å; F359-F754 HydrophobicContact CE2-CZ 3.99Å; F359-F754 AromaticContact CZ-CE1 3.67Å; F359-F754 HydrophobicContact CZ-CE1 3.67Å; F359-F754 AromaticContact CZ-CZ 3.55Å; F359-F754 HydrophobicContact CZ-CZ 3.55Å; L750-F754 PolarHBondContact O-N 2.82Å; V751-F754 WeakPolarHBondContact O-CB 3.3Å; V751-F754 PolarHBondContact O-N 3.47Å; D752-F754 VanDerWaalsContact C-N 3.26Å; D752-F754 PolarHBondContact O-N 2.79Å; F754-P756 HydrophobicContact CE1-CB 4.11Å; F754-P756 HydrophobicContact CE1-CG 4.39Å; F754-P756 HydrophobicContact CZ-CB 4.31Å; F754-Y760 HydrophobicContact CD2-CD2 4.27Å; F754-Y760 HydrophobicContact CD2-CE1 4.09Å; F754-Y760 AromaticContact CD2-CE2 3.63Å; F754-Y760 HydrophobicContact CD2-CE2 3.63Å; F754-Y760 AromaticContact CD2-CZ 3.52Å; F754-Y760 AromaticContact CE2-CD2 3.67Å; F754-Y760 HydrophobicContact CE2-CD2 3.67Å; F754-Y760 HydrophobicContact CE2-CE1 4.33Å; F754-Y760 AromaticContact CE2-CE2 3.44Å; F754-Y760 HydrophobicContact CE2-CE2 3.44Å; F754-Y760 VanDerWaalsContact CE2-CE2 3.44Å; F754-Y760 HydrophobicContact CE2-CG 4.28Å; F754-Y760 AromaticContact CE2-CZ 3.81Å; F754-Y760 HydrophobicContact CZ-CE2 4.45Å
755	D	82.2	Confident	84.9	Confident	18 Å²	18	19.6 Å²	19.6	10%	0.096	11%	0.108	C	C	.	.			trans	-145.4	109.9	175.4	-179.2	-2	0	0	0	109.7	N753 N757 Y758 N978	N753-D755 PolarHBondContact O-N 2.9Å; D755-N757 PolarHBondContact O-N 3.3Å; D755-N757 VanDerWaalsContact OD1-CB 3.3Å; D755-N757 WeakPolarHBondContact OD1-CB 3.49Å; D755-N757 PolarHBondContact OD1-N 3.29Å; D755-N757 PolarHBondContact OD1-ND2 2.86Å; D755-Y758 HydrophobicContact CB-CD2 3.95Å; D755-Y758 HydrophobicContact CB-CE2 4.5Å; D755-Y758 PolarHBondContact O-N 3Å; D755-Y758 WeakPolarHBondContact OD2-CD2 3.43Å; D755-Y758 VanDerWaalsContact OD2-CE2 3.31Å; D755-Y758 WeakPolarHBondContact OD2-CE2 3.39Å; D755-N978 WeakPolarHBondContact CB-OD1 3.27Å
756	P	82.1	Confident	85.2	Confident	18 Å²	18	21.5 Å²	21.5	12%	0.117	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-7.2	-178.5	28.5	-36.5	0	0	0	113.9	K115 G116 F359 F754 Y758	K115-P756 HydrophobicContact CB-CB 4.02Å; K115-P756 HydrophobicContact CB-CG 3.84Å; K115-P756 HydrophobicContact CD-CG 3.93Å; K115-P756 HydrophobicContact CG-CG 4.31Å; G116-P756 WeakPolarHBondContact CA-O 3.22Å; G116-P756 PolarHBondContact N-O 2.83Å; F359-P756 HydrophobicContact CB-CB 3.93Å; F359-P756 HydrophobicContact CB-CG 4.39Å; F359-P756 HydrophobicContact CD1-CB 4.23Å; F359-P756 HydrophobicContact CD2-CB 3.85Å; F359-P756 HydrophobicContact CE2-CB 4.39Å; F359-P756 HydrophobicContact CG-CB 3.75Å; F359-P756 HydrophobicContact CG-CG 4.43Å; F754-P756 HydrophobicContact CE1-CB 4.11Å; F754-P756 HydrophobicContact CE1-CG 4.39Å; F754-P756 HydrophobicContact CZ-CB 4.31Å; P756-Y758 PolarHBondContact O-N 3.15Å
757	N	80.6	Confident	85.4	Confident	72 Å²	72	26.6 Å²	26.6	39%	0.385	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-11.1	169	-60.1	-63.5	0	0	0	113.6	S134 D755	S134-N757 PolarHBondContact OG-O 3.21Å; S134-N757 VanDerWaalsContact OG-O 3.13Å; D755-N757 PolarHBondContact O-N 3.3Å; D755-N757 VanDerWaalsContact OD1-CB 3.3Å; D755-N757 WeakPolarHBondContact OD1-CB 3.49Å; D755-N757 PolarHBondContact OD1-N 3.29Å; D755-N757 PolarHBondContact OD1-ND2 2.86Å
758	Y	83.6	Confident	85.6	Confident	26 Å²	26	28.8 Å²	28.8	10%	0.102	17%	0.169	C	C	.	.	S	Bend	trans	-105.5	126	174	-69.8	-101.8	0	0	0	109.1	V139 D755 P756 Y760 L974 K981	V139-Y758 HydrophobicContact CG2-CD1 3.44Å; V139-Y758 VanDerWaalsContact CG2-CD1 3.44Å; V139-Y758 HydrophobicContact CG2-CE1 3.78Å; V139-Y758 HydrophobicContact CG2-CG 4.43Å; D755-Y758 HydrophobicContact CB-CD2 3.95Å; D755-Y758 HydrophobicContact CB-CE2 4.5Å; D755-Y758 PolarHBondContact O-N 3Å; D755-Y758 WeakPolarHBondContact OD2-CD2 3.43Å; D755-Y758 VanDerWaalsContact OD2-CE2 3.31Å; D755-Y758 WeakPolarHBondContact OD2-CE2 3.39Å; P756-Y758 PolarHBondContact O-N 3.15Å; Y758-Y760 WeakPolarHBondContact O-CD2 3.49Å; Y758-Y760 WeakPolarHBondContact O-CE2 3.25Å; Y758-Y760 PolarHBondContact O-N 3.32Å; Y758-L974 HydrophobicContact CD1-CD2 3.85Å; Y758-L974 HydrophobicContact CG-CD2 4.08Å; Y758-K981 HydrophobicContact CD2-CD 4.2Å; Y758-K981 HydrophobicContact CE1-CB 4.42Å; Y758-K981 HydrophobicContact CE1-CD 4.22Å; Y758-K981 HydrophobicContact CE2-CD 3.87Å
759	P	85.1	Confident	85.8	Confident	8 Å²	8	28.6 Å²	28.6	5%	0.052	17%	0.167	C	C	.	.			trans	-71.8	118.2	174.8	26.6	-31	0	0	0	110.5	L131 V139 V143 L257	L131-P759 HydrophobicContact CD1-CB 4.17Å; L131-P759 HydrophobicContact CD2-CB 3.94Å; L131-P759 HydrophobicContact CD2-CG 4.33Å; V139-P759 HydrophobicContact CG1-CG 3.95Å; V143-P759 HydrophobicContact CG2-CG 3.79Å; L257-P759 HydrophobicContact CD1-CB 3.9Å
760	Y	86.9	Confident	85.9	Confident	7 Å²	7	31.4 Å²	31.4	3%	0.027	18%	0.18	C	C	.	.			trans	-85	129.3	170.4	-68.8	-113.6	0	0	0	108.4	I258 M261 L750 F754 Y758 L974	I258-Y760 WeakPolarHBondContact CB-O 3.44Å; I258-Y760 VanDerWaalsContact CD1-CB 3.49Å; I258-Y760 PolarHBondContact N-O 2.84Å; I258-Y760 VanDerWaalsContact N-O 3.07Å; M261-Y760 HydrophobicContact CE-CD1 4.35Å; M261-Y760 HydrophobicContact CE-CE1 4.31Å; L750-Y760 HydrophobicContact CD1-CE1 3.81Å; L750-Y760 HydrophobicContact CG-CE1 4.2Å; F754-Y760 HydrophobicContact CD2-CD2 4.27Å; F754-Y760 HydrophobicContact CD2-CE1 4.09Å; F754-Y760 AromaticContact CD2-CE2 3.63Å; F754-Y760 HydrophobicContact CD2-CE2 3.63Å; F754-Y760 AromaticContact CD2-CZ 3.52Å; F754-Y760 AromaticContact CE2-CD2 3.67Å; F754-Y760 HydrophobicContact CE2-CD2 3.67Å; F754-Y760 HydrophobicContact CE2-CE1 4.33Å; F754-Y760 AromaticContact CE2-CE2 3.44Å; F754-Y760 HydrophobicContact CE2-CE2 3.44Å; F754-Y760 VanDerWaalsContact CE2-CE2 3.44Å; F754-Y760 HydrophobicContact CE2-CG 4.28Å; F754-Y760 AromaticContact CE2-CZ 3.81Å; F754-Y760 HydrophobicContact CZ-CE2 4.45Å; Y758-Y760 WeakPolarHBondContact O-CD2 3.49Å; Y758-Y760 WeakPolarHBondContact O-CE2 3.25Å; Y758-Y760 PolarHBondContact O-N 3.32Å; Y760-L974 HydrophobicContact CD1-CD1 3.82Å; Y760-L974 HydrophobicContact CE1-CB 4.23Å; Y760-L974 HydrophobicContact CE1-CD1 3.76Å; Y760-L974 HydrophobicContact CE2-CD1 4.49Å; Y760-L974 HydrophobicContact CG-CD1 4.24Å
761	I	90	Very high	86.1	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	129.9	-176.3	-53.1	172.4	0	0	0	108.7	D142 I146 L257 W801	D142-I761 HydrophobicContact CB-CD1 3.75Å; I146-I761 HydrophobicContact CD1-CD1 3.62Å; I146-I761 HydrophobicContact CD1-CG1 4.04Å; I146-I761 HydrophobicContact CG1-CD1 4.16Å; I146-I761 HydrophobicContact CG2-CD1 4Å; I146-I761 HydrophobicContact CG2-CG2 4.2Å; L257-I761 HydrophobicContact CD1-CG1 4.36Å; I761-W801 HydrophobicContact CG2-CZ3 4.45Å
762	I	90.6	Very high	86.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	116.7	168.1	-84.7	169.5	0	0	0	107.5	Y255 L256 I258 F282 F291 V297 I299 I743	Y255-I762 CarbonylContact C-O 3.54Å; Y255-I762 VanDerWaalsContact CA-O 3.26Å; Y255-I762 WeakPolarHBondContact CA-O 3.28Å; L256-I762 HydrophobicContact CB-CB 4.21Å; L256-I762 HydrophobicContact CB-CG2 4.13Å; L256-I762 HydrophobicContact CD2-CD1 4.48Å; L256-I762 PolarHBondContact N-O 3.46Å; L256-I762 PolarHBondContact O-N 3.1Å; I258-I762 HydrophobicContact CD1-CD1 3.9Å; I258-I762 HydrophobicContact CD1-CG1 3.97Å; I258-I762 HydrophobicContact CG1-CD1 4.22Å; I258-I762 HydrophobicContact CG1-CG1 4.5Å; F282-I762 HydrophobicContact CB-CD1 3.77Å; F282-I762 HydrophobicContact CD1-CD1 4.42Å; F282-I762 HydrophobicContact CD2-CD1 3.77Å; F282-I762 HydrophobicContact CE2-CD1 4.44Å; F282-I762 HydrophobicContact CG-CD1 3.75Å; F291-I762 HydrophobicContact CE1-CG2 4.29Å; F291-I762 HydrophobicContact CZ-CG2 3.86Å; V297-I762 HydrophobicContact CB-CG2 4.41Å; V297-I762 HydrophobicContact CG1-CB 4.07Å; V297-I762 HydrophobicContact CG1-CG1 3.87Å; V297-I762 HydrophobicContact CG1-CG2 3.64Å; V297-I762 HydrophobicContact CG2-CG2 3.82Å; I299-I762 HydrophobicContact CG1-CG1 4.31Å; I743-I762 HydrophobicContact CD1-CD1 3.93Å; I743-I762 HydrophobicContact CD1-CG1 4.49Å
763	G	90	Very high	86.7	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	119	175.6	0	0	0	0	0	110.7	H298	H298-G763 PolarHBondContact N-O 2.96Å; H298-G763 PolarHBondContact O-N 2.92Å; H298-G763 VanDerWaalsContact O-N 3.13Å
764	G	90.2	Very high	87.1	Confident	2 Å²	2	39 Å²	39	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.1	172.2	0	0	0	0	0	110.9	P254 W801	P254-G764 PolarHBondContact O-N 2.98Å; G764-W801 PolarHBondContact O-NE1 3Å
765	L	90.7	Very high	87.6	Confident	10 Å²	10	37.7 Å²	37.7	5%	0.052	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-95.8	135.7	176.5	-63.8	165.8	0	0	0	109.5	S296 H298 D324 E769	S296-L765 PolarHBondContact O-N 3.27Å; H298-L765 HydrophobicContact CB-CD1 4.09Å; H298-L765 HydrophobicContact CB-CD2 4.12Å; H298-L765 HydrophobicContact CB-CG 4.09Å; D324-L765 HydrophobicContact CB-CD1 3.97Å; L765-E769 HydrophobicContact CD2-CB 4.32Å
766	L	89.8	Confident	88.2	Confident	64 Å²	64	38.2 Å²	38.2	34%	0.335	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-70.2	152.5	169.6	-56.5	173.9	0	0	0	109.7	H253 G768 E769	H253-L766 WeakPolarHBondContact NE2-CD1 3.4Å; L766-G768 PolarHBondContact O-N 3.49Å; L766-G768 VanDerWaalsContact O-N 3.09Å; L766-E769 HydrophobicContact CB-CG 4.25Å; L766-E769 WeakPolarHBondContact O-CB 3.46Å; L766-E769 PolarHBondContact O-N 3.03Å
767	P	86.4	Confident	88.9	Confident	108 Å²	108	37.4 Å²	37.4	70%	0.701	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-54.3	-34.7	-178.1	-28.8	35.7	0	0	0	114.1	E769	P767-E769 VanDerWaalsContact C-N 3.29Å; P767-E769 PolarHBondContact O-N 3.32Å
768	G	85.5	Confident	89.6	Confident	47 Å²	47	39.7 Å²	39.7	49%	0.485	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-64.9	-27.5	174.4	0	0	0	0	0	114.4	L766 T839	L766-G768 PolarHBondContact O-N 3.49Å; L766-G768 VanDerWaalsContact O-N 3.09Å; G768-T839 WeakPolarHBondContact O-CB 3.5Å
769	E	87	Confident	90.2	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.019	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-82.4	-11.9	-176.3	-58.3	-157.5	136.5	0	0	114.4	W249 H253 L765 L766 P767 R771 R802 T839 T840 P841	W249-E769 WeakPolarHBondContact CH2-OE1 3.13Å; H253-E769 IonicContact NE2-OE1 3.5Å; H253-E769 IonicContact NE2-OE2 3.91Å; L765-E769 HydrophobicContact CD2-CB 4.32Å; L766-E769 HydrophobicContact CB-CG 4.25Å; L766-E769 WeakPolarHBondContact O-CB 3.46Å; L766-E769 PolarHBondContact O-N 3.03Å; P767-E769 VanDerWaalsContact C-N 3.29Å; P767-E769 PolarHBondContact O-N 3.32Å; E769-R771 PolarHBondContact O-N 3.08Å; E769-R802 VanDerWaalsContact O-CZ 3.32Å; E769-R802 PolarHBondContact O-NH1 3Å; E769-R802 PolarHBondContact O-NH2 2.86Å; E769-T839 VanDerWaalsContact CA-O 3.25Å; E769-T839 WeakPolarHBondContact CA-O 3.5Å; E769-T840 WeakPolarHBondContact OE1-CB 3.1Å; E769-T840 VanDerWaalsContact OE1-CG2 3.31Å; E769-T840 WeakPolarHBondContact OE1-CG2 3.37Å; E769-P841 WeakPolarHBondContact OE1-CD 3.29Å
770	Q	84.9	Confident	90.7	Very high	109 Å²	109	41.4 Å²	41.4	51%	0.509	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-67.3	-25.3	173	-61.2	177.3	1.6	0	0	111.9	S296	S296-Q770 PolarHBondContact OG-NE2 3.45Å
771	R	87.2	Confident	91.1	Very high	190 Å²	190	42 Å²	42	72%	0.717	21%	0.208	S	C	*	.	S	Bend	trans	-85.6	129.4	-173.9	-171	175.9	-68.7	-179.2	-0.1	112.2	E769 T839	E769-R771 PolarHBondContact O-N 3.08Å; R771-T839 WeakPolarHBondContact O-CB 3.5Å; R771-T839 PolarHBondContact O-N 3.4Å; R771-T839 PolarHBondContact O-OG1 2.85Å
772	L	88.6	Confident	91.3	Very high	60 Å²	60	42.4 Å²	42.4	31%	0.314	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	139	167.9	-59.9	178.4	0	0	0	111.1	W836 G837 P838 Y968	L772-W836 HydrophobicContact CB-CH2 4.31Å; L772-W836 HydrophobicContact CB-CZ2 3.6Å; L772-G837 CarbonylContact C-O 3.57Å; L772-G837 WeakPolarHBondContact CA-O 3.48Å; L772-P838 HydrophobicContact CD2-CB 4.33Å; L772-Y968 HydrophobicContact CD1-CD1 4.43Å; L772-Y968 HydrophobicContact CD2-CD1 4.44Å; L772-Y968 HydrophobicContact CD2-CE1 4.14Å
773	S	91.2	Very high	91.4	Very high	9 Å²	9	52.6 Å²	52.6	6%	0.063	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	-179.8	-178.1	62.2	0	0	0	0	112	W836 G837 T839	S773-W836 VanDerWaalsContact C-CE3 3.47Å; S773-W836 VanDerWaalsContact C-CZ3 3.49Å; S773-W836 VanDerWaalsContact O-CE3 3.29Å; S773-G837 PolarHBondContact N-O 2.85Å; S773-G837 PolarHBondContact O-N 3.18Å; S773-G837 VanDerWaalsContact O-N 3.15Å; S773-G837 VanDerWaalsContact O-O 3.13Å; S773-T839 WeakPolarHBondContact CB-OG1 3.17Å; S773-T839 PolarHBondContact OG-OG1 3.25Å
774	Y	93.4	Very high	91.4	Very high	34 Å²	34	56.3 Å²	56.3	13%	0.133	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	107.4	165.6	-63.8	-72.9	0	0	0	109.4	Q776 F835 W836 D876 A877 V964 K966	Y774-Q776 PolarHBondContact O-N 3.15Å; Y774-F835 WeakPolarHBondContact CA-O 3.35Å; Y774-W836 AromaticContact CD1-CE3 3.73Å; Y774-W836 HydrophobicContact CD1-CE3 3.73Å; Y774-W836 HydrophobicContact CD1-CZ3 4.46Å; Y774-W836 HydrophobicContact CD2-CE3 4.23Å; Y774-W836 HydrophobicContact CD2-CZ3 4.15Å; Y774-W836 AromaticContact CE1-CE3 3.73Å; Y774-W836 HydrophobicContact CE1-CE3 3.73Å; Y774-W836 HydrophobicContact CE1-CZ3 4.42Å; Y774-W836 HydrophobicContact CE2-CE3 4.27Å; Y774-W836 HydrophobicContact CE2-CZ3 4.15Å; Y774-W836 HydrophobicContact CG-CE3 4Å; Y774-W836 HydrophobicContact CG-CZ3 4.33Å; Y774-D876 WeakPolarHBondContact CB-O 3.25Å; Y774-D876 PolarHBondContact N-O 2.96Å; Y774-D876 PolarHBondContact O-N 2.31Å; Y774-D876 VanDerWaalsContact O-N 3.12Å; Y774-A877 WeakPolarHBondContact CD2-O 3.37Å; Y774-A877 WeakPolarHBondContact CE2-O 3.47Å; Y774-V964 HydrophobicContact CD1-CB 4.01Å; Y774-V964 HydrophobicContact CD1-CG1 4.04Å; Y774-V964 HydrophobicContact CE1-CB 3.77Å; Y774-V964 HydrophobicContact CE1-CG1 4.09Å; Y774-K966 HydrophobicContact CE1-CG 4.43Å; Y774-K966 WeakPolarHBondContact OH-CE 3.43Å
775	V	93.9	Very high	91.5	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	119.6	175.9	-175.3	0	0	0	0	108.5	T834 F835 P838 V872 L875	V775-T834 WeakPolarHBondContact O-CA 3.45Å; V775-F835 HydrophobicContact CB-CD2 4.17Å; V775-F835 HydrophobicContact CB-CE1 4.37Å; V775-F835 HydrophobicContact CB-CE2 3.67Å; V775-F835 HydrophobicContact CB-CZ 3.79Å; V775-F835 HydrophobicContact CG1-CE1 4.34Å; V775-F835 HydrophobicContact CG1-CE2 4.13Å; V775-F835 HydrophobicContact CG1-CZ 3.76Å; V775-F835 HydrophobicContact CG2-CE2 3.93Å; V775-F835 HydrophobicContact CG2-CZ 4.41Å; V775-F835 PolarHBondContact N-O 3.44Å; V775-F835 PolarHBondContact O-N 2.89Å; V775-P838 VanDerWaalsContact CG2-O 3.24Å; V775-P838 WeakPolarHBondContact CG2-O 3.37Å; V775-V872 HydrophobicContact CG1-CG1 4.01Å; V775-V872 HydrophobicContact CG1-CG2 4.08Å; V775-L875 HydrophobicContact CG1-CD2 4.29Å; V775-L875 HydrophobicContact CG2-CD2 4.25Å
776	Q	95.1	Very high	91.4	Very high	29 Å²	29	62.8 Å²	62.8	14%	0.136	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.8	166.4	-154.9	-154.2	56.2	0	0	109.2	Y774 L873 G874	Y774-Q776 PolarHBondContact O-N 3.15Å; Q776-L873 WeakPolarHBondContact O-CB 3.28Å; Q776-L873 PolarHBondContact O-N 2.79Å; Q776-G874 PolarHBondContact N-O 3.11Å; Q776-G874 PolarHBondContact O-N 2.72Å; Q776-G874 VanDerWaalsContact O-N 3.11Å
777	A	95.8	Very high	91.4	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	153.4	-172.4	0	0	0	0	0	112	H832 A833 F835 F846 T871	A777-H832 CarbonylContact O-C 3.59Å; A777-H832 VanDerWaalsContact O-CA 3.3Å; A777-H832 WeakPolarHBondContact O-CA 3.49Å; A777-A833 HydrophobicContact CB-CB 4.15Å; A777-A833 PolarHBondContact N-O 3.24Å; A777-A833 PolarHBondContact O-N 3.09Å; A777-F835 HydrophobicContact CB-CE1 3.94Å; A777-F846 HydrophobicContact CB-CE1 3.56Å; A777-F846 HydrophobicContact CB-CZ 3.73Å; A777-T871 CarbonylContact C-O 3.53Å; A777-T871 WeakPolarHBondContact CA-O 3.16Å
778	R	96.5	Very high	91.7	Very high	120 Å²	120	63.3 Å²	63.3	45%	0.453	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	109.3	166.5	-176.8	178.6	-71	172.6	0.8	108.6	H830 G870 T871 L873	R778-H830 HydrophobicContact CG-CB 3.87Å; R778-G870 CarbonylContact O-C 3.58Å; R778-G870 WeakPolarHBondContact O-CA 3.41Å; R778-T871 PolarHBondContact N-O 3.14Å; R778-T871 PolarHBondContact O-N 3.41Å; R778-L873 HydrophobicContact CB-CD1 3.98Å; R778-L873 HydrophobicContact CB-CD2 4.05Å; R778-L873 HydrophobicContact CB-CG 3.98Å
779	I	96.3	Very high	92.1	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	152.7	-176.6	-157	172.1	0	0	0	111.9	Y810 H830 C831 A833 F846 A868	I779-Y810 HydrophobicContact CD1-CE1 4.28Å; I779-Y810 HydrophobicContact CG2-CD1 3.93Å; I779-Y810 HydrophobicContact CG2-CE1 3.86Å; I779-H830 CarbonylContact O-C 3.59Å; I779-H830 WeakPolarHBondContact O-CA 3.45Å; I779-C831 PolarHBondContact N-O 2.91Å; I779-C831 PolarHBondContact O-N 2.77Å; I779-A833 HydrophobicContact CB-CB 4.11Å; I779-A833 HydrophobicContact CG2-CB 3.73Å; I779-F846 HydrophobicContact CB-CZ 4.27Å; I779-F846 HydrophobicContact CD1-CE2 3.96Å; I779-F846 HydrophobicContact CD1-CZ 4.19Å; I779-F846 HydrophobicContact CG1-CE2 4.18Å; I779-F846 HydrophobicContact CG1-CZ 4.1Å; I779-A868 HydrophobicContact CD1-CB 3.81Å; I779-A868 HydrophobicContact CG1-CB 3.82Å
780	K	96	Very high	92.5	Very high	69 Å²	69	63.9 Å²	63.9	30%	0.3	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	139.1	174	170.4	166.4	167.8	169	0	110.5	H782 F828 H830 A868 T869	K780-H782 PolarHBondContact O-N 2.85Å; K780-F828 WeakPolarHBondContact CE-O 3.37Å; K780-F828 PolarHBondContact NZ-O 2.95Å; K780-H830 VanDerWaalsContact CD-CE1 3.5Å; K780-H830 WeakPolarHBondContact CD-CE1 3.15Å; K780-H830 VanDerWaalsContact CD-NE2 3.29Å; K780-H830 WeakPolarHBondContact CD-NE2 3.35Å; K780-A868 VanDerWaalsContact O-CA 3.27Å; K780-A868 WeakPolarHBondContact O-CA 3.47Å; K780-A868 VanDerWaalsContact O-CB 3.31Å; K780-A868 WeakPolarHBondContact O-CB 3.32Å; K780-T869 PolarHBondContact N-O 2.95Å; K780-T869 PolarHBondContact O-N 3.48Å
781	K	94.8	Very high	93	Very high	18 Å²	18	59.1 Å²	59.1	8%	0.078	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	135.2	172.1	-170	-163.7	64.1	144.2	0	109.3	Y785 D786 R787 Q827	K781-Y785 HydrophobicContact CD-CD1 4.28Å; K781-Y785 WeakPolarHBondContact CD-O 3.33Å; K781-Y785 VanDerWaalsContact CE-O 3.26Å; K781-Y785 WeakPolarHBondContact CE-O 3.39Å; K781-Y785 HydrophobicContact CG-CD1 4.11Å; K781-Y785 PolarHBondContact NZ-O 2.88Å; K781-D786 PolarHBondContact NZ-O 3.28Å; K781-R787 WeakPolarHBondContact CD-O 3.31Å; K781-Q827 VanDerWaalsContact CE-O 3.27Å; K781-Q827 WeakPolarHBondContact CE-O 3.48Å
782	H	94.5	Very high	93.3	Very high	14 Å²	14	54.5 Å²	54.5	7%	0.065	24%	0.236	C	C	.	.			trans	-61.8	148.8	176.9	-168.6	-95.9	0	0	0	111.8	N169 K780 W784 Y785 F864 V867	N169-H782 PolarHBondContact OD1-NE2 3.4Å; K780-H782 PolarHBondContact O-N 2.85Å; H782-W784 VanDerWaalsContact C-N 3.32Å; H782-W784 AromaticContact CE1-CD2 3.93Å; H782-W784 AromaticContact CE1-CE3 3.71Å; H782-W784 PolarHBondContact ND1-N 3.36Å; H782-W784 VanDerWaalsContact ND1-N 3.13Å; H782-W784 PolarHBondContact O-N 2.88Å; H782-Y785 PolarHBondContact O-N 2.91Å; H782-F864 HydrophobicContact CB-CE1 4.5Å; H782-F864 AromaticContact CE1-CE1 3.25Å; H782-F864 WeakPolarHBondContact CE1-CE1 3.4Å; H782-F864 AromaticContact CE1-CZ 3.59Å; H782-F864 AromaticContact CG-CE1 3.65Å; H782-F864 AromaticContact ND1-CD1 3.52Å; H782-F864 AromaticContact ND1-CE1 3Å; H782-F864 WeakPolarHBondContact ND1-CE1 3.36Å; H782-F864 AromaticContact ND1-CZ 3.84Å; H782-V867 PolarHBondContact N-O 3.37Å
783	R	91.9	Very high	93.6	Very high	214 Å²	214	52.6 Å²	52.6	81%	0.808	23%	0.226	S	C	*	.	S	Bend	trans	-60.6	-39.4	-176.8	-177.5	-177.3	178.4	-170.5	0.3	112.9
784	W	90.5	Very high	93.7	Very high	80 Å²	80	52.2 Å²	52.2	30%	0.303	22%	0.223	S	C	.	.	S	Bend	trans	-95.4	-6	-176.8	-58.3	-35.7	0	0	0	114	F165 N169 H782 F864	F165-W784 HydrophobicContact CB-CE3 4.4Å; F165-W784 HydrophobicContact CB-CZ3 3.76Å; F165-W784 AromaticContact CD1-CH2 3.71Å; F165-W784 HydrophobicContact CD1-CH2 3.71Å; F165-W784 AromaticContact CD1-CZ3 3.83Å; F165-W784 HydrophobicContact CD1-CZ3 3.83Å; F165-W784 HydrophobicContact CE1-CH2 4.28Å; F165-W784 HydrophobicContact CG-CH2 4.34Å; F165-W784 HydrophobicContact CG-CZ3 4.03Å; N169-W784 WeakPolarHBondContact ND2-CZ3 3.38Å; H782-W784 VanDerWaalsContact C-N 3.32Å; H782-W784 AromaticContact CE1-CD2 3.93Å; H782-W784 AromaticContact CE1-CE3 3.71Å; H782-W784 PolarHBondContact ND1-N 3.36Å; H782-W784 VanDerWaalsContact ND1-N 3.13Å; H782-W784 PolarHBondContact O-N 2.88Å; W784-F864 HydrophobicContact CB-CB 4.39Å; W784-F864 HydrophobicContact CB-CD1 4.05Å; W784-F864 HydrophobicContact CB-CD2 4.46Å; W784-F864 HydrophobicContact CB-CE1 4.44Å; W784-F864 HydrophobicContact CB-CG 4.08Å; W784-F864 HydrophobicContact CE3-CD2 4.22Å; W784-F864 HydrophobicContact CE3-CE1 4.39Å; W784-F864 AromaticContact CE3-CE2 3.64Å; W784-F864 HydrophobicContact CE3-CE2 3.64Å; W784-F864 AromaticContact CE3-CZ 3.74Å; W784-F864 HydrophobicContact CE3-CZ 3.74Å; W784-F864 HydrophobicContact CZ3-CE2 4.22Å; W784-F864 HydrophobicContact CZ3-CZ 4.35Å
785	Y	90.8	Very high	93.7	Very high	14 Å²	14	50.8 Å²	50.8	6%	0.055	22%	0.218	C	C	.	.			trans	-83.1	120.9	170	-171.6	-106.5	0	0	0	109.2	K781 H782 R787 L789 Q850 F864 V867	K781-Y785 HydrophobicContact CD-CD1 4.28Å; K781-Y785 WeakPolarHBondContact CD-O 3.33Å; K781-Y785 VanDerWaalsContact CE-O 3.26Å; K781-Y785 WeakPolarHBondContact CE-O 3.39Å; K781-Y785 HydrophobicContact CG-CD1 4.11Å; K781-Y785 PolarHBondContact NZ-O 2.88Å; H782-Y785 PolarHBondContact O-N 2.91Å; Y785-R787 WeakPolarHBondContact CD1-O 3.39Å; Y785-R787 HydrophobicContact CE1-CB 3.76Å; Y785-R787 WeakPolarHBondContact CE1-O 3.26Å; Y785-L789 HydrophobicContact CD1-CD2 4.07Å; Y785-L789 HydrophobicContact CE1-CD2 3.55Å; Y785-Q850 PolarHBondContact OH-OE1 2.91Å; Y785-F864 WeakPolarHBondContact CD2-O 3.06Å; Y785-V867 HydrophobicContact CD1-CB 4.48Å; Y785-V867 HydrophobicContact CD1-CG1 3.96Å; Y785-V867 HydrophobicContact CD2-CG2 4Å; Y785-V867 HydrophobicContact CE1-CG1 3.75Å; Y785-V867 HydrophobicContact CE1-CG2 4.47Å; Y785-V867 HydrophobicContact CE2-CG2 3.8Å; Y785-V867 HydrophobicContact CG-CB 4.48Å; Y785-V867 HydrophobicContact CG-CG1 4.43Å; Y785-V867 HydrophobicContact CG-CG2 4.45Å
786	D	88.9	Confident	93.7	Very high	133 Å²	133	51.3 Å²	51.3	71%	0.711	22%	0.221	S	C	*	.			trans	-68.5	-60.7	-174.6	169.9	49.8	0	0	0	112.6	K781	K781-D786 PolarHBondContact NZ-O 3.28Å
787	R	90.1	Very high	93.7	Very high	120 Å²	120	50 Å²	50	45%	0.453	21%	0.214	S	C	.	.	S	Bend	trans	-65.6	145	-167.5	-58.3	169.8	179.7	170.8	-0.8	112.8	K781 Y785	K781-R787 WeakPolarHBondContact CD-O 3.31Å; Y785-R787 WeakPolarHBondContact CD1-O 3.39Å; Y785-R787 HydrophobicContact CE1-CB 3.76Å; Y785-R787 WeakPolarHBondContact CE1-O 3.26Å
788	V	93.1	Very high	93.5	Very high	63 Å²	63	50.2 Å²	50.2	38%	0.382	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-79.1	147.8	170.2	-66	0	0	0	0	111.6	Y824 Q827	V788-Y824 HydrophobicContact CG2-CD1 4.34Å; V788-Y824 HydrophobicContact CG2-CG 4.47Å; V788-Q827 HydrophobicContact CG1-CG 3.8Å
789	L	94.2	Very high	93.3	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.026	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-89.9	149	-177.9	-40.6	-177.2	0	0	0	110	Y785 L795 Y810 Y824 T825 V867 A868	Y785-L789 HydrophobicContact CD1-CD2 4.07Å; Y785-L789 HydrophobicContact CE1-CD2 3.55Å; L789-L795 HydrophobicContact CD1-CD1 4.21Å; L789-Y810 HydrophobicContact CB-CE2 3.87Å; L789-Y810 WeakPolarHBondContact CB-OH 3.38Å; L789-Y824 CarbonylContact O-C 3.49Å; L789-Y824 WeakPolarHBondContact O-CA 3.41Å; L789-Y824 WeakPolarHBondContact O-CB 3.41Å; L789-T825 HydrophobicContact CB-CG2 3.81Å; L789-T825 HydrophobicContact CD1-CG2 4.18Å; L789-T825 HydrophobicContact CG-CG2 4.13Å; L789-T825 PolarHBondContact N-OG1 3.44Å; L789-T825 PolarHBondContact O-N 2.79Å; L789-V867 HydrophobicContact CD1-CG1 3.75Å; L789-V867 HydrophobicContact CD2-CG1 3.19Å; L789-V867 HydrophobicContact CG-CG1 4.11Å; L789-A868 HydrophobicContact CD1-CB 3.78Å
790	K	95	Very high	93	Very high	59 Å²	59	44.6 Å²	44.6	26%	0.257	20%	0.196	S	C	.	.	B	Isolated β-bridge	trans	-112.9	134.6	-174	-178.7	-171.5	147.4	-64.5	0	110.6	R792 D793 Y824	K790-R792 PolarHBondContact O-N 3.11Å; K790-D793 HydrophobicContact CB-CB 4.41Å; K790-D793 IonicContact NZ-OD1 3.65Å; K790-D793 PolarHBondContact NZ-OD1 3.32Å; K790-D793 PolarHBondContact O-N 3.03Å; K790-D793 VanDerWaalsContact O-N 3.13Å; K790-Y824 HydrophobicContact CB-CD1 3.78Å; K790-Y824 HydrophobicContact CB-CE1 3.8Å; K790-Y824 HydrophobicContact CD-CE1 4.21Å; K790-Y824 HydrophobicContact CG-CD1 4.01Å; K790-Y824 HydrophobicContact CG-CE1 3.69Å
791	T	95.6	Very high	92.7	Very high	9 Å²	9	41.6 Å²	41.6	6%	0.055	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	136.3	173.9	-69.5	0	0	0	0	111.1	D793 V809 Y810 M821 L822 K823	T791-D793 PolarHBondContact O-N 3.2Å; T791-V809 HydrophobicContact CG2-CB 4.36Å; T791-V809 HydrophobicContact CG2-CG1 4.1Å; T791-V809 HydrophobicContact CG2-CG2 4.37Å; T791-Y810 VanDerWaalsContact OG1-CD2 3.32Å; T791-Y810 WeakPolarHBondContact OG1-CD2 3.43Å; T791-Y810 PolarHBondContact OG1-N 2.78Å; T791-M821 HydrophobicContact CG2-CE 3.37Å; T791-L822 WeakPolarHBondContact CB-O 3.44Å; T791-L822 PolarHBondContact OG1-O 3.02Å; T791-K823 PolarHBondContact N-O 3.36Å
792	R	94.1	Very high	92.4	Very high	93 Å²	93	40.9 Å²	40.9	35%	0.351	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	24.7	-174.9	-62.4	-177.5	177.5	-178.7	-3.8	114.4	K790 M807 V808 V809 D963 P965	K790-R792 PolarHBondContact O-N 3.11Å; R792-M807 HydrophobicContact CB-CE 4.01Å; R792-M807 VanDerWaalsContact O-CE 3.28Å; R792-M807 WeakPolarHBondContact O-CE 3.4Å; R792-V808 PolarHBondContact N-O 2.63Å; R792-V809 HydrophobicContact CG-CG2 4.11Å; R792-D963 PolarHBondContact NH2-O 2.74Å; R792-P965 HydrophobicContact CG-CG 4.17Å
793	D	93.7	Very high	92.2	Very high	19 Å²	19	40.5 Å²	40.5	10%	0.102	18%	0.178	C	C	.	.	S	Bend	trans	-88.8	147.2	153.1	-78.3	6.4	0	0	0	108.6	K790 T791 V990	K790-D793 HydrophobicContact CB-CB 4.41Å; K790-D793 IonicContact NZ-OD1 3.65Å; K790-D793 PolarHBondContact NZ-OD1 3.32Å; K790-D793 PolarHBondContact O-N 3.03Å; K790-D793 VanDerWaalsContact O-N 3.13Å; T791-D793 PolarHBondContact O-N 3.2Å; D793-V990 WeakPolarHBondContact OD1-CB 3.48Å; D793-V990 WeakPolarHBondContact OD1-CG2 3.43Å
794	P	93.8	Very high	92.2	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.013	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	142.5	-179	30.6	-35.5	0	0	0	111.5	Q805 T806 M987 T989	P794-Q805 HydrophobicContact CB-CG 4.05Å; P794-T806 WeakPolarHBondContact CA-O 3.35Å; P794-M987 HydrophobicContact CB-CB 4.11Å; P794-M987 HydrophobicContact CB-CG 4.27Å; P794-M987 HydrophobicContact CB-SD 3.85Å; P794-M987 HydrophobicContact CG-CB 4.09Å; P794-M987 HydrophobicContact CG-CG 3.97Å; P794-M987 VanDerWaalsContact CG-O 3.3Å; P794-M987 WeakPolarHBondContact CG-O 3.37Å; P794-M987 HydrophobicContact CG-SD 3.91Å; P794-T989 HydrophobicContact CG-CG2 4.47Å
795	L	93.8	Very high	92.3	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.021	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	143.1	172.3	-72.1	178.4	0	0	0	110.3	L789 Q805 T806 V808 Y810 A848 Q850 V867	L789-L795 HydrophobicContact CD1-CD1 4.21Å; L795-Q805 CarbonylContact O-C 3.55Å; L795-Q805 VanDerWaalsContact O-CA 3.3Å; L795-Q805 WeakPolarHBondContact O-CA 3.3Å; L795-T806 PolarHBondContact N-O 2.91Å; L795-T806 PolarHBondContact O-N 3.46Å; L795-V808 HydrophobicContact CB-CG2 4.43Å; L795-V808 HydrophobicContact CD1-CG2 4.23Å; L795-Y810 WeakPolarHBondContact CD1-OH 3.44Å; L795-A848 HydrophobicContact CD1-CB 4.47Å; L795-Q850 HydrophobicContact CD2-CB 4.31Å; L795-V867 HydrophobicContact CD2-CG1 4.25Å
796	I	93.4	Very high	92.5	Very high	11 Å²	11	26.1 Å²	26.1	6%	0.056	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120	172.7	-57.1	168.3	0	0	0	107.1	F804 Q805 A848 V849 V852 V971 W984	I796-F804 CarbonylContact C-O 3.58Å; I796-F804 WeakPolarHBondContact CA-O 3.19Å; I796-Q805 HydrophobicContact CG1-CB 4.29Å; I796-Q805 HydrophobicContact CG1-CG 3.99Å; I796-A848 CarbonylContact O-C 3.5Å; I796-A848 VanDerWaalsContact O-CA 3.32Å; I796-A848 WeakPolarHBondContact O-CA 3.48Å; I796-V849 HydrophobicContact CB-CB 4.48Å; I796-V849 WeakPolarHBondContact CB-O 3.43Å; I796-V849 PolarHBondContact N-O 2.96Å; I796-V849 PolarHBondContact O-N 2.96Å; I796-V852 HydrophobicContact CD1-CG2 3.86Å; I796-V971 HydrophobicContact CG2-CG2 3.58Å; I796-W984 HydrophobicContact CD1-CE3 4.38Å; I796-W984 HydrophobicContact CD1-CZ3 3.8Å; I796-W984 HydrophobicContact CG1-CZ3 4.34Å
797	I	94.5	Very high	92.7	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.7	-179.4	-64.3	-176.1	0	0	0	109	L799 R803 F804 T806 V808 F835 F846 L847 A848	I797-L799 HydrophobicContact CG2-CB 3.65Å; I797-R803 WeakPolarHBondContact O-CA 3.22Å; I797-F804 HydrophobicContact CB-CE2 4.07Å; I797-F804 HydrophobicContact CB-CZ 4.04Å; I797-F804 HydrophobicContact CG2-CE1 4.33Å; I797-F804 HydrophobicContact CG2-CE2 4.42Å; I797-F804 HydrophobicContact CG2-CZ 3.91Å; I797-F804 PolarHBondContact N-O 3.23Å; I797-F804 PolarHBondContact O-N 3.12Å; I797-T806 HydrophobicContact CD1-CG2 3.61Å; I797-T806 HydrophobicContact CG1-CG2 4.22Å; I797-V808 HydrophobicContact CD1-CG2 4.2Å; I797-F835 HydrophobicContact CD1-CD1 4.05Å; I797-F835 HydrophobicContact CD1-CD2 4.36Å; I797-F835 HydrophobicContact CD1-CE1 3.77Å; I797-F835 HydrophobicContact CD1-CE2 4.1Å; I797-F835 HydrophobicContact CD1-CG 4.33Å; I797-F835 HydrophobicContact CD1-CZ 3.8Å; I797-F846 HydrophobicContact CD1-CE2 4.44Å; I797-F846 HydrophobicContact CG2-CB 4.23Å; I797-F846 HydrophobicContact CG2-CD2 3.81Å; I797-F846 HydrophobicContact CG2-CG 4.29Å; I797-L847 WeakPolarHBondContact CA-O 3.46Å; I797-A848 HydrophobicContact CG1-CB 4.48Å
798	S	92.8	Very high	93	Very high	4 Å²	4	15.5 Å²	15.5	3%	0.028	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	113	163.1	174	0	0	0	0	108.1	I141 K145 H174 F846 L847	I141-S798 WeakPolarHBondContact CG2-OG 3.45Å; K145-S798 WeakPolarHBondContact CE-OG 3.32Å; K145-S798 PolarHBondContact NZ-OG 3.38Å; H174-S798 PolarHBondContact CE1-O 3.37Å; H174-S798 PolarHBondContact CE1-OG 2.98Å; H174-S798 PolarHBondContact NE2-OG 2.93Å; S798-F846 WeakPolarHBondContact O-CA 3.44Å; S798-F846 VanDerWaalsContact O-CB 3.27Å; S798-F846 WeakPolarHBondContact O-CB 3.5Å; S798-L847 PolarHBondContact N-O 2.88Å; S798-L847 PolarHBondContact O-N 2.92Å; S798-L847 VanDerWaalsContact O-N 3.1Å
799	L	92	Very high	93.1	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	6%	0.057	C	C	.	.			trans	-146.4	119	-172.4	167.6	139.3	0	0	0	108.2	I797 R802 F804 F835 P838 T840 F846 V872	I797-L799 HydrophobicContact CG2-CB 3.65Å; L799-R802 PolarHBondContact N-O 2.86Å; L799-R802 VanDerWaalsContact N-O 3.15Å; L799-R802 PolarHBondContact O-N 3.31Å; L799-F804 HydrophobicContact CB-CE1 4.06Å; L799-F804 HydrophobicContact CB-CZ 4.33Å; L799-F804 HydrophobicContact CD2-CE1 3.94Å; L799-F804 HydrophobicContact CD2-CZ 4.08Å; L799-F835 HydrophobicContact CD1-CZ 4.22Å; L799-P838 HydrophobicContact CD2-CG 3.78Å; L799-T840 HydrophobicContact CD2-CG2 3.36Å; L799-T840 HydrophobicContact CG-CG2 4.1Å; L799-F846 HydrophobicContact CB-CB 3.85Å; L799-F846 HydrophobicContact CD1-CB 3.99Å; L799-F846 HydrophobicContact CD1-CD1 4.24Å; L799-F846 HydrophobicContact CD1-CG 4.22Å; L799-F846 HydrophobicContact CG-CB 4.36Å; L799-V872 HydrophobicContact CD1-CG2 3.63Å
800	G	89.7	Confident	93.3	Very high	4 Å²	4	12.4 Å²	12.4	4%	0.041	6%	0.056	C	C	.	.	S	Bend	trans	57.2	-142.7	-162.6	0	0	0	0	0	111.8	K145	K145-G800 VanDerWaalsContact CE-O 3.31Å; K145-G800 WeakPolarHBondContact CE-O 3.46Å; K145-G800 PolarHBondContact NZ-O 3.28Å
801	W	89.6	Confident	93.3	Very high	5 Å²	5	9.6 Å²	9.6	2%	0.019	4%	0.044	C	C	.	.	S	Bend	trans	-65.1	-40.9	172.1	-61	121.3	0	0	0	112.4	K145 I146 W249 H253 Y255 H298 I761 G764	K145-W801 HydrophobicContact CB-CZ3 4.06Å; K145-W801 HydrophobicContact CD-CE3 4.26Å; K145-W801 HydrophobicContact CD-CZ3 4.47Å; K145-W801 PolarHBondContact NZ-O 3.47Å; I146-W801 HydrophobicContact CG2-CH2 4.39Å; I146-W801 HydrophobicContact CG2-CZ3 4.11Å; W249-W801 AromaticContact CD1-CH2 3.99Å; W249-W801 AromaticContact CD1-CZ2 3.94Å; W249-W801 AromaticContact CZ2-CD1 3.88Å; W249-W801 HydrophobicContact CZ2-CD2 4.31Å; W249-W801 HydrophobicContact CZ2-CG 4.19Å; W249-W801 AromaticContact CZ2-NE1 3.79Å; W249-W801 AromaticContact NE1-CD2 3.8Å; W249-W801 AromaticContact NE1-CE2 3.37Å; W249-W801 AromaticContact NE1-CH2 3.55Å; W249-W801 AromaticContact NE1-CZ2 3.22Å; W249-W801 AromaticContact NE1-CZ3 3.97Å; W249-W801 AromaticContact NE1-NE1 3.97Å; H253-W801 HydrophobicContact CB-CZ2 3.99Å; Y255-W801 HydrophobicContact CD1-CH2 4.06Å; Y255-W801 HydrophobicContact CD1-CZ2 4.21Å; Y255-W801 HydrophobicContact CD2-CH2 4.29Å; Y255-W801 AromaticContact CG-CH2 3.74Å; Y255-W801 HydrophobicContact CG-CH2 3.74Å; Y255-W801 HydrophobicContact CG-CZ2 4.09Å; H298-W801 HydrophobicContact CB-CB 4.29Å; I761-W801 HydrophobicContact CG2-CZ3 4.45Å; G764-W801 PolarHBondContact O-NE1 3Å
802	R	89.4	Confident	93.3	Very high	4 Å²	4	10.6 Å²	10.6	2%	0.015	5%	0.05	C	C	.	.			trans	-69.4	146.9	-168.1	-53.7	-160.9	-176.1	99	-27.3	113.4	D324 E769 L799 F804 P838 Y968	D324-R802 IonicContact OD1-CZ 3.61Å; D324-R802 IonicContact OD1-NE 2.65Å; D324-R802 PolarHBondContact OD1-NE 2.82Å; D324-R802 IonicContact OD1-NH2 2.73Å; D324-R802 IonicContact OD2-CZ 2.92Å; D324-R802 IonicContact OD2-NE 2.63Å; D324-R802 PolarHBondContact OD2-NE 3.47Å; D324-R802 IonicContact OD2-NH2 3.37Å; D324-R802 PolarHBondContact OD2-NH2 2.6Å; E769-R802 VanDerWaalsContact O-CZ 3.32Å; E769-R802 PolarHBondContact O-NH1 3Å; E769-R802 PolarHBondContact O-NH2 2.86Å; L799-R802 PolarHBondContact N-O 2.86Å; L799-R802 VanDerWaalsContact N-O 3.15Å; L799-R802 PolarHBondContact O-N 3.31Å; R802-F804 HydrophobicContact CB-CD1 4.23Å; R802-P838 VanDerWaalsContact NH1-CB 3.27Å; R802-Y968 WeakPolarHBondContact CD-OH 3.48Å
803	R	90.1	Very high	93.3	Very high	6 Å²	6	10.5 Å²	10.5	2%	0.023	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.4	170.7	-57.6	-177	-54.9	-144.9	-1.6	108.8	N138 D142 V300 I797 V971	N138-R803 PolarHBondContact O-NH1 2.64Å; D142-R803 IonicContact OD1-CZ 2.93Å; D142-R803 IonicContact OD1-NE 2.86Å; D142-R803 IonicContact OD1-NH1 3.62Å; D142-R803 PolarHBondContact OD1-NH1 2.66Å; D142-R803 IonicContact OD2-CZ 3.29Å; D142-R803 IonicContact OD2-NH1 3.23Å; D142-R803 PolarHBondContact OD2-NH1 2.91Å; V300-R803 VanDerWaalsContact CG1-NH2 3.27Å; I797-R803 WeakPolarHBondContact O-CA 3.22Å; R803-V971 HydrophobicContact CB-CB 3.95Å; R803-V971 HydrophobicContact CB-CG2 4.05Å; R803-V971 PolarHBondContact O-N 3.24Å
804	F	91.4	Very high	93.1	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	149.3	-172.9	59.2	-89.4	0	0	0	112.9	I796 I797 L799 R802 T806 F835 P838 Y968 A969 I970	I796-F804 CarbonylContact C-O 3.58Å; I796-F804 WeakPolarHBondContact CA-O 3.19Å; I797-F804 HydrophobicContact CB-CE2 4.07Å; I797-F804 HydrophobicContact CB-CZ 4.04Å; I797-F804 HydrophobicContact CG2-CE1 4.33Å; I797-F804 HydrophobicContact CG2-CE2 4.42Å; I797-F804 HydrophobicContact CG2-CZ 3.91Å; I797-F804 PolarHBondContact N-O 3.23Å; I797-F804 PolarHBondContact O-N 3.12Å; L799-F804 HydrophobicContact CB-CE1 4.06Å; L799-F804 HydrophobicContact CB-CZ 4.33Å; L799-F804 HydrophobicContact CD2-CE1 3.94Å; L799-F804 HydrophobicContact CD2-CZ 4.08Å; R802-F804 HydrophobicContact CB-CD1 4.23Å; F804-T806 HydrophobicContact CD2-CG2 4.2Å; F804-T806 HydrophobicContact CE2-CG2 3.87Å; F804-F835 HydrophobicContact CE2-CD2 4.28Å; F804-F835 HydrophobicContact CE2-CE2 4.02Å; F804-F835 AromaticContact CZ-CE2 3.98Å; F804-F835 HydrophobicContact CZ-CE2 3.98Å; F804-P838 HydrophobicContact CD1-CG 4.31Å; F804-P838 HydrophobicContact CE1-CG 3.7Å; F804-P838 HydrophobicContact CZ-CG 4.13Å; F804-Y968 HydrophobicContact CB-CD2 3.92Å; F804-Y968 HydrophobicContact CB-CE2 3.43Å; F804-Y968 VanDerWaalsContact CB-CE2 3.43Å; F804-Y968 AromaticContact CD1-CE2 3.79Å; F804-Y968 HydrophobicContact CD1-CE2 3.79Å; F804-Y968 AromaticContact CD2-CD2 3.61Å; F804-Y968 HydrophobicContact CD2-CD2 3.61Å; F804-Y968 AromaticContact CD2-CE2 3.53Å; F804-Y968 HydrophobicContact CD2-CE2 3.53Å; F804-Y968 HydrophobicContact CE1-CE2 4.42Å; F804-Y968 HydrophobicContact CE2-CD2 4.3Å; F804-Y968 HydrophobicContact CE2-CE2 4.2Å; F804-Y968 AromaticContact CG-CD2 3.84Å; F804-Y968 HydrophobicContact CG-CD2 3.84Å; F804-Y968 AromaticContact CG-CE2 3.3Å; F804-Y968 HydrophobicContact CG-CE2 3.3Å; F804-A969 CarbonylContact C-O 3.38Å; F804-A969 VanDerWaalsContact CA-O 3.23Å; F804-A969 WeakPolarHBondContact CA-O 3.16Å; F804-A969 WeakPolarHBondContact CB-O 3.39Å; F804-I970 HydrophobicContact CB-CG1 4.18Å
805	Q	92.9	Very high	93	Very high	6 Å²	6	19.2 Å²	19.2	3%	0.028	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.8	169.9	-155.7	-179.1	38.4	0	0	110.6	P794 L795 I796 F967 A969 M987	P794-Q805 HydrophobicContact CB-CG 4.05Å; L795-Q805 CarbonylContact O-C 3.55Å; L795-Q805 VanDerWaalsContact O-CA 3.3Å; L795-Q805 WeakPolarHBondContact O-CA 3.3Å; I796-Q805 HydrophobicContact CG1-CB 4.29Å; I796-Q805 HydrophobicContact CG1-CG 3.99Å; Q805-F967 HydrophobicContact CB-CE1 4.24Å; Q805-F967 HydrophobicContact CG-CE1 4.27Å; Q805-A969 PolarHBondContact N-O 3.21Å; Q805-A969 PolarHBondContact O-N 3.31Å; Q805-A969 VanDerWaalsContact O-N 3.12Å; Q805-M987 PolarHBondContact NE2-O 2.85Å; Q805-M987 VanDerWaalsContact OE1-CB 3.25Å
806	T	93.8	Very high	92.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	164.3	178.2	-172.6	0	0	0	0	111.4	P794 L795 I797 F804 V808 F835 W836 F967	P794-T806 WeakPolarHBondContact CA-O 3.35Å; L795-T806 PolarHBondContact N-O 2.91Å; L795-T806 PolarHBondContact O-N 3.46Å; I797-T806 HydrophobicContact CD1-CG2 3.61Å; I797-T806 HydrophobicContact CG1-CG2 4.22Å; F804-T806 HydrophobicContact CD2-CG2 4.2Å; F804-T806 HydrophobicContact CE2-CG2 3.87Å; T806-V808 HydrophobicContact CG2-CG2 4.12Å; T806-F835 HydrophobicContact CG2-CB 3.85Å; T806-F835 HydrophobicContact CG2-CD2 3.82Å; T806-F835 HydrophobicContact CG2-CG 3.9Å; T806-W836 PolarHBondContact OG1-O 3.11Å; T806-F967 PolarHBondContact OG1-O 2.92Å; T806-F967 VanDerWaalsContact OG1-O 3.06Å
807	M	94.6	Very high	92.4	Very high	30 Å²	30	28.6 Å²	28.6	15%	0.148	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	95.4	179.9	-69	-174.7	80	0	0	111.5	R792 P965 F967 M987	R792-M807 HydrophobicContact CB-CE 4.01Å; R792-M807 VanDerWaalsContact O-CE 3.28Å; R792-M807 WeakPolarHBondContact O-CE 3.4Å; M807-P965 HydrophobicContact CB-CB 4.19Å; M807-P965 HydrophobicContact CB-CG 4.29Å; M807-P965 HydrophobicContact SD-CB 3.99Å; M807-P965 HydrophobicContact SD-CG 4.32Å; M807-F967 HydrophobicContact CB-CB 4.42Å; M807-F967 HydrophobicContact CG-CB 3.9Å; M807-F967 HydrophobicContact CG-CD1 3.83Å; M807-F967 HydrophobicContact CG-CG 4.1Å; M807-F967 HydrophobicContact SD-CB 4.02Å; M807-F967 HydrophobicContact SD-CG 4.36Å; M807-M987 HydrophobicContact CE-CE 4.31Å; M807-M987 HydrophobicContact CG-SD 4.49Å; M807-M987 HydrophobicContact SD-CE 4.44Å; M807-M987 HydrophobicContact SD-SD 4.39Å
808	V	95.2	Very high	92.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.162	C	C	.	.			trans	-75.7	134	-172.8	-171.9	0	0	0	0	112.8	R792 L795 I797 T806 Y810 A833 F835	R792-V808 PolarHBondContact N-O 2.63Å; L795-V808 HydrophobicContact CB-CG2 4.43Å; L795-V808 HydrophobicContact CD1-CG2 4.23Å; I797-V808 HydrophobicContact CD1-CG2 4.2Å; T806-V808 HydrophobicContact CG2-CG2 4.12Å; V808-Y810 HydrophobicContact CB-CE1 4.15Å; V808-Y810 HydrophobicContact CG1-CD1 3.85Å; V808-Y810 HydrophobicContact CG1-CE1 3.47Å; V808-Y810 VanDerWaalsContact CG1-CE1 3.47Å; V808-A833 HydrophobicContact CG1-CB 3.55Å; V808-F835 HydrophobicContact CG1-CD1 4.43Å; V808-F835 HydrophobicContact CG2-CB 4.22Å; V808-F835 HydrophobicContact CG2-CD1 4.25Å; V808-F835 HydrophobicContact CG2-CG 4.5Å
809	V	96.4	Very high	92.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	111.8	169.3	179.4	0	0	0	0	109.9	T791 R792 M821 A833 T834 V881 L962 V964	T791-V809 HydrophobicContact CG2-CB 4.36Å; T791-V809 HydrophobicContact CG2-CG1 4.1Å; T791-V809 HydrophobicContact CG2-CG2 4.37Å; R792-V809 HydrophobicContact CG-CG2 4.11Å; V809-M821 HydrophobicContact CG1-CG 4.39Å; V809-A833 WeakPolarHBondContact O-CA 3.22Å; V809-T834 PolarHBondContact N-O 3.21Å; V809-T834 PolarHBondContact O-N 2.75Å; V809-V881 HydrophobicContact CG1-CG1 3.94Å; V809-L962 HydrophobicContact CG1-CD2 4.04Å; V809-V964 HydrophobicContact CB-CG2 4.26Å; V809-V964 HydrophobicContact CG2-CB 4.43Å; V809-V964 HydrophobicContact CG2-CG1 4.24Å; V809-V964 HydrophobicContact CG2-CG2 4.1Å
810	Y	97.3	Very high	92.5	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.008	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	142.8	176.3	-54.4	-57.3	0	0	0	111.8	I779 L789 T791 L795 V808 M821 L822 T825 H832 A833	I779-Y810 HydrophobicContact CD1-CE1 4.28Å; I779-Y810 HydrophobicContact CG2-CD1 3.93Å; I779-Y810 HydrophobicContact CG2-CE1 3.86Å; L789-Y810 HydrophobicContact CB-CE2 3.87Å; L789-Y810 WeakPolarHBondContact CB-OH 3.38Å; T791-Y810 VanDerWaalsContact OG1-CD2 3.32Å; T791-Y810 WeakPolarHBondContact OG1-CD2 3.43Å; T791-Y810 PolarHBondContact OG1-N 2.78Å; L795-Y810 WeakPolarHBondContact CD1-OH 3.44Å; V808-Y810 HydrophobicContact CB-CE1 4.15Å; V808-Y810 HydrophobicContact CG1-CD1 3.85Å; V808-Y810 HydrophobicContact CG1-CE1 3.47Å; V808-Y810 VanDerWaalsContact CG1-CE1 3.47Å; Y810-M821 WeakPolarHBondContact O-CA 3.24Å; Y810-L822 PolarHBondContact O-N 2.95Å; Y810-T825 HydrophobicContact CD1-CG2 3.91Å; Y810-T825 HydrophobicContact CD2-CG2 3.86Å; Y810-T825 HydrophobicContact CE1-CG2 3.74Å; Y810-T825 HydrophobicContact CE2-CG2 3.69Å; Y810-T825 HydrophobicContact CG-CG2 3.98Å; Y810-H832 CarbonylContact C-O 3.54Å; Y810-H832 WeakPolarHBondContact CA-O 3.39Å; Y810-A833 HydrophobicContact CD1-CB 4.25Å; Y810-A833 HydrophobicContact CE1-CB 4.48Å
811	S	96.2	Very high	92.9	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	172.3	179.3	60.7	0	0	0	0	112.4	R820 C831 H832	S811-R820 CarbonylContact C-O 3.55Å; S811-R820 WeakPolarHBondContact CA-O 3.41Å; S811-R820 WeakPolarHBondContact CB-O 3.48Å; S811-C831 WeakPolarHBondContact O-CB 3.48Å; S811-H832 PolarHBondContact N-O 3.1Å; S811-H832 PolarHBondContact O-N 3.49Å; S811-H832 WeakPolarHBondContact OG-CB 3.4Å
812	T	95.5	Very high	93.2	Very high	30 Å²	30	40.5 Å²	40.5	18%	0.184	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	128.9	173.4	-50.8	0	0	0	0	108.4	D814 R820 L822	T812-D814 PolarHBondContact O-N 3.43Å; T812-R820 PolarHBondContact N-O 3.16Å; T812-R820 PolarHBondContact O-N 3.15Å; T812-L822 WeakPolarHBondContact OG1-CD1 3.41Å; T812-L822 WeakPolarHBondContact OG1-CG 3.46Å
813	Q	92.8	Very high	93.5	Very high	92 Å²	92	48.1 Å²	48.1	43%	0.43	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	112.2	169.6	-164.9	169.4	-9.2	0	0	108.4	D817	Q813-D817 PolarHBondContact NE2-OD1 2.78Å
814	D	91	Very high	93.8	Very high	23 Å²	23	53.9 Å²	53.9	12%	0.123	25%	0.249	C	C	.	.			trans	-73.3	162.1	163.9	-86.1	-36.3	0	0	0	109	T812 N816 D817 R818 R820	T812-D814 PolarHBondContact O-N 3.43Å; D814-N816 PolarHBondContact O-N 2.72Å; D814-D817 PolarHBondContact O-N 2.94Å; D814-R818 PolarHBondContact N-O 3.34Å; D814-R818 VanDerWaalsContact N-O 3.11Å; D814-R820 IonicContact OD1-CZ 2.8Å; D814-R820 IonicContact OD1-NH1 4Å; D814-R820 PolarHBondContact OD1-NH1 3.3Å; D814-R820 IonicContact OD1-NH2 2.75Å; D814-R820 PolarHBondContact OD1-NH2 3.15Å; D814-R820 IonicContact OD2-CZ 3.59Å; D814-R820 VanDerWaalsContact OD2-CZ 3.29Å; D814-R820 IonicContact OD2-NE 3.72Å; D814-R820 IonicContact OD2-NH1 3.67Å; D814-R820 PolarHBondContact OD2-NH1 3.18Å; D814-R820 IonicContact OD2-NH2 3.63Å
815	H	90.8	Very high	94	Very high	181 Å²	181	54.1 Å²	54.1	84%	0.838	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	35	174.5	19.3	53.5	0	0	0	114.9
816	N	88.2	Confident	94.1	Very high	101 Å²	101	55.9 Å²	55.9	54%	0.54	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.8	25.7	166.6	-57.3	113.8	0	0	0	109.2	D814 R818	D814-N816 PolarHBondContact O-N 2.72Å; N816-R818 VanDerWaalsContact CG-NH2 3.27Å; N816-R818 PolarHBondContact O-N 2.85Å; N816-R818 PolarHBondContact OD1-NH2 3.08Å
817	D	86.9	Confident	94	Very high	111 Å²	111	61.2 Å²	61.2	59%	0.594	29%	0.288	S	S	*	.	S	Bend	trans	53.5	4.7	-178.5	-52.8	-60.1	0	0	0	117.9	Q813 D814 N819	Q813-D817 PolarHBondContact NE2-OD1 2.78Å; D814-D817 PolarHBondContact O-N 2.94Å; D817-N819 PolarHBondContact O-N 2.78Å
818	R	91.8	Very high	94	Very high	102 Å²	102	67 Å²	67	39%	0.385	31%	0.312	S	S	.	.			trans	-68.6	117.4	173.7	-72	177	-68.4	-154.8	-6	111.1	D814 N816 R820 V882	D814-R818 PolarHBondContact N-O 3.34Å; D814-R818 VanDerWaalsContact N-O 3.11Å; N816-R818 VanDerWaalsContact CG-NH2 3.27Å; N816-R818 PolarHBondContact O-N 2.85Å; N816-R818 PolarHBondContact OD1-NH2 3.08Å; R818-R820 VanDerWaalsContact C-N 3.35Å; R818-R820 PolarHBondContact O-N 3.37Å; R818-V882 HydrophobicContact CB-CG2 4.13Å
819	N	94	Very high	93.9	Very high	23 Å²	23	73 Å²	73	12%	0.123	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	83.1	172.3	-76	-48.4	0	0	0	111.6	D817 M821 V882	D817-N819 PolarHBondContact O-N 2.78Å; N819-M821 PolarHBondContact O-N 3.24Å; N819-V882 PolarHBondContact O-N 2.96Å
820	R	95.8	Very high	93.9	Very high	66 Å²	66	77.4 Å²	77.4	25%	0.249	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	120.4	178.6	175.8	-179.5	64.3	-133.7	-13.2	111	S811 T812 D814 R818 L822 V882 W959	S811-R820 CarbonylContact C-O 3.55Å; S811-R820 WeakPolarHBondContact CA-O 3.41Å; S811-R820 WeakPolarHBondContact CB-O 3.48Å; T812-R820 PolarHBondContact N-O 3.16Å; T812-R820 PolarHBondContact O-N 3.15Å; D814-R820 IonicContact OD1-CZ 2.8Å; D814-R820 IonicContact OD1-NH1 4Å; D814-R820 PolarHBondContact OD1-NH1 3.3Å; D814-R820 IonicContact OD1-NH2 2.75Å; D814-R820 PolarHBondContact OD1-NH2 3.15Å; D814-R820 IonicContact OD2-CZ 3.59Å; D814-R820 VanDerWaalsContact OD2-CZ 3.29Å; D814-R820 IonicContact OD2-NE 3.72Å; D814-R820 IonicContact OD2-NH1 3.67Å; D814-R820 PolarHBondContact OD2-NH1 3.18Å; D814-R820 IonicContact OD2-NH2 3.63Å; R818-R820 VanDerWaalsContact C-N 3.35Å; R818-R820 PolarHBondContact O-N 3.37Å; R820-L822 PolarHBondContact O-N 3.21Å; R820-V882 CarbonylContact C-O 3.44Å; R820-V882 WeakPolarHBondContact CA-O 3.34Å; R820-W959 HydrophobicContact CB-CZ3 4.18Å; R820-W959 HydrophobicContact CG-CZ3 3.92Å
821	M	96.5	Very high	93.8	Very high	37 Å²	37	77.5 Å²	77.5	18%	0.182	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	128.6	171.4	-172	-140.1	-179	0	0	112.5	T791 V809 Y810 N819 V881 V882 K883 L962	T791-M821 HydrophobicContact CG2-CE 3.37Å; V809-M821 HydrophobicContact CG1-CG 4.39Å; Y810-M821 WeakPolarHBondContact O-CA 3.24Å; N819-M821 PolarHBondContact O-N 3.24Å; M821-V881 HydrophobicContact CB-CG1 4Å; M821-V882 PolarHBondContact N-O 2.85Å; M821-K883 HydrophobicContact CB-CB 4.25Å; M821-K883 HydrophobicContact SD-CB 4.1Å; M821-K883 HydrophobicContact SD-CD 3.9Å; M821-K883 HydrophobicContact SD-CG 3.81Å; M821-L962 HydrophobicContact CB-CD2 4.46Å; M821-L962 HydrophobicContact CE-CD2 3.8Å; M821-L962 HydrophobicContact CG-CD2 3.74Å; M821-L962 HydrophobicContact SD-CD2 3.73Å
822	L	96.7	Very high	93.8	Very high	36 Å²	36	78.8 Å²	78.8	19%	0.188	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-93.4	156.1	164.7	-63.1	-175	0	0	0	111	T791 Y810 T812 R820 C831	T791-L822 WeakPolarHBondContact CB-O 3.44Å; T791-L822 PolarHBondContact OG1-O 3.02Å; Y810-L822 PolarHBondContact O-N 2.95Å; T812-L822 WeakPolarHBondContact OG1-CD1 3.41Å; T812-L822 WeakPolarHBondContact OG1-CG 3.46Å; R820-L822 PolarHBondContact O-N 3.21Å; L822-C831 HydrophobicContact CD1-CB 3.99Å
823	K	95.4	Very high	93.8	Very high	164 Å²	164	77.3 Å²	77.3	71%	0.713	36%	0.36	S	S	*	.	S	Bend	trans	-83.9	-34.6	169.5	-66.4	-177.5	-179.9	179.8	0	112.5	T791	T791-K823 PolarHBondContact N-O 3.36Å
824	Y	96.7	Very high	94	Very high	128 Å²	128	73 Å²	73	50%	0.502	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-141.9	156.7	-176.6	-56.3	-76.3	0	0	0	110.1	V788 L789 K790	V788-Y824 HydrophobicContact CG2-CD1 4.34Å; V788-Y824 HydrophobicContact CG2-CG 4.47Å; L789-Y824 CarbonylContact O-C 3.49Å; L789-Y824 WeakPolarHBondContact O-CA 3.41Å; L789-Y824 WeakPolarHBondContact O-CB 3.41Å; K790-Y824 HydrophobicContact CB-CD1 3.78Å; K790-Y824 HydrophobicContact CB-CE1 3.8Å; K790-Y824 HydrophobicContact CD-CE1 4.21Å; K790-Y824 HydrophobicContact CG-CD1 4.01Å; K790-Y824 HydrophobicContact CG-CE1 3.69Å
825	T	95.7	Very high	94.1	Very high	5 Å²	5	71.9 Å²	71.9	3%	0.031	33%	0.334	C	S	.	.			trans	-64.6	140.1	168	52.3	0	0	0	0	111.1	L789 Y810	L789-T825 HydrophobicContact CB-CG2 3.81Å; L789-T825 HydrophobicContact CD1-CG2 4.18Å; L789-T825 HydrophobicContact CG-CG2 4.13Å; L789-T825 PolarHBondContact N-OG1 3.44Å; L789-T825 PolarHBondContact O-N 2.79Å; Y810-T825 HydrophobicContact CD1-CG2 3.91Å; Y810-T825 HydrophobicContact CD2-CG2 3.86Å; Y810-T825 HydrophobicContact CE1-CG2 3.74Å; Y810-T825 HydrophobicContact CE2-CG2 3.69Å; Y810-T825 HydrophobicContact CG-CG2 3.98Å
826	P	95.4	Very high	94.3	Very high	42 Å²	42	65.4 Å²	65.4	27%	0.273	30%	0.302	S	S	.	.			trans	-63.2	152.7	165.1	29.9	-34.2	0	0	0	110.7	F828 M829 C831	P826-F828 PolarHBondContact O-N 3.03Å; P826-M829 HydrophobicContact CB-CB 4Å; P826-M829 HydrophobicContact CG-CB 3.83Å; P826-C831 HydrophobicContact CG-CB 4.24Å
827	Q	91.7	Very high	94.5	Very high	113 Å²	113	60.6 Å²	60.6	53%	0.528	28%	0.276	S	S	.	.	S	Bend	trans	-67.7	-37.3	-171.2	-73.1	177.6	-21	0	0	114.5	K781 V788	K781-Q827 VanDerWaalsContact CE-O 3.27Å; K781-Q827 WeakPolarHBondContact CE-O 3.48Å; V788-Q827 HydrophobicContact CG1-CG 3.8Å
828	F	92.9	Very high	94.6	Very high	152 Å²	152	55.3 Å²	55.3	67%	0.667	25%	0.248	S	C	*	.	S	Bend	trans	-130.6	-9.4	-170.6	-50.9	-62.8	0	0	0	114.4	K780 P826	K780-F828 WeakPolarHBondContact CE-O 3.37Å; K780-F828 PolarHBondContact NZ-O 2.95Å; P826-F828 PolarHBondContact O-N 3.03Å
829	M	94.4	Very high	94.6	Very high	126 Å²	126	51.5 Å²	51.5	62%	0.621	24%	0.236	S	C	*	.	S	Bend	trans	-94.8	157	-177.8	-168.3	-175.1	170.3	0	0	110.2	P826	P826-M829 HydrophobicContact CB-CB 4Å; P826-M829 HydrophobicContact CG-CB 3.83Å
830	H	95.8	Very high	94.4	Very high	92 Å²	92	50.5 Å²	50.5	43%	0.426	23%	0.231	S	C	.	.			trans	-77.9	145.9	166.2	-60.8	-102.4	0	0	0	109.8	R778 I779 K780	R778-H830 HydrophobicContact CG-CB 3.87Å; I779-H830 CarbonylContact O-C 3.59Å; I779-H830 WeakPolarHBondContact O-CA 3.45Å; K780-H830 VanDerWaalsContact CD-CE1 3.5Å; K780-H830 WeakPolarHBondContact CD-CE1 3.15Å; K780-H830 VanDerWaalsContact CD-NE2 3.29Å; K780-H830 WeakPolarHBondContact CD-NE2 3.35Å
831	C	95.7	Very high	94.2	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.02	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	165.2	167.4	61.3	0	0	0	0	109.9	I779 S811 L822 P826	I779-C831 PolarHBondContact N-O 2.91Å; I779-C831 PolarHBondContact O-N 2.77Å; S811-C831 WeakPolarHBondContact O-CB 3.48Å; L822-C831 HydrophobicContact CD1-CB 3.99Å; P826-C831 HydrophobicContact CG-CB 4.24Å
832	H	96	Very high	94	Very high	27 Å²	27	53.9 Å²	53.9	13%	0.125	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	149.9	171.2	-62.8	-113.5	0	0	0	108.7	A777 Y810 S811	A777-H832 CarbonylContact O-C 3.59Å; A777-H832 VanDerWaalsContact O-CA 3.3Å; A777-H832 WeakPolarHBondContact O-CA 3.49Å; Y810-H832 CarbonylContact C-O 3.54Å; Y810-H832 WeakPolarHBondContact CA-O 3.39Å; S811-H832 PolarHBondContact N-O 3.1Å; S811-H832 PolarHBondContact O-N 3.49Å; S811-H832 WeakPolarHBondContact OG-CB 3.4Å
833	A	95.7	Very high	93.8	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136.4	173.8	0	0	0	0	0	107.9	A777 I779 V808 V809 Y810	A777-A833 HydrophobicContact CB-CB 4.15Å; A777-A833 PolarHBondContact N-O 3.24Å; A777-A833 PolarHBondContact O-N 3.09Å; I779-A833 HydrophobicContact CB-CB 4.11Å; I779-A833 HydrophobicContact CG2-CB 3.73Å; V808-A833 HydrophobicContact CG1-CB 3.55Å; V809-A833 WeakPolarHBondContact O-CA 3.22Å; Y810-A833 HydrophobicContact CD1-CB 4.25Å; Y810-A833 HydrophobicContact CE1-CB 4.48Å
834	T	95.8	Very high	93.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.4	170	-47.9	0	0	0	0	108.1	V775 V809 V879 V964	V775-T834 WeakPolarHBondContact O-CA 3.45Å; V809-T834 PolarHBondContact N-O 3.21Å; V809-T834 PolarHBondContact O-N 2.75Å; T834-V879 HydrophobicContact CG2-CB 3.87Å; T834-V879 HydrophobicContact CG2-CG1 4.03Å; T834-V879 HydrophobicContact CG2-CG2 3.9Å; T834-V964 HydrophobicContact CG2-CG1 4.46Å; T834-V964 HydrophobicContact CG2-CG2 3.84Å
835	F	94.9	Very high	93.6	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	159.6	178.2	58	-97.2	0	0	0	110.2	Y774 V775 A777 I797 L799 F804 T806 V808	Y774-F835 WeakPolarHBondContact CA-O 3.35Å; V775-F835 HydrophobicContact CB-CD2 4.17Å; V775-F835 HydrophobicContact CB-CE1 4.37Å; V775-F835 HydrophobicContact CB-CE2 3.67Å; V775-F835 HydrophobicContact CB-CZ 3.79Å; V775-F835 HydrophobicContact CG1-CE1 4.34Å; V775-F835 HydrophobicContact CG1-CE2 4.13Å; V775-F835 HydrophobicContact CG1-CZ 3.76Å; V775-F835 HydrophobicContact CG2-CE2 3.93Å; V775-F835 HydrophobicContact CG2-CZ 4.41Å; V775-F835 PolarHBondContact N-O 3.44Å; V775-F835 PolarHBondContact O-N 2.89Å; A777-F835 HydrophobicContact CB-CE1 3.94Å; I797-F835 HydrophobicContact CD1-CD1 4.05Å; I797-F835 HydrophobicContact CD1-CD2 4.36Å; I797-F835 HydrophobicContact CD1-CE1 3.77Å; I797-F835 HydrophobicContact CD1-CE2 4.1Å; I797-F835 HydrophobicContact CD1-CG 4.33Å; I797-F835 HydrophobicContact CD1-CZ 3.8Å; L799-F835 HydrophobicContact CD1-CZ 4.22Å; F804-F835 HydrophobicContact CE2-CD2 4.28Å; F804-F835 HydrophobicContact CE2-CE2 4.02Å; F804-F835 AromaticContact CZ-CE2 3.98Å; F804-F835 HydrophobicContact CZ-CE2 3.98Å; T806-F835 HydrophobicContact CG2-CB 3.85Å; T806-F835 HydrophobicContact CG2-CD2 3.82Å; T806-F835 HydrophobicContact CG2-CG 3.9Å; V808-F835 HydrophobicContact CG1-CD1 4.43Å; V808-F835 HydrophobicContact CG2-CB 4.22Å; V808-F835 HydrophobicContact CG2-CD1 4.25Å; V808-F835 HydrophobicContact CG2-CG 4.5Å
836	W	94.1	Very high	93.5	Very high	44 Å²	44	45.7 Å²	45.7	17%	0.167	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	131.8	170.9	-175.2	-104.4	0	0	0	109.2	L772 S773 Y774 T806 K966	L772-W836 HydrophobicContact CB-CH2 4.31Å; L772-W836 HydrophobicContact CB-CZ2 3.6Å; S773-W836 VanDerWaalsContact C-CE3 3.47Å; S773-W836 VanDerWaalsContact C-CZ3 3.49Å; S773-W836 VanDerWaalsContact O-CE3 3.29Å; Y774-W836 AromaticContact CD1-CE3 3.73Å; Y774-W836 HydrophobicContact CD1-CE3 3.73Å; Y774-W836 HydrophobicContact CD1-CZ3 4.46Å; Y774-W836 HydrophobicContact CD2-CE3 4.23Å; Y774-W836 HydrophobicContact CD2-CZ3 4.15Å; Y774-W836 AromaticContact CE1-CE3 3.73Å; Y774-W836 HydrophobicContact CE1-CE3 3.73Å; Y774-W836 HydrophobicContact CE1-CZ3 4.42Å; Y774-W836 HydrophobicContact CE2-CE3 4.27Å; Y774-W836 HydrophobicContact CE2-CZ3 4.15Å; Y774-W836 HydrophobicContact CG-CE3 4Å; Y774-W836 HydrophobicContact CG-CZ3 4.33Å; T806-W836 PolarHBondContact OG1-O 3.11Å; W836-K966 HydrophobicContact CB-CB 4.49Å; W836-K966 HydrophobicContact CD2-CB 4.33Å; W836-K966 HydrophobicContact CD2-CD 4.42Å; W836-K966 HydrophobicContact CD2-CG 4.04Å; W836-K966 HydrophobicContact CE3-CG 4.28Å; W836-K966 HydrophobicContact CG-CB 4.05Å; W836-K966 HydrophobicContact CG-CG 4.17Å
837	G	91.5	Very high	93.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	-173.5	-175.1	0	0	0	0	0	112.7	L772 S773	L772-G837 CarbonylContact C-O 3.57Å; L772-G837 WeakPolarHBondContact CA-O 3.48Å; S773-G837 PolarHBondContact N-O 2.85Å; S773-G837 PolarHBondContact O-N 3.18Å; S773-G837 VanDerWaalsContact O-N 3.15Å; S773-G837 VanDerWaalsContact O-O 3.13Å
838	P	90.7	Very high	93.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	142.7	176.6	29.8	-36.3	0	0	0	111.1	L772 V775 L799 R802 F804 Y968	L772-P838 HydrophobicContact CD2-CB 4.33Å; V775-P838 VanDerWaalsContact CG2-O 3.24Å; V775-P838 WeakPolarHBondContact CG2-O 3.37Å; L799-P838 HydrophobicContact CD2-CG 3.78Å; R802-P838 VanDerWaalsContact NH1-CB 3.27Å; F804-P838 HydrophobicContact CD1-CG 4.31Å; F804-P838 HydrophobicContact CE1-CG 3.7Å; F804-P838 HydrophobicContact CZ-CG 4.13Å; P838-Y968 HydrophobicContact CG-CE2 4.5Å
839	T	90.6	Very high	93.6	Very high	22 Å²	22	31.3 Å²	31.3	14%	0.135	16%	0.162	C	C	.	.			trans	-66.1	136.4	166.4	-53.5	0	0	0	0	108.4	G768 E769 R771 S773 L875	G768-T839 WeakPolarHBondContact O-CB 3.5Å; E769-T839 VanDerWaalsContact CA-O 3.25Å; E769-T839 WeakPolarHBondContact CA-O 3.5Å; R771-T839 WeakPolarHBondContact O-CB 3.5Å; R771-T839 PolarHBondContact O-N 3.4Å; R771-T839 PolarHBondContact O-OG1 2.85Å; S773-T839 WeakPolarHBondContact CB-OG1 3.17Å; S773-T839 PolarHBondContact OG-OG1 3.25Å; T839-L875 HydrophobicContact CG2-CB 4.22Å; T839-L875 HydrophobicContact CG2-CD1 3.43Å; T839-L875 VanDerWaalsContact CG2-CD1 3.43Å; T839-L875 HydrophobicContact CG2-CD2 4.04Å; T839-L875 HydrophobicContact CG2-CG 4.09Å
840	T	89.8	Confident	93.3	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.012	14%	0.141	C	C	.	.			trans	-148.9	149.7	175.6	56.9	0	0	0	0	109.4	E769 L799 L875	E769-T840 WeakPolarHBondContact OE1-CB 3.1Å; E769-T840 VanDerWaalsContact OE1-CG2 3.31Å; E769-T840 WeakPolarHBondContact OE1-CG2 3.37Å; L799-T840 HydrophobicContact CD2-CG2 3.36Å; L799-T840 HydrophobicContact CG-CG2 4.1Å; T840-L875 WeakPolarHBondContact O-CD1 3.38Å
841	P	91.1	Very high	92.7	Very high	53 Å²	53	24.3 Å²	24.3	34%	0.344	13%	0.131	S	C	.	.			trans	-45.4	140.7	-178.9	-31.1	35.8	0	0	0	114.5	E769 T844	E769-P841 WeakPolarHBondContact OE1-CD 3.29Å; P841-T844 WeakPolarHBondContact O-CB 3.3Å; P841-T844 PolarHBondContact O-N 2.64Å; P841-T844 PolarHBondContact O-OG1 3.45Å
842	Q	92.5	Very high	91.8	Very high	121 Å²	121	24.3 Å²	24.3	57%	0.565	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	154.1	178.1	-61.9	-178.4	8	0	0	111.2	T844 L873	Q842-T844 PolarHBondContact O-N 3.01Å; Q842-T844 VanDerWaalsContact O-N 3.11Å; Q842-L873 VanDerWaalsContact CD-O 3.31Å; Q842-L873 WeakPolarHBondContact CG-O 3.46Å; Q842-L873 PolarHBondContact OE1-O 3.29Å
843	N	93.1	Very high	90.5	Very high	122 Å²	122	23.3 Å²	23.3	65%	0.652	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	-2.2	-172.9	-56.1	-60.9	0	0	0	116.3	G845 V872	N843-G845 PolarHBondContact O-N 3.49Å; N843-V872 WeakPolarHBondContact CA-O 3.37Å; N843-V872 PolarHBondContact N-O 3.03Å
844	T	93.3	Very high	88.8	Confident	22 Å²	22	26 Å²	26	14%	0.135	14%	0.139	C	C	.	.			trans	-54.5	128.1	169.6	-63.6	0	0	0	0	111.2	W249 P841 Q842 T871 V872	W249-T844 HydrophobicContact CE3-CG2 4.21Å; W249-T844 HydrophobicContact CZ3-CG2 4.04Å; P841-T844 WeakPolarHBondContact O-CB 3.3Å; P841-T844 PolarHBondContact O-N 2.64Å; P841-T844 PolarHBondContact O-OG1 3.45Å; Q842-T844 PolarHBondContact O-N 3.01Å; Q842-T844 VanDerWaalsContact O-N 3.11Å; T844-T871 CarbonylContact O-C 3.4Å; T844-T871 WeakPolarHBondContact O-CA 3.48Å; T844-V872 PolarHBondContact O-N 3.39Å
845	G	93.8	Very high	86.9	Confident	17 Å²	17	29.5 Å²	29.5	18%	0.175	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	134.6	177.8	0	0	0	0	0	112.3	H174 N843 G870	H174-G845 PolarHBondContact ND1-O 3.05Å; N843-G845 PolarHBondContact O-N 3.49Å; G845-G870 WeakPolarHBondContact CA-O 3.03Å
846	F	95.2	Very high	84.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	150.4	179.1	74.5	-92.1	0	0	0	113.2	V173 A777 I779 I797 S798 L799 G870	V173-F846 WeakPolarHBondContact CG1-O 3.12Å; A777-F846 HydrophobicContact CB-CE1 3.56Å; A777-F846 HydrophobicContact CB-CZ 3.73Å; I779-F846 HydrophobicContact CB-CZ 4.27Å; I779-F846 HydrophobicContact CD1-CE2 3.96Å; I779-F846 HydrophobicContact CD1-CZ 4.19Å; I779-F846 HydrophobicContact CG1-CE2 4.18Å; I779-F846 HydrophobicContact CG1-CZ 4.1Å; I797-F846 HydrophobicContact CD1-CE2 4.44Å; I797-F846 HydrophobicContact CG2-CB 4.23Å; I797-F846 HydrophobicContact CG2-CD2 3.81Å; I797-F846 HydrophobicContact CG2-CG 4.29Å; S798-F846 WeakPolarHBondContact O-CA 3.44Å; S798-F846 VanDerWaalsContact O-CB 3.27Å; S798-F846 WeakPolarHBondContact O-CB 3.5Å; L799-F846 HydrophobicContact CB-CB 3.85Å; L799-F846 HydrophobicContact CD1-CB 3.99Å; L799-F846 HydrophobicContact CD1-CD1 4.24Å; L799-F846 HydrophobicContact CD1-CG 4.22Å; L799-F846 HydrophobicContact CG-CB 4.36Å; F846-G870 VanDerWaalsContact CD1-C 3.49Å; F846-G870 WeakPolarHBondContact CD1-O 3.46Å; F846-G870 PolarHBondContact N-O 2.96Å; F846-G870 PolarHBondContact O-N 2.88Å
847	L	94.6	Very high	82.7	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	142.1	-179.5	-169.8	96.2	0	0	0	109.4	I141 I170 V173 I797 S798 V849 I866 T869	I141-L847 HydrophobicContact CD1-CD2 3.6Å; I141-L847 HydrophobicContact CG1-CD2 3.85Å; I170-L847 HydrophobicContact CG1-CD1 3.98Å; I170-L847 HydrophobicContact CG1-CD2 3.91Å; V173-L847 HydrophobicContact CG1-CB 4.4Å; V173-L847 HydrophobicContact CG2-CD1 4.4Å; I797-L847 WeakPolarHBondContact CA-O 3.46Å; S798-L847 PolarHBondContact N-O 2.88Å; S798-L847 PolarHBondContact O-N 2.92Å; S798-L847 VanDerWaalsContact O-N 3.1Å; L847-V849 HydrophobicContact CD2-CG2 3.99Å; L847-I866 HydrophobicContact CD1-CD1 4.15Å; L847-I866 HydrophobicContact CD1-CG1 4.23Å; L847-I866 HydrophobicContact CD1-CG2 3.63Å; L847-I866 HydrophobicContact CD2-CG1 4.3Å; L847-I866 HydrophobicContact CG-CG2 4.14Å; L847-T869 HydrophobicContact CD1-CG2 4.45Å
848	A	95	Very high	80.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.4	172.6	0	0	0	0	0	112.4	L795 I796 I797 V867 A868	L795-A848 HydrophobicContact CD1-CB 4.47Å; I796-A848 CarbonylContact O-C 3.5Å; I796-A848 VanDerWaalsContact O-CA 3.32Å; I796-A848 WeakPolarHBondContact O-CA 3.48Å; I797-A848 HydrophobicContact CG1-CB 4.48Å; A848-V867 WeakPolarHBondContact O-CB 3.27Å; A848-V867 PolarHBondContact O-N 2.97Å; A848-A868 HydrophobicContact CB-CB 3.92Å; A848-A868 PolarHBondContact N-O 2.93Å; A848-A868 PolarHBondContact O-N 2.87Å
849	V	91.9	Very high	77.7	Confident	4 Å²	4	46 Å²	46	2%	0.024	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.1	180	173	0	0	0	0	108.8	I137 I796 L847 T851	I137-V849 HydrophobicContact CD1-CG2 3.84Å; I796-V849 HydrophobicContact CB-CB 4.48Å; I796-V849 WeakPolarHBondContact CB-O 3.43Å; I796-V849 PolarHBondContact N-O 2.96Å; I796-V849 PolarHBondContact O-N 2.96Å; L847-V849 HydrophobicContact CD2-CG2 3.99Å; V849-T851 WeakPolarHBondContact CG1-O 3.41Å
850	Q	88	Confident	75.6	Confident	38 Å²	38	47 Å²	47	18%	0.178	26%	0.256	C	S	.	.	S	Bend	trans	-95.1	-30.8	180	173.9	164	95.1	0	0	113.3	Y785 L795 V867 T989	Y785-Q850 PolarHBondContact OH-OE1 2.91Å; L795-Q850 HydrophobicContact CD2-CB 4.31Å; Q850-V867 HydrophobicContact CB-CG2 3.73Å; Q850-T989 HydrophobicContact CG-CG2 3.79Å
851	T	83.4	Confident	73.7	Confident	33 Å²	33	50 Å²	50	20%	0.202	28%	0.281	C	S	.	.			trans	-156.1	132.7	179.5	-62.2	0	0	0	0	108.5	V849 T856 Q992	V849-T851 WeakPolarHBondContact CG1-O 3.41Å; T851-T856 HydrophobicContact CG2-CG2 4.24Å; T851-Q992 PolarHBondContact OG1-NE2 3.17Å
852	V	77.5	Confident	72.1	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.018	31%	0.307	C	S	.	.			trans	-85.4	-46.5	174.4	169.2	0	0	0	0	110.6	I137 I796 E854	I137-V852 HydrophobicContact CG2-CB 4.46Å; I137-V852 HydrophobicContact CG2-CG1 4.13Å; I137-V852 HydrophobicContact CG2-CG2 4.24Å; I796-V852 HydrophobicContact CD1-CG2 3.86Å; V852-E854 PolarHBondContact O-N 2.69Å
853	S	68.1	Low	71.1	Confident	6 Å²	6	54.9 Å²	54.9	4%	0.042	30%	0.297	C	S	.	.			trans	-41.9	110.1	-171.8	-169.4	0	0	0	0	116	V855 T856 V857 A982 K983	S853-V855 PolarHBondContact O-N 2.64Å; S853-V855 VanDerWaalsContact O-N 3.16Å; S853-T856 PolarHBondContact O-N 3.39Å; S853-T856 VanDerWaalsContact O-N 3.09Å; S853-V857 PolarHBondContact O-N 2.74Å; S853-A982 WeakPolarHBondContact CA-O 3.45Å; S853-K983 WeakPolarHBondContact CB-O 3.45Å; S853-K983 WeakPolarHBondContact OG-CA 3.25Å; S853-K983 PolarHBondContact OG-O 3.29Å
854	E	60.8	Low	70.7	Confident	56 Å²	56	49.4 Å²	49.4	26%	0.262	27%	0.267	S	S	.	.	H	α-helix	trans	-52	-37.5	177.2	-89.2	-155.6	173.4	0	0	113.5	V852 T856 V857 R858 A982	V852-E854 PolarHBondContact O-N 2.69Å; E854-T856 VanDerWaalsContact C-N 3.28Å; E854-T856 PolarHBondContact O-N 3.03Å; E854-V857 CarbonylContact O-C 3.6Å; E854-V857 WeakPolarHBondContact O-CA 3.43Å; E854-V857 WeakPolarHBondContact O-CB 3.18Å; E854-V857 PolarHBondContact O-N 2.8Å; E854-R858 PolarHBondContact O-N 2.91Å; E854-R858 IonicContact OE2-NH2 2.64Å; E854-R858 PolarHBondContact OE2-NH2 3.02Å; E854-A982 HydrophobicContact CG-CB 4.21Å; E854-A982 PolarHBondContact N-O 3.07Å
855	V	54.5	Low	70.4	Confident	75 Å²	75	49.4 Å²	49.4	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-39.3	-177.2	175.8	0	0	0	0	110.6	S853 V857 R858 K983	S853-V855 PolarHBondContact O-N 2.64Å; S853-V855 VanDerWaalsContact O-N 3.16Å; V855-V857 VanDerWaalsContact C-N 3.3Å; V855-R858 PolarHBondContact O-N 3.13Å; V855-K983 HydrophobicContact CG2-CD 3.87Å; V855-K983 HydrophobicContact CG2-CG 3.99Å
856	T	52.2	Low	70.4	Confident	56 Å²	56	48.6 Å²	48.6	34%	0.344	26%	0.256	S	S	.	.	H	α-helix	trans	-69.5	-33.1	173.4	-51.1	0	0	0	0	110.9	T851 S853 E854 C860	T851-T856 HydrophobicContact CG2-CG2 4.24Å; S853-T856 PolarHBondContact O-N 3.39Å; S853-T856 VanDerWaalsContact O-N 3.09Å; E854-T856 VanDerWaalsContact C-N 3.28Å; E854-T856 PolarHBondContact O-N 3.03Å; T856-C860 WeakPolarHBondContact O-CB 3.17Å; T856-C860 PolarHBondContact O-N 3.04Å; T856-C860 PolarHBondContact O-SG 3.35Å
857	V	48.4	Very low	70.3	Confident	34 Å²	34	48.7 Å²	48.7	21%	0.206	26%	0.257	C	S	.	.	H	α-helix	trans	-68.6	-37.4	175	179.8	0	0	0	0	111.6	S853 E854 V855 C859 C860 A861 R865	S853-V857 PolarHBondContact O-N 2.74Å; E854-V857 CarbonylContact O-C 3.6Å; E854-V857 WeakPolarHBondContact O-CA 3.43Å; E854-V857 WeakPolarHBondContact O-CB 3.18Å; E854-V857 PolarHBondContact O-N 2.8Å; V855-V857 VanDerWaalsContact C-N 3.3Å; V857-C859 VanDerWaalsContact C-N 3.3Å; V857-C859 PolarHBondContact O-N 3.11Å; V857-C860 CarbonylContact O-C 3.59Å; V857-C860 WeakPolarHBondContact O-CA 3.44Å; V857-C860 PolarHBondContact O-N 3.46Å; V857-A861 WeakPolarHBondContact O-CA 3.42Å; V857-A861 WeakPolarHBondContact O-CB 3.36Å; V857-A861 PolarHBondContact O-N 2.88Å; V857-R865 HydrophobicContact CG2-CG 4.27Å
858	R	42.2	Very low	70.3	Confident	186 Å²	186	48.7 Å²	48.7	70%	0.702	26%	0.257	S	S	*	.	H	α-helix	trans	-58.2	-41.6	177.1	-69.8	-175	-168.5	-167.1	3.4	112.1	E854 V855 C860	E854-R858 PolarHBondContact O-N 2.91Å; E854-R858 IonicContact OE2-NH2 2.64Å; E854-R858 PolarHBondContact OE2-NH2 3.02Å; V855-R858 PolarHBondContact O-N 3.13Å; R858-C860 PolarHBondContact O-N 3.02Å
859	C	35.8	Very low	70.4	Confident	116 Å²	116	50.4 Å²	50.4	78%	0.784	27%	0.267	S	S	*	.	H	α-helix	trans	-68.7	-20.7	172.3	-56.2	0	0	0	0	113.7	V857	V857-C859 VanDerWaalsContact C-N 3.3Å; V857-C859 PolarHBondContact O-N 3.11Å
860	C	46.3	Very low	70.5	Confident	41 Å²	41	50.7 Å²	50.7	28%	0.277	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	15.1	-176.7	-65.2	0	0	0	0	113.8	T856 V857 R858 K862 Q863	T856-C860 WeakPolarHBondContact O-CB 3.17Å; T856-C860 PolarHBondContact O-N 3.04Å; T856-C860 PolarHBondContact O-SG 3.35Å; V857-C860 CarbonylContact O-C 3.59Å; V857-C860 WeakPolarHBondContact O-CA 3.44Å; V857-C860 PolarHBondContact O-N 3.46Å; R858-C860 PolarHBondContact O-N 3.02Å; C860-K862 PolarHBondContact O-N 3.14Å; C860-Q863 WeakPolarHBondContact O-CB 3.46Å; C860-Q863 PolarHBondContact O-N 3.33Å
861	A	49.2	Very low	70.9	Confident	65 Å²	65	51.2 Å²	51.2	54%	0.537	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-8.8	-152.7	0	0	0	0	0	116.3	V857 Q863	V857-A861 WeakPolarHBondContact O-CA 3.42Å; V857-A861 WeakPolarHBondContact O-CB 3.36Å; V857-A861 PolarHBondContact O-N 2.88Å; A861-Q863 VanDerWaalsContact C-N 3.31Å
862	K	58	Low	71.5	Confident	203 Å²	203	49.6 Å²	49.6	88%	0.883	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	2.8	174.2	-55.2	-179.1	-178.3	-179.4	0	112.9	C860	C860-K862 PolarHBondContact O-N 3.14Å
863	Q	71	Confident	72.3	Confident	75 Å²	75	51.2 Å²	51.2	35%	0.35	28%	0.275	S	S	.	.	S	Bend	trans	-108.6	131.1	-177	-68.9	169.3	56.7	0	0	111.7	C860 A861 R865	C860-Q863 WeakPolarHBondContact O-CB 3.46Å; C860-Q863 PolarHBondContact O-N 3.33Å; A861-Q863 VanDerWaalsContact C-N 3.31Å; Q863-R865 PolarHBondContact O-N 3.12Å
864	F	86.4	Confident	73.2	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.026	28%	0.279	C	S	.	.			trans	-63.9	124.3	174.3	-170.2	-108.6	0	0	0	110.9	M162 F165 E166 N169 H782 W784 Y785 I866	M162-F864 HydrophobicContact CE-CB 3.74Å; M162-F864 HydrophobicContact CE-CD2 3.92Å; M162-F864 HydrophobicContact CE-CG 4.32Å; F165-F864 HydrophobicContact CB-CE2 4.21Å; E166-F864 HydrophobicContact CB-CE2 4.24Å; E166-F864 HydrophobicContact CG-CD2 3.57Å; E166-F864 HydrophobicContact CG-CE2 3.29Å; E166-F864 HydrophobicContact CG-CG 4.4Å; E166-F864 HydrophobicContact CG-CZ 3.91Å; N169-F864 HydrophobicContact CB-CZ 4.39Å; H782-F864 HydrophobicContact CB-CE1 4.5Å; H782-F864 AromaticContact CE1-CE1 3.25Å; H782-F864 WeakPolarHBondContact CE1-CE1 3.4Å; H782-F864 AromaticContact CE1-CZ 3.59Å; H782-F864 AromaticContact CG-CE1 3.65Å; H782-F864 AromaticContact ND1-CD1 3.52Å; H782-F864 AromaticContact ND1-CE1 3Å; H782-F864 WeakPolarHBondContact ND1-CE1 3.36Å; H782-F864 AromaticContact ND1-CZ 3.84Å; W784-F864 HydrophobicContact CB-CB 4.39Å; W784-F864 HydrophobicContact CB-CD1 4.05Å; W784-F864 HydrophobicContact CB-CD2 4.46Å; W784-F864 HydrophobicContact CB-CE1 4.44Å; W784-F864 HydrophobicContact CB-CG 4.08Å; W784-F864 HydrophobicContact CE3-CD2 4.22Å; W784-F864 HydrophobicContact CE3-CE1 4.39Å; W784-F864 AromaticContact CE3-CE2 3.64Å; W784-F864 HydrophobicContact CE3-CE2 3.64Å; W784-F864 AromaticContact CE3-CZ 3.74Å; W784-F864 HydrophobicContact CE3-CZ 3.74Å; W784-F864 HydrophobicContact CZ3-CE2 4.22Å; W784-F864 HydrophobicContact CZ3-CZ 4.35Å; Y785-F864 WeakPolarHBondContact CD2-O 3.06Å; F864-I866 HydrophobicContact CD1-CB 4.1Å; F864-I866 WeakPolarHBondContact CD1-O 3.36Å; F864-I866 HydrophobicContact CE1-CB 3.54Å; F864-I866 HydrophobicContact CE1-CD1 4.36Å; F864-I866 HydrophobicContact CE1-CG1 4.41Å; F864-I866 HydrophobicContact CE1-CG2 4.18Å; F864-I866 HydrophobicContact CZ-CB 4.13Å; F864-I866 HydrophobicContact CZ-CD1 4.08Å; F864-I866 PolarHBondContact O-N 2.92Å
865	R	87.1	Confident	74.5	Confident	23 Å²	23	51.3 Å²	51.3	9%	0.087	28%	0.28	C	S	.	.	S	Bend	trans	-70.1	-28.3	-172.7	-68.6	-176.3	-77.6	-157.1	-8.1	113.8	N135 I137 E163 E166 V857 Q863 V867	N135-R865 PolarHBondContact O-NH1 3.49Å; I137-R865 HydrophobicContact CD1-CB 3.67Å; E163-R865 IonicContact OE1-CZ 2.81Å; E163-R865 IonicContact OE1-NH1 2.78Å; E163-R865 PolarHBondContact OE1-NH1 3.35Å; E163-R865 IonicContact OE1-NH2 3.17Å; E163-R865 PolarHBondContact OE1-NH2 2.95Å; E166-R865 WeakPolarHBondContact OE1-CB 3.33Å; E166-R865 PolarHBondContact OE1-N 2.88Å; E166-R865 IonicContact OE1-NE 3.69Å; E166-R865 IonicContact OE2-CZ 3.44Å; E166-R865 IonicContact OE2-NE 2.7Å; E166-R865 PolarHBondContact OE2-NE 3.07Å; E166-R865 IonicContact OE2-NH2 2.69Å; E166-R865 PolarHBondContact OE2-NH2 2.96Å; V857-R865 HydrophobicContact CG2-CG 4.27Å; Q863-R865 PolarHBondContact O-N 3.12Å; R865-V867 WeakPolarHBondContact O-CG2 3.45Å
866	I	92	Very high	76.1	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	125.9	-179.4	-61.7	162	0	0	0	110.1	I137 E166 N169 I170 L847 F864	I137-I866 HydrophobicContact CD1-CG1 4.06Å; E166-I866 HydrophobicContact CB-CD1 3.79Å; E166-I866 HydrophobicContact CG-CD1 4.06Å; E166-I866 HydrophobicContact CG-CG1 4.43Å; E166-I866 VanDerWaalsContact O-CD1 3.24Å; E166-I866 WeakPolarHBondContact O-CD1 3.45Å; N169-I866 HydrophobicContact CB-CD1 4.12Å; I170-I866 HydrophobicContact CD1-CD1 4.14Å; I170-I866 HydrophobicContact CG1-CD1 3.73Å; L847-I866 HydrophobicContact CD1-CD1 4.15Å; L847-I866 HydrophobicContact CD1-CG1 4.23Å; L847-I866 HydrophobicContact CD1-CG2 3.63Å; L847-I866 HydrophobicContact CD2-CG1 4.3Å; L847-I866 HydrophobicContact CG-CG2 4.14Å; F864-I866 HydrophobicContact CD1-CB 4.1Å; F864-I866 WeakPolarHBondContact CD1-O 3.36Å; F864-I866 HydrophobicContact CE1-CB 3.54Å; F864-I866 HydrophobicContact CE1-CD1 4.36Å; F864-I866 HydrophobicContact CE1-CG1 4.41Å; F864-I866 HydrophobicContact CE1-CG2 4.18Å; F864-I866 HydrophobicContact CZ-CB 4.13Å; F864-I866 HydrophobicContact CZ-CD1 4.08Å; F864-I866 PolarHBondContact O-N 2.92Å
867	V	93.6	Very high	77.6	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.012	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-40	-161.8	174.6	0	0	0	0	112.2	H782 Y785 L789 L795 A848 Q850 R865	H782-V867 PolarHBondContact N-O 3.37Å; Y785-V867 HydrophobicContact CD1-CB 4.48Å; Y785-V867 HydrophobicContact CD1-CG1 3.96Å; Y785-V867 HydrophobicContact CD2-CG2 4Å; Y785-V867 HydrophobicContact CE1-CG1 3.75Å; Y785-V867 HydrophobicContact CE1-CG2 4.47Å; Y785-V867 HydrophobicContact CE2-CG2 3.8Å; Y785-V867 HydrophobicContact CG-CB 4.48Å; Y785-V867 HydrophobicContact CG-CG1 4.43Å; Y785-V867 HydrophobicContact CG-CG2 4.45Å; L789-V867 HydrophobicContact CD1-CG1 3.75Å; L789-V867 HydrophobicContact CD2-CG1 3.19Å; L789-V867 HydrophobicContact CG-CG1 4.11Å; L795-V867 HydrophobicContact CD2-CG1 4.25Å; A848-V867 WeakPolarHBondContact O-CB 3.27Å; A848-V867 PolarHBondContact O-N 2.97Å; Q850-V867 HydrophobicContact CB-CG2 3.73Å; R865-V867 WeakPolarHBondContact O-CG2 3.45Å
868	A	95.4	Very high	79.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	159.4	177.6	0	0	0	0	0	111	I779 K780 L789 A848	I779-A868 HydrophobicContact CD1-CB 3.81Å; I779-A868 HydrophobicContact CG1-CB 3.82Å; K780-A868 VanDerWaalsContact O-CA 3.27Å; K780-A868 WeakPolarHBondContact O-CA 3.47Å; K780-A868 VanDerWaalsContact O-CB 3.31Å; K780-A868 WeakPolarHBondContact O-CB 3.32Å; L789-A868 HydrophobicContact CD1-CB 3.78Å; A848-A868 HydrophobicContact CB-CB 3.92Å; A848-A868 PolarHBondContact N-O 2.93Å; A848-A868 PolarHBondContact O-N 2.87Å
869	T	96.3	Very high	81.6	Confident	36 Å²	36	47.7 Å²	47.7	22%	0.221	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.5	169.7	60.2	0	0	0	0	109.4	V173 K780 L847	V173-T869 HydrophobicContact CG2-CG2 3.56Å; K780-T869 PolarHBondContact N-O 2.95Å; K780-T869 PolarHBondContact O-N 3.48Å; L847-T869 HydrophobicContact CD1-CG2 4.45Å
870	G	95.1	Very high	84.3	Confident	10 Å²	10	48.6 Å²	48.6	10%	0.103	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	178.3	179.6	0	0	0	0	0	114.5	R778 G845 F846	R778-G870 CarbonylContact O-C 3.58Å; R778-G870 WeakPolarHBondContact O-CA 3.41Å; G845-G870 WeakPolarHBondContact CA-O 3.03Å; F846-G870 VanDerWaalsContact CD1-C 3.49Å; F846-G870 WeakPolarHBondContact CD1-O 3.46Å; F846-G870 PolarHBondContact N-O 2.96Å; F846-G870 PolarHBondContact O-N 2.88Å
871	T	96.1	Very high	86.6	Confident	49 Å²	49	46.7 Å²	46.7	30%	0.301	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148.9	173.2	60.3	0	0	0	0	110.4	A777 R778 T844	A777-T871 CarbonylContact C-O 3.53Å; A777-T871 WeakPolarHBondContact CA-O 3.16Å; R778-T871 PolarHBondContact N-O 3.14Å; R778-T871 PolarHBondContact O-N 3.41Å; T844-T871 CarbonylContact O-C 3.4Å; T844-T871 WeakPolarHBondContact O-CA 3.48Å
872	V	95.7	Very high	88.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	138.1	169.7	179.4	0	0	0	0	109.4	V775 L799 N843 T844 L875	V775-V872 HydrophobicContact CG1-CG1 4.01Å; V775-V872 HydrophobicContact CG1-CG2 4.08Å; L799-V872 HydrophobicContact CD1-CG2 3.63Å; N843-V872 WeakPolarHBondContact CA-O 3.37Å; N843-V872 PolarHBondContact N-O 3.03Å; T844-V872 PolarHBondContact O-N 3.39Å; V872-L875 HydrophobicContact CG1-CD2 4.01Å; V872-L875 HydrophobicContact CG1-CG 4.46Å
873	L	93.5	Very high	90.6	Very high	36 Å²	36	40.1 Å²	40.1	19%	0.188	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-51.2	174.3	-65.3	176.3	0	0	0	111.4	Q776 R778 Q842	Q776-L873 WeakPolarHBondContact O-CB 3.28Å; Q776-L873 PolarHBondContact O-N 2.79Å; R778-L873 HydrophobicContact CB-CD1 3.98Å; R778-L873 HydrophobicContact CB-CD2 4.05Å; R778-L873 HydrophobicContact CB-CG 3.98Å; Q842-L873 VanDerWaalsContact CD-O 3.31Å; Q842-L873 WeakPolarHBondContact CG-O 3.46Å; Q842-L873 PolarHBondContact OE1-O 3.29Å
874	G	89	Confident	91.8	Very high	12 Å²	12	40.3 Å²	40.3	12%	0.124	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	163.4	-170.2	0	0	0	0	0	112.1	Q776	Q776-G874 PolarHBondContact N-O 3.11Å; Q776-G874 PolarHBondContact O-N 2.72Å; Q776-G874 VanDerWaalsContact O-N 3.11Å
875	L	87.7	Confident	92.2	Very high	53 Å²	53	43.7 Å²	43.7	28%	0.277	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	88.1	-166.5	-63.8	172.6	0	0	0	109	V775 T839 T840 V872	V775-L875 HydrophobicContact CG1-CD2 4.29Å; V775-L875 HydrophobicContact CG2-CD2 4.25Å; T839-L875 HydrophobicContact CG2-CB 4.22Å; T839-L875 HydrophobicContact CG2-CD1 3.43Å; T839-L875 VanDerWaalsContact CG2-CD1 3.43Å; T839-L875 HydrophobicContact CG2-CD2 4.04Å; T839-L875 HydrophobicContact CG2-CG 4.09Å; T840-L875 WeakPolarHBondContact O-CD1 3.38Å; V872-L875 HydrophobicContact CG1-CD2 4.01Å; V872-L875 HydrophobicContact CG1-CG 4.46Å
876	D	86.9	Confident	92.6	Very high	68 Å²	68	48.3 Å²	48.3	36%	0.364	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	145.7	-168.3	-58.3	-41.2	0	0	0	112.1	Y774 S878 V879	Y774-D876 WeakPolarHBondContact CB-O 3.25Å; Y774-D876 PolarHBondContact N-O 2.96Å; Y774-D876 PolarHBondContact O-N 2.31Å; Y774-D876 VanDerWaalsContact O-N 3.12Å; D876-S878 PolarHBondContact O-N 3.33Å; D876-V879 HydrophobicContact CB-CG2 3.71Å
877	A	84.9	Confident	92.8	Very high	96 Å²	96	50.2 Å²	50.2	79%	0.793	28%	0.283	S	S	*	.	S	Bend	trans	-69	-22.7	168.3	0	0	0	0	0	112.5	Y774	Y774-A877 WeakPolarHBondContact CD2-O 3.37Å; Y774-A877 WeakPolarHBondContact CE2-O 3.47Å
878	S	86.4	Confident	92.9	Very high	89 Å²	89	53.7 Å²	53.7	62%	0.622	30%	0.304	S	S	*	.			trans	-155.8	140	174.6	71.7	0	0	0	0	111.5	D876	D876-S878 PolarHBondContact O-N 3.33Å
879	V	87.6	Confident	92.9	Very high	21 Å²	21	53.8 Å²	53.8	13%	0.127	31%	0.305	C	S	.	.			trans	-127.2	119.7	-179.5	-177.5	0	0	0	0	110.8	T834 D876 V881	T834-V879 HydrophobicContact CG2-CB 3.87Å; T834-V879 HydrophobicContact CG2-CG1 4.03Å; T834-V879 HydrophobicContact CG2-CG2 3.9Å; D876-V879 HydrophobicContact CB-CG2 3.71Å; V879-V881 HydrophobicContact CG1-CG2 4.06Å; V879-V881 PolarHBondContact O-N 2.79Å
880	L	92.1	Very high	93	Very high	136 Å²	136	54.6 Å²	54.6	71%	0.712	31%	0.31	S	S	*	.			trans	-78.9	81.2	178.7	-66.4	178.8	0	0	0	112.4
881	V	94.5	Very high	93	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	123.5	168	-176.5	0	0	0	0	109.8	V809 M821 V879 L962 V964	V809-V881 HydrophobicContact CG1-CG1 3.94Å; M821-V881 HydrophobicContact CB-CG1 4Å; V879-V881 HydrophobicContact CG1-CG2 4.06Å; V879-V881 PolarHBondContact O-N 2.79Å; V881-L962 PolarHBondContact O-N 3.23Å; V881-V964 HydrophobicContact CG2-CG2 4.39Å
882	V	95.9	Very high	93	Very high	24 Å²	24	55.3 Å²	55.3	15%	0.145	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.4	-177.9	-67	0	0	0	0	113	R818 N819 R820 M821 W959 V960	R818-V882 HydrophobicContact CB-CG2 4.13Å; N819-V882 PolarHBondContact O-N 2.96Å; R820-V882 CarbonylContact C-O 3.44Å; R820-V882 WeakPolarHBondContact CA-O 3.34Å; M821-V882 PolarHBondContact N-O 2.85Å; V882-W959 HydrophobicContact CB-CB 4.49Å; V882-W959 HydrophobicContact CG2-CE3 4.06Å; V882-V960 CarbonylContact C-O 3.6Å
883	K	96	Very high	93	Very high	105 Å²	105	60.7 Å²	60.7	46%	0.457	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.6	172.6	-177.8	180	172.8	-168.3	0	110	M821 L885 V960 L962	M821-K883 HydrophobicContact CB-CB 4.25Å; M821-K883 HydrophobicContact SD-CB 4.1Å; M821-K883 HydrophobicContact SD-CD 3.9Å; M821-K883 HydrophobicContact SD-CG 3.81Å; K883-L885 PolarHBondContact O-N 3.41Å; K883-V960 PolarHBondContact N-O 2.92Å; K883-V960 PolarHBondContact O-N 2.73Å; K883-L962 HydrophobicContact CB-CB 4.45Å; K883-L962 HydrophobicContact CD-CD1 4.27Å
884	K	95.7	Very high	93.1	Very high	80 Å²	80	60.6 Å²	60.6	35%	0.348	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	120.8	176.4	-166.3	170.9	-163	150.6	0	110.8	W959	K884-W959 HydrophobicContact CB-CE3 3.89Å; K884-W959 HydrophobicContact CB-CH2 4.45Å; K884-W959 HydrophobicContact CB-CZ3 3.75Å; K884-W959 HydrophobicContact CD-CH2 3.92Å; K884-W959 HydrophobicContact CD-CZ2 4.4Å; K884-W959 HydrophobicContact CD-CZ3 4.06Å; K884-W959 HydrophobicContact CG-CE3 4.13Å; K884-W959 HydrophobicContact CG-CH2 4.23Å; K884-W959 HydrophobicContact CG-CZ3 3.97Å
885	L	94.9	Very high	93.4	Very high	77 Å²	77	64.3 Å²	64.3	40%	0.403	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	154.8	170.4	-174.1	68	0	0	0	109	K883 L887 T958 V960	K883-L885 PolarHBondContact O-N 3.41Å; L885-L887 HydrophobicContact CD2-CD2 3.89Å; L885-L887 HydrophobicContact CG-CD2 4.31Å; L885-T958 WeakPolarHBondContact CB-OG1 3.29Å; L885-T958 PolarHBondContact N-O 3.09Å; L885-T958 PolarHBondContact O-N 2.92Å; L885-V960 HydrophobicContact CB-CG2 3.94Å; L885-V960 HydrophobicContact CD2-CG2 3.93Å
886	K	95.4	Very high	93.7	Very high	120 Å²	120	70.5 Å²	70.5	52%	0.522	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	119.7	166.4	-69.8	-175.4	-175.9	178.4	0	107.1	T888 V956	K886-T888 HydrophobicContact CB-CG2 4.5Å; K886-V956 WeakPolarHBondContact CA-O 3.08Å
887	L	96	Very high	94.1	Very high	40 Å²	40	73.4 Å²	73.4	21%	0.209	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	129.6	163.9	-53.5	-178.7	0	0	0	106.6	L885 M904 F905 F914 F955 V956 T958	L885-L887 HydrophobicContact CD2-CD2 3.89Å; L885-L887 HydrophobicContact CG-CD2 4.31Å; L887-M904 HydrophobicContact CB-CG 3.74Å; L887-M904 HydrophobicContact CB-SD 4.25Å; L887-F905 HydrophobicContact CD1-CD1 4.41Å; L887-F905 HydrophobicContact CD1-CE1 3.55Å; L887-F905 HydrophobicContact CD1-CZ 4.13Å; L887-F914 HydrophobicContact CD1-CE1 4.47Å; L887-F914 HydrophobicContact CD1-CE2 4.19Å; L887-F914 HydrophobicContact CD1-CZ 4.06Å; L887-F955 CarbonylContact O-C 3.59Å; L887-F955 WeakPolarHBondContact O-CA 3.29Å; L887-F955 VanDerWaalsContact O-CB 3.3Å; L887-F955 WeakPolarHBondContact O-CB 3.41Å; L887-V956 HydrophobicContact CB-CB 4.49Å; L887-V956 PolarHBondContact N-O 3.22Å; L887-V956 PolarHBondContact O-N 3.4Å; L887-T958 HydrophobicContact CD1-CG2 4.38Å
888	T	96.5	Very high	94.7	Very high	75 Å²	75	69.8 Å²	69.8	46%	0.46	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135	-174.1	47	0	0	0	0	109.8	K886 D903 M904 I953 V954 F955	K886-T888 HydrophobicContact CB-CG2 4.5Å; T888-D903 VanDerWaalsContact O-O 3.11Å; T888-M904 WeakPolarHBondContact O-CA 3.44Å; T888-I953 HydrophobicContact CG2-CG2 4.2Å; T888-V954 CarbonylContact C-O 3.44Å; T888-V954 WeakPolarHBondContact CA-O 3.39Å; T888-F955 HydrophobicContact CG2-CB 4.14Å
889	G	95.8	Very high	95.1	Very high	2 Å²	2	65.5 Å²	65.5	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	164	177	0	0	0	0	0	112.3	K902 V954	G889-K902 CarbonylContact C-O 3.58Å; G889-K902 WeakPolarHBondContact CA-O 3.31Å; G889-V954 PolarHBondContact N-O 2.87Å; G889-V954 PolarHBondContact O-N 2.85Å
890	T	96.6	Very high	95.6	Very high	53 Å²	53	65.4 Å²	65.4	33%	0.325	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.4	180	69.8	0	0	0	0	110.9	I901 K902 D903	T890-I901 WeakPolarHBondContact O-CA 3.34Å; T890-K902 PolarHBondContact N-O 3.21Å; T890-K902 PolarHBondContact O-N 3.24Å; T890-D903 PolarHBondContact OG1-OD2 3.32Å
891	P	96.8	Very high	95.8	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.032	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	128	171.1	30.5	-32.7	0	0	0	109.8	V894 L900 I948 M950 D952	P891-V894 HydrophobicContact CB-CG2 3.95Å; P891-L900 WeakPolarHBondContact CA-O 2.99Å; P891-I948 HydrophobicContact CB-CD1 3.71Å; P891-I948 HydrophobicContact CG-CD1 4.04Å; P891-M950 WeakPolarHBondContact O-CE 3.41Å; P891-D952 WeakPolarHBondContact CD-O 3.35Å
892	Y	94.9	Very high	95.8	Very high	68 Å²	68	62.3 Å²	62.3	27%	0.267	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-16	174.8	78.1	-89.7	0	0	0	113.5	L900 K902	Y892-L900 HydrophobicContact CD1-CB 3.95Å; Y892-L900 VanDerWaalsContact CD1-O 3.28Å; Y892-L900 WeakPolarHBondContact CD1-O 3.33Å; Y892-L900 HydrophobicContact CE1-CB 3.31Å; Y892-L900 HydrophobicContact CE2-CB 4.23Å; Y892-L900 HydrophobicContact CE2-CD1 4.21Å; Y892-L900 VanDerWaalsContact CZ-CB 3.49Å; Y892-L900 PolarHBondContact N-O 3.48Å; Y892-L900 WeakPolarHBondContact OH-CD1 3.39Å; Y892-K902 HydrophobicContact CD1-CB 3.97Å; Y892-K902 HydrophobicContact CD1-CD 4.24Å; Y892-K902 HydrophobicContact CD1-CG 3.98Å; Y892-K902 HydrophobicContact CE1-CB 4.48Å; Y892-K902 HydrophobicContact CG-CD 4.3Å; Y892-K902 HydrophobicContact CG-CG 4.44Å
893	K	95.7	Very high	95.6	Very high	113 Å²	113	65.6 Å²	65.6	49%	0.491	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	125.8	172.9	-165.5	167.2	-173.7	169.4	0	109.8	F895 A899 L900	K893-F895 HydrophobicContact CD-CZ 3.95Å; K893-F895 HydrophobicContact CG-CE2 4.27Å; K893-F895 HydrophobicContact CG-CZ 4.08Å; K893-A899 CarbonylContact O-C 3.59Å; K893-A899 WeakPolarHBondContact O-CA 3.12Å; K893-A899 WeakPolarHBondContact O-CB 3.42Å; K893-L900 HydrophobicContact CB-CB 4.21Å; K893-L900 HydrophobicContact CB-CD1 4.13Å; K893-L900 HydrophobicContact CB-CG 4.21Å; K893-L900 HydrophobicContact CD-CD1 4.17Å; K893-L900 PolarHBondContact N-O 3.09Å; K893-L900 PolarHBondContact O-N 2.99Å
894	V	96.2	Very high	95.6	Very high	34 Å²	34	61.4 Å²	61.4	21%	0.206	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.8	-177	-173.9	0	0	0	0	110.6	P891 A899 K947 I948 M950	P891-V894 HydrophobicContact CB-CG2 3.95Å; V894-A899 HydrophobicContact CG2-CB 4.24Å; V894-K947 HydrophobicContact CG1-CD 4.46Å; V894-K947 HydrophobicContact CG1-CG 3.78Å; V894-I948 HydrophobicContact CG1-CG1 4Å; V894-I948 WeakPolarHBondContact CG1-O 3.49Å; V894-I948 HydrophobicContact CG2-CD1 4.41Å; V894-I948 HydrophobicContact CG2-CG1 4.16Å; V894-M950 HydrophobicContact CG2-SD 4.49Å
895	F	95.4	Very high	95.6	Very high	90 Å²	90	58.5 Å²	58.5	40%	0.395	28%	0.281	S	S	.	.			trans	-98.8	-136.4	178.4	-58.3	-83.8	0	0	0	110.7	K893 S898 L900 K947	K893-F895 HydrophobicContact CD-CZ 3.95Å; K893-F895 HydrophobicContact CG-CE2 4.27Å; K893-F895 HydrophobicContact CG-CZ 4.08Å; F895-S898 WeakPolarHBondContact CB-O 3.43Å; F895-S898 PolarHBondContact N-O 3.1Å; F895-L900 HydrophobicContact CE2-CD1 4.41Å; F895-L900 HydrophobicContact CE2-CD2 4.4Å; F895-L900 HydrophobicContact CE2-CG 4.08Å; F895-K947 WeakPolarHBondContact O-CD 3.32Å; F895-K947 VanDerWaalsContact O-CE 3.24Å; F895-K947 WeakPolarHBondContact O-CE 3.36Å
896	K	94.5	Very high	95.6	Very high	183 Å²	183	59 Å²	59	80%	0.796	29%	0.291	S	S	*	.	S	Bend	trans	-81.2	-77.7	170.3	-66.3	-178.5	-179.1	177.4	0	110.4	K947	K896-K947 VanDerWaalsContact O-CA 3.31Å; K896-K947 WeakPolarHBondContact O-CA 3.25Å; K896-K947 VanDerWaalsContact O-CB 3.28Å; K896-K947 WeakPolarHBondContact O-CB 3.44Å
897	K	95.3	Very high	95.5	Very high	130 Å²	130	55.3 Å²	55.3	57%	0.565	28%	0.28	S	S	*	.	S	Bend	trans	-109.5	17.9	179.4	-66.5	-161.4	179.1	-152	0	114	T943 F944 E945	K897-T943 CarbonylContact O-C 3.48Å; K897-T943 WeakPolarHBondContact O-CA 3.37Å; K897-F944 PolarHBondContact O-N 2.89Å; K897-E945 WeakPolarHBondContact CD-O 3.31Å; K897-E945 WeakPolarHBondContact CE-O 3.26Å; K897-E945 PolarHBondContact NZ-O 2.69Å
898	S	96.1	Very high	95.4	Very high	19 Å²	19	55.2 Å²	55.2	13%	0.133	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	154	175.2	55.3	0	0	0	0	111.3	F895 A942	F895-S898 WeakPolarHBondContact CB-O 3.43Å; F895-S898 PolarHBondContact N-O 3.1Å; S898-A942 CarbonylContact C-O 3.57Å; S898-A942 WeakPolarHBondContact CA-O 3.4Å; S898-A942 WeakPolarHBondContact CB-O 3.36Å
899	A	96.3	Very high	95.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	156.8	173.8	0	0	0	0	0	110.3	K893 V894 A942 F944 I948	K893-A899 CarbonylContact O-C 3.59Å; K893-A899 WeakPolarHBondContact O-CA 3.12Å; K893-A899 WeakPolarHBondContact O-CB 3.42Å; V894-A899 HydrophobicContact CG2-CB 4.24Å; A899-A942 PolarHBondContact N-O 2.92Å; A899-A942 PolarHBondContact O-N 3.09Å; A899-F944 HydrophobicContact CB-CE2 4.11Å; A899-I948 HydrophobicContact CB-CD1 3.67Å; A899-I948 HydrophobicContact CB-CG1 4.18Å
900	L	96.2	Very high	95.1	Very high	18 Å²	18	62.1 Å²	62.1	9%	0.094	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.6	167.5	-49.4	-178.9	0	0	0	107.4	P891 Y892 K893 F895 M933 F940 R941	P891-L900 WeakPolarHBondContact CA-O 2.99Å; Y892-L900 HydrophobicContact CD1-CB 3.95Å; Y892-L900 VanDerWaalsContact CD1-O 3.28Å; Y892-L900 WeakPolarHBondContact CD1-O 3.33Å; Y892-L900 HydrophobicContact CE1-CB 3.31Å; Y892-L900 HydrophobicContact CE2-CB 4.23Å; Y892-L900 HydrophobicContact CE2-CD1 4.21Å; Y892-L900 VanDerWaalsContact CZ-CB 3.49Å; Y892-L900 PolarHBondContact N-O 3.48Å; Y892-L900 WeakPolarHBondContact OH-CD1 3.39Å; K893-L900 HydrophobicContact CB-CB 4.21Å; K893-L900 HydrophobicContact CB-CD1 4.13Å; K893-L900 HydrophobicContact CB-CG 4.21Å; K893-L900 HydrophobicContact CD-CD1 4.17Å; K893-L900 PolarHBondContact N-O 3.09Å; K893-L900 PolarHBondContact O-N 2.99Å; F895-L900 HydrophobicContact CE2-CD1 4.41Å; F895-L900 HydrophobicContact CE2-CD2 4.4Å; F895-L900 HydrophobicContact CE2-CG 4.08Å; L900-M933 HydrophobicContact CD2-CG 4.5Å; L900-M933 HydrophobicContact CD2-SD 4.29Å; L900-F940 WeakPolarHBondContact CA-O 3.3Å; L900-R941 HydrophobicContact CD2-CB 3.78Å; L900-R941 HydrophobicContact CD2-CG 4.01Å
901	I	96.6	Very high	95	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	138.4	-173.5	-63.7	166.1	0	0	0	108.7	T890 M904 L919 S939 F940 A942 F944 V954	T890-I901 WeakPolarHBondContact O-CA 3.34Å; I901-M904 HydrophobicContact CG2-CE 4.43Å; I901-L919 HydrophobicContact CD1-CD2 4.23Å; I901-S939 CarbonylContact O-C 3.56Å; I901-S939 WeakPolarHBondContact O-CA 2.94Å; I901-S939 WeakPolarHBondContact O-CB 3.34Å; I901-F940 HydrophobicContact CB-CD1 4.47Å; I901-F940 HydrophobicContact CB-CD2 4.49Å; I901-F940 HydrophobicContact CB-CE1 3.93Å; I901-F940 HydrophobicContact CB-CE2 3.97Å; I901-F940 HydrophobicContact CB-CZ 3.67Å; I901-F940 HydrophobicContact CD1-CE2 3.7Å; I901-F940 HydrophobicContact CD1-CZ 3.86Å; I901-F940 HydrophobicContact CG1-CE2 4.37Å; I901-F940 HydrophobicContact CG1-CZ 4.38Å; I901-F940 HydrophobicContact CG2-CE1 3.77Å; I901-F940 HydrophobicContact CG2-CE2 4.38Å; I901-F940 HydrophobicContact CG2-CZ 3.61Å; I901-F940 PolarHBondContact N-O 3.22Å; I901-F940 PolarHBondContact O-N 2.85Å; I901-A942 HydrophobicContact CD1-CB 3.66Å; I901-F944 HydrophobicContact CD1-CE2 4.1Å; I901-F944 HydrophobicContact CD1-CZ 3.98Å; I901-V954 HydrophobicContact CD1-CB 4.03Å; I901-V954 HydrophobicContact CD1-CG1 3.84Å; I901-V954 HydrophobicContact CD1-CG2 3.89Å; I901-V954 HydrophobicContact CG1-CG2 4.4Å
902	K	94.2	Very high	94.8	Very high	73 Å²	73	62 Å²	62	32%	0.317	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	178	175.5	63.2	172.4	-162.6	75.4	0	111	G889 T890 Y892 M904	G889-K902 CarbonylContact C-O 3.58Å; G889-K902 WeakPolarHBondContact CA-O 3.31Å; T890-K902 PolarHBondContact N-O 3.21Å; T890-K902 PolarHBondContact O-N 3.24Å; Y892-K902 HydrophobicContact CD1-CB 3.97Å; Y892-K902 HydrophobicContact CD1-CD 4.24Å; Y892-K902 HydrophobicContact CD1-CG 3.98Å; Y892-K902 HydrophobicContact CE1-CB 4.48Å; Y892-K902 HydrophobicContact CG-CD 4.3Å; Y892-K902 HydrophobicContact CG-CG 4.44Å; K902-M904 PolarHBondContact O-N 3.11Å; K902-M904 VanDerWaalsContact O-N 3.12Å
903	D	93.4	Very high	94.8	Very high	93 Å²	93	67.3 Å²	67.3	50%	0.497	35%	0.345	S	S	.	.	S	Bend	trans	63.6	8.6	175.3	-34.1	-36.4	0	0	0	116.3	T888 T890	T888-D903 VanDerWaalsContact O-O 3.11Å; T890-D903 PolarHBondContact OG1-OD2 3.32Å
904	M	95.2	Very high	94.8	Very high	16 Å²	16	64.8 Å²	64.8	8%	0.079	33%	0.334	C	S	.	.	S	Bend	trans	-95.4	-30.3	177.3	-169.2	174.5	-69.3	0	0	113.3	L887 T888 I901 K902 F940 V954 V956	L887-M904 HydrophobicContact CB-CG 3.74Å; L887-M904 HydrophobicContact CB-SD 4.25Å; T888-M904 WeakPolarHBondContact O-CA 3.44Å; I901-M904 HydrophobicContact CG2-CE 4.43Å; K902-M904 PolarHBondContact O-N 3.11Å; K902-M904 VanDerWaalsContact O-N 3.12Å; M904-F940 HydrophobicContact CB-CE1 3.97Å; M904-F940 HydrophobicContact CE-CZ 4.18Å; M904-F940 HydrophobicContact CG-CE1 4.46Å; M904-F940 HydrophobicContact SD-CE1 3.96Å; M904-F940 HydrophobicContact SD-CZ 3.77Å; M904-V954 HydrophobicContact CE-CB 4.39Å; M904-V954 HydrophobicContact CE-CG1 4.29Å; M904-V954 WeakPolarHBondContact CE-O 3.34Å; M904-V956 HydrophobicContact CE-CG2 4.46Å; M904-V956 HydrophobicContact SD-CB 4.47Å; M904-V956 HydrophobicContact SD-CG2 3.71Å
905	F	95.7	Very high	94.7	Very high	20 Å²	20	68.1 Å²	68.1	9%	0.088	35%	0.347	C	S	.	.			trans	-134.8	160.7	179.6	-55.7	-70.7	0	0	0	108.6	L887 E910 F914 I929 G938 F940	L887-F905 HydrophobicContact CD1-CD1 4.41Å; L887-F905 HydrophobicContact CD1-CE1 3.55Å; L887-F905 HydrophobicContact CD1-CZ 4.13Å; F905-E910 HydrophobicContact CB-CB 3.98Å; F905-E910 HydrophobicContact CD1-CB 3.88Å; F905-E910 HydrophobicContact CG-CB 4.17Å; F905-F914 HydrophobicContact CD1-CD2 4.18Å; F905-F914 HydrophobicContact CE1-CB 4.21Å; F905-F914 AromaticContact CE1-CD2 3.25Å; F905-F914 HydrophobicContact CE1-CD2 3.25Å; F905-F914 AromaticContact CE1-CE2 3.72Å; F905-F914 HydrophobicContact CE1-CE2 3.72Å; F905-F914 AromaticContact CE1-CG 3.83Å; F905-F914 HydrophobicContact CE1-CG 3.83Å; F905-F914 HydrophobicContact CE2-CB 4.42Å; F905-F914 HydrophobicContact CZ-CB 3.68Å; F905-F914 AromaticContact CZ-CD2 3.65Å; F905-F914 HydrophobicContact CZ-CD2 3.65Å; F905-F914 HydrophobicContact CZ-CE2 4.44Å; F905-F914 AromaticContact CZ-CG 3.73Å; F905-F914 HydrophobicContact CZ-CG 3.73Å; F905-I929 HydrophobicContact CE2-CD1 3.82Å; F905-I929 HydrophobicContact CZ-CD1 4.11Å; F905-G938 WeakPolarHBondContact O-CA 3.31Å; F905-F940 AromaticContact CD2-CD1 3.82Å; F905-F940 HydrophobicContact CD2-CD1 3.82Å; F905-F940 AromaticContact CD2-CE1 3.75Å; F905-F940 HydrophobicContact CD2-CE1 3.75Å; F905-F940 AromaticContact CE2-CD1 3.95Å; F905-F940 HydrophobicContact CE2-CD1 3.95Å; F905-F940 AromaticContact CE2-CE1 3.64Å; F905-F940 HydrophobicContact CE2-CE1 3.64Å; F905-F940 HydrophobicContact CE2-CZ 4.31Å
906	S	94.1	Very high	94.6	Very high	88 Å²	88	65.9 Å²	65.9	62%	0.615	35%	0.349	S	S	*	.	S	Bend	trans	-96.8	-37.7	175.9	69	0	0	0	0	112.3	E910 G938	S906-E910 WeakPolarHBondContact CA-OE2 3.32Å; S906-E910 WeakPolarHBondContact CB-OE2 3.34Å; S906-E910 PolarHBondContact N-OE2 3.36Å; S906-E910 PolarHBondContact OG-OE2 2.99Å; S906-G938 PolarHBondContact O-N 3.02Å
907	S	93.7	Very high	94.7	Very high	42 Å²	42	58.3 Å²	58.3	29%	0.294	32%	0.321	S	S	.	.	S	Bend	trans	-118.8	150.8	-173	178.4	0	0	0	0	112.8	L909 E910 C911	S907-L909 PolarHBondContact O-N 2.87Å; S907-L909 PolarHBondContact OG-N 3.4Å; S907-E910 PolarHBondContact N-OE2 2.95Å; S907-E910 WeakPolarHBondContact O-CB 3.35Å; S907-E910 PolarHBondContact O-N 2.65Å; S907-E910 VanDerWaalsContact O-N 3.16Å; S907-C911 PolarHBondContact O-N 3.42Å; S907-C911 VanDerWaalsContact O-N 3.15Å
908	A	93.6	Very high	94.7	Very high	38 Å²	38	55.9 Å²	55.9	31%	0.314	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-27	170.1	0	0	0	0	0	112.5	C911 A912 A932	A908-C911 WeakPolarHBondContact O-CB 3.49Å; A908-C911 PolarHBondContact O-N 3.32Å; A908-A912 PolarHBondContact O-N 3Å; A908-A932 HydrophobicContact CB-CB 4.34Å
909	L	93.4	Very high	94.7	Very high	141 Å²	141	55.2 Å²	55.2	74%	0.738	32%	0.32	S	S	*	.	H	α-helix	trans	-67.5	-37.1	174.5	-62	176.3	0	0	0	111.9	S907 A912 K913	S907-L909 PolarHBondContact O-N 2.87Å; S907-L909 PolarHBondContact OG-N 3.4Å; L909-A912 PolarHBondContact O-N 3.46Å; L909-K913 PolarHBondContact O-N 3.08Å
910	E	93.7	Very high	94.7	Very high	80 Å²	80	59.8 Å²	59.8	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-67.5	-43.8	172.7	-64.3	-179.8	118.8	0	0	110.8	F905 S906 S907 A912 K913 F914	F905-E910 HydrophobicContact CB-CB 3.98Å; F905-E910 HydrophobicContact CD1-CB 3.88Å; F905-E910 HydrophobicContact CG-CB 4.17Å; S906-E910 WeakPolarHBondContact CA-OE2 3.32Å; S906-E910 WeakPolarHBondContact CB-OE2 3.34Å; S906-E910 PolarHBondContact N-OE2 3.36Å; S906-E910 PolarHBondContact OG-OE2 2.99Å; S907-E910 PolarHBondContact N-OE2 2.95Å; S907-E910 WeakPolarHBondContact O-CB 3.35Å; S907-E910 PolarHBondContact O-N 2.65Å; S907-E910 VanDerWaalsContact O-N 3.16Å; E910-A912 VanDerWaalsContact C-N 3.29Å; E910-A912 PolarHBondContact O-N 3.15Å; E910-K913 PolarHBondContact O-N 3.04Å; E910-F914 WeakPolarHBondContact O-CD2 3.49Å; E910-F914 PolarHBondContact O-N 2.78Å
911	C	93.7	Very high	94.7	Very high	0 Å²	0	59 Å²	59	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56	-43.3	173.7	-69.4	0	0	0	0	112.2	S907 A908 F914 E915 A932 G938 F940	S907-C911 PolarHBondContact O-N 3.42Å; S907-C911 VanDerWaalsContact O-N 3.15Å; A908-C911 WeakPolarHBondContact O-CB 3.49Å; A908-C911 PolarHBondContact O-N 3.32Å; C911-F914 CarbonylContact O-C 3.55Å; C911-F914 PolarHBondContact O-N 2.98Å; C911-E915 PolarHBondContact O-N 3.35Å; C911-E915 VanDerWaalsContact O-N 3.13Å; C911-A932 HydrophobicContact CB-CB 3.57Å; C911-G938 PolarHBondContact SG-O 3.04Å; C911-G938 VanDerWaalsContact SG-O 3.35Å; C911-F940 HydrophobicContact CB-CB 4.41Å
912	A	93.7	Very high	94.7	Very high	55 Å²	55	63.8 Å²	63.8	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-65.2	-41.8	177.8	0	0	0	0	0	112.1	A908 L909 E910 F914 E915	A908-A912 PolarHBondContact O-N 3Å; L909-A912 PolarHBondContact O-N 3.46Å; E910-A912 VanDerWaalsContact C-N 3.29Å; E910-A912 PolarHBondContact O-N 3.15Å; A912-F914 PolarHBondContact O-N 2.82Å; A912-F914 VanDerWaalsContact O-N 3.15Å; A912-E915 WeakPolarHBondContact O-CB 3.49Å; A912-E915 PolarHBondContact O-N 3.37Å
913	K	94.8	Very high	94.7	Very high	181 Å²	181	63.9 Å²	63.9	79%	0.787	37%	0.372	S	S	*	.	H	α-helix	trans	-62.3	-19.1	174.8	-172.9	167	-176.3	168.6	0	113.7	L909 E910	L909-K913 PolarHBondContact O-N 3.08Å; E910-K913 PolarHBondContact O-N 3.04Å
914	F	94.6	Very high	94.7	Very high	59 Å²	59	60.6 Å²	60.6	26%	0.259	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	18.3	173.7	-72.1	-81	0	0	0	113.3	L887 F905 E910 C911 A912 A917 I929 T958	L887-F914 HydrophobicContact CD1-CE1 4.47Å; L887-F914 HydrophobicContact CD1-CE2 4.19Å; L887-F914 HydrophobicContact CD1-CZ 4.06Å; F905-F914 HydrophobicContact CD1-CD2 4.18Å; F905-F914 HydrophobicContact CE1-CB 4.21Å; F905-F914 AromaticContact CE1-CD2 3.25Å; F905-F914 HydrophobicContact CE1-CD2 3.25Å; F905-F914 AromaticContact CE1-CE2 3.72Å; F905-F914 HydrophobicContact CE1-CE2 3.72Å; F905-F914 AromaticContact CE1-CG 3.83Å; F905-F914 HydrophobicContact CE1-CG 3.83Å; F905-F914 HydrophobicContact CE2-CB 4.42Å; F905-F914 HydrophobicContact CZ-CB 3.68Å; F905-F914 AromaticContact CZ-CD2 3.65Å; F905-F914 HydrophobicContact CZ-CD2 3.65Å; F905-F914 HydrophobicContact CZ-CE2 4.44Å; F905-F914 AromaticContact CZ-CG 3.73Å; F905-F914 HydrophobicContact CZ-CG 3.73Å; E910-F914 WeakPolarHBondContact O-CD2 3.49Å; E910-F914 PolarHBondContact O-N 2.78Å; C911-F914 CarbonylContact O-C 3.55Å; C911-F914 PolarHBondContact O-N 2.98Å; A912-F914 PolarHBondContact O-N 2.82Å; A912-F914 VanDerWaalsContact O-N 3.15Å; F914-A917 HydrophobicContact CB-CB 4.2Å; F914-A917 HydrophobicContact CD1-CB 4.31Å; F914-A917 WeakPolarHBondContact O-CB 3.35Å; F914-A917 PolarHBondContact O-N 2.78Å; F914-A917 VanDerWaalsContact O-N 3.11Å; F914-I929 HydrophobicContact CB-CD1 4.04Å; F914-I929 WeakPolarHBondContact O-CB 3.21Å; F914-I929 WeakPolarHBondContact O-CD1 3.2Å; F914-T958 HydrophobicContact CE1-CG2 3.77Å; F914-T958 HydrophobicContact CZ-CG2 4.26Å
915	E	93.9	Very high	94.8	Very high	105 Å²	105	61.2 Å²	61.2	49%	0.491	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	143.8	174.3	-163.3	156.5	128.1	0	0	111.1	C911 A912 A917 K931	C911-E915 PolarHBondContact O-N 3.35Å; C911-E915 VanDerWaalsContact O-N 3.13Å; A912-E915 WeakPolarHBondContact O-CB 3.49Å; A912-E915 PolarHBondContact O-N 3.37Å; E915-A917 PolarHBondContact O-N 2.93Å; E915-A917 VanDerWaalsContact O-N 3.09Å; E915-K931 WeakPolarHBondContact OE2-CA 3.27Å
916	G	95	Very high	94.9	Very high	43 Å²	43	67.7 Å²	67.7	44%	0.443	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	73	-13.8	-170.6	0	0	0	0	0	115.6	A918 I929	G916-A918 PolarHBondContact O-N 3.37Å; G916-I929 VanDerWaalsContact CA-O 3.31Å; G916-I929 WeakPolarHBondContact CA-O 3.48Å; G916-I929 PolarHBondContact N-O 2.68Å
917	A	95.4	Very high	95	Very high	23 Å²	23	64.1 Å²	64.1	19%	0.19	37%	0.365	C	S	.	.			trans	-59.8	137.6	-173.4	0	0	0	0	0	113.3	F914 E915 L919 Q928 I929	F914-A917 HydrophobicContact CB-CB 4.2Å; F914-A917 HydrophobicContact CD1-CB 4.31Å; F914-A917 WeakPolarHBondContact O-CB 3.35Å; F914-A917 PolarHBondContact O-N 2.78Å; F914-A917 VanDerWaalsContact O-N 3.11Å; E915-A917 PolarHBondContact O-N 2.93Å; E915-A917 VanDerWaalsContact O-N 3.09Å; A917-L919 PolarHBondContact O-N 2.97Å; A917-Q928 WeakPolarHBondContact O-CA 3.29Å; A917-I929 HydrophobicContact CB-CD1 4.36Å; A917-I929 HydrophobicContact CB-CG1 4.5Å; A917-I929 PolarHBondContact O-N 3.12Å; A917-I929 VanDerWaalsContact O-N 3.1Å
918	A	96.3	Very high	95.1	Very high	79 Å²	79	66.3 Å²	66.3	65%	0.653	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.4	-179.1	0	0	0	0	0	111.9	G916	G916-A918 PolarHBondContact O-N 3.37Å
919	L	95.2	Very high	95.3	Very high	6 Å²	6	64.5 Å²	64.5	3%	0.031	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	165.2	179.6	57	72.6	0	0	0	111.9	I901 A917 G927 I929 F940 A942 F944 V954 F955 V956	I901-L919 HydrophobicContact CD1-CD2 4.23Å; A917-L919 PolarHBondContact O-N 2.97Å; L919-G927 VanDerWaalsContact CD1-C 3.47Å; L919-G927 PolarHBondContact N-O 2.91Å; L919-G927 PolarHBondContact O-N 2.93Å; L919-I929 HydrophobicContact CD2-CG1 3.72Å; L919-F940 HydrophobicContact CD2-CE2 3.77Å; L919-F940 HydrophobicContact CD2-CZ 4.33Å; L919-A942 HydrophobicContact CD2-CB 3.8Å; L919-F944 HydrophobicContact CD1-CD1 3.98Å; L919-F944 HydrophobicContact CD1-CE1 3.27Å; L919-F944 HydrophobicContact CD1-CE2 4.2Å; L919-F944 HydrophobicContact CD1-CZ 3.41Å; L919-F944 VanDerWaalsContact CD1-CZ 3.41Å; L919-V954 HydrophobicContact CB-CG1 4.12Å; L919-V954 HydrophobicContact CD1-CG1 3.97Å; L919-V954 HydrophobicContact CD2-CG1 4.2Å; L919-V954 HydrophobicContact CG-CG1 4.34Å; L919-F955 WeakPolarHBondContact CA-O 3.43Å; L919-V956 HydrophobicContact CB-CG2 3.94Å
920	R	96.6	Very high	95.4	Very high	95 Å²	95	62.2 Å²	62.2	36%	0.358	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	142.6	179.5	-153.6	173.2	-174.7	177.5	-4.6	111.4	G924 I925 F955	R920-G924 PolarHBondContact NE-O 3.31Å; R920-G924 PolarHBondContact NH2-O 2.68Å; R920-I925 WeakPolarHBondContact CA-O 3.42Å; R920-I925 VanDerWaalsContact CG-O 3.25Å; R920-I925 WeakPolarHBondContact CG-O 3.29Å; R920-F955 HydrophobicContact CB-CE2 3.92Å; R920-F955 HydrophobicContact CB-CZ 4Å; R920-F955 PolarHBondContact N-O 2.79Å; R920-F955 WeakPolarHBondContact O-CD1 3.44Å; R920-F955 PolarHBondContact O-N 2.63Å
921	S	96.6	Very high	95.4	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.007	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	160.6	168.6	72.8	0	0	0	0	111.6	S923 G924 I925 I953	S921-S923 PolarHBondContact O-N 3.01Å; S921-S923 PolarHBondContact OG-N 3.25Å; S921-G924 PolarHBondContact O-N 2.85Å; S921-G924 PolarHBondContact OG-N 2.89Å; S921-I925 PolarHBondContact N-O 3Å; S921-I925 PolarHBondContact OG-N 3.03Å; S921-I953 WeakPolarHBondContact CA-O 3.37Å
922	V	96	Very high	95.5	Very high	101 Å²	101	66.4 Å²	66.4	61%	0.612	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-33.7	168.3	170.2	0	0	0	0	111.5	G924 I953 F955	V922-G924 PolarHBondContact O-N 2.72Å; V922-G924 VanDerWaalsContact O-N 3.15Å; V922-I953 HydrophobicContact CG2-CB 3.97Å; V922-I953 PolarHBondContact N-O 3.46Å; V922-F955 HydrophobicContact CG2-CD1 4.3Å; V922-F955 HydrophobicContact CG2-CE1 4.08Å
923	S	93.4	Very high	95.5	Very high	76 Å²	76	66.8 Å²	66.8	53%	0.531	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-3.9	172.4	-64.7	0	0	0	0	114	S921 D952	S921-S923 PolarHBondContact O-N 3.01Å; S921-S923 PolarHBondContact OG-N 3.25Å; S923-D952 PolarHBondContact OG-OD1 3.3Å
924	G	94.9	Very high	95.2	Very high	24 Å²	24	67 Å²	67	25%	0.247	36%	0.355	C	S	.	.			trans	94.4	-6.3	168.3	0	0	0	0	0	115.5	R920 S921 V922	R920-G924 PolarHBondContact NE-O 3.31Å; R920-G924 PolarHBondContact NH2-O 2.68Å; S921-G924 PolarHBondContact O-N 2.85Å; S921-G924 PolarHBondContact OG-N 2.89Å; V922-G924 PolarHBondContact O-N 2.72Å; V922-G924 VanDerWaalsContact O-N 3.15Å
925	I	96.9	Very high	94.9	Very high	29 Å²	29	70.6 Å²	70.6	15%	0.149	38%	0.377	C	S	.	.			trans	-65.6	130	177.4	-52.7	173.1	0	0	0	109	R920 S921 F944 E945 I948	R920-I925 WeakPolarHBondContact CA-O 3.42Å; R920-I925 VanDerWaalsContact CG-O 3.25Å; R920-I925 WeakPolarHBondContact CG-O 3.29Å; S921-I925 PolarHBondContact N-O 3Å; S921-I925 PolarHBondContact OG-N 3.03Å; I925-F944 HydrophobicContact CG2-CB 4.04Å; I925-F944 HydrophobicContact CG2-CD1 4.05Å; I925-E945 HydrophobicContact CG2-CB 4.04Å; I925-I948 HydrophobicContact CB-CG2 4.43Å; I925-I948 HydrophobicContact CD1-CG2 4.11Å
926	R	97.2	Very high	94.7	Very high	156 Å²	156	68.3 Å²	68.3	59%	0.589	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	159.7	177	-45.3	179.5	-158	-160.9	2	111	F944 E945	R926-F944 VanDerWaalsContact O-CA 3.31Å; R926-F944 WeakPolarHBondContact O-CA 3.28Å; R926-F944 WeakPolarHBondContact O-CD1 3.28Å; R926-E945 VanDerWaalsContact CB-CD 3.47Å; R926-E945 HydrophobicContact CB-CG 4.14Å; R926-E945 WeakPolarHBondContact CB-OE1 3.47Å; R926-E945 WeakPolarHBondContact CB-OE2 3.49Å; R926-E945 WeakPolarHBondContact CD-OE1 3.42Å; R926-E945 VanDerWaalsContact CG-OE1 3.29Å; R926-E945 WeakPolarHBondContact CG-OE1 3.15Å; R926-E945 WeakPolarHBondContact CG-OE2 3.14Å; R926-E945 PolarHBondContact N-OE2 3.37Å; R926-E945 IonicContact NE-OE1 3.17Å; R926-E945 PolarHBondContact NE-OE1 2.71Å; R926-E945 PolarHBondContact O-N 2.87Å
927	G	95.9	Very high	94.5	Very high	13 Å²	13	70.8 Å²	70.8	13%	0.134	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	-174.4	173.2	0	0	0	0	0	113.5	L919 T943	L919-G927 VanDerWaalsContact CD1-C 3.47Å; L919-G927 PolarHBondContact N-O 2.91Å; L919-G927 PolarHBondContact O-N 2.93Å; G927-T943 CarbonylContact C-O 3Å; G927-T943 WeakPolarHBondContact CA-O 3.45Å
928	Q	97	Very high	94.4	Very high	88 Å²	88	69.7 Å²	69.7	41%	0.411	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.5	-179.8	-69.8	174.8	-13.2	0	0	110.7	A917 A942 T943	A917-Q928 WeakPolarHBondContact O-CA 3.29Å; Q928-A942 VanDerWaalsContact O-CA 3.25Å; Q928-A942 WeakPolarHBondContact O-CA 3.3Å; Q928-T943 PolarHBondContact N-O 2.77Å; Q928-T943 PolarHBondContact O-N 2.7Å
929	I	96.6	Very high	94.3	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	136.2	161.9	-58.2	-167.6	0	0	0	108.7	F905 F914 G916 A917 L919 F940 V956	F905-I929 HydrophobicContact CE2-CD1 3.82Å; F905-I929 HydrophobicContact CZ-CD1 4.11Å; F914-I929 HydrophobicContact CB-CD1 4.04Å; F914-I929 WeakPolarHBondContact O-CB 3.21Å; F914-I929 WeakPolarHBondContact O-CD1 3.2Å; G916-I929 VanDerWaalsContact CA-O 3.31Å; G916-I929 WeakPolarHBondContact CA-O 3.48Å; G916-I929 PolarHBondContact N-O 2.68Å; A917-I929 HydrophobicContact CB-CD1 4.36Å; A917-I929 HydrophobicContact CB-CG1 4.5Å; A917-I929 PolarHBondContact O-N 3.12Å; A917-I929 VanDerWaalsContact O-N 3.1Å; L919-I929 HydrophobicContact CD2-CG1 3.72Å; I929-F940 HydrophobicContact CB-CD2 4.23Å; I929-F940 HydrophobicContact CB-CE2 4.41Å; I929-F940 HydrophobicContact CD1-CD2 4.13Å; I929-F940 HydrophobicContact CD1-CE1 4.44Å; I929-F940 HydrophobicContact CD1-CE2 3.8Å; I929-F940 HydrophobicContact CD1-CZ 3.96Å; I929-F940 HydrophobicContact CG1-CD2 3.87Å; I929-F940 HydrophobicContact CG1-CE2 3.59Å; I929-F940 HydrophobicContact CG1-CZ 4.23Å; I929-F940 HydrophobicContact CG2-CB 4.32Å; I929-F940 HydrophobicContact CG2-CD2 3.8Å; I929-F940 HydrophobicContact CG2-CE2 4.41Å; I929-F940 HydrophobicContact CG2-CG 4.2Å; I929-V956 HydrophobicContact CD1-CG2 4.31Å
930	K	95.2	Very high	94.3	Very high	93 Å²	93	65.7 Å²	65.7	40%	0.404	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	-30.8	-175.8	-74.1	-53.8	-159.2	-168.2	0	116.5	R941 T943	K930-R941 PolarHBondContact N-O 3.28Å; K930-T943 WeakPolarHBondContact CE-OG1 3.46Å; K930-T943 HydrophobicContact CG-CG2 3.82Å; K930-T943 WeakPolarHBondContact CG-OG1 3.24Å
931	K	94.8	Very high	94.3	Very high	140 Å²	140	67.1 Å²	67.1	61%	0.609	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-164.6	138.6	173.5	-160.6	164.4	-179.6	163.2	0	111.5	E915 F940 R941	E915-K931 WeakPolarHBondContact OE2-CA 3.27Å; K931-F940 CarbonylContact O-C 3.57Å; K931-F940 WeakPolarHBondContact O-CA 3.18Å; K931-F940 WeakPolarHBondContact O-CB 3.46Å; K931-R941 PolarHBondContact N-O 3.22Å; K931-R941 PolarHBondContact O-N 3.4Å
932	A	95.8	Very high	94.3	Very high	27 Å²	27	67.1 Å²	67.1	22%	0.223	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	141.3	165.9	0	0	0	0	0	111.5	A908 C911	A908-A932 HydrophobicContact CB-CB 4.34Å; C911-A932 HydrophobicContact CB-CB 3.57Å
933	M	93	Very high	94.4	Very high	63 Å²	63	64.4 Å²	64.4	31%	0.31	33%	0.327	S	S	.	.			trans	-101.3	145.8	172.9	-63.3	-63.9	-61.8	0	0	109.6	L900 S939 R941	L900-M933 HydrophobicContact CD2-CG 4.5Å; L900-M933 HydrophobicContact CD2-SD 4.29Å; M933-S939 WeakPolarHBondContact CB-OG 3.08Å; M933-S939 PolarHBondContact N-O 3.19Å; M933-R941 HydrophobicContact SD-CB 4.38Å
934	K	87.9	Confident	94.6	Very high	186 Å²	186	61.3 Å²	61.3	81%	0.809	31%	0.305	S	S	*	.	S	Bend	trans	-71.3	-50.1	174.8	-66.8	-169.8	176.4	-171.8	0	111.5	P936	K934-P936 CarbonylContact O-C 3.41Å
935	N	88.5	Confident	94.7	Very high	135 Å²	135	64.9 Å²	64.9	72%	0.722	32%	0.315	S	S	*	.	S	Bend	trans	-121	122.6	-173.7	-61.7	6.6	0	0	0	110.6
936	P	90.6	Very high	94.6	Very high	57 Å²	57	68.3 Å²	68.3	37%	0.37	33%	0.333	S	S	.	.	S	Bend	cis	-70.6	158.4	-12.3	30.9	-34.2	0	0	0	112.2	K934 S939	K934-P936 CarbonylContact O-C 3.41Å; P936-S939 WeakPolarHBondContact CD-OG 3.25Å; P936-S939 WeakPolarHBondContact O-CB 3.15Å; P936-S939 PolarHBondContact O-N 3.34Å; P936-S939 PolarHBondContact O-OG 2.9Å
937	P	91.8	Very high	94.5	Very high	94 Å²	94	66.6 Å²	66.6	61%	0.61	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	153.9	173.7	27.4	-35.7	0	0	0	111.3	S939	P937-S939 PolarHBondContact O-N 2.95Å; P937-S939 VanDerWaalsContact O-N 3.08Å
938	G	91.5	Very high	94.5	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.01	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	1.8	-177.1	0	0	0	0	0	115	F905 S906 C911	F905-G938 WeakPolarHBondContact O-CA 3.31Å; S906-G938 PolarHBondContact O-N 3.02Å; C911-G938 PolarHBondContact SG-O 3.04Å; C911-G938 VanDerWaalsContact SG-O 3.35Å
939	S	95.3	Very high	94.4	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.332	C	S	.	.			trans	-93.2	157	172.4	75.4	0	0	0	0	112.4	I901 M933 P936 P937	I901-S939 CarbonylContact O-C 3.56Å; I901-S939 WeakPolarHBondContact O-CA 2.94Å; I901-S939 WeakPolarHBondContact O-CB 3.34Å; M933-S939 WeakPolarHBondContact CB-OG 3.08Å; M933-S939 PolarHBondContact N-O 3.19Å; P936-S939 WeakPolarHBondContact CD-OG 3.25Å; P936-S939 WeakPolarHBondContact O-CB 3.15Å; P936-S939 PolarHBondContact O-N 3.34Å; P936-S939 PolarHBondContact O-OG 2.9Å; P937-S939 PolarHBondContact O-N 2.95Å; P937-S939 VanDerWaalsContact O-N 3.08Å
940	F	95.8	Very high	94.3	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	155	-177.3	61.1	-85.8	0	0	0	112.3	L900 I901 M904 F905 C911 L919 I929 K931 A942	L900-F940 WeakPolarHBondContact CA-O 3.3Å; I901-F940 HydrophobicContact CB-CD1 4.47Å; I901-F940 HydrophobicContact CB-CD2 4.49Å; I901-F940 HydrophobicContact CB-CE1 3.93Å; I901-F940 HydrophobicContact CB-CE2 3.97Å; I901-F940 HydrophobicContact CB-CZ 3.67Å; I901-F940 HydrophobicContact CD1-CE2 3.7Å; I901-F940 HydrophobicContact CD1-CZ 3.86Å; I901-F940 HydrophobicContact CG1-CE2 4.37Å; I901-F940 HydrophobicContact CG1-CZ 4.38Å; I901-F940 HydrophobicContact CG2-CE1 3.77Å; I901-F940 HydrophobicContact CG2-CE2 4.38Å; I901-F940 HydrophobicContact CG2-CZ 3.61Å; I901-F940 PolarHBondContact N-O 3.22Å; I901-F940 PolarHBondContact O-N 2.85Å; M904-F940 HydrophobicContact CB-CE1 3.97Å; M904-F940 HydrophobicContact CE-CZ 4.18Å; M904-F940 HydrophobicContact CG-CE1 4.46Å; M904-F940 HydrophobicContact SD-CE1 3.96Å; M904-F940 HydrophobicContact SD-CZ 3.77Å; F905-F940 AromaticContact CD2-CD1 3.82Å; F905-F940 HydrophobicContact CD2-CD1 3.82Å; F905-F940 AromaticContact CD2-CE1 3.75Å; F905-F940 HydrophobicContact CD2-CE1 3.75Å; F905-F940 AromaticContact CE2-CD1 3.95Å; F905-F940 HydrophobicContact CE2-CD1 3.95Å; F905-F940 AromaticContact CE2-CE1 3.64Å; F905-F940 HydrophobicContact CE2-CE1 3.64Å; F905-F940 HydrophobicContact CE2-CZ 4.31Å; C911-F940 HydrophobicContact CB-CB 4.41Å; L919-F940 HydrophobicContact CD2-CE2 3.77Å; L919-F940 HydrophobicContact CD2-CZ 4.33Å; I929-F940 HydrophobicContact CB-CD2 4.23Å; I929-F940 HydrophobicContact CB-CE2 4.41Å; I929-F940 HydrophobicContact CD1-CD2 4.13Å; I929-F940 HydrophobicContact CD1-CE1 4.44Å; I929-F940 HydrophobicContact CD1-CE2 3.8Å; I929-F940 HydrophobicContact CD1-CZ 3.96Å; I929-F940 HydrophobicContact CG1-CD2 3.87Å; I929-F940 HydrophobicContact CG1-CE2 3.59Å; I929-F940 HydrophobicContact CG1-CZ 4.23Å; I929-F940 HydrophobicContact CG2-CB 4.32Å; I929-F940 HydrophobicContact CG2-CD2 3.8Å; I929-F940 HydrophobicContact CG2-CE2 4.41Å; I929-F940 HydrophobicContact CG2-CG 4.2Å; K931-F940 CarbonylContact O-C 3.57Å; K931-F940 WeakPolarHBondContact O-CA 3.18Å; K931-F940 WeakPolarHBondContact O-CB 3.46Å; F940-A942 HydrophobicContact CD2-CB 4.25Å; F940-A942 HydrophobicContact CE2-CB 4.01Å
941	R	96.1	Very high	94.2	Very high	126 Å²	126	77.9 Å²	77.9	48%	0.475	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.4	168.1	-178.8	175.4	174.6	178.1	-2	109.5	L900 K930 K931 M933	L900-R941 HydrophobicContact CD2-CB 3.78Å; L900-R941 HydrophobicContact CD2-CG 4.01Å; K930-R941 PolarHBondContact N-O 3.28Å; K931-R941 PolarHBondContact N-O 3.22Å; K931-R941 PolarHBondContact O-N 3.4Å; M933-R941 HydrophobicContact SD-CB 4.38Å
942	A	96.9	Very high	94.2	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	153.7	172.5	0	0	0	0	0	111.6	S898 A899 I901 L919 Q928 F940 F944	S898-A942 CarbonylContact C-O 3.57Å; S898-A942 WeakPolarHBondContact CA-O 3.4Å; S898-A942 WeakPolarHBondContact CB-O 3.36Å; A899-A942 PolarHBondContact N-O 2.92Å; A899-A942 PolarHBondContact O-N 3.09Å; I901-A942 HydrophobicContact CD1-CB 3.66Å; L919-A942 HydrophobicContact CD2-CB 3.8Å; Q928-A942 VanDerWaalsContact O-CA 3.25Å; Q928-A942 WeakPolarHBondContact O-CA 3.3Å; F940-A942 HydrophobicContact CD2-CB 4.25Å; F940-A942 HydrophobicContact CE2-CB 4.01Å; A942-F944 HydrophobicContact CB-CD2 4.35Å; A942-F944 HydrophobicContact CB-CE2 3.71Å; A942-F944 HydrophobicContact CB-CZ 4.37Å
943	T	97.2	Very high	94.3	Very high	44 Å²	44	74.7 Å²	74.7	27%	0.27	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	139.2	169.6	48.1	0	0	0	0	110.5	K897 G927 Q928 K930	K897-T943 CarbonylContact O-C 3.48Å; K897-T943 WeakPolarHBondContact O-CA 3.37Å; G927-T943 CarbonylContact C-O 3Å; G927-T943 WeakPolarHBondContact CA-O 3.45Å; Q928-T943 PolarHBondContact N-O 2.77Å; Q928-T943 PolarHBondContact O-N 2.7Å; K930-T943 WeakPolarHBondContact CE-OG1 3.46Å; K930-T943 HydrophobicContact CG-CG2 3.82Å; K930-T943 WeakPolarHBondContact CG-OG1 3.24Å
944	F	97.3	Very high	94.4	Very high	12 Å²	12	71.7 Å²	71.7	5%	0.053	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	159.7	-175.3	-71.7	-92.3	0	0	0	111.7	K897 A899 I901 L919 I925 R926 A942 D946 I948 V954	K897-F944 PolarHBondContact O-N 2.89Å; A899-F944 HydrophobicContact CB-CE2 4.11Å; I901-F944 HydrophobicContact CD1-CE2 4.1Å; I901-F944 HydrophobicContact CD1-CZ 3.98Å; L919-F944 HydrophobicContact CD1-CD1 3.98Å; L919-F944 HydrophobicContact CD1-CE1 3.27Å; L919-F944 HydrophobicContact CD1-CE2 4.2Å; L919-F944 HydrophobicContact CD1-CZ 3.41Å; L919-F944 VanDerWaalsContact CD1-CZ 3.41Å; I925-F944 HydrophobicContact CG2-CB 4.04Å; I925-F944 HydrophobicContact CG2-CD1 4.05Å; R926-F944 VanDerWaalsContact O-CA 3.31Å; R926-F944 WeakPolarHBondContact O-CA 3.28Å; R926-F944 WeakPolarHBondContact O-CD1 3.28Å; A942-F944 HydrophobicContact CB-CD2 4.35Å; A942-F944 HydrophobicContact CB-CE2 3.71Å; A942-F944 HydrophobicContact CB-CZ 4.37Å; F944-D946 VanDerWaalsContact C-N 3.27Å; F944-D946 VanDerWaalsContact CB-O 3.27Å; F944-D946 WeakPolarHBondContact CB-O 3.4Å; F944-D946 PolarHBondContact O-N 3.28Å; F944-I948 HydrophobicContact CB-CG2 4.48Å; F944-I948 HydrophobicContact CD1-CG2 3.53Å; F944-I948 HydrophobicContact CD2-CD1 4.41Å; F944-I948 HydrophobicContact CD2-CG2 4.16Å; F944-I948 HydrophobicContact CE1-CG2 3.61Å; F944-I948 HydrophobicContact CE2-CD1 3.8Å; F944-I948 HydrophobicContact CE2-CG1 4.43Å; F944-I948 HydrophobicContact CE2-CG2 4.25Å; F944-I948 HydrophobicContact CG-CG2 3.81Å; F944-I948 HydrophobicContact CZ-CD1 3.9Å; F944-I948 HydrophobicContact CZ-CG2 3.98Å; F944-V954 HydrophobicContact CE1-CG1 4.29Å; F944-V954 HydrophobicContact CE1-CG2 4.43Å; F944-V954 HydrophobicContact CZ-CG1 3.91Å; F944-V954 HydrophobicContact CZ-CG2 3.84Å
945	E	96.5	Very high	94.9	Very high	99 Å²	99	63.7 Å²	63.7	46%	0.463	32%	0.317	S	S	.	.	S	Bend	trans	-58	-40.3	173.8	-65.2	164.1	147.4	0	0	112	K897 I925 R926	K897-E945 WeakPolarHBondContact CD-O 3.31Å; K897-E945 WeakPolarHBondContact CE-O 3.26Å; K897-E945 PolarHBondContact NZ-O 2.69Å; I925-E945 HydrophobicContact CG2-CB 4.04Å; R926-E945 VanDerWaalsContact CB-CD 3.47Å; R926-E945 HydrophobicContact CB-CG 4.14Å; R926-E945 WeakPolarHBondContact CB-OE1 3.47Å; R926-E945 WeakPolarHBondContact CB-OE2 3.49Å; R926-E945 WeakPolarHBondContact CD-OE1 3.42Å; R926-E945 VanDerWaalsContact CG-OE1 3.29Å; R926-E945 WeakPolarHBondContact CG-OE1 3.15Å; R926-E945 WeakPolarHBondContact CG-OE2 3.14Å; R926-E945 PolarHBondContact N-OE2 3.37Å; R926-E945 IonicContact NE-OE1 3.17Å; R926-E945 PolarHBondContact NE-OE1 2.71Å; R926-E945 PolarHBondContact O-N 2.87Å
946	D	95.7	Very high	95.2	Very high	101 Å²	101	57.6 Å²	57.6	54%	0.54	29%	0.285	S	S	.	.	S	Bend	trans	-148.2	176.4	-179.2	-167.1	18.2	0	0	0	111.1	F944 I948	F944-D946 VanDerWaalsContact C-N 3.27Å; F944-D946 VanDerWaalsContact CB-O 3.27Å; F944-D946 WeakPolarHBondContact CB-O 3.4Å; F944-D946 PolarHBondContact O-N 3.28Å; D946-I948 PolarHBondContact O-N 3.05Å
947	K	95.3	Very high	95.4	Very high	120 Å²	120	61 Å²	61	52%	0.522	29%	0.291	S	S	.	.			trans	-70.9	107.6	-176.8	-169.7	177	-179.3	179.8	0	112.6	V894 F895 K896	V894-K947 HydrophobicContact CG1-CD 4.46Å; V894-K947 HydrophobicContact CG1-CG 3.78Å; F895-K947 WeakPolarHBondContact O-CD 3.32Å; F895-K947 VanDerWaalsContact O-CE 3.24Å; F895-K947 WeakPolarHBondContact O-CE 3.36Å; K896-K947 VanDerWaalsContact O-CA 3.31Å; K896-K947 WeakPolarHBondContact O-CA 3.25Å; K896-K947 VanDerWaalsContact O-CB 3.28Å; K896-K947 WeakPolarHBondContact O-CB 3.44Å
948	I	96.3	Very high	95.5	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	27%	0.269	C	S	.	.			trans	-61.9	159.2	167.8	63	167.2	0	0	0	112.2	P891 V894 A899 I925 F944 D946 D952 V954	P891-I948 HydrophobicContact CB-CD1 3.71Å; P891-I948 HydrophobicContact CG-CD1 4.04Å; V894-I948 HydrophobicContact CG1-CG1 4Å; V894-I948 WeakPolarHBondContact CG1-O 3.49Å; V894-I948 HydrophobicContact CG2-CD1 4.41Å; V894-I948 HydrophobicContact CG2-CG1 4.16Å; A899-I948 HydrophobicContact CB-CD1 3.67Å; A899-I948 HydrophobicContact CB-CG1 4.18Å; I925-I948 HydrophobicContact CB-CG2 4.43Å; I925-I948 HydrophobicContact CD1-CG2 4.11Å; F944-I948 HydrophobicContact CB-CG2 4.48Å; F944-I948 HydrophobicContact CD1-CG2 3.53Å; F944-I948 HydrophobicContact CD2-CD1 4.41Å; F944-I948 HydrophobicContact CD2-CG2 4.16Å; F944-I948 HydrophobicContact CE1-CG2 3.61Å; F944-I948 HydrophobicContact CE2-CD1 3.8Å; F944-I948 HydrophobicContact CE2-CG1 4.43Å; F944-I948 HydrophobicContact CE2-CG2 4.25Å; F944-I948 HydrophobicContact CG-CG2 3.81Å; F944-I948 HydrophobicContact CZ-CD1 3.9Å; F944-I948 HydrophobicContact CZ-CG2 3.98Å; D946-I948 PolarHBondContact O-N 3.05Å; I948-D952 HydrophobicContact CB-CB 4.48Å; I948-D952 WeakPolarHBondContact CB-OD2 3.38Å; I948-V954 HydrophobicContact CD1-CG2 4.08Å
949	L	94	Very high	95.7	Very high	109 Å²	109	61.2 Å²	61.2	57%	0.571	28%	0.282	S	S	*	.			trans	-87.9	151.8	172.3	-61.8	179.5	0	0	0	111.5	K951 D952	L949-K951 PolarHBondContact O-N 3.44Å; L949-K951 VanDerWaalsContact O-N 3.08Å; L949-D952 PolarHBondContact N-OD2 2.83Å; L949-D952 WeakPolarHBondContact O-CB 3.15Å; L949-D952 PolarHBondContact O-N 2.83Å
950	M	94.8	Very high	95.6	Very high	120 Å²	120	64.3 Å²	64.3	59%	0.591	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.8	170.4	-165.5	75.3	-176.7	0	0	112.7	P891 V894	P891-M950 WeakPolarHBondContact O-CE 3.41Å; V894-M950 HydrophobicContact CG2-SD 4.49Å
951	K	93.2	Very high	95.6	Very high	199 Å²	199	68.5 Å²	68.5	87%	0.865	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-3.3	176.3	-60.2	-173	178.4	-173.6	0	113.7	L949	L949-K951 PolarHBondContact O-N 3.44Å; L949-K951 VanDerWaalsContact O-N 3.08Å
952	D	95.3	Very high	95.4	Very high	12 Å²	12	63.7 Å²	63.7	6%	0.064	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-76	131.2	178.5	-77.5	-19.5	0	0	0	110.5	P891 S923 I948 L949	P891-D952 WeakPolarHBondContact CD-O 3.35Å; S923-D952 PolarHBondContact OG-OD1 3.3Å; I948-D952 HydrophobicContact CB-CB 4.48Å; I948-D952 WeakPolarHBondContact CB-OD2 3.38Å; L949-D952 PolarHBondContact N-OD2 2.83Å; L949-D952 WeakPolarHBondContact O-CB 3.15Å; L949-D952 PolarHBondContact O-N 2.83Å
953	I	96.4	Very high	95.1	Very high	88 Å²	88	69.9 Å²	69.9	45%	0.451	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-80.5	129.1	162.7	-58.9	171	0	0	0	107.8	T888 S921 V922	T888-I953 HydrophobicContact CG2-CG2 4.2Å; S921-I953 WeakPolarHBondContact CA-O 3.37Å; V922-I953 HydrophobicContact CG2-CB 3.97Å; V922-I953 PolarHBondContact N-O 3.46Å
954	V	96.8	Very high	94.9	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	141.2	172.4	-174.1	0	0	0	0	108.8	T888 G889 I901 M904 L919 F944 I948	T888-V954 CarbonylContact C-O 3.44Å; T888-V954 WeakPolarHBondContact CA-O 3.39Å; G889-V954 PolarHBondContact N-O 2.87Å; G889-V954 PolarHBondContact O-N 2.85Å; I901-V954 HydrophobicContact CD1-CB 4.03Å; I901-V954 HydrophobicContact CD1-CG1 3.84Å; I901-V954 HydrophobicContact CD1-CG2 3.89Å; I901-V954 HydrophobicContact CG1-CG2 4.4Å; M904-V954 HydrophobicContact CE-CB 4.39Å; M904-V954 HydrophobicContact CE-CG1 4.29Å; M904-V954 WeakPolarHBondContact CE-O 3.34Å; L919-V954 HydrophobicContact CB-CG1 4.12Å; L919-V954 HydrophobicContact CD1-CG1 3.97Å; L919-V954 HydrophobicContact CD2-CG1 4.2Å; L919-V954 HydrophobicContact CG-CG1 4.34Å; F944-V954 HydrophobicContact CE1-CG1 4.29Å; F944-V954 HydrophobicContact CE1-CG2 4.43Å; F944-V954 HydrophobicContact CZ-CG1 3.91Å; F944-V954 HydrophobicContact CZ-CG2 3.84Å; I948-V954 HydrophobicContact CD1-CG2 4.08Å
955	F	96.9	Very high	94.6	Very high	18 Å²	18	69.1 Å²	69.1	8%	0.079	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.1	175.2	58.9	-95.6	0	0	0	113.9	L887 T888 L919 R920 V922 R957	L887-F955 CarbonylContact O-C 3.59Å; L887-F955 WeakPolarHBondContact O-CA 3.29Å; L887-F955 VanDerWaalsContact O-CB 3.3Å; L887-F955 WeakPolarHBondContact O-CB 3.41Å; T888-F955 HydrophobicContact CG2-CB 4.14Å; L919-F955 WeakPolarHBondContact CA-O 3.43Å; R920-F955 HydrophobicContact CB-CE2 3.92Å; R920-F955 HydrophobicContact CB-CZ 4Å; R920-F955 PolarHBondContact N-O 2.79Å; R920-F955 WeakPolarHBondContact O-CD1 3.44Å; R920-F955 PolarHBondContact O-N 2.63Å; V922-F955 HydrophobicContact CG2-CD1 4.3Å; V922-F955 HydrophobicContact CG2-CE1 4.08Å; F955-R957 HydrophobicContact CD2-CG 4.01Å; F955-R957 HydrophobicContact CE2-CG 4.02Å
956	V	95.9	Very high	94.4	Very high	7 Å²	7	71 Å²	71	4%	0.042	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	142	163.2	-180	0	0	0	0	108.1	K886 L887 M904 L919 I929 T958	K886-V956 WeakPolarHBondContact CA-O 3.08Å; L887-V956 HydrophobicContact CB-CB 4.49Å; L887-V956 PolarHBondContact N-O 3.22Å; L887-V956 PolarHBondContact O-N 3.4Å; M904-V956 HydrophobicContact CE-CG2 4.46Å; M904-V956 HydrophobicContact SD-CB 4.47Å; M904-V956 HydrophobicContact SD-CG2 3.71Å; L919-V956 HydrophobicContact CB-CG2 3.94Å; I929-V956 HydrophobicContact CD1-CG2 4.31Å; V956-T958 HydrophobicContact CG1-CG2 4.05Å
957	R	94.8	Very high	94.3	Very high	130 Å²	130	69.2 Å²	69.2	49%	0.491	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	97	177.5	-68.6	178.9	174.4	-173.7	0.4	109.8	F955	F955-R957 HydrophobicContact CD2-CG 4.01Å; F955-R957 HydrophobicContact CE2-CG 4.02Å
958	T	93.7	Very high	94	Very high	23 Å²	23	64.9 Å²	64.9	14%	0.141	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	161.2	177.2	44.9	0	0	0	0	111.7	L885 L887 F914 V956	L885-T958 WeakPolarHBondContact CB-OG1 3.29Å; L885-T958 PolarHBondContact N-O 3.09Å; L885-T958 PolarHBondContact O-N 2.92Å; L887-T958 HydrophobicContact CD1-CG2 4.38Å; F914-T958 HydrophobicContact CE1-CG2 3.77Å; F914-T958 HydrophobicContact CZ-CG2 4.26Å; V956-T958 HydrophobicContact CG1-CG2 4.05Å
959	W	94.6	Very high	93.6	Very high	75 Å²	75	66 Å²	66	28%	0.284	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135	176.3	-56.4	93.6	0	0	0	107.7	R820 V882 K884	R820-W959 HydrophobicContact CB-CZ3 4.18Å; R820-W959 HydrophobicContact CG-CZ3 3.92Å; V882-W959 HydrophobicContact CB-CB 4.49Å; V882-W959 HydrophobicContact CG2-CE3 4.06Å; K884-W959 HydrophobicContact CB-CE3 3.89Å; K884-W959 HydrophobicContact CB-CH2 4.45Å; K884-W959 HydrophobicContact CB-CZ3 3.75Å; K884-W959 HydrophobicContact CD-CH2 3.92Å; K884-W959 HydrophobicContact CD-CZ2 4.4Å; K884-W959 HydrophobicContact CD-CZ3 4.06Å; K884-W959 HydrophobicContact CG-CE3 4.13Å; K884-W959 HydrophobicContact CG-CH2 4.23Å; K884-W959 HydrophobicContact CG-CZ3 3.97Å
960	V	95.1	Very high	93.3	Very high	65 Å²	65	61.1 Å²	61.1	39%	0.394	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.3	-177.4	-173.4	0	0	0	0	107	V882 K883 L885	V882-V960 CarbonylContact C-O 3.6Å; K883-V960 PolarHBondContact N-O 2.92Å; K883-V960 PolarHBondContact O-N 2.73Å; L885-V960 HydrophobicContact CB-CG2 3.94Å; L885-V960 HydrophobicContact CD2-CG2 3.93Å
961	P	95.9	Very high	92.8	Very high	89 Å²	89	55.5 Å²	55.5	58%	0.578	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.6	153.4	172.5	27.3	-34.2	0	0	0	110.3
962	L	91.5	Very high	92.2	Very high	24 Å²	24	47.1 Å²	47.1	13%	0.126	24%	0.238	C	C	.	.			trans	-135.8	113.6	-177.8	-175.2	86.1	0	0	0	110.2	V809 M821 V881 K883	V809-L962 HydrophobicContact CG1-CD2 4.04Å; M821-L962 HydrophobicContact CB-CD2 4.46Å; M821-L962 HydrophobicContact CE-CD2 3.8Å; M821-L962 HydrophobicContact CG-CD2 3.74Å; M821-L962 HydrophobicContact SD-CD2 3.73Å; V881-L962 PolarHBondContact O-N 3.23Å; K883-L962 HydrophobicContact CB-CB 4.45Å; K883-L962 HydrophobicContact CD-CD1 4.27Å
963	D	90.9	Very high	91.4	Very high	130 Å²	130	46.6 Å²	46.6	70%	0.695	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-64	138.6	178.7	-43.6	-68.7	0	0	0	111.5	R792	R792-D963 PolarHBondContact NH2-O 2.74Å
964	V	91.9	Very high	90.5	Very high	8 Å²	8	42.7 Å²	42.7	5%	0.048	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-87.3	123.4	173.7	176.8	0	0	0	0	107.5	Y774 V809 T834 V881 K966	Y774-V964 HydrophobicContact CD1-CB 4.01Å; Y774-V964 HydrophobicContact CD1-CG1 4.04Å; Y774-V964 HydrophobicContact CE1-CB 3.77Å; Y774-V964 HydrophobicContact CE1-CG1 4.09Å; V809-V964 HydrophobicContact CB-CG2 4.26Å; V809-V964 HydrophobicContact CG2-CB 4.43Å; V809-V964 HydrophobicContact CG2-CG1 4.24Å; V809-V964 HydrophobicContact CG2-CG2 4.1Å; T834-V964 HydrophobicContact CG2-CG1 4.46Å; T834-V964 HydrophobicContact CG2-CG2 3.84Å; V881-V964 HydrophobicContact CG2-CG2 4.39Å; V964-K966 PolarHBondContact O-N 3.12Å
965	P	92.1	Very high	89.8	Confident	32 Å²	32	43.5 Å²	43.5	21%	0.208	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-61.2	127.3	-178.6	-21.9	33	0	0	0	111.4	R792 M807 F967	R792-P965 HydrophobicContact CG-CG 4.17Å; M807-P965 HydrophobicContact CB-CB 4.19Å; M807-P965 HydrophobicContact CB-CG 4.29Å; M807-P965 HydrophobicContact SD-CB 3.99Å; M807-P965 HydrophobicContact SD-CG 4.32Å; P965-F967 PolarHBondContact O-N 3.02Å
966	K	91.9	Very high	89	Confident	140 Å²	140	45.3 Å²	45.3	61%	0.609	23%	0.229	S	C	*	.			trans	-76.6	57.5	174.2	-63.2	-171.5	178.4	-173.8	0	111.6	Y774 W836 V964	Y774-K966 HydrophobicContact CE1-CG 4.43Å; Y774-K966 WeakPolarHBondContact OH-CE 3.43Å; W836-K966 HydrophobicContact CB-CB 4.49Å; W836-K966 HydrophobicContact CD2-CB 4.33Å; W836-K966 HydrophobicContact CD2-CD 4.42Å; W836-K966 HydrophobicContact CD2-CG 4.04Å; W836-K966 HydrophobicContact CE3-CG 4.28Å; W836-K966 HydrophobicContact CG-CB 4.05Å; W836-K966 HydrophobicContact CG-CG 4.17Å; V964-K966 PolarHBondContact O-N 3.12Å
967	F	92.2	Very high	88.2	Confident	63 Å²	63	47 Å²	47	28%	0.276	24%	0.241	S	C	.	.			trans	-101.2	124.9	175.8	179.5	-102.4	0	0	0	110.3	Q805 T806 M807 P965 A969 M987	Q805-F967 HydrophobicContact CB-CE1 4.24Å; Q805-F967 HydrophobicContact CG-CE1 4.27Å; T806-F967 PolarHBondContact OG1-O 2.92Å; T806-F967 VanDerWaalsContact OG1-O 3.06Å; M807-F967 HydrophobicContact CB-CB 4.42Å; M807-F967 HydrophobicContact CG-CB 3.9Å; M807-F967 HydrophobicContact CG-CD1 3.83Å; M807-F967 HydrophobicContact CG-CG 4.1Å; M807-F967 HydrophobicContact SD-CB 4.02Å; M807-F967 HydrophobicContact SD-CG 4.36Å; P965-F967 PolarHBondContact O-N 3.02Å; F967-A969 HydrophobicContact CE1-CB 4.49Å; F967-A969 HydrophobicContact CE2-CB 4.49Å; F967-A969 HydrophobicContact CZ-CB 3.97Å; F967-M987 HydrophobicContact CE1-CB 4.49Å; F967-M987 HydrophobicContact CE1-SD 4.41Å; F967-M987 HydrophobicContact CZ-CB 4.27Å
968	Y	89.6	Confident	87.2	Confident	29 Å²	29	44.2 Å²	44.2	11%	0.114	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	123.4	179.3	177.3	-105	0	0	0	108.5	L772 R802 F804 P838 I970	L772-Y968 HydrophobicContact CD1-CD1 4.43Å; L772-Y968 HydrophobicContact CD2-CD1 4.44Å; L772-Y968 HydrophobicContact CD2-CE1 4.14Å; R802-Y968 WeakPolarHBondContact CD-OH 3.48Å; F804-Y968 HydrophobicContact CB-CD2 3.92Å; F804-Y968 HydrophobicContact CB-CE2 3.43Å; F804-Y968 VanDerWaalsContact CB-CE2 3.43Å; F804-Y968 AromaticContact CD1-CE2 3.79Å; F804-Y968 HydrophobicContact CD1-CE2 3.79Å; F804-Y968 AromaticContact CD2-CD2 3.61Å; F804-Y968 HydrophobicContact CD2-CD2 3.61Å; F804-Y968 AromaticContact CD2-CE2 3.53Å; F804-Y968 HydrophobicContact CD2-CE2 3.53Å; F804-Y968 HydrophobicContact CE1-CE2 4.42Å; F804-Y968 HydrophobicContact CE2-CD2 4.3Å; F804-Y968 HydrophobicContact CE2-CE2 4.2Å; F804-Y968 AromaticContact CG-CD2 3.84Å; F804-Y968 HydrophobicContact CG-CD2 3.84Å; F804-Y968 AromaticContact CG-CE2 3.3Å; F804-Y968 HydrophobicContact CG-CE2 3.3Å; P838-Y968 HydrophobicContact CG-CE2 4.5Å; Y968-I970 HydrophobicContact CE1-CD1 3.73Å; Y968-I970 HydrophobicContact CE1-CG1 3.89Å; Y968-I970 WeakPolarHBondContact OH-CD1 3.19Å
969	A	88.9	Confident	86.2	Confident	24 Å²	24	47.9 Å²	47.9	20%	0.198	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	131.4	176.4	0	0	0	0	0	109.4	F804 Q805 F967	F804-A969 CarbonylContact C-O 3.38Å; F804-A969 VanDerWaalsContact CA-O 3.23Å; F804-A969 WeakPolarHBondContact CA-O 3.16Å; F804-A969 WeakPolarHBondContact CB-O 3.39Å; Q805-A969 PolarHBondContact N-O 3.21Å; Q805-A969 PolarHBondContact O-N 3.31Å; Q805-A969 VanDerWaalsContact O-N 3.12Å; F967-A969 HydrophobicContact CE1-CB 4.49Å; F967-A969 HydrophobicContact CE2-CB 4.49Å; F967-A969 HydrophobicContact CZ-CB 3.97Å
970	I	86.1	Confident	85.3	Confident	8 Å²	8	49.3 Å²	49.3	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	151.7	-173.9	-75.8	162.9	0	0	0	111.4	V322 F804 Y968 T972 W984	V322-I970 HydrophobicContact CB-CD1 4.23Å; V322-I970 WeakPolarHBondContact O-CD1 3.13Å; F804-I970 HydrophobicContact CB-CG1 4.18Å; Y968-I970 HydrophobicContact CE1-CD1 3.73Å; Y968-I970 HydrophobicContact CE1-CG1 3.89Å; Y968-I970 WeakPolarHBondContact OH-CD1 3.19Å; I970-T972 PolarHBondContact O-N 3.42Å; I970-W984 WeakPolarHBondContact O-CZ2 3.38Å
971	V	84.3	Confident	84.3	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	25%	0.251	C	S	.	.			trans	-85	91.3	-178.6	-178	0	0	0	0	110.3	I796 R803 N973 W984	I796-V971 HydrophobicContact CG2-CG2 3.58Å; R803-V971 HydrophobicContact CB-CB 3.95Å; R803-V971 HydrophobicContact CB-CG2 4.05Å; R803-V971 PolarHBondContact O-N 3.24Å; V971-N973 PolarHBondContact O-N 2.73Å; V971-W984 HydrophobicContact CB-CZ2 4.48Å; V971-W984 HydrophobicContact CG1-CD2 4.02Å; V971-W984 HydrophobicContact CG1-CE3 4.16Å; V971-W984 HydrophobicContact CG1-CG 4.42Å; V971-W984 HydrophobicContact CG1-CZ3 4.49Å; V971-W984 HydrophobicContact CG2-CH2 4.06Å; V971-W984 HydrophobicContact CG2-CZ2 4.39Å; V971-W984 HydrophobicContact CG2-CZ3 4.21Å
972	T	80.9	Confident	83.2	Confident	24 Å²	24	42.7 Å²	42.7	15%	0.147	23%	0.23	C	C	.	.			trans	-79.6	46.4	-171.9	52.9	0	0	0	0	115	G301 M303 I970 L974 W984	G301-T972 WeakPolarHBondContact O-CA 3.14Å; M303-T972 HydrophobicContact CB-CG2 3.6Å; I970-T972 PolarHBondContact O-N 3.42Å; T972-L974 PolarHBondContact O-N 3.05Å; T972-W984 PolarHBondContact OG1-NE1 3.41Å
973	N	78.3	Confident	82.5	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-56.5	-49.6	-171.1	-165	15.4	0	0	0	112.7	D136 N138 V971 L975 L976 K981	D136-N973 PolarHBondContact OD2-ND2 2.73Å; N138-N973 PolarHBondContact ND2-ND2 3.41Å; V971-N973 PolarHBondContact O-N 2.73Å; N973-L975 VanDerWaalsContact C-N 3.29Å; N973-L975 PolarHBondContact O-N 3.42Å; N973-L976 PolarHBondContact O-N 2.77Å; N973-K981 WeakPolarHBondContact OD1-CA 3.42Å; N973-K981 WeakPolarHBondContact OD1-CB 3.49Å; N973-K981 PolarHBondContact OD1-O 3.05Å
974	L	79.1	Confident	82.1	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.031	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-76	-9.5	-167	-57.1	-177.5	0	0	0	114.8	V300 L750 Y758 Y760 T972	V300-L974 WeakPolarHBondContact O-CD1 3.48Å; L750-L974 HydrophobicContact CD1-CB 3.98Å; Y758-L974 HydrophobicContact CD1-CD2 3.85Å; Y758-L974 HydrophobicContact CG-CD2 4.08Å; Y760-L974 HydrophobicContact CD1-CD1 3.82Å; Y760-L974 HydrophobicContact CE1-CB 4.23Å; Y760-L974 HydrophobicContact CE1-CD1 3.76Å; Y760-L974 HydrophobicContact CE2-CD1 4.49Å; Y760-L974 HydrophobicContact CG-CD1 4.24Å; T972-L974 PolarHBondContact O-N 3.05Å
975	L	80.8	Confident	81.6	Confident	17 Å²	17	44.7 Å²	44.7	9%	0.089	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-79.5	-23.6	171.7	-61.4	-168.4	0	0	0	113.3	K302 P747 E749 L750 N753 N973	K302-L975 HydrophobicContact CB-CD1 4.02Å; K302-L975 HydrophobicContact CB-CD2 4.33Å; K302-L975 HydrophobicContact CG-CD1 4.09Å; P747-L975 HydrophobicContact CB-CD2 3.64Å; P747-L975 HydrophobicContact CG-CD2 3.67Å; E749-L975 HydrophobicContact CB-CB 4.31Å; E749-L975 HydrophobicContact CB-CD2 4.45Å; L750-L975 HydrophobicContact CB-CD2 3.75Å; L750-L975 HydrophobicContact CD1-CD2 3.87Å; L750-L975 HydrophobicContact CG-CD2 4.42Å; N753-L975 PolarHBondContact ND2-O 3.11Å; N753-L975 VanDerWaalsContact ND2-O 3.1Å; N973-L975 VanDerWaalsContact C-N 3.29Å; N973-L975 PolarHBondContact O-N 3.42Å
976	L	81	Confident	81.2	Confident	55 Å²	55	44.4 Å²	44.4	29%	0.288	24%	0.24	S	C	.	.	S	Bend	trans	-74.1	149.7	-178	-61.8	180	0	0	0	110.2	N973 M980 K981 W984	N973-L976 PolarHBondContact O-N 2.77Å; L976-M980 HydrophobicContact CB-CB 4.11Å; L976-M980 WeakPolarHBondContact CD1-O 3.33Å; L976-K981 HydrophobicContact CB-CG 4.27Å; L976-K981 WeakPolarHBondContact O-CE 3.42Å; L976-K981 WeakPolarHBondContact O-CG 3.41Å; L976-W984 HydrophobicContact CD1-CB 4.07Å; L976-W984 HydrophobicContact CD1-CG 4.39Å
977	S	79.5	Confident	81.1	Confident	43 Å²	43	41.6 Å²	41.6	30%	0.301	23%	0.23	S	C	.	.			trans	-59.3	152.2	172.4	64.9	0	0	0	0	111.8	N753 T979 M980 K981	N753-S977 WeakPolarHBondContact OD1-CA 3.47Å; N753-S977 WeakPolarHBondContact OD1-CB 3.13Å; S977-T979 PolarHBondContact O-N 3.36Å; S977-M980 CarbonylContact O-C 3.41Å; S977-M980 WeakPolarHBondContact O-CA 3.29Å; S977-M980 PolarHBondContact O-N 2.82Å; S977-K981 PolarHBondContact O-N 2.98Å
978	N	72.5	Confident	81	Confident	71 Å²	71	44.4 Å²	44.4	38%	0.38	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-30.3	-165.5	-65.8	-19.8	0	0	0	114.4	D755 M980 K981	D755-N978 WeakPolarHBondContact CB-OD1 3.27Å; N978-M980 VanDerWaalsContact C-N 3.35Å; N978-K981 WeakPolarHBondContact OD1-CE 3.45Å; N978-K981 PolarHBondContact OD1-NZ 2.76Å
979	T	74.3	Confident	81.1	Confident	100 Å²	100	43.4 Å²	43.4	61%	0.613	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.3	175.9	70.7	0	0	0	0	114.1	S977 K983	S977-T979 PolarHBondContact O-N 3.36Å; T979-K983 WeakPolarHBondContact O-CD 3.48Å; T979-K983 WeakPolarHBondContact O-CE 3.37Å; T979-K983 PolarHBondContact O-NZ 2.79Å
980	M	74.7	Confident	81.2	Confident	105 Å²	105	44.3 Å²	44.3	52%	0.517	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-20.4	-179.9	-62.6	-161.4	-170.3	0	0	113.9	L976 S977 N978 A982 K983 W984	L976-M980 HydrophobicContact CB-CB 4.11Å; L976-M980 WeakPolarHBondContact CD1-O 3.33Å; S977-M980 CarbonylContact O-C 3.41Å; S977-M980 WeakPolarHBondContact O-CA 3.29Å; S977-M980 PolarHBondContact O-N 2.82Å; N978-M980 VanDerWaalsContact C-N 3.35Å; M980-A982 PolarHBondContact O-N 2.79Å; M980-K983 WeakPolarHBondContact O-CA 3.35Å; M980-K983 WeakPolarHBondContact O-CB 3.32Å; M980-K983 PolarHBondContact O-N 3.3Å; M980-W984 PolarHBondContact O-N 3.34Å
981	K	74.1	Confident	81.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-42.7	-67.5	173.3	-68.4	-174	175.2	167.3	0	111.8	N753 Y758 N973 L976 S977 N978 K983 W984	N753-K981 WeakPolarHBondContact O-CE 3.26Å; N753-K981 PolarHBondContact O-NZ 3Å; Y758-K981 HydrophobicContact CD2-CD 4.2Å; Y758-K981 HydrophobicContact CE1-CB 4.42Å; Y758-K981 HydrophobicContact CE1-CD 4.22Å; Y758-K981 HydrophobicContact CE2-CD 3.87Å; N973-K981 WeakPolarHBondContact OD1-CA 3.42Å; N973-K981 WeakPolarHBondContact OD1-CB 3.49Å; N973-K981 PolarHBondContact OD1-O 3.05Å; L976-K981 HydrophobicContact CB-CG 4.27Å; L976-K981 WeakPolarHBondContact O-CE 3.42Å; L976-K981 WeakPolarHBondContact O-CG 3.41Å; S977-K981 PolarHBondContact O-N 2.98Å; N978-K981 WeakPolarHBondContact OD1-CE 3.45Å; N978-K981 PolarHBondContact OD1-NZ 2.76Å; K981-K983 PolarHBondContact O-N 2.98Å; K981-W984 PolarHBondContact O-N 3.28Å; K981-W984 VanDerWaalsContact O-N 3.14Å
982	A	73	Confident	81.6	Confident	16 Å²	16	48.4 Å²	48.4	13%	0.132	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-58.4	-1.5	177	0	0	0	0	0	115.8	D136 S853 E854 M980	D136-A982 WeakPolarHBondContact OD1-CA 3.36Å; S853-A982 WeakPolarHBondContact CA-O 3.45Å; E854-A982 HydrophobicContact CG-CB 4.21Å; E854-A982 PolarHBondContact N-O 3.07Å; M980-A982 PolarHBondContact O-N 2.79Å
983	K	75.9	Confident	82.1	Confident	86 Å²	86	50 Å²	50	37%	0.374	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-109.9	-3.3	-177.9	-57.3	-179.6	-177.3	145.1	0	114.4	S853 V855 T979 M980 K981 V985	S853-K983 WeakPolarHBondContact CB-O 3.45Å; S853-K983 WeakPolarHBondContact OG-CA 3.25Å; S853-K983 PolarHBondContact OG-O 3.29Å; V855-K983 HydrophobicContact CG2-CD 3.87Å; V855-K983 HydrophobicContact CG2-CG 3.99Å; T979-K983 WeakPolarHBondContact O-CD 3.48Å; T979-K983 WeakPolarHBondContact O-CE 3.37Å; T979-K983 PolarHBondContact O-NZ 2.79Å; M980-K983 WeakPolarHBondContact O-CA 3.35Å; M980-K983 WeakPolarHBondContact O-CB 3.32Å; M980-K983 PolarHBondContact O-N 3.3Å; K981-K983 PolarHBondContact O-N 2.98Å; K983-V985 WeakPolarHBondContact O-CG2 3.42Å; K983-V985 PolarHBondContact O-N 2.96Å
984	W	82.2	Confident	82.8	Confident	25 Å²	25	53.8 Å²	53.8	10%	0.095	29%	0.292	C	S	.	.			trans	-37.8	128.8	-174.4	-173.6	95.2	0	0	0	114.7	I796 I970 V971 T972 L976 M980 K981	I796-W984 HydrophobicContact CD1-CE3 4.38Å; I796-W984 HydrophobicContact CD1-CZ3 3.8Å; I796-W984 HydrophobicContact CG1-CZ3 4.34Å; I970-W984 WeakPolarHBondContact O-CZ2 3.38Å; V971-W984 HydrophobicContact CB-CZ2 4.48Å; V971-W984 HydrophobicContact CG1-CD2 4.02Å; V971-W984 HydrophobicContact CG1-CE3 4.16Å; V971-W984 HydrophobicContact CG1-CG 4.42Å; V971-W984 HydrophobicContact CG1-CZ3 4.49Å; V971-W984 HydrophobicContact CG2-CH2 4.06Å; V971-W984 HydrophobicContact CG2-CZ2 4.39Å; V971-W984 HydrophobicContact CG2-CZ3 4.21Å; T972-W984 PolarHBondContact OG1-NE1 3.41Å; L976-W984 HydrophobicContact CD1-CB 4.07Å; L976-W984 HydrophobicContact CD1-CG 4.39Å; M980-W984 PolarHBondContact O-N 3.34Å; K981-W984 PolarHBondContact O-N 3.28Å; K981-W984 VanDerWaalsContact O-N 3.14Å
985	V	81.5	Confident	83.4	Confident	93 Å²	93	62.1 Å²	62.1	56%	0.564	33%	0.328	S	S	*	.			trans	-122	104	-173.2	-174.1	0	0	0	0	111.4	K983	K983-V985 WeakPolarHBondContact O-CG2 3.42Å; K983-V985 PolarHBondContact O-N 2.96Å
986	G	84.3	Confident	83.9	Confident	25 Å²	25	66.4 Å²	66.4	26%	0.258	35%	0.348	S	S	.	.			trans	-84	-165	167.8	0	0	0	0	0	113.9	R988	G986-R988 PolarHBondContact O-N 3.5Å
987	M	89.9	Confident	84.6	Confident	82 Å²	82	72.7 Å²	72.7	40%	0.404	37%	0.367	S	S	.	.	S	Bend	trans	-52.9	123.4	172.9	-171.2	-168.8	-175.6	0	0	110.8	P794 Q805 M807 F967	P794-M987 HydrophobicContact CB-CB 4.11Å; P794-M987 HydrophobicContact CB-CG 4.27Å; P794-M987 HydrophobicContact CB-SD 3.85Å; P794-M987 HydrophobicContact CG-CB 4.09Å; P794-M987 HydrophobicContact CG-CG 3.97Å; P794-M987 VanDerWaalsContact CG-O 3.3Å; P794-M987 WeakPolarHBondContact CG-O 3.37Å; P794-M987 HydrophobicContact CG-SD 3.91Å; Q805-M987 PolarHBondContact NE2-O 2.85Å; Q805-M987 VanDerWaalsContact OE1-CB 3.25Å; M807-M987 HydrophobicContact CE-CE 4.31Å; M807-M987 HydrophobicContact CG-SD 4.49Å; M807-M987 HydrophobicContact SD-CE 4.44Å; M807-M987 HydrophobicContact SD-SD 4.39Å; F967-M987 HydrophobicContact CE1-CB 4.49Å; F967-M987 HydrophobicContact CE1-SD 4.41Å; F967-M987 HydrophobicContact CZ-CB 4.27Å
988	R	89.8	Confident	85.2	Confident	121 Å²	121	73.8 Å²	73.8	46%	0.457	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-75.5	147.3	179.9	-58.8	179.7	-168.9	165	7.6	111	G986 Q992 L993 Q996	G986-R988 PolarHBondContact O-N 3.5Å; R988-Q992 HydrophobicContact CB-CB 4.34Å; R988-L993 HydrophobicContact CB-CD2 3.94Å; R988-L993 HydrophobicContact CB-CG 3.91Å; R988-L993 WeakPolarHBondContact O-CD1 3.46Å; R988-Q996 VanDerWaalsContact CD-OE1 3.23Å
989	T	91	Very high	86.3	Confident	8 Å²	8	75.1 Å²	75.1	5%	0.049	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-69.7	158.1	178.9	63.3	0	0	0	0	112.5	P794 Q850 G991 Q992 L993	P794-T989 HydrophobicContact CG-CG2 4.47Å; Q850-T989 HydrophobicContact CG-CG2 3.79Å; T989-G991 PolarHBondContact O-N 3.27Å; T989-G991 VanDerWaalsContact O-N 3.15Å; T989-Q992 PolarHBondContact O-N 3.36Å; T989-Q992 VanDerWaalsContact O-N 3.12Å; T989-Q992 VanDerWaalsContact OG1-CD 3.28Å; T989-Q992 WeakPolarHBondContact OG1-CG 3.43Å; T989-Q992 PolarHBondContact OG1-N 2.94Å; T989-Q992 PolarHBondContact OG1-OE1 3.3Å; T989-L993 WeakPolarHBondContact O-CB 3.48Å; T989-L993 WeakPolarHBondContact O-CG 3.41Å; T989-L993 PolarHBondContact O-N 3.02Å
990	V	92.3	Very high	87.2	Confident	43 Å²	43	79.6 Å²	79.6	26%	0.261	40%	0.403	S	S	.	.	H	α-helix	trans	-61.8	-23.9	177	176.2	0	0	0	0	112.2	D793 R994	D793-V990 WeakPolarHBondContact OD1-CB 3.48Å; D793-V990 WeakPolarHBondContact OD1-CG2 3.43Å; V990-R994 WeakPolarHBondContact O-CB 3.32Å; V990-R994 WeakPolarHBondContact O-CD 3.46Å; V990-R994 VanDerWaalsContact O-CG 3.25Å; V990-R994 WeakPolarHBondContact O-CG 3.45Å; V990-R994 PolarHBondContact O-N 3.03Å
991	G	89.8	Confident	88	Confident	46 Å²	46	78.4 Å²	78.4	47%	0.474	40%	0.403	S	S	.	.	H	α-helix	trans	-68.9	-53.8	170	0	0	0	0	0	112.7	T989 L993 R994 F995	T989-G991 PolarHBondContact O-N 3.27Å; T989-G991 VanDerWaalsContact O-N 3.15Å; G991-L993 PolarHBondContact O-N 3.09Å; G991-R994 PolarHBondContact O-N 2.73Å; G991-F995 PolarHBondContact O-N 3.31Å
992	Q	87.9	Confident	88.9	Confident	49 Å²	49	83.5 Å²	83.5	23%	0.229	44%	0.436	C	S	.	.	H	α-helix	trans	-60.4	-45.5	178.4	-72.9	156.1	-36.8	0	0	111.8	T851 R988 T989 R994 F995 Q996	T851-Q992 PolarHBondContact OG1-NE2 3.17Å; R988-Q992 HydrophobicContact CB-CB 4.34Å; T989-Q992 PolarHBondContact O-N 3.36Å; T989-Q992 VanDerWaalsContact O-N 3.12Å; T989-Q992 VanDerWaalsContact OG1-CD 3.28Å; T989-Q992 WeakPolarHBondContact OG1-CG 3.43Å; T989-Q992 PolarHBondContact OG1-N 2.94Å; T989-Q992 PolarHBondContact OG1-OE1 3.3Å; Q992-R994 VanDerWaalsContact C-N 3.28Å; Q992-R994 PolarHBondContact O-N 3Å; Q992-F995 PolarHBondContact O-N 3.21Å; Q992-Q996 WeakPolarHBondContact O-CB 3.3Å; Q992-Q996 WeakPolarHBondContact O-CG 3.44Å; Q992-Q996 PolarHBondContact O-N 3.1Å
993	L	91.5	Very high	89.7	Confident	58 Å²	58	89.6 Å²	89.6	30%	0.304	46%	0.462	S	S	.	.	H	α-helix	trans	-62.1	-33	178.2	-71.4	171.6	0	0	0	113.1	R988 T989 G991 R997	R988-L993 HydrophobicContact CB-CD2 3.94Å; R988-L993 HydrophobicContact CB-CG 3.91Å; R988-L993 WeakPolarHBondContact O-CD1 3.46Å; T989-L993 WeakPolarHBondContact O-CB 3.48Å; T989-L993 WeakPolarHBondContact O-CG 3.41Å; T989-L993 PolarHBondContact O-N 3.02Å; G991-L993 PolarHBondContact O-N 3.09Å; L993-R997 WeakPolarHBondContact O-CB 3.18Å; L993-R997 VanDerWaalsContact O-CG 3.29Å; L993-R997 WeakPolarHBondContact O-CG 2.95Å; L993-R997 PolarHBondContact O-N 2.96Å
994	R	94.2	Very high	90.5	Very high	81 Å²	81	93.5 Å²	93.5	31%	0.306	48%	0.479	S	S	.	.	H	α-helix	trans	-72.4	-46.9	174.4	-84.1	177.3	-176.5	160	3.3	111.9	V990 G991 Q992 R997 G998 L999 P1002	V990-R994 WeakPolarHBondContact O-CB 3.32Å; V990-R994 WeakPolarHBondContact O-CD 3.46Å; V990-R994 VanDerWaalsContact O-CG 3.25Å; V990-R994 WeakPolarHBondContact O-CG 3.45Å; V990-R994 PolarHBondContact O-N 3.03Å; G991-R994 PolarHBondContact O-N 2.73Å; Q992-R994 VanDerWaalsContact C-N 3.28Å; Q992-R994 PolarHBondContact O-N 3Å; R994-R997 CarbonylContact O-C 3.55Å; R994-R997 PolarHBondContact O-N 3.23Å; R994-R997 VanDerWaalsContact O-N 3.16Å; R994-G998 PolarHBondContact O-N 3.22Å; R994-L999 HydrophobicContact CB-CB 4.4Å; R994-L999 WeakPolarHBondContact CB-O 2.84Å; R994-L999 HydrophobicContact CG-CB 4.17Å; R994-L999 PolarHBondContact O-N 3.14Å; R994-P1002 VanDerWaalsContact NH2-CD 3.33Å
995	F	90.7	Very high	91.1	Very high	181 Å²	181	98.3 Å²	98.3	79%	0.794	51%	0.506	S	S	*	.	H	α-helix	trans	-57.5	-50.2	177.1	-179.6	-100.8	0	0	0	111.4	G991 Q992 R997 G998	G991-F995 PolarHBondContact O-N 3.31Å; Q992-F995 PolarHBondContact O-N 3.21Å; F995-R997 PolarHBondContact O-N 3.45Å; F995-R997 VanDerWaalsContact O-N 3.15Å; F995-G998 PolarHBondContact O-N 3.18Å; F995-G998 VanDerWaalsContact O-N 3.11Å
996	Q	91.2	Very high	91.5	Very high	107 Å²	107	101.3 Å²	101.3	50%	0.5	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.6	178.2	-71.2	176.4	-21	0	0	114.4	R988 Q992	R988-Q996 VanDerWaalsContact CD-OE1 3.23Å; Q992-Q996 WeakPolarHBondContact O-CB 3.3Å; Q992-Q996 WeakPolarHBondContact O-CG 3.44Å; Q992-Q996 PolarHBondContact O-N 3.1Å
997	R	95.2	Very high	91.8	Very high	186 Å²	186	103.7 Å²	103.7	70%	0.702	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	7.2	177.4	-65.4	179.9	178.2	-165	-0.9	113.4	L993 R994 F995 L999	L993-R997 WeakPolarHBondContact O-CB 3.18Å; L993-R997 VanDerWaalsContact O-CG 3.29Å; L993-R997 WeakPolarHBondContact O-CG 2.95Å; L993-R997 PolarHBondContact O-N 2.96Å; R994-R997 CarbonylContact O-C 3.55Å; R994-R997 PolarHBondContact O-N 3.23Å; R994-R997 VanDerWaalsContact O-N 3.16Å; F995-R997 PolarHBondContact O-N 3.45Å; F995-R997 VanDerWaalsContact O-N 3.15Å; R997-L999 HydrophobicContact CB-CD1 3.92Å; R997-L999 HydrophobicContact CB-CG 3.83Å; R997-L999 PolarHBondContact O-N 3.27Å; R997-L999 VanDerWaalsContact O-N 3.12Å
998	G	94.1	Very high	92	Very high	66 Å²	66	103.8 Å²	103.8	68%	0.68	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	10.3	-174.9	0	0	0	0	0	115.6	R994 F995 K1000	R994-G998 PolarHBondContact O-N 3.22Å; F995-G998 PolarHBondContact O-N 3.18Å; F995-G998 VanDerWaalsContact O-N 3.11Å; G998-K1000 PolarHBondContact O-N 3.46Å
999	L	94.4	Very high	92.2	Very high	100 Å²	100	109.2 Å²	109.2	52%	0.524	56%	0.56	S	S	.	*			trans	-82.6	115.5	-169.4	-65.7	177.2	0	0	0	112.3	R994 R997	R994-L999 HydrophobicContact CB-CB 4.4Å; R994-L999 WeakPolarHBondContact CB-O 2.84Å; R994-L999 HydrophobicContact CG-CB 4.17Å; R994-L999 PolarHBondContact O-N 3.14Å; R997-L999 HydrophobicContact CB-CD1 3.92Å; R997-L999 HydrophobicContact CB-CG 3.83Å; R997-L999 PolarHBondContact O-N 3.27Å; R997-L999 VanDerWaalsContact O-N 3.12Å
1000	K	93	Very high	92.3	Very high	194 Å²	194	115.8 Å²	115.8	84%	0.843	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-63.2	144.3	174.7	-66.6	178.2	-179.1	173.9	0	111.4	G998	G998-K1000 PolarHBondContact O-N 3.46Å
1001	P	91.9	Very high	92.4	Very high	79 Å²	79	119.9 Å²	119.9	51%	0.513	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-62.4	137.5	175.5	-22.5	33.7	0	0	0	112.1	Q1003	P1001-Q1003 PolarHBondContact O-N 3.16Å
1002	P	92.3	Very high	92.5	Very high	107 Å²	107	124 Å²	124	70%	0.695	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-71.3	125.7	-179.4	28.5	-34	0	0	0	111.2	R994	R994-P1002 VanDerWaalsContact NH2-CD 3.33Å
1003	Q	90.7	Very high	92.7	Very high	145 Å²	145	130.7 Å²	130.7	68%	0.678	66%	0.656	S	S	*	*			trans	-123	141.6	177.5	-57.9	-176.8	14.1	0	0	109.4	P1001	P1001-Q1003 PolarHBondContact O-N 3.16Å
1004	K	93	Very high	92.7	Very high	167 Å²	167	138.4 Å²	138.4	73%	0.726	68%	0.681	S	S	*	*			trans	-105.2	123.2	171.8	-70.9	-161.5	172.8	-156.1	0	109.1	D1006 A1007 L1008	K1004-D1006 VanDerWaalsContact C-N 3.26Å; K1004-D1006 PolarHBondContact O-N 3Å; K1004-A1007 HydrophobicContact CB-CB 4.02Å; K1004-A1007 WeakPolarHBondContact O-CB 3.38Å; K1004-A1007 PolarHBondContact O-N 3.47Å; K1004-L1008 PolarHBondContact O-N 2.68Å
1005	L	93.6	Very high	92.6	Very high	126 Å²	126	144 Å²	144	66%	0.66	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-59.7	-35.4	-176	-60.1	178.7	0	0	0	112.7	A1007 L1008	L1005-A1007 PolarHBondContact O-N 3.05Å; L1005-L1008 HydrophobicContact CD2-CD1 4.15Å; L1005-L1008 PolarHBondContact O-N 2.59Å
1006	D	91.4	Very high	92.5	Very high	157 Å²	157	140.9 Å²	140.9	84%	0.84	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-73.5	-14.5	177.6	-44.2	-52.7	0	0	0	113.7	K1004	K1004-D1006 VanDerWaalsContact C-N 3.26Å; K1004-D1006 PolarHBondContact O-N 3Å
1007	A	90.1	Very high	92.4	Very high	74 Å²	74	145.4 Å²	145.4	61%	0.612	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-95.6	-4.7	176.9	0	0	0	0	0	112.9	K1004 L1005	K1004-A1007 HydrophobicContact CB-CB 4.02Å; K1004-A1007 WeakPolarHBondContact O-CB 3.38Å; K1004-A1007 PolarHBondContact O-N 3.47Å; L1005-A1007 PolarHBondContact O-N 3.05Å
1008	L	93.6	Very high	92.2	Very high	85 Å²	85	142.1 Å²	142.1	45%	0.445	72%	0.72	S	S	.	*	S	Bend	trans	-79.3	132.7	172.8	-62.3	176.3	0	0	0	109.7	K1004 L1005	K1004-L1008 PolarHBondContact O-N 2.68Å; L1005-L1008 HydrophobicContact CD2-CD1 4.15Å; L1005-L1008 PolarHBondContact O-N 2.59Å
1009	Y	94.4	Very high	92	Very high	235 Å²	235	143 Å²	143	92%	0.922	71%	0.714	S	S	*	*			trans	-69.5	135.1	174.3	-63.9	-69.6	0	0	0	110.5
1010	K	93.2	Very high	91.8	Very high	145 Å²	145	146.5 Å²	146.5	63%	0.63	73%	0.729	S	S	*	*			trans	-122.5	148.4	176.1	-60.8	177.7	-175.2	177.7	0	108.3	I1012	K1010-I1012 WeakPolarHBondContact O-CG1 3.21Å
1011	P	94.2	Very high	91.7	Very high	130 Å²	130	143 Å²	143	84%	0.844	73%	0.727	S	S	*	*			trans	-59.1	141.3	172.6	25.9	-33.7	0	0	0	110.3
1012	I	91.3	Very high	91.6	Very high	132 Å²	132	146.5 Å²	146.5	68%	0.677	74%	0.74	S	S	*	*			trans	-117.6	97.7	-173.9	-52.4	180	0	0	0	110	K1010 R1014	K1010-I1012 WeakPolarHBondContact O-CG1 3.21Å; I1012-R1014 HydrophobicContact CG2-CG 4.31Å
1013	E	92.6	Very high	91.4	Very high	190 Å²	190	152.3 Å²	152.3	89%	0.888	75%	0.748	S	S	*	*			trans	-73.9	126.1	170.1	-65.3	-176.5	-176.1	0	0	110.9
1014	R	92.5	Very high	91.3	Very high	219 Å²	219	148 Å²	148	83%	0.826	73%	0.729	S	S	*	*			trans	-109.3	106.4	179.9	-68.5	-177.6	178.3	-105.3	0.5	110.1	I1012	I1012-R1014 HydrophobicContact CG2-CG 4.31Å
1015	K	91.1	Very high	91.3	Very high	199 Å²	199	143.7 Å²	143.7	87%	0.865	72%	0.719	S	S	*	*			trans	-58.8	141.3	170	-62	-170.4	178.8	-171.2	0	109.9
1016	P	88.9	Confident	91.2	Very high	115 Å²	115	145.8 Å²	145.8	75%	0.747	72%	0.722	S	S	*	*			trans	-63.7	138.1	-179.7	26.5	-34.4	0	0	0	111	V1018	P1016-V1018 PolarHBondContact O-N 2.66Å
1017	Y	89.4	Confident	91.2	Very high	202 Å²	202	145.4 Å²	145.4	79%	0.792	72%	0.715	S	S	*	*			trans	-77.4	110.6	175.8	176.3	-106.1	0	0	0	110.3	P1019	Y1017-P1019 HydrophobicContact CE1-CB 3.91Å
1018	V	91	Very high	91.3	Very high	118 Å²	118	146.1 Å²	146.1	72%	0.715	71%	0.709	S	S	*	*			trans	-93.3	114.2	169.5	-177.3	0	0	0	0	107.8	P1016	P1016-V1018 PolarHBondContact O-N 2.66Å
1019	P	89	Confident	91	Very high	85 Å²	85	144.8 Å²	144.8	55%	0.552	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-68.8	141	176.2	28.7	-33.8	0	0	0	110.6	Y1017	Y1017-P1019 HydrophobicContact CE1-CB 3.91Å
1020	M	91.1	Very high	90.8	Very high	172 Å²	172	141.9 Å²	141.9	85%	0.847	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-67.3	146	170.9	-60.7	-164.5	-52.2	0	0	110.7
1021	P	89.8	Confident	90.7	Very high	121 Å²	121	145.3 Å²	145.3	79%	0.786	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-65.1	148.9	174.5	28.1	-35	0	0	0	111.8	R1023	P1021-R1023 PolarHBondContact O-N 3.5Å
1022	L	89.6	Confident	90.5	Very high	153 Å²	153	141 Å²	141	80%	0.801	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-67.2	118.2	178.7	179.8	64.6	0	0	0	110.9	I1024	L1022-I1024 HydrophobicContact CD2-CG1 4.46Å; L1022-I1024 HydrophobicContact CG-CG1 4.41Å
1023	R	88.7	Confident	90.5	Very high	229 Å²	229	138.8 Å²	138.8	86%	0.864	67%	0.665	S	S	*	*			trans	-100.2	103.4	175.2	-171.3	-179.9	-174.3	-175.8	3.2	110.5	P1021	P1021-R1023 PolarHBondContact O-N 3.5Å
1024	I	89.2	Confident	90.3	Very high	53 Å²	53	139 Å²	139	27%	0.272	66%	0.659	S	S	.	*			trans	-73.5	134.8	175.5	-63.7	167.2	0	0	0	109.3	L1022 L1028 Q1029 P1038	L1022-I1024 HydrophobicContact CD2-CG1 4.46Å; L1022-I1024 HydrophobicContact CG-CG1 4.41Å; I1024-L1028 HydrophobicContact CG2-CB 4.26Å; I1024-L1028 HydrophobicContact CG2-CD2 4.27Å; I1024-L1028 HydrophobicContact CG2-CG 4.27Å; I1024-Q1029 HydrophobicContact CG2-CB 4.13Å; I1024-P1038 HydrophobicContact CD1-CG 4.06Å
1025	P	92.4	Very high	90.3	Very high	78 Å²	78	133 Å²	133	51%	0.506	66%	0.657	S	S	.	*			trans	-61.2	142.1	174.8	-24.3	34.6	0	0	0	112.6	E1027 L1028 Q1029	P1025-E1027 VanDerWaalsContact C-N 3.27Å; P1025-E1027 PolarHBondContact O-N 3.36Å; P1025-L1028 HydrophobicContact CB-CB 4.34Å; P1025-L1028 PolarHBondContact O-N 2.87Å; P1025-L1028 VanDerWaalsContact O-N 3.15Å; P1025-Q1029 WeakPolarHBondContact O-CB 3.3Å; P1025-Q1029 PolarHBondContact O-N 3.35Å
1026	K	91	Very high	90.1	Very high	170 Å²	170	128 Å²	128	74%	0.739	64%	0.643	S	S	*	*	H	α-helix	trans	-56.4	-38.3	-178	-72	-174.6	176.5	-178.1	0	112.9	Q1029 K1030	K1026-Q1029 PolarHBondContact O-N 2.86Å; K1026-K1030 PolarHBondContact O-N 3.22Å
1027	E	93.1	Very high	90	Very high	148 Å²	148	126.7 Å²	126.7	69%	0.692	63%	0.625	S	S	*	*	H	α-helix	trans	-65.4	-47.3	177.2	-70.3	153.1	-134.9	0	0	112.3	P1025 Q1029 K1030 R1031	P1025-E1027 VanDerWaalsContact C-N 3.27Å; P1025-E1027 PolarHBondContact O-N 3.36Å; E1027-Q1029 VanDerWaalsContact C-N 3.31Å; E1027-Q1029 PolarHBondContact O-N 2.97Å; E1027-K1030 WeakPolarHBondContact O-CB 3.38Å; E1027-K1030 PolarHBondContact O-N 2.96Å; E1027-K1030 VanDerWaalsContact O-N 3.09Å; E1027-R1031 PolarHBondContact O-N 2.9Å
1028	L	90.2	Very high	89.7	Confident	90 Å²	90	118.7 Å²	118.7	47%	0.471	60%	0.598	S	S	.	*	H	α-helix	trans	-62.4	-41.4	175	-176.3	58.8	0	0	0	110.4	I1024 P1025 K1030 R1031 L1032	I1024-L1028 HydrophobicContact CG2-CB 4.26Å; I1024-L1028 HydrophobicContact CG2-CD2 4.27Å; I1024-L1028 HydrophobicContact CG2-CG 4.27Å; P1025-L1028 HydrophobicContact CB-CB 4.34Å; P1025-L1028 PolarHBondContact O-N 2.87Å; P1025-L1028 VanDerWaalsContact O-N 3.15Å; L1028-K1030 PolarHBondContact O-N 3.07Å; L1028-R1031 CarbonylContact O-C 3.56Å; L1028-R1031 PolarHBondContact O-N 2.62Å; L1028-R1031 VanDerWaalsContact O-N 3.08Å; L1028-L1032 HydrophobicContact CD1-CG 4.49Å; L1028-L1032 HydrophobicContact CG-CG 4.41Å; L1028-L1032 WeakPolarHBondContact O-CG 3.24Å; L1028-L1032 PolarHBondContact O-N 2.86Å
1029	Q	89.2	Confident	89.3	Confident	56 Å²	56	121.2 Å²	121.2	26%	0.262	60%	0.599	S	S	.	*	H	α-helix	trans	-63.4	-24.8	174.8	-161.3	-171.8	0.8	0	0	113.4	I1024 P1025 K1026 E1027 K1037 P1038	I1024-Q1029 HydrophobicContact CG2-CB 4.13Å; P1025-Q1029 WeakPolarHBondContact O-CB 3.3Å; P1025-Q1029 PolarHBondContact O-N 3.35Å; K1026-Q1029 PolarHBondContact O-N 2.86Å; E1027-Q1029 VanDerWaalsContact C-N 3.31Å; E1027-Q1029 PolarHBondContact O-N 2.97Å; Q1029-K1037 WeakPolarHBondContact O-CE 3.45Å; Q1029-P1038 HydrophobicContact CG-CG 3.99Å
1030	K	89.4	Confident	88.5	Confident	175 Å²	175	123.9 Å²	123.9	76%	0.761	60%	0.604	S	S	*	*	H	α-helix	trans	-75.5	-43.4	168.9	-75.6	-176.4	176.4	-172	0	111.9	K1026 E1027 L1028	K1026-K1030 PolarHBondContact O-N 3.22Å; E1027-K1030 WeakPolarHBondContact O-CB 3.38Å; E1027-K1030 PolarHBondContact O-N 2.96Å; E1027-K1030 VanDerWaalsContact O-N 3.09Å; L1028-K1030 PolarHBondContact O-N 3.07Å
1031	R	91.7	Very high	87.1	Confident	216 Å²	216	125.4 Å²	125.4	82%	0.815	61%	0.606	S	S	*	*	H	α-helix	trans	-78.1	-18.9	-176.9	-67.9	-177.3	-179.3	177.3	1.2	115.1	E1027 L1028	E1027-R1031 PolarHBondContact O-N 2.9Å; L1028-R1031 CarbonylContact O-C 3.56Å; L1028-R1031 PolarHBondContact O-N 2.62Å; L1028-R1031 VanDerWaalsContact O-N 3.08Å
1032	L	89.6	Confident	85.6	Confident	40 Å²	40	123.4 Å²	123.4	21%	0.209	60%	0.6	C	S	.	*	S	Bend	trans	-62.4	135.2	177.4	-81.5	173.8	0	0	0	111.6	L1028 V1036	L1028-L1032 HydrophobicContact CD1-CG 4.49Å; L1028-L1032 HydrophobicContact CG-CG 4.41Å; L1028-L1032 WeakPolarHBondContact O-CG 3.24Å; L1028-L1032 PolarHBondContact O-N 2.86Å; L1032-V1036 HydrophobicContact CD2-CB 4.45Å; L1032-V1036 HydrophobicContact CD2-CG1 4.03Å
1033	P	92	Very high	84.2	Confident	86 Å²	86	123 Å²	123	56%	0.558	60%	0.604	S	S	*	*			trans	-53.3	146.4	171.6	-26.8	35	0	0	0	112.3	A1035 V1036 K1037	P1033-A1035 PolarHBondContact O-N 2.69Å; P1033-A1035 VanDerWaalsContact O-N 3.09Å; P1033-V1036 PolarHBondContact O-N 2.85Å; P1033-K1037 PolarHBondContact O-N 3.19Å
1034	Y	87.6	Confident	82.4	Confident	193 Å²	193	121 Å²	121	76%	0.757	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	-36.9	-173.2	178.5	-113.2	0	0	0	113.9	V1036	Y1034-V1036 VanDerWaalsContact C-N 3.34Å; Y1034-V1036 PolarHBondContact O-N 2.94Å
1035	A	91.4	Very high	80.6	Confident	94 Å²	94	126.3 Å²	126.3	78%	0.777	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-33.3	176.7	0	0	0	0	0	114	P1033	P1033-A1035 PolarHBondContact O-N 2.69Å; P1033-A1035 VanDerWaalsContact O-N 3.09Å
1036	V	88.8	Confident	78.6	Confident	95 Å²	95	131.4 Å²	131.4	58%	0.576	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-17	-176.6	-171	0	0	0	0	111.7	L1032 P1033 Y1034	L1032-V1036 HydrophobicContact CD2-CB 4.45Å; L1032-V1036 HydrophobicContact CD2-CG1 4.03Å; P1033-V1036 PolarHBondContact O-N 2.85Å; Y1034-V1036 VanDerWaalsContact C-N 3.34Å; Y1034-V1036 PolarHBondContact O-N 2.94Å
1037	K	85.9	Confident	76.3	Confident	86 Å²	86	133 Å²	133	37%	0.374	64%	0.641	S	S	.	*	S	Bend	trans	-62.3	122.1	-176.7	-168.1	166.8	-177.2	165.1	0	110.9	Q1029 P1033 K1039	Q1029-K1037 WeakPolarHBondContact O-CE 3.45Å; P1033-K1037 PolarHBondContact O-N 3.19Å; K1037-K1039 PolarHBondContact O-N 3.24Å; K1037-K1039 VanDerWaalsContact O-N 3.15Å
1038	P	83.6	Confident	74.6	Confident	35 Å²	35	129.9 Å²	129.9	23%	0.227	65%	0.649	C	S	.	*			trans	-66.8	118.5	-172.1	26.9	-36.3	0	0	0	110.9	I1024 Q1029 H1040	I1024-P1038 HydrophobicContact CD1-CG 4.06Å; Q1029-P1038 HydrophobicContact CG-CG 3.99Å; P1038-H1040 PolarHBondContact O-N 3.47Å
1039	K	82.5	Confident	72.9	Confident	170 Å²	170	128.8 Å²	128.8	74%	0.739	65%	0.646	S	S	*	*			trans	-75.9	54.5	-179.3	-62.6	-179.8	-178.6	176.3	0	111.9	K1037 K1041	K1037-K1039 PolarHBondContact O-N 3.24Å; K1037-K1039 VanDerWaalsContact O-N 3.15Å; K1039-K1041 PolarHBondContact O-N 2.84Å
1040	H	71.5	Confident	71.4	Confident	142 Å²	142	131.3 Å²	131.3	66%	0.657	66%	0.661	S	S	*	*			trans	-61.6	106.1	168.3	-66.4	-64.8	0	0	0	108.7	P1038 A1042	P1038-H1040 PolarHBondContact O-N 3.47Å; H1040-A1042 VanDerWaalsContact C-N 3.32Å; H1040-A1042 PolarHBondContact O-N 3.46Å
1041	K	61.1	Low	69.9	Low	204 Å²	204	127.5 Å²	127.5	89%	0.887	65%	0.654	S	S	*	*			trans	-64	99.3	162	-65.2	-178.1	-177.5	-179.8	0	106.5	K1039 T1043	K1039-K1041 PolarHBondContact O-N 2.84Å; K1041-T1043 PolarHBondContact O-N 3.44Å
1042	A	60	Low	68.6	Low	79 Å²	79	122.4 Å²	122.4	65%	0.653	64%	0.642	S	S	*	*			trans	-51.5	137.6	158	0	0	0	0	0	107.2	H1040 K1044	H1040-A1042 VanDerWaalsContact C-N 3.32Å; H1040-A1042 PolarHBondContact O-N 3.46Å; A1042-K1044 PolarHBondContact O-N 2.85Å
1043	T	58.4	Low	67.3	Low	144 Å²	144	124 Å²	124	88%	0.883	65%	0.653	S	S	*	*			trans	-58	101.3	-176.4	-47.3	0	0	0	0	108.4	K1041 E1045	K1041-T1043 PolarHBondContact O-N 3.44Å; T1043-E1045 PolarHBondContact O-N 3.17Å
1044	K	51.5	Low	65.9	Low	186 Å²	186	122.1 Å²	122.1	81%	0.809	64%	0.642	S	S	*	*			trans	-73.1	95.3	-175.6	-80.4	-162.6	174.6	-166.8	0	108.8	A1042 R1046	A1042-K1044 PolarHBondContact O-N 2.85Å; K1044-R1046 PolarHBondContact O-N 3.24Å; K1044-R1046 VanDerWaalsContact O-N 3.11Å
1045	E	50.9	Low	64.8	Low	165 Å²	165	120.3 Å²	120.3	77%	0.771	64%	0.638	S	S	*	*			trans	-42.1	113.7	136.9	-69.4	166.9	-172.5	0	0	107.1	T1043 K1047	T1043-E1045 PolarHBondContact O-N 3.17Å; E1045-K1047 PolarHBondContact O-N 3.47Å
1046	R	50.3	Low	63.5	Low	186 Å²	186	122.9 Å²	122.9	70%	0.702	63%	0.634	S	S	*	*			trans	-76.8	78.8	-176.6	-73.8	-175.1	174.6	-171.9	-0.7	108.7	K1044 G1048 V1049	K1044-R1046 PolarHBondContact O-N 3.24Å; K1044-R1046 VanDerWaalsContact O-N 3.11Å; R1046-G1048 PolarHBondContact O-N 2.91Å; R1046-V1049 HydrophobicContact CB-CB 4.47Å; R1046-V1049 PolarHBondContact O-N 2.94Å
1047	K	43.6	Very low	62.4	Low	202 Å²	202	123.5 Å²	123.5	88%	0.878	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	110.4	167.7	-63.7	-164.4	174	-161.2	0	108.3	E1045	E1045-K1047 PolarHBondContact O-N 3.47Å
1048	G	56.5	Low	61.4	Low	83 Å²	83	125.9 Å²	125.9	86%	0.856	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	116.4	-4.5	-170.3	0	0	0	0	0	116.4	R1046	R1046-G1048 PolarHBondContact O-N 2.91Å
1049	V	54.5	Low	60.8	Low	67 Å²	67	131.4 Å²	131.4	41%	0.406	68%	0.677	S	S	.	*	S	Bend	trans	-141.9	124.9	167.7	-178.1	0	0	0	0	109.4	R1046 V1053	R1046-V1049 HydrophobicContact CB-CB 4.47Å; R1046-V1049 PolarHBondContact O-N 2.94Å; V1049-V1053 HydrophobicContact CG1-CB 4.14Å; V1049-V1053 HydrophobicContact CG1-CG1 4.21Å
1050	D	58.1	Low	60.5	Low	110 Å²	110	127.7 Å²	127.7	59%	0.588	68%	0.678	S	S	*	*			trans	-61.5	142.1	179.8	-68.7	-56.4	0	0	0	112.3	I1052 V1053 S1054	D1050-I1052 PolarHBondContact O-N 2.86Å; D1050-I1052 VanDerWaalsContact O-N 3.15Å; D1050-V1053 HydrophobicContact CB-CG2 4.28Å; D1050-V1053 PolarHBondContact O-N 3.44Å; D1050-V1053 VanDerWaalsContact O-N 3.13Å; D1050-S1054 PolarHBondContact O-N 3.41Å; D1050-S1054 VanDerWaalsContact O-N 3.14Å
1051	P	58.8	Low	61	Low	95 Å²	95	124.7 Å²	124.7	62%	0.617	67%	0.667	S	S	*	*	H	α-helix	trans	-58.5	-31.6	178.3	24.2	-33.7	0	0	0	111.4	S1054 K1055	P1051-S1054 PolarHBondContact O-N 3.15Å; P1051-S1054 PolarHBondContact O-OG 3.46Å; P1051-K1055 VanDerWaalsContact O-CB 3.23Å; P1051-K1055 WeakPolarHBondContact O-CB 3.47Å; P1051-K1055 PolarHBondContact O-N 3.3Å
1052	I	63.3	Low	62.2	Low	109 Å²	109	121 Å²	121	56%	0.559	65%	0.653	S	S	*	*	H	α-helix	trans	-55.9	-57.3	173.7	-63.2	172.5	0	0	0	110.9	D1050 S1054 K1055 H1056	D1050-I1052 PolarHBondContact O-N 2.86Å; D1050-I1052 VanDerWaalsContact O-N 3.15Å; I1052-S1054 VanDerWaalsContact C-N 3.28Å; I1052-S1054 PolarHBondContact O-N 2.85Å; I1052-K1055 PolarHBondContact O-N 2.9Å; I1052-H1056 VanDerWaalsContact CG2-CD2 3.47Å; I1052-H1056 WeakPolarHBondContact CG2-CD2 3.42Å; I1052-H1056 PolarHBondContact O-N 3.31Å
1053	V	64.1	Low	63.6	Low	72 Å²	72	122.1 Å²	122.1	44%	0.436	65%	0.653	S	S	.	*	H	α-helix	trans	-58.2	-42.7	179	178.6	0	0	0	0	110.6	V1049 D1050 K1055 H1056 T1057	V1049-V1053 HydrophobicContact CG1-CB 4.14Å; V1049-V1053 HydrophobicContact CG1-CG1 4.21Å; D1050-V1053 HydrophobicContact CB-CG2 4.28Å; D1050-V1053 PolarHBondContact O-N 3.44Å; D1050-V1053 VanDerWaalsContact O-N 3.13Å; V1053-K1055 PolarHBondContact O-N 2.93Å; V1053-H1056 PolarHBondContact O-N 3.37Å; V1053-T1057 HydrophobicContact CG1-CG2 4.32Å; V1053-T1057 WeakPolarHBondContact O-CB 3.17Å; V1053-T1057 WeakPolarHBondContact O-CG2 3.36Å; V1053-T1057 PolarHBondContact O-N 3.4Å; V1053-T1057 PolarHBondContact O-OG1 2.95Å
1054	S	62.3	Low	65	Low	48 Å²	48	118.1 Å²	118.1	34%	0.336	64%	0.635	S	S	.	*	H	α-helix	trans	-66.6	-18	178.1	84.2	0	0	0	0	114.6	D1050 P1051 I1052 Q1058	D1050-S1054 PolarHBondContact O-N 3.41Å; D1050-S1054 VanDerWaalsContact O-N 3.14Å; P1051-S1054 PolarHBondContact O-N 3.15Å; P1051-S1054 PolarHBondContact O-OG 3.46Å; I1052-S1054 VanDerWaalsContact C-N 3.28Å; I1052-S1054 PolarHBondContact O-N 2.85Å; S1054-Q1058 WeakPolarHBondContact O-CG 3.31Å; S1054-Q1058 PolarHBondContact O-NE2 3.45Å
1055	K	63.6	Low	66.9	Low	154 Å²	154	113.4 Å²	113.4	67%	0.67	62%	0.616	S	S	*	*	H	α-helix	trans	-101.9	-24.7	-177.2	-165.8	179.2	-177.5	-171.2	0	112.3	P1051 I1052 V1053	P1051-K1055 VanDerWaalsContact O-CB 3.23Å; P1051-K1055 WeakPolarHBondContact O-CB 3.47Å; P1051-K1055 PolarHBondContact O-N 3.3Å; I1052-K1055 PolarHBondContact O-N 2.9Å; V1053-K1055 PolarHBondContact O-N 2.93Å
1056	H	63.4	Low	68.6	Low	148 Å²	148	112.9 Å²	112.9	69%	0.685	61%	0.606	S	S	*	*	H	α-helix	trans	-91.8	-22.2	174.8	-62	-31.8	0	0	0	113.7	I1052 V1053 Q1058	I1052-H1056 VanDerWaalsContact CG2-CD2 3.47Å; I1052-H1056 WeakPolarHBondContact CG2-CD2 3.42Å; I1052-H1056 PolarHBondContact O-N 3.31Å; V1053-H1056 PolarHBondContact O-N 3.37Å; H1056-Q1058 PolarHBondContact O-N 2.85Å
1057	T	65.6	Low	70.5	Confident	109 Å²	109	110.8 Å²	110.8	67%	0.669	60%	0.603	S	S	*	*	S	Bend	trans	-80.4	2.4	170.5	50.1	0	0	0	0	114	V1053 L1059	V1053-T1057 HydrophobicContact CG1-CG2 4.32Å; V1053-T1057 WeakPolarHBondContact O-CB 3.17Å; V1053-T1057 WeakPolarHBondContact O-CG2 3.36Å; V1053-T1057 PolarHBondContact O-N 3.4Å; V1053-T1057 PolarHBondContact O-OG1 2.95Å; T1057-L1059 PolarHBondContact O-N 3.2Å
1058	Q	66.1	Low	72.8	Confident	136 Å²	136	105.5 Å²	105.5	64%	0.636	59%	0.587	S	S	*	*	S	Bend	trans	-84.4	111.1	173.8	-76.1	176	48.7	0	0	110	S1054 H1056 A1060	S1054-Q1058 WeakPolarHBondContact O-CG 3.31Å; S1054-Q1058 PolarHBondContact O-NE2 3.45Å; H1056-Q1058 PolarHBondContact O-N 2.85Å; Q1058-A1060 PolarHBondContact O-N 3.49Å
1059	L	71.7	Confident	74.5	Confident	151 Å²	151	104.6 Å²	104.6	79%	0.791	56%	0.563	S	S	*	*			trans	-55.3	119.6	171.7	-168.9	77.9	0	0	0	109.9	T1057 L1061	T1057-L1059 PolarHBondContact O-N 3.2Å; L1059-L1061 PolarHBondContact O-N 2.84Å
1060	A	75.3	Confident	76.3	Confident	92 Å²	92	105.3 Å²	105.3	76%	0.76	56%	0.562	S	S	*	*			trans	-75.3	106.3	173.2	0	0	0	0	0	109.1	Q1058 E1062	Q1058-A1060 PolarHBondContact O-N 3.49Å; A1060-E1062 PolarHBondContact O-N 2.85Å
1061	L	82.5	Confident	77.9	Confident	79 Å²	79	103.9 Å²	103.9	41%	0.414	56%	0.556	S	S	.	*			trans	-54.2	132.4	176.7	-66.6	170.3	0	0	0	111	L1059 E1065 R1066 N1069	L1059-L1061 PolarHBondContact O-N 2.84Å; L1061-E1065 HydrophobicContact CB-CB 4.28Å; L1061-E1065 HydrophobicContact CD2-CB 4.23Å; L1061-E1065 WeakPolarHBondContact CD2-OE2 3.04Å; L1061-R1066 HydrophobicContact CB-CB 4.32Å; L1061-N1069 HydrophobicContact CD1-CB 4.49Å
1062	E	85.9	Confident	79.6	Confident	127 Å²	127	103.6 Å²	103.6	59%	0.593	55%	0.548	S	S	*	.			trans	-60.5	158.7	177.6	-72.1	-159.8	157.3	0	0	112.3	A1060 A1064 E1065 R1066	A1060-E1062 PolarHBondContact O-N 2.85Å; E1062-A1064 PolarHBondContact O-N 2.87Å; E1062-A1064 VanDerWaalsContact O-N 3.07Å; E1062-E1065 HydrophobicContact CB-CB 4.5Å; E1062-E1065 HydrophobicContact CB-CG 4.27Å; E1062-E1065 PolarHBondContact N-OE2 3.29Å; E1062-E1065 PolarHBondContact O-N 3.42Å; E1062-E1065 VanDerWaalsContact O-N 3.15Å; E1062-R1066 VanDerWaalsContact O-CB 3.26Å; E1062-R1066 WeakPolarHBondContact O-CB 3.2Å; E1062-R1066 PolarHBondContact O-N 3.18Å
1063	P	88.8	Confident	81.1	Confident	101 Å²	101	104.3 Å²	104.3	66%	0.656	55%	0.547	S	S	*	.	H	α-helix	trans	-54.6	-29.9	177.3	-27.1	35.9	0	0	0	114.3	K1067	P1063-K1067 WeakPolarHBondContact O-CD 3.34Å; P1063-K1067 VanDerWaalsContact O-CG 3.24Å; P1063-K1067 WeakPolarHBondContact O-CG 3.46Å; P1063-K1067 PolarHBondContact O-N 2.95Å
1064	A	88.8	Confident	82.6	Confident	60 Å²	60	107.3 Å²	107.3	50%	0.496	56%	0.558	S	S	.	*	H	α-helix	trans	-73.6	-55.9	173.5	0	0	0	0	0	111.7	E1062 R1066 K1067 V1068	E1062-A1064 PolarHBondContact O-N 2.87Å; E1062-A1064 VanDerWaalsContact O-N 3.07Å; A1064-R1066 PolarHBondContact O-N 3.13Å; A1064-K1067 WeakPolarHBondContact O-CB 3.48Å; A1064-K1067 PolarHBondContact O-N 2.86Å; A1064-K1067 VanDerWaalsContact O-N 3.13Å; A1064-V1068 WeakPolarHBondContact O-CG2 3.43Å; A1064-V1068 PolarHBondContact O-N 2.85Å
1065	E	89.9	Confident	84.1	Confident	88 Å²	88	109.8 Å²	109.8	41%	0.411	57%	0.567	S	S	.	*	H	α-helix	trans	-57.9	-36.6	178.4	-65.1	-166.2	123.2	0	0	113.1	L1061 E1062 V1068 N1069	L1061-E1065 HydrophobicContact CB-CB 4.28Å; L1061-E1065 HydrophobicContact CD2-CB 4.23Å; L1061-E1065 WeakPolarHBondContact CD2-OE2 3.04Å; E1062-E1065 HydrophobicContact CB-CB 4.5Å; E1062-E1065 HydrophobicContact CB-CG 4.27Å; E1062-E1065 PolarHBondContact N-OE2 3.29Å; E1062-E1065 PolarHBondContact O-N 3.42Å; E1062-E1065 VanDerWaalsContact O-N 3.15Å; E1065-V1068 PolarHBondContact O-N 3.27Å; E1065-N1069 VanDerWaalsContact O-CB 3.29Å; E1065-N1069 WeakPolarHBondContact O-CB 3.04Å; E1065-N1069 PolarHBondContact O-N 3.32Å; E1065-N1069 PolarHBondContact O-ND2 2.83Å
1066	R	87.7	Confident	85.7	Confident	153 Å²	153	108.7 Å²	108.7	58%	0.577	56%	0.562	S	S	*	*	H	α-helix	trans	-63.8	-47	176.5	-179.9	173.8	173.6	172.4	-3.7	111.1	L1061 E1062 A1064 N1069 E1070	L1061-R1066 HydrophobicContact CB-CB 4.32Å; E1062-R1066 VanDerWaalsContact O-CB 3.26Å; E1062-R1066 WeakPolarHBondContact O-CB 3.2Å; E1062-R1066 PolarHBondContact O-N 3.18Å; A1064-R1066 PolarHBondContact O-N 3.13Å; R1066-N1069 PolarHBondContact O-N 2.96Å; R1066-E1070 WeakPolarHBondContact CG-OE1 3.41Å; R1066-E1070 IonicContact CZ-OE1 3.37Å; R1066-E1070 IonicContact NE-OE1 2.73Å; R1066-E1070 PolarHBondContact NE-OE1 3.37Å; R1066-E1070 IonicContact NH2-OE1 2.72Å; R1066-E1070 WeakPolarHBondContact O-CB 3.38Å; R1066-E1070 WeakPolarHBondContact O-CG 3.36Å; R1066-E1070 PolarHBondContact O-N 2.9Å
1067	K	90.4	Very high	87.2	Confident	143 Å²	143	106 Å²	106	62%	0.622	56%	0.556	S	S	*	*	H	α-helix	trans	-60	-45.4	174.1	-73.1	169.3	-176.4	176.6	0	111	P1063 A1064 N1069 E1070 V1071	P1063-K1067 WeakPolarHBondContact O-CD 3.34Å; P1063-K1067 VanDerWaalsContact O-CG 3.24Å; P1063-K1067 WeakPolarHBondContact O-CG 3.46Å; P1063-K1067 PolarHBondContact O-N 2.95Å; A1064-K1067 WeakPolarHBondContact O-CB 3.48Å; A1064-K1067 PolarHBondContact O-N 2.86Å; A1064-K1067 VanDerWaalsContact O-N 3.13Å; K1067-N1069 VanDerWaalsContact C-N 3.35Å; K1067-N1069 PolarHBondContact O-N 2.84Å; K1067-E1070 PolarHBondContact O-N 3.03Å; K1067-V1071 WeakPolarHBondContact O-CB 3.3Å; K1067-V1071 WeakPolarHBondContact O-CG2 3.22Å; K1067-V1071 PolarHBondContact O-N 2.84Å
1068	V	91.6	Very high	88.6	Confident	91 Å²	91	105.3 Å²	105.3	55%	0.552	55%	0.552	S	S	*	*	H	α-helix	trans	-59.5	-44.4	175.5	172.7	0	0	0	0	111.2	A1064 E1065 V1071 M1072	A1064-V1068 WeakPolarHBondContact O-CG2 3.43Å; A1064-V1068 PolarHBondContact O-N 2.85Å; E1065-V1068 PolarHBondContact O-N 3.27Å; V1068-V1071 PolarHBondContact O-N 3.42Å; V1068-M1072 HydrophobicContact CG1-CG 4.37Å; V1068-M1072 VanDerWaalsContact O-CB 3.29Å; V1068-M1072 WeakPolarHBondContact O-CB 3.46Å; V1068-M1072 VanDerWaalsContact O-CG 3.24Å; V1068-M1072 WeakPolarHBondContact O-CG 3.43Å; V1068-M1072 PolarHBondContact O-N 3.28Å
1069	N	91.4	Very high	90	Very high	64 Å²	64	104.2 Å²	104.2	34%	0.342	55%	0.546	S	S	.	.	H	α-helix	trans	-67.2	-35.7	177.3	-87.9	-73.8	0	0	0	113.1	L1061 E1065 R1066 K1067 K1073	L1061-N1069 HydrophobicContact CD1-CB 4.49Å; E1065-N1069 VanDerWaalsContact O-CB 3.29Å; E1065-N1069 WeakPolarHBondContact O-CB 3.04Å; E1065-N1069 PolarHBondContact O-N 3.32Å; E1065-N1069 PolarHBondContact O-ND2 2.83Å; R1066-N1069 PolarHBondContact O-N 2.96Å; K1067-N1069 VanDerWaalsContact C-N 3.35Å; K1067-N1069 PolarHBondContact O-N 2.84Å; N1069-K1073 WeakPolarHBondContact O-CB 3.47Å; N1069-K1073 VanDerWaalsContact O-CD 3.31Å; N1069-K1073 WeakPolarHBondContact O-CD 3.37Å; N1069-K1073 WeakPolarHBondContact O-CG 3.41Å; N1069-K1073 PolarHBondContact O-N 3.11Å
1070	E	92.5	Very high	91.2	Very high	82 Å²	82	102.9 Å²	102.9	38%	0.383	54%	0.536	S	S	.	.	H	α-helix	trans	-68.5	-45.1	174.7	-74.2	171.3	-169.9	0	0	111	R1066 K1067 M1072 K1073 M1074	R1066-E1070 WeakPolarHBondContact CG-OE1 3.41Å; R1066-E1070 IonicContact CZ-OE1 3.37Å; R1066-E1070 IonicContact NE-OE1 2.73Å; R1066-E1070 PolarHBondContact NE-OE1 3.37Å; R1066-E1070 IonicContact NH2-OE1 2.72Å; R1066-E1070 WeakPolarHBondContact O-CB 3.38Å; R1066-E1070 WeakPolarHBondContact O-CG 3.36Å; R1066-E1070 PolarHBondContact O-N 2.9Å; K1067-E1070 PolarHBondContact O-N 3.03Å; E1070-M1072 PolarHBondContact O-N 3.3Å; E1070-K1073 WeakPolarHBondContact O-CB 3.44Å; E1070-K1073 PolarHBondContact O-N 2.94Å; E1070-M1074 WeakPolarHBondContact O-CG 3.42Å; E1070-M1074 PolarHBondContact O-N 3.05Å
1071	V	93.2	Very high	92.1	Very high	79 Å²	79	101 Å²	101	48%	0.479	52%	0.517	S	S	.	.	H	α-helix	trans	-59.4	-45.6	171.6	170.5	0	0	0	0	111.5	K1067 V1068 K1073 M1074 L1075	K1067-V1071 WeakPolarHBondContact O-CB 3.3Å; K1067-V1071 WeakPolarHBondContact O-CG2 3.22Å; K1067-V1071 PolarHBondContact O-N 2.84Å; V1068-V1071 PolarHBondContact O-N 3.42Å; V1071-K1073 VanDerWaalsContact C-N 3.33Å; V1071-K1073 PolarHBondContact O-N 2.85Å; V1071-M1074 PolarHBondContact O-N 3.36Å; V1071-L1075 HydrophobicContact CG1-CD1 3.88Å; V1071-L1075 HydrophobicContact CG1-CG 4.31Å; V1071-L1075 WeakPolarHBondContact O-CB 3.46Å; V1071-L1075 WeakPolarHBondContact O-CG 3.39Å; V1071-L1075 PolarHBondContact O-N 2.85Å
1072	M	93.7	Very high	92.7	Very high	89 Å²	89	104.5 Å²	104.5	44%	0.438	53%	0.529	S	S	.	.	H	α-helix	trans	-67	-30.8	178.4	-75	-68.8	-94.8	0	0	113	V1068 E1070 L1075 K1076	V1068-M1072 HydrophobicContact CG1-CG 4.37Å; V1068-M1072 VanDerWaalsContact O-CB 3.29Å; V1068-M1072 WeakPolarHBondContact O-CB 3.46Å; V1068-M1072 VanDerWaalsContact O-CG 3.24Å; V1068-M1072 WeakPolarHBondContact O-CG 3.43Å; V1068-M1072 PolarHBondContact O-N 3.28Å; E1070-M1072 PolarHBondContact O-N 3.3Å; M1072-L1075 HydrophobicContact SD-CD1 4.17Å; M1072-K1076 WeakPolarHBondContact O-CB 3.19Å; M1072-K1076 WeakPolarHBondContact O-CD 3.41Å; M1072-K1076 WeakPolarHBondContact O-CG 3.26Å; M1072-K1076 PolarHBondContact O-N 2.91Å; M1072-K1076 VanDerWaalsContact O-N 3.12Å
1073	K	94.4	Very high	93.1	Very high	124 Å²	124	104 Å²	104	54%	0.539	53%	0.528	S	S	.	.	H	α-helix	trans	-66.2	-49.1	168.9	-73.3	159.9	-169.1	168.3	0	110.5	N1069 E1070 V1071 L1075 K1076 T1077	N1069-K1073 WeakPolarHBondContact O-CB 3.47Å; N1069-K1073 VanDerWaalsContact O-CD 3.31Å; N1069-K1073 WeakPolarHBondContact O-CD 3.37Å; N1069-K1073 WeakPolarHBondContact O-CG 3.41Å; N1069-K1073 PolarHBondContact O-N 3.11Å; E1070-K1073 WeakPolarHBondContact O-CB 3.44Å; E1070-K1073 PolarHBondContact O-N 2.94Å; V1071-K1073 VanDerWaalsContact C-N 3.33Å; V1071-K1073 PolarHBondContact O-N 2.85Å; K1073-L1075 PolarHBondContact O-N 3.1Å; K1073-K1076 PolarHBondContact O-N 3.05Å; K1073-T1077 PolarHBondContact O-N 2.95Å; K1073-T1077 PolarHBondContact O-OG1 2.84Å
1074	M	95	Very high	93.3	Very high	135 Å²	135	103.4 Å²	103.4	67%	0.665	52%	0.523	S	S	*	.	H	α-helix	trans	-58.2	-47.6	177.7	-70.5	178	71.1	0	0	112.1	E1070 V1071 K1076 T1077 V1078	E1070-M1074 WeakPolarHBondContact O-CG 3.42Å; E1070-M1074 PolarHBondContact O-N 3.05Å; V1071-M1074 PolarHBondContact O-N 3.36Å; M1074-K1076 PolarHBondContact O-N 3.46Å; M1074-T1077 PolarHBondContact O-N 2.95Å; M1074-V1078 WeakPolarHBondContact O-CB 3.47Å; M1074-V1078 WeakPolarHBondContact O-CG2 3.2Å; M1074-V1078 PolarHBondContact O-N 3.46Å
1075	L	95	Very high	93.6	Very high	101 Å²	101	107.2 Å²	107.2	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-58.6	-44.9	176.4	-73.4	171.4	0	0	0	111.8	V1071 M1072 K1073 V1078 H1079	V1071-L1075 HydrophobicContact CG1-CD1 3.88Å; V1071-L1075 HydrophobicContact CG1-CG 4.31Å; V1071-L1075 WeakPolarHBondContact O-CB 3.46Å; V1071-L1075 WeakPolarHBondContact O-CG 3.39Å; V1071-L1075 PolarHBondContact O-N 2.85Å; M1072-L1075 HydrophobicContact SD-CD1 4.17Å; K1073-L1075 PolarHBondContact O-N 3.1Å; L1075-V1078 PolarHBondContact O-N 3Å; L1075-H1079 VanDerWaalsContact O-CB 3.23Å; L1075-H1079 WeakPolarHBondContact O-CB 3.4Å; L1075-H1079 PolarHBondContact O-N 3.41Å
1076	K	96.6	Very high	93.8	Very high	130 Å²	130	105.5 Å²	105.5	57%	0.565	53%	0.529	S	S	*	.	H	α-helix	trans	-62	-43.7	176	-74.4	168.4	-175.6	175.8	0	111.8	M1072 K1073 M1074 H1079 Q1080	M1072-K1076 WeakPolarHBondContact O-CB 3.19Å; M1072-K1076 WeakPolarHBondContact O-CD 3.41Å; M1072-K1076 WeakPolarHBondContact O-CG 3.26Å; M1072-K1076 PolarHBondContact O-N 2.91Å; M1072-K1076 VanDerWaalsContact O-N 3.12Å; K1073-K1076 PolarHBondContact O-N 3.05Å; M1074-K1076 PolarHBondContact O-N 3.46Å; K1076-H1079 PolarHBondContact O-N 3.43Å; K1076-Q1080 WeakPolarHBondContact O-CB 3.48Å; K1076-Q1080 VanDerWaalsContact O-CG 3.28Å; K1076-Q1080 WeakPolarHBondContact O-CG 3.44Å; K1076-Q1080 PolarHBondContact O-N 2.86Å
1077	T	95.2	Very high	94.2	Very high	91 Å²	91	101.5 Å²	101.5	56%	0.558	53%	0.525	S	S	*	.	H	α-helix	trans	-66.7	-41.8	177	-57.3	0	0	0	0	112.6	K1073 M1074 Q1080 S1081	K1073-T1077 PolarHBondContact O-N 2.95Å; K1073-T1077 PolarHBondContact O-OG1 2.84Å; M1074-T1077 PolarHBondContact O-N 2.95Å; T1077-Q1080 PolarHBondContact O-N 3.19Å; T1077-S1081 WeakPolarHBondContact O-CB 3.33Å; T1077-S1081 PolarHBondContact O-N 3.35Å
1078	V	95.8	Very high	94.3	Very high	96 Å²	96	97.6 Å²	97.6	58%	0.582	51%	0.513	S	S	*	.	H	α-helix	trans	-64.9	-42.7	175.7	170.4	0	0	0	0	110.8	M1074 L1075 S1081 K1082	M1074-V1078 WeakPolarHBondContact O-CB 3.47Å; M1074-V1078 WeakPolarHBondContact O-CG2 3.2Å; M1074-V1078 PolarHBondContact O-N 3.46Å; L1075-V1078 PolarHBondContact O-N 3Å; V1078-S1081 WeakPolarHBondContact O-CB 3.36Å; V1078-S1081 PolarHBondContact O-N 3.45Å; V1078-K1082 WeakPolarHBondContact O-CB 3.33Å; V1078-K1082 PolarHBondContact O-N 2.65Å
1079	H	95.8	Very high	94.4	Very high	112 Å²	112	96.9 Å²	96.9	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-61.7	-48.2	175.8	-171.8	98.9	0	0	0	111.5	L1075 K1076 S1081 K1082 M1083	L1075-H1079 VanDerWaalsContact O-CB 3.23Å; L1075-H1079 WeakPolarHBondContact O-CB 3.4Å; L1075-H1079 PolarHBondContact O-N 3.41Å; K1076-H1079 PolarHBondContact O-N 3.43Å; H1079-S1081 VanDerWaalsContact C-N 3.34Å; H1079-S1081 PolarHBondContact O-N 2.77Å; H1079-K1082 WeakPolarHBondContact O-CB 3.35Å; H1079-K1082 PolarHBondContact O-N 3.43Å; H1079-K1082 VanDerWaalsContact O-N 3.15Å; H1079-M1083 PolarHBondContact NE2-SD 2.73Å; H1079-M1083 VanDerWaalsContact NE2-SD 3.4Å; H1079-M1083 WeakPolarHBondContact O-CG 3.48Å; H1079-M1083 PolarHBondContact O-N 3.47Å
1080	Q	95.4	Very high	94.6	Very high	123 Å²	123	96.5 Å²	96.5	58%	0.575	51%	0.514	S	S	*	.	H	α-helix	trans	-58.1	-44.2	174	-73.9	172.8	-0.7	0	0	111.9	K1076 T1077 K1082 M1083 V1084	K1076-Q1080 WeakPolarHBondContact O-CB 3.48Å; K1076-Q1080 VanDerWaalsContact O-CG 3.28Å; K1076-Q1080 WeakPolarHBondContact O-CG 3.44Å; K1076-Q1080 PolarHBondContact O-N 2.86Å; T1077-Q1080 PolarHBondContact O-N 3.19Å; Q1080-K1082 VanDerWaalsContact C-N 3.34Å; Q1080-K1082 PolarHBondContact O-N 3.49Å; Q1080-M1083 PolarHBondContact O-N 3.08Å; Q1080-V1084 WeakPolarHBondContact O-CG2 3.25Å; Q1080-V1084 PolarHBondContact O-N 3.3Å
1081	S	93.9	Very high	94.8	Very high	52 Å²	52	101.1 Å²	101.1	36%	0.364	53%	0.528	S	S	.	.	H	α-helix	trans	-60.2	-42.7	175.1	-167.6	0	0	0	0	112	T1077 V1078 H1079 V1084 K1085	T1077-S1081 WeakPolarHBondContact O-CB 3.33Å; T1077-S1081 PolarHBondContact O-N 3.35Å; V1078-S1081 WeakPolarHBondContact O-CB 3.36Å; V1078-S1081 PolarHBondContact O-N 3.45Å; H1079-S1081 VanDerWaalsContact C-N 3.34Å; H1079-S1081 PolarHBondContact O-N 2.77Å; S1081-V1084 PolarHBondContact O-N 3.25Å; S1081-K1085 WeakPolarHBondContact O-CB 3.37Å; S1081-K1085 VanDerWaalsContact O-CG 3.26Å; S1081-K1085 WeakPolarHBondContact O-CG 3.43Å; S1081-K1085 PolarHBondContact O-N 3.47Å
1082	K	95.3	Very high	94.8	Very high	154 Å²	154	101.2 Å²	101.2	67%	0.67	53%	0.525	S	S	*	.	H	α-helix	trans	-64	-44.3	176.3	-168.4	177.4	-178.4	-179.5	0	111.4	V1078 H1079 Q1080 K1085 A1086	V1078-K1082 WeakPolarHBondContact O-CB 3.33Å; V1078-K1082 PolarHBondContact O-N 2.65Å; H1079-K1082 WeakPolarHBondContact O-CB 3.35Å; H1079-K1082 PolarHBondContact O-N 3.43Å; H1079-K1082 VanDerWaalsContact O-N 3.15Å; Q1080-K1082 VanDerWaalsContact C-N 3.34Å; Q1080-K1082 PolarHBondContact O-N 3.49Å; K1082-K1085 PolarHBondContact O-N 3.07Å; K1082-A1086 VanDerWaalsContact O-CB 3.3Å; K1082-A1086 WeakPolarHBondContact O-CB 3.48Å; K1082-A1086 PolarHBondContact O-N 3.15Å
1083	M	94.7	Very high	94.9	Very high	115 Å²	115	104.2 Å²	104.2	57%	0.567	54%	0.535	S	S	*	.	H	α-helix	trans	-64.5	-40.4	175.8	-69.8	-166.8	90.6	0	0	112.9	H1079 Q1080 A1086 S1087	H1079-M1083 PolarHBondContact NE2-SD 2.73Å; H1079-M1083 VanDerWaalsContact NE2-SD 3.4Å; H1079-M1083 WeakPolarHBondContact O-CG 3.48Å; H1079-M1083 PolarHBondContact O-N 3.47Å; Q1080-M1083 PolarHBondContact O-N 3.08Å; M1083-A1086 PolarHBondContact O-N 2.8Å; M1083-S1087 WeakPolarHBondContact O-CB 3.46Å; M1083-S1087 PolarHBondContact O-N 3.36Å; M1083-S1087 PolarHBondContact O-OG 2.95Å
1084	V	93.5	Very high	95	Very high	90 Å²	90	100.2 Å²	100.2	55%	0.545	53%	0.526	S	S	.	.	H	α-helix	trans	-67.3	-41.2	176	172.3	0	0	0	0	111.1	Q1080 S1081 S1087 V1088	Q1080-V1084 WeakPolarHBondContact O-CG2 3.25Å; Q1080-V1084 PolarHBondContact O-N 3.3Å; S1081-V1084 PolarHBondContact O-N 3.25Å; V1084-S1087 PolarHBondContact O-N 3.45Å; V1084-S1087 PolarHBondContact O-OG 2.96Å; V1084-V1088 HydrophobicContact CG1-CG2 4.39Å; V1084-V1088 WeakPolarHBondContact O-CB 3.33Å; V1084-V1088 VanDerWaalsContact O-CG2 3.25Å; V1084-V1088 WeakPolarHBondContact O-CG2 3.19Å; V1084-V1088 PolarHBondContact O-N 3.32Å
1085	K	93.9	Very high	95.1	Very high	139 Å²	139	99.9 Å²	99.9	60%	0.604	52%	0.52	S	S	*	.	H	α-helix	trans	-63	-41.2	173.1	-72.2	167.2	-178.5	172.5	0	111.7	S1081 K1082 T1089	S1081-K1085 WeakPolarHBondContact O-CB 3.37Å; S1081-K1085 VanDerWaalsContact O-CG 3.26Å; S1081-K1085 WeakPolarHBondContact O-CG 3.43Å; S1081-K1085 PolarHBondContact O-N 3.47Å; K1082-K1085 PolarHBondContact O-N 3.07Å; K1085-T1089 WeakPolarHBondContact O-CB 3.34Å; K1085-T1089 WeakPolarHBondContact O-CG2 3.12Å; K1085-T1089 PolarHBondContact O-N 3.42Å; K1085-T1089 PolarHBondContact O-OG1 3.26Å
1086	A	94.9	Very high	95.1	Very high	52 Å²	52	100.2 Å²	100.2	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-46.9	176.3	0	0	0	0	0	112.2	K1082 M1083 T1089 A1090	K1082-A1086 VanDerWaalsContact O-CB 3.3Å; K1082-A1086 WeakPolarHBondContact O-CB 3.48Å; K1082-A1086 PolarHBondContact O-N 3.15Å; M1083-A1086 PolarHBondContact O-N 2.8Å; A1086-T1089 PolarHBondContact O-N 3.26Å; A1086-T1089 PolarHBondContact O-OG1 2.83Å; A1086-T1089 VanDerWaalsContact O-OG1 3.05Å; A1086-A1090 WeakPolarHBondContact O-CB 3.24Å; A1086-A1090 PolarHBondContact O-N 2.81Å
1087	S	95.3	Very high	94.9	Very high	70 Å²	70	101.1 Å²	101.1	49%	0.49	52%	0.52	S	S	.	.	H	α-helix	trans	-68.7	-36.2	179.4	67.5	0	0	0	0	112.7	M1083 V1084 R1091	M1083-S1087 WeakPolarHBondContact O-CB 3.46Å; M1083-S1087 PolarHBondContact O-N 3.36Å; M1083-S1087 PolarHBondContact O-OG 2.95Å; V1084-S1087 PolarHBondContact O-N 3.45Å; V1084-S1087 PolarHBondContact O-OG 2.96Å; S1087-R1091 WeakPolarHBondContact O-CB 3.29Å; S1087-R1091 PolarHBondContact O-N 3.45Å
1088	V	93.3	Very high	94.9	Very high	61 Å²	61	104.3 Å²	104.3	37%	0.37	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-46.2	173.4	169.5	0	0	0	0	111.4	V1084 R1091 I1092	V1084-V1088 HydrophobicContact CG1-CG2 4.39Å; V1084-V1088 WeakPolarHBondContact O-CB 3.33Å; V1084-V1088 VanDerWaalsContact O-CG2 3.25Å; V1084-V1088 WeakPolarHBondContact O-CG2 3.19Å; V1084-V1088 PolarHBondContact O-N 3.32Å; V1088-R1091 PolarHBondContact O-N 3.41Å; V1088-I1092 HydrophobicContact CG1-CD1 4.03Å; V1088-I1092 WeakPolarHBondContact O-CG1 3.38Å; V1088-I1092 PolarHBondContact O-N 3.13Å
1089	T	94.5	Very high	94.9	Very high	76 Å²	76	107.9 Å²	107.9	47%	0.466	53%	0.525	S	S	.	.	H	α-helix	trans	-68.1	-39.8	178.3	50.8	0	0	0	0	112.4	K1085 A1086 R1091 I1092 K1093	K1085-T1089 WeakPolarHBondContact O-CB 3.34Å; K1085-T1089 WeakPolarHBondContact O-CG2 3.12Å; K1085-T1089 PolarHBondContact O-N 3.42Å; K1085-T1089 PolarHBondContact O-OG1 3.26Å; A1086-T1089 PolarHBondContact O-N 3.26Å; A1086-T1089 PolarHBondContact O-OG1 2.83Å; A1086-T1089 VanDerWaalsContact O-OG1 3.05Å; T1089-R1091 PolarHBondContact O-N 2.85Å; T1089-I1092 PolarHBondContact O-N 2.89Å; T1089-K1093 WeakPolarHBondContact O-CG 3.14Å; T1089-K1093 PolarHBondContact O-N 3.42Å
1090	A	95.7	Very high	94.8	Very high	55 Å²	55	109.7 Å²	109.7	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-60.6	-42.8	170.9	0	0	0	0	0	111.8	A1086 I1092 K1093 A1094	A1086-A1090 WeakPolarHBondContact O-CB 3.24Å; A1086-A1090 PolarHBondContact O-N 2.81Å; A1090-I1092 VanDerWaalsContact C-N 3.32Å; A1090-I1092 PolarHBondContact O-N 3.26Å; A1090-K1093 PolarHBondContact O-N 2.85Å; A1090-A1094 VanDerWaalsContact O-CB 3.26Å; A1090-A1094 WeakPolarHBondContact O-CB 3.4Å; A1090-A1094 PolarHBondContact O-N 2.94Å
1091	R	95.3	Very high	94.8	Very high	179 Å²	179	107 Å²	107	68%	0.675	52%	0.521	S	S	*	.	H	α-helix	trans	-64.7	-33.5	176.7	-169.1	177	73.9	163.6	1.6	112.7	S1087 V1088 T1089 K1095	S1087-R1091 WeakPolarHBondContact O-CB 3.29Å; S1087-R1091 PolarHBondContact O-N 3.45Å; V1088-R1091 PolarHBondContact O-N 3.41Å; T1089-R1091 PolarHBondContact O-N 2.85Å; R1091-K1095 WeakPolarHBondContact O-CB 3.11Å; R1091-K1095 PolarHBondContact O-N 2.9Å; R1091-K1095 VanDerWaalsContact O-N 3.13Å
1092	I	94.6	Very high	94.8	Very high	82 Å²	82	107 Å²	107	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-67.1	-54.8	172.6	-68.9	163.2	0	0	0	109.8	V1088 T1089 A1090 A1094 K1095 E1096	V1088-I1092 HydrophobicContact CG1-CD1 4.03Å; V1088-I1092 WeakPolarHBondContact O-CG1 3.38Å; V1088-I1092 PolarHBondContact O-N 3.13Å; T1089-I1092 PolarHBondContact O-N 2.89Å; A1090-I1092 VanDerWaalsContact C-N 3.32Å; A1090-I1092 PolarHBondContact O-N 3.26Å; I1092-A1094 VanDerWaalsContact C-N 3.31Å; I1092-A1094 PolarHBondContact O-N 2.72Å; I1092-K1095 WeakPolarHBondContact O-CA 3.49Å; I1092-K1095 WeakPolarHBondContact O-CB 3.24Å; I1092-K1095 PolarHBondContact O-N 2.94Å; I1092-E1096 PolarHBondContact O-N 3.41Å
1093	K	95.3	Very high	94.7	Very high	151 Å²	151	103.8 Å²	103.8	66%	0.657	51%	0.514	S	S	*	.	H	α-helix	trans	-53.7	-45.4	176.8	-71.3	179.9	176.2	-175.2	0	112.1	T1089 A1090 K1095 E1096 Y1097	T1089-K1093 WeakPolarHBondContact O-CG 3.14Å; T1089-K1093 PolarHBondContact O-N 3.42Å; A1090-K1093 PolarHBondContact O-N 2.85Å; K1093-K1095 VanDerWaalsContact C-N 3.29Å; K1093-K1095 PolarHBondContact O-N 3.12Å; K1093-E1096 PolarHBondContact O-N 3.24Å; K1093-Y1097 WeakPolarHBondContact O-CB 3.43Å; K1093-Y1097 PolarHBondContact O-N 3.4Å
1094	A	96.3	Very high	94.7	Very high	41 Å²	41	104.6 Å²	104.6	34%	0.339	52%	0.515	S	S	.	.	H	α-helix	trans	-69.8	-19.8	177.7	0	0	0	0	0	114.1	A1090 I1092 R1098	A1090-A1094 VanDerWaalsContact O-CB 3.26Å; A1090-A1094 WeakPolarHBondContact O-CB 3.4Å; A1090-A1094 PolarHBondContact O-N 2.94Å; I1092-A1094 VanDerWaalsContact C-N 3.31Å; I1092-A1094 PolarHBondContact O-N 2.72Å; A1094-R1098 WeakPolarHBondContact O-CB 3.49Å; A1094-R1098 WeakPolarHBondContact O-CG 3.36Å; A1094-R1098 PolarHBondContact O-N 2.94Å; A1094-R1098 PolarHBondContact O-NE 3.05Å
1095	K	96	Very high	94.7	Very high	127 Å²	127	104.5 Å²	104.5	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-81.9	-36.7	171.9	-174.8	175.3	-178.7	176.1	0	111.3	R1091 I1092 K1093 R1099	R1091-K1095 WeakPolarHBondContact O-CB 3.11Å; R1091-K1095 PolarHBondContact O-N 2.9Å; R1091-K1095 VanDerWaalsContact O-N 3.13Å; I1092-K1095 WeakPolarHBondContact O-CA 3.49Å; I1092-K1095 WeakPolarHBondContact O-CB 3.24Å; I1092-K1095 PolarHBondContact O-N 2.94Å; K1093-K1095 VanDerWaalsContact C-N 3.29Å; K1093-K1095 PolarHBondContact O-N 3.12Å; K1095-R1099 WeakPolarHBondContact O-CG 3.38Å; K1095-R1099 PolarHBondContact O-N 3.15Å; K1095-R1099 VanDerWaalsContact O-N 3.17Å
1096	E	95	Very high	94.7	Very high	108 Å²	108	104.3 Å²	104.3	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-70.2	-43.1	174.4	-69.7	170.9	-176.4	0	0	111.7	I1092 K1093 R1099 K1100	I1092-E1096 PolarHBondContact O-N 3.41Å; K1093-E1096 PolarHBondContact O-N 3.24Å; E1096-R1099 WeakPolarHBondContact O-CB 3.26Å; E1096-R1099 PolarHBondContact O-N 3.23Å; E1096-K1100 PolarHBondContact O-N 3.46Å
1097	Y	94.4	Very high	94.7	Very high	150 Å²	150	106.9 Å²	106.9	59%	0.588	51%	0.513	S	S	*	.	H	α-helix	trans	-59.1	-48.8	174.3	-176.7	-98.2	0	0	0	111.7	K1093 R1099 K1100 L1101	K1093-Y1097 WeakPolarHBondContact O-CB 3.43Å; K1093-Y1097 PolarHBondContact O-N 3.4Å; Y1097-R1099 VanDerWaalsContact C-N 3.28Å; Y1097-R1099 PolarHBondContact O-N 2.99Å; Y1097-K1100 WeakPolarHBondContact O-CB 3.47Å; Y1097-K1100 PolarHBondContact O-N 2.89Å; Y1097-K1100 VanDerWaalsContact O-N 3.09Å; Y1097-L1101 PolarHBondContact O-N 3.01Å
1098	R	94.5	Very high	94.6	Very high	157 Å²	157	110.7 Å²	110.7	59%	0.592	52%	0.517	S	S	*	.	H	α-helix	trans	-61.8	-31.4	175.8	-79.8	-179.1	-73.6	-174.9	-5.9	113.7	A1094 S1102	A1094-R1098 WeakPolarHBondContact O-CB 3.49Å; A1094-R1098 WeakPolarHBondContact O-CG 3.36Å; A1094-R1098 PolarHBondContact O-N 2.94Å; A1094-R1098 PolarHBondContact O-NE 3.05Å; R1098-S1102 WeakPolarHBondContact O-CB 3.5Å; R1098-S1102 PolarHBondContact O-N 2.65Å
1099	R	94.7	Very high	94.5	Very high	171 Å²	171	112.6 Å²	112.6	65%	0.645	52%	0.522	S	S	*	.	H	α-helix	trans	-65.2	-47	170.9	-80	173.7	163	-173.8	-8.6	111.6	K1095 E1096 Y1097 S1102 T1103	K1095-R1099 WeakPolarHBondContact O-CG 3.38Å; K1095-R1099 PolarHBondContact O-N 3.15Å; K1095-R1099 VanDerWaalsContact O-N 3.17Å; E1096-R1099 WeakPolarHBondContact O-CB 3.26Å; E1096-R1099 PolarHBondContact O-N 3.23Å; Y1097-R1099 VanDerWaalsContact C-N 3.28Å; Y1097-R1099 PolarHBondContact O-N 2.99Å; R1099-S1102 PolarHBondContact O-N 3.42Å; R1099-T1103 PolarHBondContact O-N 2.89Å; R1099-T1103 VanDerWaalsContact O-N 3.1Å; R1099-T1103 PolarHBondContact O-OG1 3.18Å
1100	K	94.8	Very high	94.5	Very high	151 Å²	151	115 Å²	115	66%	0.657	53%	0.529	S	S	*	.	H	α-helix	trans	-61.1	-44.4	176.4	-69.9	179.4	177.6	-176.7	0	111.9	E1096 Y1097 T1103 F1104	E1096-K1100 PolarHBondContact O-N 3.46Å; Y1097-K1100 WeakPolarHBondContact O-CB 3.47Å; Y1097-K1100 PolarHBondContact O-N 2.89Å; Y1097-K1100 VanDerWaalsContact O-N 3.09Å; K1100-T1103 WeakPolarHBondContact CA-OG1 3.45Å; K1100-T1103 PolarHBondContact O-N 3.07Å; K1100-T1103 PolarHBondContact O-OG1 3.28Å; K1100-F1104 PolarHBondContact O-N 2.83Å
1101	L	94.4	Very high	94.3	Very high	66 Å²	66	121.1 Å²	121.1	35%	0.346	54%	0.541	S	S	.	.	H	α-helix	trans	-61.2	-49.5	177.9	-170.4	70.3	0	0	0	111	Y1097 T1103 F1104 E1105	Y1097-L1101 PolarHBondContact O-N 3.01Å; L1101-T1103 VanDerWaalsContact C-N 3.3Å; L1101-T1103 PolarHBondContact O-N 3.01Å; L1101-F1104 CarbonylContact O-C 3.6Å; L1101-F1104 WeakPolarHBondContact O-CA 3.29Å; L1101-F1104 WeakPolarHBondContact O-CB 3.15Å; L1101-F1104 PolarHBondContact O-N 2.97Å; L1101-E1105 HydrophobicContact CG-CG 4.44Å; L1101-E1105 WeakPolarHBondContact O-CG 3.44Å; L1101-E1105 PolarHBondContact O-N 2.93Å
1102	S	94.2	Very high	94.2	Very high	51 Å²	51	115.7 Å²	115.7	36%	0.357	52%	0.523	S	S	.	.	H	α-helix	trans	-61.7	-32.7	177.6	-172.6	0	0	0	0	113.7	R1098 R1099 E1105 K1106	R1098-S1102 WeakPolarHBondContact O-CB 3.5Å; R1098-S1102 PolarHBondContact O-N 2.65Å; R1099-S1102 PolarHBondContact O-N 3.42Å; S1102-E1105 WeakPolarHBondContact CA-OE2 3.31Å; S1102-K1106 WeakPolarHBondContact O-CG 3.24Å; S1102-K1106 PolarHBondContact O-N 2.82Å
1103	T	94.6	Very high	94.1	Very high	87 Å²	87	120.1 Å²	120.1	53%	0.534	53%	0.534	S	S	.	.	H	α-helix	trans	-70.1	-34.4	171.2	45.5	0	0	0	0	113	R1099 K1100 L1101 L1107	R1099-T1103 PolarHBondContact O-N 2.89Å; R1099-T1103 VanDerWaalsContact O-N 3.1Å; R1099-T1103 PolarHBondContact O-OG1 3.18Å; K1100-T1103 WeakPolarHBondContact CA-OG1 3.45Å; K1100-T1103 PolarHBondContact O-N 3.07Å; K1100-T1103 PolarHBondContact O-OG1 3.28Å; L1101-T1103 VanDerWaalsContact C-N 3.3Å; L1101-T1103 PolarHBondContact O-N 3.01Å; T1103-L1107 PolarHBondContact O-N 3.13Å
1104	F	94.4	Very high	94	Very high	132 Å²	132	115.5 Å²	115.5	58%	0.579	52%	0.524	S	S	*	.	H	α-helix	trans	-72.1	-42.8	176.8	-175.1	-95.4	0	0	0	112	K1100 L1101 K1106 L1107 R1108	K1100-F1104 PolarHBondContact O-N 2.83Å; L1101-F1104 CarbonylContact O-C 3.6Å; L1101-F1104 WeakPolarHBondContact O-CA 3.29Å; L1101-F1104 WeakPolarHBondContact O-CB 3.15Å; L1101-F1104 PolarHBondContact O-N 2.97Å; F1104-K1106 VanDerWaalsContact C-N 3.33Å; F1104-K1106 PolarHBondContact O-N 2.8Å; F1104-L1107 WeakPolarHBondContact O-CB 3.37Å; F1104-L1107 PolarHBondContact O-N 3.07Å; F1104-L1107 VanDerWaalsContact O-N 3.16Å; F1104-R1108 WeakPolarHBondContact O-CB 3.48Å; F1104-R1108 PolarHBondContact O-N 3.24Å
1105	E	92.8	Very high	93.8	Very high	88 Å²	88	119.1 Å²	119.1	41%	0.411	53%	0.534	S	S	.	.	H	α-helix	trans	-57.9	-43.1	174.4	-71.2	165.9	168	0	0	111.7	L1101 S1102 R1108 Q1109	L1101-E1105 HydrophobicContact CG-CG 4.44Å; L1101-E1105 WeakPolarHBondContact O-CG 3.44Å; L1101-E1105 PolarHBondContact O-N 2.93Å; S1102-E1105 WeakPolarHBondContact CA-OE2 3.31Å; E1105-R1108 PolarHBondContact O-N 3.42Å; E1105-Q1109 WeakPolarHBondContact O-CB 3.18Å; E1105-Q1109 WeakPolarHBondContact O-CG 3.44Å; E1105-Q1109 PolarHBondContact O-N 3.12Å
1106	K	93.9	Very high	93.7	Very high	136 Å²	136	120.2 Å²	120.2	59%	0.591	54%	0.539	S	S	*	.	H	α-helix	trans	-62.4	-42.7	174.4	-74.4	177.4	180	-169.6	0	112.6	S1102 F1104 R1108 Q1109 M1110	S1102-K1106 WeakPolarHBondContact O-CG 3.24Å; S1102-K1106 PolarHBondContact O-N 2.82Å; F1104-K1106 VanDerWaalsContact C-N 3.33Å; F1104-K1106 PolarHBondContact O-N 2.8Å; K1106-R1108 VanDerWaalsContact C-N 3.34Å; K1106-Q1109 PolarHBondContact O-N 3.13Å; K1106-M1110 VanDerWaalsContact O-CG 3.3Å; K1106-M1110 WeakPolarHBondContact O-CG 3.24Å; K1106-M1110 PolarHBondContact O-N 3.21Å
1107	L	94	Very high	93.6	Very high	106 Å²	106	123.1 Å²	123.1	56%	0.555	55%	0.55	S	S	*	.	H	α-helix	trans	-63.2	-39.9	174.5	-88.9	160.8	0	0	0	112	T1103 F1104 M1110 R1111	T1103-L1107 PolarHBondContact O-N 3.13Å; F1104-L1107 WeakPolarHBondContact O-CB 3.37Å; F1104-L1107 PolarHBondContact O-N 3.07Å; F1104-L1107 VanDerWaalsContact O-N 3.16Å; L1107-M1110 PolarHBondContact O-N 2.86Å; L1107-R1111 WeakPolarHBondContact O-CG 3.23Å; L1107-R1111 PolarHBondContact O-N 2.96Å; L1107-R1111 VanDerWaalsContact O-N 3.14Å
1108	R	93.5	Very high	93.4	Very high	149 Å²	149	125 Å²	125	56%	0.562	56%	0.556	S	S	*	*	H	α-helix	trans	-63.6	-49.9	174.7	179.1	178.1	167.5	165.1	2.2	111.5	F1104 E1105 K1106 M1110 R1111 E1112	F1104-R1108 WeakPolarHBondContact O-CB 3.48Å; F1104-R1108 PolarHBondContact O-N 3.24Å; E1105-R1108 PolarHBondContact O-N 3.42Å; K1106-R1108 VanDerWaalsContact C-N 3.34Å; R1108-M1110 VanDerWaalsContact C-N 3.28Å; R1108-M1110 PolarHBondContact O-N 2.88Å; R1108-R1111 WeakPolarHBondContact O-CB 3.43Å; R1108-R1111 PolarHBondContact O-N 3.44Å; R1108-E1112 HydrophobicContact CG-CG 4.42Å; R1108-E1112 IonicContact CZ-OE1 3.67Å; R1108-E1112 VanDerWaalsContact CZ-OE1 3.29Å; R1108-E1112 IonicContact NE-OE1 3.47Å; R1108-E1112 PolarHBondContact NE-OE1 3.25Å; R1108-E1112 IonicContact NH2-OE1 3.18Å; R1108-E1112 PolarHBondContact NH2-OE1 3.3Å; R1108-E1112 WeakPolarHBondContact O-CG 3.37Å; R1108-E1112 PolarHBondContact O-N 3.23Å
1109	Q	92.4	Very high	93.3	Very high	101 Å²	101	121.8 Å²	121.8	47%	0.472	55%	0.55	S	S	.	.	H	α-helix	trans	-59.6	-36.5	177	-73.1	174.7	1.9	0	0	112.5	E1105 K1106 R1113	E1105-Q1109 WeakPolarHBondContact O-CB 3.18Å; E1105-Q1109 WeakPolarHBondContact O-CG 3.44Å; E1105-Q1109 PolarHBondContact O-N 3.12Å; K1106-Q1109 PolarHBondContact O-N 3.13Å; Q1109-R1113 WeakPolarHBondContact O-CB 3.38Å; Q1109-R1113 WeakPolarHBondContact O-CG 3.28Å; Q1109-R1113 PolarHBondContact O-N 2.9Å
1110	M	93	Very high	93	Very high	126 Å²	126	117.2 Å²	117.2	62%	0.621	54%	0.543	S	S	*	.	H	α-helix	trans	-64.9	-39.9	173.8	-74.3	-67.3	-71	0	0	112.3	K1106 L1107 R1108 A1114	K1106-M1110 VanDerWaalsContact O-CG 3.3Å; K1106-M1110 WeakPolarHBondContact O-CG 3.24Å; K1106-M1110 PolarHBondContact O-N 3.21Å; L1107-M1110 PolarHBondContact O-N 2.86Å; R1108-M1110 VanDerWaalsContact C-N 3.28Å; R1108-M1110 PolarHBondContact O-N 2.88Å; M1110-A1114 WeakPolarHBondContact O-CB 3.37Å; M1110-A1114 PolarHBondContact O-N 3.41Å
1111	R	93.2	Very high	92.8	Very high	184 Å²	184	112.8 Å²	112.8	69%	0.694	53%	0.531	S	S	*	.	H	α-helix	trans	-64.8	-50.7	174	-69.8	175.1	-179.9	-172.1	-1	111.5	L1107 R1108 R1113 A1114 E1115	L1107-R1111 WeakPolarHBondContact O-CG 3.23Å; L1107-R1111 PolarHBondContact O-N 2.96Å; L1107-R1111 VanDerWaalsContact O-N 3.14Å; R1108-R1111 WeakPolarHBondContact O-CB 3.43Å; R1108-R1111 PolarHBondContact O-N 3.44Å; R1111-R1113 VanDerWaalsContact C-N 3.27Å; R1111-R1113 PolarHBondContact O-N 3.05Å; R1111-A1114 PolarHBondContact O-N 2.89Å; R1111-A1114 VanDerWaalsContact O-N 3.11Å; R1111-E1115 WeakPolarHBondContact O-CB 3.36Å; R1111-E1115 PolarHBondContact O-N 3.19Å
1112	E	92	Very high	92.7	Very high	65 Å²	65	116.4 Å²	116.4	30%	0.304	54%	0.544	S	S	.	.	H	α-helix	trans	-59.6	-36.1	179	-69.7	172.9	172.5	0	0	112.1	R1108 K1116	R1108-E1112 HydrophobicContact CG-CG 4.42Å; R1108-E1112 IonicContact CZ-OE1 3.67Å; R1108-E1112 VanDerWaalsContact CZ-OE1 3.29Å; R1108-E1112 IonicContact NE-OE1 3.47Å; R1108-E1112 PolarHBondContact NE-OE1 3.25Å; R1108-E1112 IonicContact NH2-OE1 3.18Å; R1108-E1112 PolarHBondContact NH2-OE1 3.3Å; R1108-E1112 WeakPolarHBondContact O-CG 3.37Å; R1108-E1112 PolarHBondContact O-N 3.23Å; E1112-K1116 WeakPolarHBondContact O-CB 3.47Å; E1112-K1116 VanDerWaalsContact O-CG 3.25Å; E1112-K1116 WeakPolarHBondContact O-CG 3.37Å; E1112-K1116 PolarHBondContact O-N 3.15Å
1113	R	93.7	Very high	92.5	Very high	176 Å²	176	118 Å²	118	66%	0.664	55%	0.548	S	S	*	.	H	α-helix	trans	-67.7	-45	172.8	-75.5	172	179.9	-158.6	-1.7	112.7	Q1109 R1111 E1115 K1116 K1117	Q1109-R1113 WeakPolarHBondContact O-CB 3.38Å; Q1109-R1113 WeakPolarHBondContact O-CG 3.28Å; Q1109-R1113 PolarHBondContact O-N 2.9Å; R1111-R1113 VanDerWaalsContact C-N 3.27Å; R1111-R1113 PolarHBondContact O-N 3.05Å; R1113-E1115 VanDerWaalsContact C-N 3.34Å; R1113-K1116 PolarHBondContact O-N 2.8Å; R1113-K1117 PolarHBondContact O-N 3.11Å
1114	A	93	Very high	92.3	Very high	53 Å²	53	116.6 Å²	116.6	44%	0.438	54%	0.539	S	S	.	.	H	α-helix	trans	-65.1	-38.8	178.1	0	0	0	0	0	111.9	M1110 R1111 K1117 R1118	M1110-A1114 WeakPolarHBondContact O-CB 3.37Å; M1110-A1114 PolarHBondContact O-N 3.41Å; R1111-A1114 PolarHBondContact O-N 2.89Å; R1111-A1114 VanDerWaalsContact O-N 3.11Å; A1114-K1117 PolarHBondContact O-N 2.8Å; A1114-R1118 WeakPolarHBondContact O-CG 3.44Å; A1114-R1118 PolarHBondContact O-N 2.98Å
1115	E	91.9	Very high	91.9	Very high	118 Å²	118	114.2 Å²	114.2	55%	0.551	53%	0.53	S	S	*	.	H	α-helix	trans	-65.9	-48	174.6	-177.1	162.6	-138.3	0	0	111.8	R1111 R1113 K1117 R1118 I1119	R1111-E1115 WeakPolarHBondContact O-CB 3.36Å; R1111-E1115 PolarHBondContact O-N 3.19Å; R1113-E1115 VanDerWaalsContact C-N 3.34Å; E1115-K1117 VanDerWaalsContact C-N 3.32Å; E1115-K1117 PolarHBondContact O-N 3.44Å; E1115-R1118 WeakPolarHBondContact O-CB 3.44Å; E1115-R1118 PolarHBondContact O-N 2.77Å; E1115-R1118 VanDerWaalsContact O-N 3.1Å; E1115-I1119 HydrophobicContact CG-CD1 3.88Å; E1115-I1119 WeakPolarHBondContact O-CG1 3.49Å; E1115-I1119 PolarHBondContact O-N 3.37Å
1116	K	93.2	Very high	91.6	Very high	150 Å²	150	118.6 Å²	118.6	65%	0.652	54%	0.543	S	S	*	.	H	α-helix	trans	-58	-40.7	173	-76.3	176.1	178.6	-175.4	0	112.5	E1112 R1113 I1119 C1120	E1112-K1116 WeakPolarHBondContact O-CB 3.47Å; E1112-K1116 VanDerWaalsContact O-CG 3.25Å; E1112-K1116 WeakPolarHBondContact O-CG 3.37Å; E1112-K1116 PolarHBondContact O-N 3.15Å; R1113-K1116 PolarHBondContact O-N 2.8Å; K1116-I1119 PolarHBondContact O-N 2.84Å; K1116-C1120 VanDerWaalsContact O-CB 3.24Å; K1116-C1120 WeakPolarHBondContact O-CB 3.41Å; K1116-C1120 PolarHBondContact O-N 2.92Å
1117	K	92.2	Very high	91.3	Very high	169 Å²	169	117.6 Å²	117.6	74%	0.735	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-40.7	174.4	-169.2	174.1	-178	179.7	0	111.9	R1113 A1114 E1115 S1121	R1113-K1117 PolarHBondContact O-N 3.11Å; A1114-K1117 PolarHBondContact O-N 2.8Å; E1115-K1117 VanDerWaalsContact C-N 3.32Å; E1115-K1117 PolarHBondContact O-N 3.44Å; K1117-S1121 VanDerWaalsContact O-CB 3.24Å; K1117-S1121 WeakPolarHBondContact O-CB 3.49Å; K1117-S1121 PolarHBondContact O-N 2.95Å
1118	R	91	Very high	90.7	Very high	190 Å²	190	118.6 Å²	118.6	72%	0.717	54%	0.536	S	S	*	.	H	α-helix	trans	-64.9	-42.4	175.1	-76.1	173.2	170.4	-169.5	-4.1	112.8	A1114 E1115 K1122	A1114-R1118 WeakPolarHBondContact O-CG 3.44Å; A1114-R1118 PolarHBondContact O-N 2.98Å; E1115-R1118 WeakPolarHBondContact O-CB 3.44Å; E1115-R1118 PolarHBondContact O-N 2.77Å; E1115-R1118 VanDerWaalsContact O-N 3.1Å; R1118-K1122 WeakPolarHBondContact O-CG 3.37Å; R1118-K1122 PolarHBondContact O-N 3Å
1119	I	93.1	Very high	90.2	Very high	89 Å²	89	113.3 Å²	113.3	46%	0.456	52%	0.523	S	S	.	.	H	α-helix	trans	-66.5	-49.7	178.1	-67.8	167	0	0	0	110.3	E1115 K1116 S1121 K1122 L1123	E1115-I1119 HydrophobicContact CG-CD1 3.88Å; E1115-I1119 WeakPolarHBondContact O-CG1 3.49Å; E1115-I1119 PolarHBondContact O-N 3.37Å; K1116-I1119 PolarHBondContact O-N 2.84Å; I1119-S1121 PolarHBondContact O-N 3.15Å; I1119-K1122 PolarHBondContact O-N 2.94Å; I1119-L1123 HydrophobicContact CG2-CD1 4.03Å; I1119-L1123 WeakPolarHBondContact O-CG 3.5Å; I1119-L1123 PolarHBondContact O-N 3.08Å
1120	C	88.5	Confident	89.9	Confident	75 Å²	75	111.2 Å²	111.2	51%	0.507	52%	0.522	S	S	.	.	H	α-helix	trans	-57	-49.1	176.7	178.3	0	0	0	0	111.4	K1116 K1122 L1123 T1124	K1116-C1120 VanDerWaalsContact O-CB 3.24Å; K1116-C1120 WeakPolarHBondContact O-CB 3.41Å; K1116-C1120 PolarHBondContact O-N 2.92Å; C1120-K1122 VanDerWaalsContact C-N 3.35Å; C1120-K1122 PolarHBondContact O-N 3.29Å; C1120-L1123 PolarHBondContact O-N 3Å; C1120-T1124 PolarHBondContact O-N 3.27Å; C1120-T1124 PolarHBondContact O-OG1 3.49Å
1121	S	89.8	Confident	89.3	Confident	57 Å²	57	112.6 Å²	112.6	40%	0.399	53%	0.525	S	S	.	.	H	α-helix	trans	-55.3	-46	175.1	177.1	0	0	0	0	112.5	K1117 I1119 L1123 T1124 Q1125	K1117-S1121 VanDerWaalsContact O-CB 3.24Å; K1117-S1121 WeakPolarHBondContact O-CB 3.49Å; K1117-S1121 PolarHBondContact O-N 2.95Å; I1119-S1121 PolarHBondContact O-N 3.15Å; S1121-L1123 VanDerWaalsContact C-N 3.35Å; S1121-L1123 PolarHBondContact O-N 3.09Å; S1121-T1124 PolarHBondContact O-N 3.45Å; S1121-Q1125 WeakPolarHBondContact O-CB 3.29Å; S1121-Q1125 VanDerWaalsContact O-CG 3.29Å; S1121-Q1125 WeakPolarHBondContact O-CG 3.5Å; S1121-Q1125 PolarHBondContact O-N 2.86Å
1122	K	91.4	Very high	88.6	Confident	142 Å²	142	111 Å²	111	62%	0.617	52%	0.523	S	S	*	.	H	α-helix	trans	-63.9	-35.2	175.8	-76.4	-175.3	175.6	-170.5	0	113.3	R1118 I1119 C1120 R1126	R1118-K1122 WeakPolarHBondContact O-CG 3.37Å; R1118-K1122 PolarHBondContact O-N 3Å; I1119-K1122 PolarHBondContact O-N 2.94Å; C1120-K1122 VanDerWaalsContact C-N 3.35Å; C1120-K1122 PolarHBondContact O-N 3.29Å; K1122-R1126 WeakPolarHBondContact O-CG 3.39Å; K1122-R1126 PolarHBondContact O-N 3.26Å
1123	L	91.2	Very high	87.9	Confident	85 Å²	85	115 Å²	115	45%	0.445	54%	0.539	S	S	.	.	H	α-helix	trans	-68.2	-51.3	175.1	-70.4	170.4	0	0	0	111.1	I1119 C1120 S1121 Q1125 R1126 E1127	I1119-L1123 HydrophobicContact CG2-CD1 4.03Å; I1119-L1123 WeakPolarHBondContact O-CG 3.5Å; I1119-L1123 PolarHBondContact O-N 3.08Å; C1120-L1123 PolarHBondContact O-N 3Å; S1121-L1123 VanDerWaalsContact C-N 3.35Å; S1121-L1123 PolarHBondContact O-N 3.09Å; L1123-Q1125 VanDerWaalsContact C-N 3.26Å; L1123-Q1125 PolarHBondContact O-N 3.25Å; L1123-R1126 CarbonylContact O-C 3.6Å; L1123-R1126 WeakPolarHBondContact O-CA 3.42Å; L1123-R1126 WeakPolarHBondContact O-CB 3.46Å; L1123-R1126 PolarHBondContact O-N 3.03Å; L1123-E1127 WeakPolarHBondContact O-CG 3.27Å; L1123-E1127 PolarHBondContact O-N 3.29Å
1124	T	89.4	Confident	87.3	Confident	57 Å²	57	110.1 Å²	110.1	35%	0.35	54%	0.537	S	S	.	.	H	α-helix	trans	-61.3	-34.1	175.9	-50.5	0	0	0	0	112.1	C1120 S1121 R1128	C1120-T1124 PolarHBondContact O-N 3.27Å; C1120-T1124 PolarHBondContact O-OG1 3.49Å; S1121-T1124 PolarHBondContact O-N 3.45Å; T1124-R1128 WeakPolarHBondContact O-CB 3.4Å; T1124-R1128 WeakPolarHBondContact O-CG 3.49Å; T1124-R1128 PolarHBondContact O-N 3.42Å
1125	Q	86.6	Confident	86.5	Confident	82 Å²	82	114.7 Å²	114.7	38%	0.383	55%	0.553	S	S	.	*	H	α-helix	trans	-63.2	-43.8	171.8	-79.8	-172.9	-14.4	0	0	112	K623 S1121 L1123 S1129	K623-Q1125 PolarHBondContact NZ-O 3.03Å; S1121-Q1125 WeakPolarHBondContact O-CB 3.29Å; S1121-Q1125 VanDerWaalsContact O-CG 3.29Å; S1121-Q1125 WeakPolarHBondContact O-CG 3.5Å; S1121-Q1125 PolarHBondContact O-N 2.86Å; L1123-Q1125 VanDerWaalsContact C-N 3.26Å; L1123-Q1125 PolarHBondContact O-N 3.25Å; Q1125-S1129 PolarHBondContact O-N 3.05Å; Q1125-S1129 VanDerWaalsContact O-N 3.13Å
1126	R	87	Confident	85.2	Confident	181 Å²	181	114.8 Å²	114.8	68%	0.683	56%	0.562	S	S	*	*	H	α-helix	trans	-63.7	-48.2	174.4	-77.7	175.1	171.8	-171.9	-3.5	111.7	K1122 L1123 S1129 A1130	K1122-R1126 WeakPolarHBondContact O-CG 3.39Å; K1122-R1126 PolarHBondContact O-N 3.26Å; L1123-R1126 CarbonylContact O-C 3.6Å; L1123-R1126 WeakPolarHBondContact O-CA 3.42Å; L1123-R1126 WeakPolarHBondContact O-CB 3.46Å; L1123-R1126 PolarHBondContact O-N 3.03Å; R1126-S1129 CarbonylContact O-C 3.25Å; R1126-S1129 WeakPolarHBondContact O-CA 3.23Å; R1126-S1129 WeakPolarHBondContact O-CB 3.41Å; R1126-S1129 PolarHBondContact O-N 3.42Å; R1126-S1129 PolarHBondContact O-OG 2.94Å; R1126-A1130 PolarHBondContact O-N 3.46Å
1127	E	86.3	Confident	83.3	Confident	114 Å²	114	114.5 Å²	114.5	53%	0.533	59%	0.587	S	S	.	*	H	α-helix	trans	-59.9	-49.2	177.9	-71.6	168.9	-178.9	0	0	112.2	L1123 S1129 A1130 K1131	L1123-E1127 WeakPolarHBondContact O-CG 3.27Å; L1123-E1127 PolarHBondContact O-N 3.29Å; E1127-S1129 PolarHBondContact O-N 3.45Å; E1127-A1130 PolarHBondContact O-N 3.23Å; E1127-A1130 VanDerWaalsContact O-N 3.13Å; E1127-K1131 PolarHBondContact O-N 2.67Å
1128	R	82.3	Confident	82.8	Confident	127 Å²	127	111.8 Å²	111.8	48%	0.479	58%	0.58	S	S	.	*	H	α-helix	trans	-56.4	-33.2	172.5	-78.2	-170.6	-176.1	-173.7	5.8	111.3	T1124 K1132	T1124-R1128 WeakPolarHBondContact O-CB 3.4Å; T1124-R1128 WeakPolarHBondContact O-CG 3.49Å; T1124-R1128 PolarHBondContact O-N 3.42Å; R1128-K1132 WeakPolarHBondContact O-CB 3.2Å; R1128-K1132 PolarHBondContact O-N 3.05Å; R1128-K1132 VanDerWaalsContact O-N 3.07Å
1129	S	82.9	Confident	82.4	Confident	39 Å²	39	107.6 Å²	107.6	27%	0.273	57%	0.573	S	S	.	*	H	α-helix	trans	-77.1	-35	176.4	80.1	0	0	0	0	113.7	Q1125 R1126 E1127 K1133	Q1125-S1129 PolarHBondContact O-N 3.05Å; Q1125-S1129 VanDerWaalsContact O-N 3.13Å; R1126-S1129 CarbonylContact O-C 3.25Å; R1126-S1129 WeakPolarHBondContact O-CA 3.23Å; R1126-S1129 WeakPolarHBondContact O-CB 3.41Å; R1126-S1129 PolarHBondContact O-N 3.42Å; R1126-S1129 PolarHBondContact O-OG 2.94Å; E1127-S1129 PolarHBondContact O-N 3.45Å; S1129-K1133 WeakPolarHBondContact O-CG 3.49Å; S1129-K1133 PolarHBondContact O-N 2.89Å
1130	A	85.7	Confident	81.8	Confident	57 Å²	57	108.7 Å²	108.7	47%	0.471	58%	0.579	S	S	.	*	H	α-helix	trans	-68.8	-44.2	174.9	0	0	0	0	0	110.8	R1126 E1127 K1133 A1134	R1126-A1130 PolarHBondContact O-N 3.46Å; E1127-A1130 PolarHBondContact O-N 3.23Å; E1127-A1130 VanDerWaalsContact O-N 3.13Å; A1130-K1133 PolarHBondContact O-N 2.94Å; A1130-A1134 WeakPolarHBondContact O-CB 3.49Å; A1130-A1134 PolarHBondContact O-N 3.27Å
1131	K	81.6	Confident	81.4	Confident	155 Å²	155	110.6 Å²	110.6	67%	0.674	58%	0.583	S	S	*	*	H	α-helix	trans	-59.4	-46.8	171.6	-72.2	-170.2	176.2	-172.2	0	111.8	E1127 K1133 A1134 L1135	E1127-K1131 PolarHBondContact O-N 2.67Å; K1131-K1133 VanDerWaalsContact C-N 3.35Å; K1131-K1133 PolarHBondContact O-N 3.03Å; K1131-A1134 PolarHBondContact O-N 2.88Å; K1131-L1135 WeakPolarHBondContact O-CB 3.47Å; K1131-L1135 PolarHBondContact O-N 3.06Å
1132	K	77.5	Confident	80.9	Confident	149 Å²	149	114 Å²	114	65%	0.648	60%	0.595	S	S	*	*	H	α-helix	trans	-59.3	-42.2	174.3	-81.4	-167.4	176.1	-175.4	0	112.2	R1128 L1135 T1136	R1128-K1132 WeakPolarHBondContact O-CB 3.2Å; R1128-K1132 PolarHBondContact O-N 3.05Å; R1128-K1132 VanDerWaalsContact O-N 3.07Å; K1132-L1135 PolarHBondContact O-N 3.13Å; K1132-T1136 WeakPolarHBondContact O-CG2 3.35Å; K1132-T1136 PolarHBondContact O-N 3.31Å; K1132-T1136 PolarHBondContact O-OG1 3.14Å; K1132-T1136 VanDerWaalsContact O-OG1 3.12Å
1133	K	78.1	Confident	80.2	Confident	150 Å²	150	112.1 Å²	112.1	65%	0.652	59%	0.593	S	S	*	*	H	α-helix	trans	-60.2	-47.2	175.1	-77.4	177.2	178.8	-177.8	0	112.6	S1129 A1130 K1131 L1135 T1136 A1137	S1129-K1133 WeakPolarHBondContact O-CG 3.49Å; S1129-K1133 PolarHBondContact O-N 2.89Å; A1130-K1133 PolarHBondContact O-N 2.94Å; K1131-K1133 VanDerWaalsContact C-N 3.35Å; K1131-K1133 PolarHBondContact O-N 3.03Å; K1133-L1135 PolarHBondContact O-N 3.44Å; K1133-T1136 WeakPolarHBondContact CA-OG1 3.45Å; K1133-T1136 CarbonylContact O-C 3.46Å; K1133-T1136 PolarHBondContact O-N 2.9Å; K1133-T1136 PolarHBondContact O-OG1 3.42Å; K1133-A1137 WeakPolarHBondContact O-CB 3.43Å; K1133-A1137 PolarHBondContact O-N 3.09Å
1134	A	80.9	Confident	79.4	Confident	74 Å²	74	114.1 Å²	114.1	61%	0.612	60%	0.604	S	S	*	*	H	α-helix	trans	-70.5	-10.9	178.8	0	0	0	0	0	114.4	A1130 K1131	A1130-A1134 WeakPolarHBondContact O-CB 3.49Å; A1130-A1134 PolarHBondContact O-N 3.27Å; K1131-A1134 PolarHBondContact O-N 2.88Å
1135	L	75.5	Confident	78.6	Confident	149 Å²	149	118.5 Å²	118.5	78%	0.78	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-2.4	170.1	-110.4	154.7	0	0	0	112.9	K1131 K1132 K1133	K1131-L1135 WeakPolarHBondContact O-CB 3.47Å; K1131-L1135 PolarHBondContact O-N 3.06Å; K1132-L1135 PolarHBondContact O-N 3.13Å; K1133-L1135 PolarHBondContact O-N 3.44Å
1136	T	65.6	Low	78	Confident	120 Å²	120	121.5 Å²	121.5	74%	0.736	64%	0.644	S	S	*	*			trans	-122.8	11.3	179.9	57.4	0	0	0	0	112.9	K1132 K1133	K1132-T1136 WeakPolarHBondContact O-CG2 3.35Å; K1132-T1136 PolarHBondContact O-N 3.31Å; K1132-T1136 PolarHBondContact O-OG1 3.14Å; K1132-T1136 VanDerWaalsContact O-OG1 3.12Å; K1133-T1136 WeakPolarHBondContact CA-OG1 3.45Å; K1133-T1136 CarbonylContact O-C 3.46Å; K1133-T1136 PolarHBondContact O-N 2.9Å; K1133-T1136 PolarHBondContact O-OG1 3.42Å
1137	A	52.1	Low	77.1	Confident	143 Å²	143	116.1 Å²	116.1	100%	1.182	64%	0.64	S	S	*	*			trans	-125.8	0	-179.6	0	0	0	0	0	108.8	K1133	K1133-A1137 WeakPolarHBondContact O-CB 3.43Å; K1133-A1137 PolarHBondContact O-N 3.09Å

Retrieved 1,137 of 1,137 residues in 1213.4 ms (Link to these results)

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