A0A3Q0KU90_SCHMA Loading...

histone deacetylase

AlphaFold DB , UniProt , Accession A0A3Q0KU90, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,258 aa.

						>A0A3Q0KU90_SCHMA|A0A3Q0KU90
MYTDINISNQSNNTNLTSLLVRERLKNCVLNKRKSKEQSIHINNTTVLNMGITPQQQQQQQQQQQQQQANHVTDKDLTQINQEQSISNSSLINNKLNGGKSIPLSNQNGNNNSSTNDGNCITPLMIDVENLSSQHHHQTNPITSLSNNTKKSNTLHQIQHSLSNHETDIHYMDFQNVHTSDIETSIYGNHLIEHNHSSHHHHHYHQQQQQNKCIDENLRKTVSEPSLKMRSGSGGVQKSRYKPDRRHYNQHHHHHFGMNTATAAAAVAAAAITVSNDPLAIVGLWPQLSSAFQHANLIQKTINKKPLQQLQDMNNNNNNNNMSSIDSDERLSKSEVKSLTQSMTPLSKTFQDVILTELMKRNQLIETINTCCSGSQPMDSSISFGDPNINQSIFNSTINGFCASLPNLTAQYHRTAASTSSSSSTSQTNHNININRTTSTTMHTNTSTPTIHHVTESSFDSNEFNQPDATMSDLINITNNPNESNTEFNQTKQISKPFHLFPYRRHQSIGLISRTRSAPLSLATGYSTNYRHIQLQNLNNVHNLSNSMNTPTSVTSAANILAMEAATTNFGNQQQTNGLNSNQSMIENDQLGVQSNNLQSSVDNELSSRSKVVLQLRKKILERSEFLTSDRSGVNNLDGSNSPNSRINQTTGRINPLLERTASSPVVNMAPTIRSETVPEATFTTVLAYDLGMLAHHCTCQTDANHPENPQRLISIWQRLQQTGLAAKCHHQPGRRASLIELQLVHKDVYTVLFGSNPASRCRIDPTLLATVRLCRLACGGVGVDSDTAWHTAGHTAHAARLAAGCVVDLACRVMLGQCPNGFALVRPPGHHAEPGQAMGFCYFNSVAIAAKRAQFLGSTTLGTGQSSVISSSATTLFDQSTFLPYTIESALKPRILIVDWDIHHGNGTQTVFYTDPTVLYISLHRHDEGGFFPGTGSPEEIGSGPGEGYTINIAWPSGIVMSDAEYLAAFRLIILPVACEFQPSIVLISAGFDAAPGHSANLGGYSVSPAAFGWMTRLLSIDRIANSKVVLSLEGGYDMNSLCDCTEACVRALLRSAAEINERNSIPISVPDLIPLKQSELDRVPHPSAIQTLLKVAHLHSVYWTSFSNEIDTQYASMPASSWLPTIFDNSSIEIKDLSSTTEHISVVSTNVTPLSANKRFLKSLIKQTPLTTDLNVLTSGNVTENNRYYNFVMRQASSMDETNETEMKPNSIRRRSTTGITPSNMDSITSINDTNETITRIALTRLAELHVTSQPE
					

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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	31.5	Very low	30.2	Very low	242 Å²	242	159.8 Å²	159.8	100%	1.192	84%	0.836	S	S	*	*				0	115.8	0	-76.1	173.8	167.4	0	0	107.4
2	Y	28.4	Very low	30	Very low	225 Å²	225	158.2 Å²	158.2	88%	0.882	83%	0.829	S	S	*	*			trans	-145.5	129.1	178.2	-103.2	-85.5	0	0	0	106.9
3	T	32.5	Very low	30.2	Very low	142 Å²	142	157.2 Å²	157.2	87%	0.871	83%	0.825	S	S	*	*			trans	-171.4	147.1	149.8	17.8	0	0	0	0	109.2
4	D	31.1	Very low	30.4	Very low	149 Å²	149	155.6 Å²	155.6	80%	0.797	83%	0.825	S	S	*	*			trans	-83.5	147.7	-171	-50.2	-94.6	0	0	0	113.6
5	I	35	Very low	31.1	Very low	155 Å²	155	153.7 Å²	153.7	80%	0.795	82%	0.815	S	S	*	*			trans	-133.8	117	148	-63.5	-175.4	0	0	0	107.7	I7	I5-I7 HydrophobicContact CG2-CD1 3.72Å; I5-I7 HydrophobicContact CG2-CG1 3.83Å
6	N	27.4	Very low	31.6	Very low	156 Å²	156	151.8 Å²	151.8	83%	0.834	80%	0.804	S	S	*	*			trans	-110.3	108.6	177.7	-170.1	-0.5	0	0	0	108.6
7	I	33.7	Very low	32	Very low	146 Å²	146	147.9 Å²	147.9	75%	0.749	79%	0.788	S	S	*	*			trans	-129.9	134.4	178.9	-67.8	176.2	0	0	0	109.2	I5	I5-I7 HydrophobicContact CG2-CD1 3.72Å; I5-I7 HydrophobicContact CG2-CG1 3.83Å
8	S	28.5	Very low	32.4	Very low	96 Å²	96	144.2 Å²	144.2	67%	0.671	78%	0.776	S	S	*	*			trans	-92.8	151.5	-167.7	52	0	0	0	0	114.4
9	N	27.6	Very low	32.7	Very low	152 Å²	152	143.1 Å²	143.1	81%	0.813	77%	0.769	S	S	*	*			trans	44.1	100.2	151.5	-63.8	-19.6	0	0	0	119.2
10	Q	28.6	Very low	33.1	Very low	203 Å²	203	140.5 Å²	140.5	95%	0.949	75%	0.754	S	S	*	*				-152.5	171.2	117.3	-112.3	170.5	40.7	0	0	111.9
11	S	27.8	Very low	33.8	Very low	92 Å²	92	137.6 Å²	137.6	64%	0.643	74%	0.742	S	S	*	*			trans	-102.1	167.8	-150.5	53.5	0	0	0	0	116.1
12	N	28.3	Very low	34.4	Very low	140 Å²	140	135.3 Å²	135.3	75%	0.749	72%	0.72	S	S	*	*			trans	68.7	90.5	159.1	-55.5	-25.4	0	0	0	118.6
13	N	32.2	Very low	35.2	Very low	146 Å²	146	128.9 Å²	128.9	78%	0.781	70%	0.698	S	S	*	*			trans	-173.2	46.2	134.9	-102	-43.8	0	0	0	115	N15	N13-N15 VanDerWaalsContact C-N 3.28Å; N13-N15 PolarHBondContact O-N 2.86Å
14	T	32.6	Very low	35.9	Very low	135 Å²	135	131.1 Å²	131.1	83%	0.828	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	60.7	-177.6	40.1	0	0	0	0	114.1
15	N	41.7	Very low	36.7	Very low	126 Å²	126	129.2 Å²	129.2	67%	0.674	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.5	-17.9	169	-124.2	-4.3	0	0	0	115.4	N13	N13-N15 VanDerWaalsContact C-N 3.28Å; N13-N15 PolarHBondContact O-N 2.86Å
16	L	38.2	Very low	37.3	Very low	123 Å²	123	127.7 Å²	127.7	64%	0.644	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-32.1	172.9	-104.3	67.1	0	0	0	112.9	S18 L19 L20	L16-S18 PolarHBondContact O-N 2.91Å; L16-L19 PolarHBondContact O-N 2.93Å; L16-L20 HydrophobicContact CB-CD1 4.28Å; L16-L20 WeakPolarHBondContact O-CB 3.38Å; L16-L20 WeakPolarHBondContact O-CG 3.1Å; L16-L20 PolarHBondContact O-N 2.79Å
17	T	39.5	Very low	38.1	Very low	86 Å²	86	123.7 Å²	123.7	53%	0.528	65%	0.646	S	S	.	*	H	α-helix	trans	-67.5	-39.1	-168.4	-2.5	0	0	0	0	113.5	L20 V21	T17-L20 PolarHBondContact O-N 3.29Å; T17-V21 WeakPolarHBondContact O-CB 3.32Å; T17-V21 WeakPolarHBondContact O-CG2 3.29Å; T17-V21 PolarHBondContact O-N 3.07Å
18	S	38.7	Very low	38.5	Very low	82 Å²	82	119.9 Å²	119.9	57%	0.573	63%	0.632	S	S	*	*	H	α-helix	trans	-68.6	-39.5	179.1	55.9	0	0	0	0	112.3	L16 R22	L16-S18 PolarHBondContact O-N 2.91Å; S18-R22 WeakPolarHBondContact O-CB 3.5Å; S18-R22 PolarHBondContact O-N 3.42Å
19	L	37.9	Very low	39.4	Very low	123 Å²	123	119.4 Å²	119.4	64%	0.644	62%	0.624	S	S	*	*	H	α-helix	trans	-65.3	-45.4	172.6	-86.2	162.7	0	0	0	111.5	L16 V21 R22 E23	L16-L19 PolarHBondContact O-N 2.93Å; L19-V21 VanDerWaalsContact C-N 3.34Å; L19-V21 PolarHBondContact O-N 2.73Å; L19-R22 PolarHBondContact O-N 2.93Å; L19-E23 PolarHBondContact O-N 2.79Å
20	L	41.4	Very low	40.2	Very low	90 Å²	90	116.5 Å²	116.5	47%	0.471	61%	0.608	S	S	.	*	H	α-helix	trans	-63.4	-35.5	177.2	-77	167.2	0	0	0	112.9	L16 T17 R24	L16-L20 HydrophobicContact CB-CD1 4.28Å; L16-L20 WeakPolarHBondContact O-CB 3.38Å; L16-L20 WeakPolarHBondContact O-CG 3.1Å; L16-L20 PolarHBondContact O-N 2.79Å; T17-L20 PolarHBondContact O-N 3.29Å; L20-R24 VanDerWaalsContact O-CB 3.22Å; L20-R24 WeakPolarHBondContact O-CB 2.95Å; L20-R24 WeakPolarHBondContact O-CG 3.41Å; L20-R24 PolarHBondContact O-N 2.77Å
21	V	46.5	Very low	40.9	Very low	81 Å²	81	111.4 Å²	111.4	49%	0.491	59%	0.587	S	S	.	*	H	α-helix	trans	-69.7	-43	173.1	169.1	0	0	0	0	111.2	T17 L19 E23 R24 L25	T17-V21 WeakPolarHBondContact O-CB 3.32Å; T17-V21 WeakPolarHBondContact O-CG2 3.29Å; T17-V21 PolarHBondContact O-N 3.07Å; L19-V21 VanDerWaalsContact C-N 3.34Å; L19-V21 PolarHBondContact O-N 2.73Å; V21-E23 PolarHBondContact O-N 3.41Å; V21-R24 PolarHBondContact O-N 3.47Å; V21-L25 HydrophobicContact CG1-CD1 3.95Å; V21-L25 WeakPolarHBondContact O-CB 3.22Å; V21-L25 WeakPolarHBondContact O-CG 3.22Å; V21-L25 PolarHBondContact O-N 2.74Å
22	R	45.7	Very low	41.7	Very low	194 Å²	194	114.2 Å²	114.2	73%	0.732	59%	0.588	S	S	*	*	H	α-helix	trans	-67.2	-36.1	-179.9	-141.2	169	-167.4	164.3	3.7	112.4	S18 L19 K26	S18-R22 WeakPolarHBondContact O-CB 3.5Å; S18-R22 PolarHBondContact O-N 3.42Å; L19-R22 PolarHBondContact O-N 2.93Å; R22-K26 WeakPolarHBondContact O-CG 3.39Å; R22-K26 PolarHBondContact O-N 2.99Å; R22-K26 VanDerWaalsContact O-N 3.1Å
23	E	45.2	Very low	42.3	Very low	90 Å²	90	115.5 Å²	115.5	42%	0.421	58%	0.582	S	S	.	*	H	α-helix	trans	-72.6	-40.6	170	-91.7	-57.3	126.2	0	0	112.9	L19 V21 L25 K26 N27	L19-E23 PolarHBondContact O-N 2.79Å; V21-E23 PolarHBondContact O-N 3.41Å; E23-L25 VanDerWaalsContact C-N 3.3Å; E23-L25 PolarHBondContact O-N 2.94Å; E23-K26 PolarHBondContact O-N 3.01Å; E23-K26 WeakPolarHBondContact OE1-CD 3.27Å; E23-N27 WeakPolarHBondContact O-CB 3.29Å; E23-N27 PolarHBondContact O-N 3.15Å; E23-N27 PolarHBondContact O-ND2 3.38Å; E23-N27 PolarHBondContact OE2-ND2 3.35Å
24	R	46.5	Very low	42.7	Very low	188 Å²	188	113.7 Å²	113.7	71%	0.709	57%	0.568	S	S	*	*	H	α-helix	trans	-62.4	-36.9	175.5	-78.7	173.9	176.8	-167.8	-1.3	112.2	L20 V21 C28	L20-R24 VanDerWaalsContact O-CB 3.22Å; L20-R24 WeakPolarHBondContact O-CB 2.95Å; L20-R24 WeakPolarHBondContact O-CG 3.41Å; L20-R24 PolarHBondContact O-N 2.77Å; V21-R24 PolarHBondContact O-N 3.47Å; R24-C28 VanDerWaalsContact O-CB 3.24Å; R24-C28 WeakPolarHBondContact O-CB 3.48Å; R24-C28 PolarHBondContact O-N 2.92Å
25	L	48.3	Very low	43	Very low	109 Å²	109	110.8 Å²	110.8	57%	0.571	55%	0.553	S	S	*	*	H	α-helix	trans	-66.3	-47.9	172.4	-77	166.6	0	0	0	112	V21 E23 N27 C28 V29	V21-L25 HydrophobicContact CG1-CD1 3.95Å; V21-L25 WeakPolarHBondContact O-CB 3.22Å; V21-L25 WeakPolarHBondContact O-CG 3.22Å; V21-L25 PolarHBondContact O-N 2.74Å; E23-L25 VanDerWaalsContact C-N 3.3Å; E23-L25 PolarHBondContact O-N 2.94Å; L25-N27 VanDerWaalsContact C-N 3.35Å; L25-N27 PolarHBondContact O-N 3.45Å; L25-C28 PolarHBondContact O-N 3.35Å; L25-V29 WeakPolarHBondContact O-CG2 3.35Å; L25-V29 PolarHBondContact O-N 3.04Å
26	K	46.6	Very low	42.9	Very low	123 Å²	123	113 Å²	113	54%	0.535	56%	0.556	S	S	.	*	H	α-helix	trans	-56.3	-46.5	174.3	-81.8	-179.1	172.9	-175.1	0	112.5	R22 E23 V29 L30	R22-K26 WeakPolarHBondContact O-CG 3.39Å; R22-K26 PolarHBondContact O-N 2.99Å; R22-K26 VanDerWaalsContact O-N 3.1Å; E23-K26 PolarHBondContact O-N 3.01Å; E23-K26 WeakPolarHBondContact OE1-CD 3.27Å; K26-V29 PolarHBondContact O-N 2.77Å; K26-L30 WeakPolarHBondContact O-CB 3.49Å; K26-L30 PolarHBondContact O-N 3.5Å
27	N	44.5	Very low	42.8	Very low	72 Å²	72	113.9 Å²	113.9	39%	0.385	56%	0.557	S	S	.	*	H	α-helix	trans	-68.9	-32.5	178.3	-73.3	-72.2	0	0	0	112.4	E23 L25 N31	E23-N27 WeakPolarHBondContact O-CB 3.29Å; E23-N27 PolarHBondContact O-N 3.15Å; E23-N27 PolarHBondContact O-ND2 3.38Å; E23-N27 PolarHBondContact OE2-ND2 3.35Å; L25-N27 VanDerWaalsContact C-N 3.35Å; L25-N27 PolarHBondContact O-N 3.45Å; N27-N31 WeakPolarHBondContact O-CB 3.03Å; N27-N31 PolarHBondContact O-N 3.39Å; N27-N31 PolarHBondContact O-ND2 2.75Å
28	C	42.8	Very low	42.5	Very low	67 Å²	67	116.8 Å²	116.8	45%	0.453	57%	0.565	S	S	.	*	H	α-helix	trans	-65.5	-44	172.5	-169.1	0	0	0	0	111.7	R24 L25 N31 K32	R24-C28 VanDerWaalsContact O-CB 3.24Å; R24-C28 WeakPolarHBondContact O-CB 3.48Å; R24-C28 PolarHBondContact O-N 2.92Å; L25-C28 PolarHBondContact O-N 3.35Å; C28-N31 PolarHBondContact O-N 3.26Å; C28-K32 WeakPolarHBondContact O-CB 3.47Å; C28-K32 PolarHBondContact O-N 3.47Å
29	V	47.5	Very low	42.2	Very low	85 Å²	85	117.2 Å²	117.2	52%	0.515	57%	0.568	S	S	.	*	H	α-helix	trans	-66.8	-42.2	175.6	174.1	0	0	0	0	111.6	L25 K26 K32 R33	L25-V29 WeakPolarHBondContact O-CG2 3.35Å; L25-V29 PolarHBondContact O-N 3.04Å; K26-V29 PolarHBondContact O-N 2.77Å; V29-K32 PolarHBondContact O-N 3.04Å; V29-R33 PolarHBondContact O-N 2.83Å
30	L	43.3	Very low	42.1	Very low	92 Å²	92	117.8 Å²	117.8	48%	0.482	57%	0.57	S	S	.	*	H	α-helix	trans	-64	-38.6	174.6	-84.9	160	0	0	0	112.4	K26 R33 K34	K26-L30 WeakPolarHBondContact O-CB 3.49Å; K26-L30 PolarHBondContact O-N 3.5Å; L30-R33 PolarHBondContact O-N 3.15Å; L30-K34 WeakPolarHBondContact O-CB 3.48Å; L30-K34 WeakPolarHBondContact O-CG 3.37Å; L30-K34 PolarHBondContact O-N 3.12Å
31	N	43.2	Very low	41.6	Very low	95 Å²	95	120.7 Å²	120.7	51%	0.508	58%	0.581	S	S	.	*	H	α-helix	trans	-73	-35.3	176.6	-71.6	-13.3	0	0	0	112.1	N27 C28 K34 S35	N27-N31 WeakPolarHBondContact O-CB 3.03Å; N27-N31 PolarHBondContact O-N 3.39Å; N27-N31 PolarHBondContact O-ND2 2.75Å; C28-N31 PolarHBondContact O-N 3.26Å; N31-K34 PolarHBondContact O-N 2.66Å; N31-S35 PolarHBondContact O-N 2.75Å; N31-S35 PolarHBondContact O-OG 3.5Å
32	K	45.3	Very low	40.9	Very low	151 Å²	151	124.6 Å²	124.6	66%	0.657	60%	0.597	S	S	*	*	H	α-helix	trans	-66.8	-32.6	170	-82	-170.9	172.6	-173.7	0	113.2	C28 V29 S35 K36	C28-K32 WeakPolarHBondContact O-CB 3.47Å; C28-K32 PolarHBondContact O-N 3.47Å; V29-K32 PolarHBondContact O-N 3.04Å; K32-S35 PolarHBondContact O-OG 2.83Å; K32-K36 PolarHBondContact O-N 3.35Å
33	R	41.6	Very low	40.2	Very low	167 Å²	167	122.5 Å²	122.5	63%	0.63	60%	0.6	S	S	*	*	H	α-helix	trans	-68.3	-48.7	169.9	-80.7	-173.3	171.4	164.4	0.1	111.1	V29 L30 S35 K36 E37	V29-R33 PolarHBondContact O-N 2.83Å; L30-R33 PolarHBondContact O-N 3.15Å; R33-S35 VanDerWaalsContact C-N 3.3Å; R33-S35 PolarHBondContact O-N 3.07Å; R33-K36 PolarHBondContact O-N 2.69Å; R33-K36 VanDerWaalsContact O-N 3.08Å; R33-E37 WeakPolarHBondContact O-CG 3.27Å; R33-E37 PolarHBondContact O-N 2.95Å
34	K	39.7	Very low	39.4	Very low	109 Å²	109	125.2 Å²	125.2	47%	0.474	62%	0.618	S	S	.	*	H	α-helix	trans	-57.4	-38.7	175.3	-74.8	175.9	178.5	178.2	0	112.9	L30 N31 E37 Q38	L30-K34 WeakPolarHBondContact O-CB 3.48Å; L30-K34 WeakPolarHBondContact O-CG 3.37Å; L30-K34 PolarHBondContact O-N 3.12Å; N31-K34 PolarHBondContact O-N 2.66Å; K34-E37 PolarHBondContact O-N 3.24Å; K34-Q38 VanDerWaalsContact O-CB 3.28Å; K34-Q38 WeakPolarHBondContact O-CB 3.48Å; K34-Q38 VanDerWaalsContact O-CG 3.27Å; K34-Q38 WeakPolarHBondContact O-CG 3.45Å; K34-Q38 PolarHBondContact O-N 3.41Å
35	S	39.3	Very low	38.7	Very low	73 Å²	73	122.3 Å²	122.3	51%	0.51	62%	0.621	S	S	.	*	H	α-helix	trans	-71.7	-27.3	177.3	69.7	0	0	0	0	113.8	N31 K32 R33 S39	N31-S35 PolarHBondContact O-N 2.75Å; N31-S35 PolarHBondContact O-OG 3.5Å; K32-S35 PolarHBondContact O-OG 2.83Å; R33-S35 VanDerWaalsContact C-N 3.3Å; R33-S35 PolarHBondContact O-N 3.07Å; S35-S39 PolarHBondContact O-OG 3.28Å
36	K	39.6	Very low	37.8	Very low	173 Å²	173	123.2 Å²	123.2	75%	0.752	63%	0.631	S	S	*	*	H	α-helix	trans	-78.3	-23.1	169	-85.4	-168.4	165.6	-175.1	0	113.5	K32 R33 S39	K32-K36 PolarHBondContact O-N 3.35Å; R33-K36 PolarHBondContact O-N 2.69Å; R33-K36 VanDerWaalsContact O-N 3.08Å; K36-S39 PolarHBondContact O-OG 2.89Å
37	E	36.6	Very low	37	Very low	142 Å²	142	123.6 Å²	123.6	66%	0.664	64%	0.644	S	S	*	*	H	α-helix	trans	-89.1	-29.4	176.5	-70.6	172.7	162.3	0	0	112.9	R33 K34	R33-E37 WeakPolarHBondContact O-CG 3.27Å; R33-E37 PolarHBondContact O-N 2.95Å; K34-E37 PolarHBondContact O-N 3.24Å
38	Q	33.3	Very low	36.2	Very low	147 Å²	147	127.3 Å²	127.3	69%	0.687	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-83.1	-8.1	178.7	-71.7	178.6	-41.3	0	0	114.1	K34 I40	K34-Q38 VanDerWaalsContact O-CB 3.28Å; K34-Q38 WeakPolarHBondContact O-CB 3.48Å; K34-Q38 VanDerWaalsContact O-CG 3.27Å; K34-Q38 WeakPolarHBondContact O-CG 3.45Å; K34-Q38 PolarHBondContact O-N 3.41Å; Q38-I40 PolarHBondContact O-N 3.31Å
39	S	31.8	Very low	35.6	Very low	90 Å²	90	131.4 Å²	131.4	63%	0.629	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-79.9	5.4	-178.8	19.5	0	0	0	0	114.7	S35 K36	S35-S39 PolarHBondContact O-OG 3.28Å; K36-S39 PolarHBondContact O-OG 2.89Å
40	I	35.6	Very low	34.8	Very low	136 Å²	136	136.4 Å²	136.4	70%	0.697	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-99	-13.4	-177.9	-66	176.7	0	0	0	112.9	Q38	Q38-I40 PolarHBondContact O-N 3.31Å
41	H	29.9	Very low	34.3	Very low	151 Å²	151	134.9 Å²	134.9	70%	0.699	71%	0.707	S	S	*	*	S	Bend	trans	-145.5	118.1	174.7	-88.8	-77.7	0	0	0	112.4
42	I	32.3	Very low	34.4	Very low	163 Å²	163	135.7 Å²	135.7	84%	0.836	71%	0.71	S	S	*	*			trans	169.6	136.4	135.5	-89.2	154.1	0	0	0	108.5
43	N	30.7	Very low	34.7	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	70%	0.697	S	S	*	*			trans	-94.8	147.3	173.6	-81	-19	0	0	0	111.4
44	N	30.1	Very low	34.7	Very low	147 Å²	147	128.4 Å²	128.4	79%	0.786	70%	0.699	S	S	*	*			trans	71.3	148.8	161	-62.6	-8	0	0	0	119.6
45	T	31.3	Very low	35	Very low	127 Å²	127	130.2 Å²	130.2	78%	0.779	71%	0.709	S	S	*	*			trans	78.1	83	162.2	-40.1	0	0	0	0	117.9
46	T	28.6	Very low	35.6	Very low	128 Å²	128	131.1 Å²	131.1	79%	0.785	71%	0.705	S	S	*	*			trans	42.2	109.9	130.7	-42.6	0	0	0	0	119.7
47	V	30.7	Very low	36.1	Very low	131 Å²	131	128.5 Å²	128.5	79%	0.794	70%	0.695	S	S	*	*				-169.6	132.2	117.6	143.8	0	0	0	0	111.7
48	L	27.7	Very low	36.9	Very low	151 Å²	151	127.3 Å²	127.3	79%	0.791	69%	0.69	S	S	*	*			trans	-13.7	119.9	165.5	-54.5	165.3	0	0	0	119
49	N	30.6	Very low	38.1	Very low	153 Å²	153	125.6 Å²	125.6	82%	0.818	68%	0.682	S	S	*	*				-174.4	142.8	106.3	-103.8	-35.9	0	0	0	115	G51	N49-G51 PolarHBondContact O-N 3.49Å
50	M	30.6	Very low	39.5	Very low	190 Å²	190	126.1 Å²	126.1	94%	0.936	67%	0.674	S	S	*	*			trans	18.3	89.6	164.2	-57.8	-163.6	-59.9	0	0	118.8
51	G	31.7	Very low	40.5	Very low	59 Å²	59	124.9 Å²	124.9	61%	0.608	67%	0.665	S	S	*	*			trans	-147.7	133.8	159.1	0	0	0	0	0	109.8	N49 T53	N49-G51 PolarHBondContact O-N 3.49Å; G51-T53 PolarHBondContact O-N 2.72Å
52	I	46.3	Very low	42.2	Very low	113 Å²	113	122.8 Å²	122.8	58%	0.579	66%	0.656	S	S	*	*			trans	-68.6	116.4	176.6	-59.9	177.5	0	0	0	107.6	Q56 Q57	I52-Q56 HydrophobicContact CG2-CB 3.84Å; I52-Q57 HydrophobicContact CG2-CB 4.32Å
53	T	51	Low	43.6	Very low	64 Å²	64	120.1 Å²	120.1	39%	0.393	64%	0.64	S	S	.	*			trans	-71.8	153.5	177.2	58.1	0	0	0	0	110.9	G51 Q55 Q56 Q57	G51-T53 PolarHBondContact O-N 2.72Å; T53-Q55 PolarHBondContact O-N 3.02Å; T53-Q55 VanDerWaalsContact O-N 3.1Å; T53-Q56 WeakPolarHBondContact O-CA 3.49Å; T53-Q56 WeakPolarHBondContact O-CB 3.35Å; T53-Q56 PolarHBondContact O-N 2.76Å; T53-Q56 WeakPolarHBondContact OG1-CG 3.46Å; T53-Q56 PolarHBondContact OG1-N 3.45Å; T53-Q56 PolarHBondContact OG1-OE1 3.34Å; T53-Q57 PolarHBondContact O-N 2.89Å
54	P	42	Very low	45	Very low	101 Å²	101	118.4 Å²	118.4	66%	0.656	63%	0.627	S	S	*	*	H	α-helix	trans	-55.6	-29.3	174.3	-28	36.1	0	0	0	113.6	Q57 Q58	P54-Q57 PolarHBondContact O-N 3.11Å; P54-Q58 PolarHBondContact O-N 3.48Å
55	Q	45.1	Very low	46.3	Very low	147 Å²	147	117.3 Å²	117.3	69%	0.687	62%	0.617	S	S	*	*	H	α-helix	trans	-70.8	-37.5	172.4	-75	-176.8	-29.5	0	0	113.1	T53 Q57 Q58 Q59	T53-Q55 PolarHBondContact O-N 3.02Å; T53-Q55 VanDerWaalsContact O-N 3.1Å; Q55-Q57 VanDerWaalsContact C-N 3.34Å; Q55-Q58 PolarHBondContact O-N 3.46Å; Q55-Q59 WeakPolarHBondContact O-CB 3.38Å; Q55-Q59 WeakPolarHBondContact O-CG 3.42Å; Q55-Q59 PolarHBondContact O-N 3.2Å
56	Q	52.3	Low	47.4	Very low	92 Å²	92	117.2 Å²	117.2	43%	0.43	61%	0.608	S	S	.	*	H	α-helix	trans	-68.7	-34.2	171.8	-75.5	164.2	-49.2	0	0	111.9	I52 T53 Q59 Q60	I52-Q56 HydrophobicContact CG2-CB 3.84Å; T53-Q56 WeakPolarHBondContact O-CA 3.49Å; T53-Q56 WeakPolarHBondContact O-CB 3.35Å; T53-Q56 PolarHBondContact O-N 2.76Å; T53-Q56 WeakPolarHBondContact OG1-CG 3.46Å; T53-Q56 PolarHBondContact OG1-N 3.45Å; T53-Q56 PolarHBondContact OG1-OE1 3.34Å; Q56-Q59 PolarHBondContact O-N 3.17Å; Q56-Q60 WeakPolarHBondContact O-CB 3.31Å; Q56-Q60 WeakPolarHBondContact O-CG 3.45Å; Q56-Q60 PolarHBondContact O-N 2.91Å
57	Q	49.5	Very low	48.6	Very low	117 Å²	117	117.3 Å²	117.3	55%	0.547	60%	0.599	S	S	.	*	H	α-helix	trans	-66.1	-41.5	173.6	-154.8	172.1	17.2	0	0	111	I52 T53 P54 Q55 Q60 Q61	I52-Q57 HydrophobicContact CG2-CB 4.32Å; T53-Q57 PolarHBondContact O-N 2.89Å; P54-Q57 PolarHBondContact O-N 3.11Å; Q55-Q57 VanDerWaalsContact C-N 3.34Å; Q57-Q60 PolarHBondContact O-N 2.99Å; Q57-Q61 WeakPolarHBondContact O-CG 3.43Å; Q57-Q61 PolarHBondContact O-N 3.3Å
58	Q	53.3	Low	49.5	Very low	118 Å²	118	117.2 Å²	117.2	55%	0.551	59%	0.59	S	S	*	*	H	α-helix	trans	-63.2	-40	169.1	-103.1	-177.8	-8.1	0	0	113	P54 Q55 Q61 Q62	P54-Q58 PolarHBondContact O-N 3.48Å; Q55-Q58 PolarHBondContact O-N 3.46Å; Q58-Q61 PolarHBondContact O-N 3.49Å; Q58-Q62 WeakPolarHBondContact O-CB 3.35Å; Q58-Q62 WeakPolarHBondContact O-CG 3.34Å; Q58-Q62 PolarHBondContact O-N 3.07Å
59	Q	58.3	Low	50.4	Low	111 Å²	111	112.6 Å²	112.6	52%	0.519	57%	0.574	S	S	.	*	H	α-helix	trans	-67.4	-36.1	175.7	-78.7	-177.7	-17.4	0	0	112.3	Q55 Q56 Q62 Q63	Q55-Q59 WeakPolarHBondContact O-CB 3.38Å; Q55-Q59 WeakPolarHBondContact O-CG 3.42Å; Q55-Q59 PolarHBondContact O-N 3.2Å; Q56-Q59 PolarHBondContact O-N 3.17Å; Q59-Q62 PolarHBondContact O-N 2.74Å; Q59-Q63 WeakPolarHBondContact O-CB 3.45Å; Q59-Q63 VanDerWaalsContact O-CG 3.3Å; Q59-Q63 WeakPolarHBondContact O-CG 3.5Å; Q59-Q63 PolarHBondContact O-N 3.39Å
60	Q	61.6	Low	51	Low	100 Å²	100	110.1 Å²	110.1	47%	0.467	56%	0.561	S	S	.	*	H	α-helix	trans	-66.4	-41.6	172.6	-78.8	-177.8	-26.9	0	0	111.5	Q56 Q57 Q63 Q64	Q56-Q60 WeakPolarHBondContact O-CB 3.31Å; Q56-Q60 WeakPolarHBondContact O-CG 3.45Å; Q56-Q60 PolarHBondContact O-N 2.91Å; Q57-Q60 PolarHBondContact O-N 2.99Å; Q60-Q63 PolarHBondContact O-N 3.27Å; Q60-Q64 WeakPolarHBondContact O-CB 3.31Å; Q60-Q64 WeakPolarHBondContact O-CG 3.4Å; Q60-Q64 PolarHBondContact O-N 3.03Å
61	Q	58	Low	51.7	Low	110 Å²	110	106.2 Å²	106.2	51%	0.514	54%	0.54	S	S	.	.	H	α-helix	trans	-62.1	-42	172	-74.5	-179.1	-14	0	0	112.2	Q57 Q58 Q64 Q65	Q57-Q61 WeakPolarHBondContact O-CG 3.43Å; Q57-Q61 PolarHBondContact O-N 3.3Å; Q58-Q61 PolarHBondContact O-N 3.49Å; Q61-Q64 PolarHBondContact O-N 2.93Å; Q61-Q65 WeakPolarHBondContact O-CB 3.42Å; Q61-Q65 VanDerWaalsContact O-CG 3.26Å; Q61-Q65 WeakPolarHBondContact O-CG 3.48Å; Q61-Q65 PolarHBondContact O-N 3.3Å
62	Q	64	Low	52.3	Low	107 Å²	107	107.5 Å²	107.5	50%	0.5	54%	0.536	S	S	.	.	H	α-helix	trans	-66.9	-38	175.5	-74.1	177.1	3.8	0	0	112.6	Q58 Q59 Q65 Q66	Q58-Q62 WeakPolarHBondContact O-CB 3.35Å; Q58-Q62 WeakPolarHBondContact O-CG 3.34Å; Q58-Q62 PolarHBondContact O-N 3.07Å; Q59-Q62 PolarHBondContact O-N 2.74Å; Q62-Q65 PolarHBondContact O-N 3.24Å; Q62-Q66 WeakPolarHBondContact O-CB 3.44Å; Q62-Q66 WeakPolarHBondContact O-CG 3.4Å; Q62-Q66 PolarHBondContact O-N 3Å
63	Q	63.2	Low	52.1	Low	107 Å²	107	106 Å²	106	50%	0.5	53%	0.532	S	S	.	.	H	α-helix	trans	-69.4	-38.5	175	-76.6	179	3	0	0	112	Q59 Q60 Q66 Q67	Q59-Q63 WeakPolarHBondContact O-CB 3.45Å; Q59-Q63 VanDerWaalsContact O-CG 3.3Å; Q59-Q63 WeakPolarHBondContact O-CG 3.5Å; Q59-Q63 PolarHBondContact O-N 3.39Å; Q60-Q63 PolarHBondContact O-N 3.27Å; Q63-Q66 PolarHBondContact O-N 3.41Å; Q63-Q67 WeakPolarHBondContact O-CB 3.48Å; Q63-Q67 VanDerWaalsContact O-CG 3.23Å; Q63-Q67 WeakPolarHBondContact O-CG 3.2Å; Q63-Q67 PolarHBondContact O-N 3.19Å
64	Q	59	Low	51.6	Low	114 Å²	114	108.4 Å²	108.4	53%	0.533	54%	0.543	S	S	.	.	H	α-helix	trans	-65.2	-41.2	172	-75.5	179.1	-7.2	0	0	111.5	Q60 Q61 Q67 Q68	Q60-Q64 WeakPolarHBondContact O-CB 3.31Å; Q60-Q64 WeakPolarHBondContact O-CG 3.4Å; Q60-Q64 PolarHBondContact O-N 3.03Å; Q61-Q64 PolarHBondContact O-N 2.93Å; Q64-Q67 PolarHBondContact O-N 3.11Å; Q64-Q68 WeakPolarHBondContact O-CB 3.43Å; Q64-Q68 VanDerWaalsContact O-CG 3.29Å; Q64-Q68 WeakPolarHBondContact O-CG 3.36Å; Q64-Q68 PolarHBondContact O-N 3.12Å
65	Q	57	Low	51.6	Low	124 Å²	124	109.6 Å²	109.6	58%	0.579	54%	0.537	S	S	*	.	H	α-helix	trans	-64.3	-39.1	173.9	-74.4	172.1	10	0	0	112.3	Q61 Q62 A69	Q61-Q65 WeakPolarHBondContact O-CB 3.42Å; Q61-Q65 VanDerWaalsContact O-CG 3.26Å; Q61-Q65 WeakPolarHBondContact O-CG 3.48Å; Q61-Q65 PolarHBondContact O-N 3.3Å; Q62-Q65 PolarHBondContact O-N 3.24Å; Q65-A69 VanDerWaalsContact O-CB 3.24Å; Q65-A69 WeakPolarHBondContact O-CB 3.32Å; Q65-A69 PolarHBondContact O-N 2.89Å
66	Q	55.3	Low	51.3	Low	125 Å²	125	107.6 Å²	107.6	58%	0.584	53%	0.532	S	S	*	.	H	α-helix	trans	-70.1	-38.8	174.4	-76.8	179.6	-16.8	0	0	112.5	Q62 Q63 A69 N70	Q62-Q66 WeakPolarHBondContact O-CB 3.44Å; Q62-Q66 WeakPolarHBondContact O-CG 3.4Å; Q62-Q66 PolarHBondContact O-N 3Å; Q63-Q66 PolarHBondContact O-N 3.41Å; Q66-A69 PolarHBondContact O-N 3.43Å; Q66-N70 WeakPolarHBondContact O-CB 3.25Å; Q66-N70 PolarHBondContact O-N 2.98Å; Q66-N70 PolarHBondContact O-OD1 3.13Å
67	Q	54.1	Low	50.5	Low	129 Å²	129	109.2 Å²	109.2	60%	0.603	54%	0.542	S	S	*	.	H	α-helix	trans	-66.1	-40.7	174.4	-74.5	172.3	12.2	0	0	111.4	Q63 Q64 H71	Q63-Q67 WeakPolarHBondContact O-CB 3.48Å; Q63-Q67 VanDerWaalsContact O-CG 3.23Å; Q63-Q67 WeakPolarHBondContact O-CG 3.2Å; Q63-Q67 PolarHBondContact O-N 3.19Å; Q64-Q67 PolarHBondContact O-N 3.11Å; Q67-H71 VanDerWaalsContact O-CB 3.23Å; Q67-H71 WeakPolarHBondContact O-CB 3.49Å; Q67-H71 PolarHBondContact O-N 3.41Å
68	Q	48.8	Very low	50.1	Low	129 Å²	129	109.1 Å²	109.1	60%	0.603	55%	0.55	S	S	*	.	H	α-helix	trans	-67.1	-43.8	174.1	-73.4	175.2	2.7	0	0	111.8	Q64 N70 H71 V72	Q64-Q68 WeakPolarHBondContact O-CB 3.43Å; Q64-Q68 VanDerWaalsContact O-CG 3.29Å; Q64-Q68 WeakPolarHBondContact O-CG 3.36Å; Q64-Q68 PolarHBondContact O-N 3.12Å; Q68-N70 PolarHBondContact O-N 3.49Å; Q68-H71 PolarHBondContact O-N 3.11Å; Q68-V72 WeakPolarHBondContact O-CB 3.21Å; Q68-V72 VanDerWaalsContact O-CG2 3.3Å; Q68-V72 WeakPolarHBondContact O-CG2 3.38Å; Q68-V72 PolarHBondContact O-N 2.92Å
69	A	46.3	Very low	49.3	Very low	54 Å²	54	111.8 Å²	111.8	45%	0.446	56%	0.563	S	S	.	*	H	α-helix	trans	-57.5	-48.6	174.9	0	0	0	0	0	111.5	Q65 Q66 V72 T73	Q65-A69 VanDerWaalsContact O-CB 3.24Å; Q65-A69 WeakPolarHBondContact O-CB 3.32Å; Q65-A69 PolarHBondContact O-N 2.89Å; Q66-A69 PolarHBondContact O-N 3.43Å; A69-V72 PolarHBondContact O-N 3.22Å; A69-T73 PolarHBondContact O-N 3.28Å; A69-T73 PolarHBondContact O-OG1 2.89Å; A69-T73 VanDerWaalsContact O-OG1 3.13Å
70	N	44	Very low	48.2	Very low	102 Å²	102	112.7 Å²	112.7	55%	0.545	57%	0.569	S	S	.	*	H	α-helix	trans	-64.6	-40.9	178.1	-67	-3	0	0	0	111.8	Q66 Q68 T73 D74	Q66-N70 WeakPolarHBondContact O-CB 3.25Å; Q66-N70 PolarHBondContact O-N 2.98Å; Q66-N70 PolarHBondContact O-OD1 3.13Å; Q68-N70 PolarHBondContact O-N 3.49Å; N70-T73 WeakPolarHBondContact CA-OG1 3.43Å; N70-T73 PolarHBondContact O-N 3.12Å; N70-T73 PolarHBondContact O-OG1 3.18Å; N70-D74 PolarHBondContact O-N 2.78Å; N70-D74 VanDerWaalsContact O-N 3.1Å
71	H	45.5	Very low	46.9	Very low	108 Å²	108	114.4 Å²	114.4	50%	0.5	58%	0.582	S	S	.	*	H	α-helix	trans	-76.7	-22.6	-176.7	-150.5	0.2	0	0	0	113.8	Q67 Q68 K75	Q67-H71 VanDerWaalsContact O-CB 3.23Å; Q67-H71 WeakPolarHBondContact O-CB 3.49Å; Q67-H71 PolarHBondContact O-N 3.41Å; Q68-H71 PolarHBondContact O-N 3.11Å; H71-K75 VanDerWaalsContact CE1-CE 3.41Å; H71-K75 WeakPolarHBondContact CE1-CE 3.46Å; H71-K75 PolarHBondContact CE1-NZ 3.15Å; H71-K75 VanDerWaalsContact CE1-NZ 3.28Å; H71-K75 PolarHBondContact NE2-NZ 2.82Å
72	V	44.6	Very low	45.9	Very low	85 Å²	85	117.9 Å²	117.9	52%	0.515	60%	0.598	S	S	.	*	H	α-helix	trans	-73.3	-43.4	166.7	169.8	0	0	0	0	110.2	Q68 A69 D74 K75 D76	Q68-V72 WeakPolarHBondContact O-CB 3.21Å; Q68-V72 VanDerWaalsContact O-CG2 3.3Å; Q68-V72 WeakPolarHBondContact O-CG2 3.38Å; Q68-V72 PolarHBondContact O-N 2.92Å; A69-V72 PolarHBondContact O-N 3.22Å; V72-D74 VanDerWaalsContact C-N 3.34Å; V72-D74 PolarHBondContact O-N 3.04Å; V72-K75 PolarHBondContact O-N 2.77Å; V72-D76 PolarHBondContact O-N 2.81Å
73	T	42.1	Very low	44.4	Very low	81 Å²	81	121.8 Å²	121.8	50%	0.497	62%	0.616	S	S	.	*	H	α-helix	trans	-65	-30.7	178.6	48.2	0	0	0	0	114.4	A69 N70	A69-T73 PolarHBondContact O-N 3.28Å; A69-T73 PolarHBondContact O-OG1 2.89Å; A69-T73 VanDerWaalsContact O-OG1 3.13Å; N70-T73 WeakPolarHBondContact CA-OG1 3.43Å; N70-T73 PolarHBondContact O-N 3.12Å; N70-T73 PolarHBondContact O-OG1 3.18Å
74	D	39.8	Very low	42.9	Very low	116 Å²	116	125.8 Å²	125.8	62%	0.62	64%	0.635	S	S	*	*	H	α-helix	trans	-82.5	-15.6	177.7	-89.2	-34.6	0	0	0	114.6	N70 V72 T78	N70-D74 PolarHBondContact O-N 2.78Å; N70-D74 VanDerWaalsContact O-N 3.1Å; V72-D74 VanDerWaalsContact C-N 3.34Å; V72-D74 PolarHBondContact O-N 3.04Å; D74-T78 PolarHBondContact O-OG1 2.94Å
75	K	41.8	Very low	41.6	Very low	125 Å²	125	125.1 Å²	125.1	54%	0.543	64%	0.643	S	S	.	*	H	α-helix	trans	-96.3	-35.4	-178	-81.1	176.5	170	163.1	0	113.9	H71 V72 T78	H71-K75 VanDerWaalsContact CE1-CE 3.41Å; H71-K75 WeakPolarHBondContact CE1-CE 3.46Å; H71-K75 PolarHBondContact CE1-NZ 3.15Å; H71-K75 VanDerWaalsContact CE1-NZ 3.28Å; H71-K75 PolarHBondContact NE2-NZ 2.82Å; V72-K75 PolarHBondContact O-N 2.77Å; K75-T78 PolarHBondContact O-OG1 3.18Å
76	D	39.5	Very low	40.6	Very low	106 Å²	106	126.7 Å²	126.7	57%	0.567	65%	0.654	S	S	*	*	H	α-helix	trans	-80.2	-15.5	177.4	-67.4	-31.1	0	0	0	113.4	V72 I80	V72-D76 PolarHBondContact O-N 2.81Å; D76-I80 VanDerWaalsContact O-CD1 3.28Å; D76-I80 WeakPolarHBondContact O-CD1 3.41Å; D76-I80 WeakPolarHBondContact O-CG1 3.34Å
77	L	35.8	Very low	39.6	Very low	125 Å²	125	125.6 Å²	125.6	65%	0.654	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-9.4	179.5	-91.6	165.4	0	0	0	115.2
78	T	39.2	Very low	38.4	Very low	115 Å²	115	127.8 Å²	127.8	71%	0.706	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-11.9	-177.2	43.6	0	0	0	0	114.7	D74 K75	D74-T78 PolarHBondContact O-OG1 2.94Å; K75-T78 PolarHBondContact O-OG1 3.18Å
79	Q	37.4	Very low	37.8	Very low	175 Å²	175	126.4 Å²	126.4	82%	0.818	68%	0.68	S	S	*	*	S	Bend	trans	-109.3	-3.9	-178.3	-151.9	165.5	5.9	0	0	114.8
80	I	35.9	Very low	37.2	Very low	129 Å²	129	129 Å²	129	66%	0.662	70%	0.695	S	S	*	*	S	Bend	trans	-91.7	-8	-177.2	-67.3	-179.7	0	0	0	113.4	D76	D76-I80 VanDerWaalsContact O-CD1 3.28Å; D76-I80 WeakPolarHBondContact O-CD1 3.41Å; D76-I80 WeakPolarHBondContact O-CG1 3.34Å
81	N	34.2	Very low	36.5	Very low	137 Å²	137	131.7 Å²	131.7	73%	0.733	71%	0.709	S	S	*	*	S	Bend	trans	-100.9	18.9	-170.9	-80.1	-54.6	0	0	0	116.2
82	Q	35.4	Very low	35.9	Very low	183 Å²	183	133.9 Å²	133.9	86%	0.855	72%	0.723	S	S	*	*	S	Bend	trans	-127.4	-11.3	180	-77.6	-170.9	-24.8	0	0	117.1
83	E	34.3	Very low	35.4	Very low	188 Å²	188	136.1 Å²	136.1	88%	0.879	73%	0.732	S	S	*	*	S	Bend	trans	-118.3	39.4	-176.1	-63.2	-165.4	155.3	0	0	114.5
84	Q	30.3	Very low	34.9	Very low	192 Å²	192	139 Å²	139	90%	0.897	74%	0.744	S	S	*	*			trans	-130.8	63.5	166.9	-70.2	-161.3	2.4	0	0	112.8
85	S	32.2	Very low	34.6	Very low	99 Å²	99	142 Å²	142	69%	0.692	75%	0.752	S	S	*	*			trans	-146.5	156.5	159.5	72	0	0	0	0	111.1
86	I	36.9	Very low	34.2	Very low	158 Å²	158	142.5 Å²	142.5	81%	0.81	76%	0.759	S	S	*	*	S	Bend	trans	83.9	131.9	179.6	-50.4	173.2	0	0	0	115.9
87	S	33.6	Very low	33.8	Very low	102 Å²	102	144.4 Å²	144.4	71%	0.713	77%	0.77	S	S	*	*			trans	60.7	77.4	165.3	54.1	0	0	0	0	120.4
88	N	29.7	Very low	33.6	Very low	175 Å²	175	142.5 Å²	142.5	94%	0.936	78%	0.78	S	S	*	*			trans	-77.9	116.6	135.7	-91.7	-52.3	0	0	0	109.2
89	S	35	Very low	33.2	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	78%	0.782	S	S	*	*			trans	-166.5	144	154.6	47.8	0	0	0	0	114.5
90	S	33.2	Very low	33	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	78%	0.784	S	S	*	*			trans	53.6	104.6	160.1	49.1	0	0	0	0	119.6
91	L	30.1	Very low	32.9	Very low	159 Å²	159	140 Å²	140	83%	0.832	79%	0.785	S	S	*	*			trans	-56	153.2	138	-69.1	69.1	0	0	0	109.4
92	I	33.8	Very low	32.7	Very low	154 Å²	154	141.5 Å²	141.5	79%	0.79	79%	0.791	S	S	*	*				179.1	136.4	121.3	-94.6	158.5	0	0	0	112.4
93	N	33.1	Very low	32.8	Very low	132 Å²	132	137.8 Å²	137.8	71%	0.706	78%	0.783	S	S	*	*			trans	48.5	103.6	159.6	-67.7	-17.5	0	0	0	122.6
94	N	32.3	Very low	32.6	Very low	141 Å²	141	136.1 Å²	136.1	75%	0.754	78%	0.779	S	S	*	*				48.4	132.5	102.7	-82.3	-50.7	0	0	0	122
95	K	32.6	Very low	32.6	Very low	180 Å²	180	131.8 Å²	131.8	78%	0.783	77%	0.77	S	S	*	*			trans	95	124.3	134.6	-86.9	-176.2	177	-178.6	0	121.8
96	L	33.7	Very low	32.6	Very low	134 Å²	134	133 Å²	133	70%	0.702	77%	0.769	S	S	*	*			trans	84.7	123.8	140.8	-66.7	165.2	0	0	0	120.6
97	N	31.3	Very low	32.5	Very low	147 Å²	147	132.3 Å²	132.3	79%	0.786	76%	0.762	S	S	*	*			trans	42.7	99.9	140.3	-54.6	-1.1	0	0	0	116.7
98	G	30.7	Very low	32.6	Very low	85 Å²	85	134.5 Å²	134.5	88%	0.876	77%	0.766	S	S	*	*				95.1	131.1	60.6	0	0	0	0	0	110.6
99	G	31.5	Very low	32.9	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	76%	0.755	S	S	*	*			trans	161.3	89.6	178.6	0	0	0	0	0	116.8
100	K	33.3	Very low	33	Very low	197 Å²	197	131.4 Å²	131.4	86%	0.857	76%	0.757	S	S	*	*			trans	55.3	144.6	142.3	-62.9	-178.1	172.6	-178.9	0	122
101	S	33.8	Very low	33.2	Very low	97 Å²	97	132.1 Å²	132.1	68%	0.678	75%	0.753	S	S	*	*			trans	58	109.8	146.7	49.5	0	0	0	0	118.6
102	I	30.4	Very low	33.5	Very low	167 Å²	167	131.2 Å²	131.2	86%	0.856	75%	0.749	S	S	*	*				86.5	135.1	68.5	-75.6	169.2	0	0	0	111.6
103	P	37.6	Very low	33.5	Very low	106 Å²	106	128.2 Å²	128.2	69%	0.688	74%	0.741	S	S	*	*			trans	-107.9	-176.4	-157.2	41.3	-31.1	0	0	0	112.6
104	L	29.6	Very low	33.5	Very low	153 Å²	153	126.4 Å²	126.4	80%	0.801	74%	0.739	S	S	*	*				168.5	138.8	127	-93.5	160.3	0	0	0	112.3
105	S	30.6	Very low	33.6	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	74%	0.738	S	S	*	*			trans	70.4	162.5	146.3	88.2	0	0	0	0	117.5
106	N	31.9	Very low	33.5	Very low	126 Å²	126	122.9 Å²	122.9	67%	0.674	73%	0.733	S	S	*	*			cis	-155.8	165.4	-4	-140	-11.3	0	0	0	113.8
107	Q	34.4	Very low	33.5	Very low	143 Å²	143	123.7 Å²	123.7	67%	0.668	74%	0.739	S	S	*	*			trans	74	145.8	141.2	-87.6	169.7	15.4	0	0	123.7
108	N	35.9	Very low	33.6	Very low	147 Å²	147	119.7 Å²	119.7	79%	0.786	73%	0.732	S	S	*	*			trans	74.4	125.6	152.5	-56.5	-19.2	0	0	0	119.7
109	G	36.4	Very low	33.7	Very low	68 Å²	68	123.2 Å²	123.2	70%	0.701	73%	0.73	S	S	*	*			cis	158.2	172.1	-15.7	0	0	0	0	0	116.9
110	N	36.1	Very low	33.4	Very low	142 Å²	142	125 Å²	125	76%	0.759	73%	0.731	S	S	*	*			trans	71.2	137.9	152.3	-83.9	11	0	0	0	122.7
111	N	37.7	Very low	33.3	Very low	124 Å²	124	123.1 Å²	123.1	66%	0.663	73%	0.728	S	S	*	*			trans	68.4	142.9	146.7	-58.7	-4.2	0	0	0	116.2
112	N	36.4	Very low	33.3	Very low	139 Å²	139	124.9 Å²	124.9	74%	0.743	74%	0.735	S	S	*	*			cis	170.7	163.2	2	-97.7	-12.7	0	0	0	102.4
113	S	34.9	Very low	33.3	Very low	91 Å²	91	121.6 Å²	121.6	64%	0.636	73%	0.725	S	S	*	*			cis	-167.8	177.8	-9.2	48	0	0	0	0	107
114	S	33.2	Very low	32.8	Very low	95 Å²	95	123.5 Å²	123.5	66%	0.664	73%	0.728	S	S	*	*			trans	50.3	136.9	140.9	61.5	0	0	0	0	121.7
115	T	32.8	Very low	32.7	Very low	117 Å²	117	123.5 Å²	123.5	72%	0.718	73%	0.726	S	S	*	*			cis	-176.1	153.4	-4.4	21.6	0	0	0	0	108.2
116	N	31.6	Very low	32.5	Very low	129 Å²	129	125.2 Å²	125.2	69%	0.69	73%	0.726	S	S	*	*			trans	67.3	148.3	142.1	-74.9	37.9	0	0	0	123.2
117	D	34	Very low	32.3	Very low	152 Å²	152	125.3 Å²	125.3	81%	0.813	73%	0.726	S	S	*	*			trans	58.3	139.4	150.1	-49.5	-25.8	0	0	0	120.1
118	G	32.1	Very low	32.1	Very low	62 Å²	62	124 Å²	124	64%	0.639	73%	0.728	S	S	*	*			cis	170	169.3	-3.4	0	0	0	0	0	112.1
119	N	32.8	Very low	31.7	Very low	159 Å²	159	124.8 Å²	124.8	85%	0.85	73%	0.727	S	S	*	*			trans	57.8	111.6	177	-61	-26.3	0	0	0	116.2
120	C	25.9	Very low	31.3	Very low	112 Å²	112	126.8 Å²	126.8	76%	0.757	72%	0.721	S	S	*	*				57.4	111	65.1	-165.4	0	0	0	0	113.8
121	I	31.2	Very low	30.9	Very low	156 Å²	156	126.8 Å²	126.8	80%	0.8	72%	0.721	S	S	*	*			trans	174.5	117.1	133.6	-89.5	153.9	0	0	0	109.2
122	T	33.4	Very low	30.4	Very low	135 Å²	135	126 Å²	126	83%	0.828	73%	0.725	S	S	*	*			trans	-80.1	149.1	159.6	52.3	0	0	0	0	109.5
123	P	31.8	Very low	29.9	Very low	98 Å²	98	123.6 Å²	123.6	64%	0.636	72%	0.719	S	S	*	*				-156.3	155.5	108.9	35.9	-17.5	0	0	0	117.8
124	L	27	Very low	29.7	Very low	146 Å²	146	126.9 Å²	126.9	76%	0.764	72%	0.724	S	S	*	*			trans	59.1	132.5	142.3	-60.9	166.3	0	0	0	119.5
125	M	26.1	Very low	29.8	Very low	153 Å²	153	128.3 Å²	128.3	75%	0.754	72%	0.72	S	S	*	*			cis	93.6	156.2	43.1	-162.2	-173.4	-169.7	0	0	112.6
126	I	27.6	Very low	29.8	Very low	135 Å²	135	128.7 Å²	128.7	69%	0.692	71%	0.713	S	S	*	*			trans	80.9	139.1	170.8	-55.6	168.1	0	0	0	114.9
127	D	27.2	Very low	29.9	Very low	128 Å²	128	129.3 Å²	129.3	68%	0.684	71%	0.712	S	S	*	*			cis	-172.6	-167.2	-30.1	-94.2	-33.9	0	0	0	107.9
128	V	31.1	Very low	29.8	Very low	116 Å²	116	129 Å²	129	70%	0.703	71%	0.706	S	S	*	*			trans	77	100.4	158	-157.8	0	0	0	0	114.1
129	E	27.4	Very low	29.7	Very low	163 Å²	163	132 Å²	132	76%	0.762	71%	0.712	S	S	*	*				53.1	143.3	83.7	-52.6	-170.5	160.1	0	0	113.5
130	N	27.1	Very low	29.5	Very low	111 Å²	111	131.7 Å²	131.7	59%	0.594	71%	0.71	S	S	*	*				177.5	155.8	54.3	-122.7	-40.2	0	0	0	111.7
131	L	26.8	Very low	30	Very low	142 Å²	142	131.5 Å²	131.5	74%	0.743	71%	0.707	S	S	*	*			trans	58.8	133.9	143.6	-72.4	161.1	0	0	0	124.2
132	S	28.2	Very low	30	Very low	108 Å²	108	132 Å²	132	76%	0.755	71%	0.71	S	S	*	*			trans	77.6	149	138.4	75.6	0	0	0	0	120
133	S	26.9	Very low	29.7	Very low	88 Å²	88	131.6 Å²	131.6	62%	0.615	71%	0.708	S	S	*	*			cis	-171.6	160.8	-26.2	56.1	0	0	0	0	110.1
134	Q	29.7	Very low	29.6	Very low	160 Å²	160	132.3 Å²	132.3	75%	0.748	72%	0.715	S	S	*	*			trans	68.6	158.4	159.3	-71.9	171.8	2.2	0	0	116.5
135	H	34.8	Very low	29.6	Very low	124 Å²	124	133.5 Å²	133.5	57%	0.574	72%	0.721	S	S	*	*			cis	-150.4	150.6	-3.9	-121.7	-50.9	0	0	0	112.3
136	H	34	Very low	29.6	Very low	125 Å²	125	130.9 Å²	130.9	58%	0.579	72%	0.718	S	S	*	*			trans	63.2	119.1	144.4	-74.4	-48	0	0	0	124.4
137	H	33	Very low	29.8	Very low	143 Å²	143	131.5 Å²	131.5	66%	0.662	72%	0.723	S	S	*	*				71.8	152.3	122.3	-67.2	-18.1	0	0	0	120.6
138	Q	31	Very low	29.8	Very low	146 Å²	146	133 Å²	133	68%	0.682	73%	0.73	S	S	*	*			cis	-156.4	162.4	0.1	-123.6	161.6	7.2	0	0	112.9
139	T	31.6	Very low	29.8	Very low	124 Å²	124	134.5 Å²	134.5	76%	0.761	74%	0.74	S	S	*	*			trans	53.4	98.9	152.4	50.6	0	0	0	0	122.4
140	N	27.8	Very low	29.9	Very low	152 Å²	152	136 Å²	136	81%	0.813	74%	0.744	S	S	*	*				-14.7	167.2	116.3	-68.1	-14.6	0	0	0	117.5
141	P	35.6	Very low	30	Very low	108 Å²	108	140.3 Å²	140.3	70%	0.701	76%	0.758	S	S	*	*			cis	-138.7	-168.6	-46.7	41.2	-24.1	0	0	0	110.5
142	I	31.5	Very low	30.2	Very low	168 Å²	168	138.2 Å²	138.2	86%	0.862	76%	0.755	S	S	*	*			trans	-166.5	155.7	140.9	-106	155.3	0	0	0	110.8
143	T	27.7	Very low	30.4	Very low	126 Å²	126	140.6 Å²	140.6	77%	0.773	76%	0.759	S	S	*	*			trans	-118.2	-174.7	-167.5	51.9	0	0	0	0	113.2
144	S	30.4	Very low	30.6	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	76%	0.763	S	S	*	*			trans	106	114.1	165.1	75.2	0	0	0	0	116.6
145	L	27	Very low	30.5	Very low	171 Å²	171	140.5 Å²	140.5	90%	0.895	76%	0.76	S	S	*	*			trans	-82.7	161.2	-177.2	-68.9	62.1	0	0	0	111
146	S	26.3	Very low	30.4	Very low	98 Å²	98	142 Å²	142	69%	0.685	77%	0.767	S	S	*	*			trans	-148.7	164	144.9	64.2	0	0	0	0	112.2
147	N	30.6	Very low	30.1	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	77%	0.773	S	S	*	*			trans	74.6	95.2	159.9	-55.4	-24.6	0	0	0	119.6
148	N	27.8	Very low	30	Very low	158 Å²	158	143.4 Å²	143.4	85%	0.845	78%	0.777	S	S	*	*			trans	-55.3	144.1	142.3	-75.7	-65.4	0	0	0	111
149	T	31.1	Very low	29.8	Very low	148 Å²	148	143.9 Å²	143.9	91%	0.908	78%	0.78	S	S	*	*				-169.9	158.1	127.6	13.1	0	0	0	0	112.7
150	K	28.8	Very low	29.9	Very low	196 Å²	196	144.9 Å²	144.9	85%	0.852	78%	0.775	S	S	*	*			trans	-101.6	141.7	-178.1	-58.5	173	178.9	177.2	0	111.9
151	K	29.7	Very low	30	Very low	201 Å²	201	141.9 Å²	141.9	87%	0.874	77%	0.767	S	S	*	*			trans	163	134.4	139.9	-88.7	156.4	-175.2	-177.3	0	108.6
152	S	30.4	Very low	29.7	Very low	98 Å²	98	144.1 Å²	144.1	69%	0.685	77%	0.772	S	S	*	*			cis	90.1	102.8	41.8	-175.9	0	0	0	0	113.7
153	N	32.6	Very low	29.7	Very low	157 Å²	157	140.7 Å²	140.7	84%	0.84	76%	0.763	S	S	*	*			trans	-170.6	146.8	152.1	-84.9	-35.4	0	0	0	106.3
154	T	31.8	Very low	29.9	Very low	113 Å²	113	141.5 Å²	141.5	69%	0.693	76%	0.762	S	S	*	*			cis	110.5	131.1	-2.6	-53.3	0	0	0	0	115.3
155	L	27.3	Very low	29.9	Very low	133 Å²	133	144.3 Å²	144.3	70%	0.696	76%	0.763	S	S	*	*			trans	73.7	141.3	-174.3	-66.4	154.3	0	0	0	114.9	Q157	L155-Q157 HydrophobicContact CD2-CG 4.41Å
156	H	33.1	Very low	29.9	Very low	157 Å²	157	144.6 Å²	144.6	73%	0.727	76%	0.759	S	S	*	*			cis	-119.7	153.3	15.3	-79.8	-71.7	0	0	0	112.4
157	Q	27.3	Very low	30.1	Very low	148 Å²	148	146.1 Å²	146.1	69%	0.692	77%	0.765	S	S	*	*				51.8	125.8	75.4	-58.6	173.1	-56	0	0	112.9	L155	L155-Q157 HydrophobicContact CD2-CG 4.41Å
158	I	30.6	Very low	30	Very low	148 Å²	148	146.8 Å²	146.8	76%	0.759	77%	0.768	S	S	*	*				-153.6	129.3	62.7	-81.7	168.5	0	0	0	108.5
159	Q	27.6	Very low	30.2	Very low	156 Å²	156	146.7 Å²	146.7	73%	0.729	77%	0.766	S	S	*	*				59.7	127.3	104.5	-126.2	172.3	-52.2	0	0	114
160	H	32.6	Very low	30	Very low	145 Å²	145	147.2 Å²	147.2	67%	0.671	76%	0.758	S	S	*	*				-172.8	142.1	66	-138.1	-88.2	0	0	0	114.5
161	S	30.5	Very low	30	Very low	90 Å²	90	147.1 Å²	147.1	63%	0.629	75%	0.754	S	S	*	*			trans	51.9	151.5	147.9	47.9	0	0	0	0	123
162	L	29.6	Very low	29.9	Very low	154 Å²	154	144 Å²	144	81%	0.806	74%	0.744	S	S	*	*			cis	-168.2	162.9	-9.8	-110.6	168.1	0	0	0	110.1
163	S	30.7	Very low	29.8	Very low	97 Å²	97	143.2 Å²	143.2	68%	0.678	73%	0.732	S	S	*	*			trans	66.8	145.4	159.7	67.5	0	0	0	0	118.8
164	N	31.7	Very low	29.8	Very low	142 Å²	142	144.4 Å²	144.4	76%	0.759	73%	0.73	S	S	*	*			cis	-155.6	151	-4.3	-116.6	3.2	0	0	0	113.7
165	H	31.7	Very low	29.7	Very low	173 Å²	173	143.5 Å²	143.5	80%	0.801	72%	0.718	S	S	*	*			trans	59	114.8	156.1	-83.5	-73.7	0	0	0	122.8
166	E	26.8	Very low	29.7	Very low	177 Å²	177	143 Å²	143	83%	0.827	72%	0.716	S	S	*	*			trans	-72.2	154.3	152.8	-54.1	150.7	124.7	0	0	111.5
167	T	30.6	Very low	29.6	Very low	129 Å²	129	141.7 Å²	141.7	79%	0.791	72%	0.718	S	S	*	*			trans	-149.4	113.3	142.4	37.2	0	0	0	0	109.9
168	D	27.5	Very low	29.7	Very low	162 Å²	162	143.7 Å²	143.7	87%	0.866	73%	0.728	S	S	*	*			trans	-66.4	129	161.7	-84	-48.1	0	0	0	110.1
169	I	31.5	Very low	29.8	Very low	156 Å²	156	142.8 Å²	142.8	80%	0.8	73%	0.729	S	S	*	*			trans	-130.7	106.4	162	-62.2	-175.3	0	0	0	109.4
170	H	27.6	Very low	30	Very low	160 Å²	160	140 Å²	140	74%	0.741	73%	0.727	S	S	*	*			trans	-68.2	161.5	164	-95.4	-90.7	0	0	0	111.7
171	Y	28.4	Very low	29.9	Very low	194 Å²	194	140 Å²	140	76%	0.761	73%	0.732	S	S	*	*			trans	88.9	144.5	138.9	-109.8	-62.2	0	0	0	121.7
172	M	29	Very low	30	Very low	136 Å²	136	143.4 Å²	143.4	67%	0.67	74%	0.741	S	S	*	*			trans	94.7	123	152.5	-66	-56.8	174.2	0	0	120.9	F174	M172-F174 HydrophobicContact CB-CD2 4.13Å; M172-F174 HydrophobicContact CB-CE2 4.16Å
173	D	27.4	Very low	30	Very low	81 Å²	81	143.7 Å²	143.7	43%	0.433	74%	0.738	S	S	.	*			trans	-63.9	120.6	156.3	-72.6	-80.2	0	0	0	111	S663 P665	D173-S663 PolarHBondContact OD2-OG 2.88Å; D173-P665 WeakPolarHBondContact OD1-CD 3.22Å; D173-P665 WeakPolarHBondContact OD1-CG 3.34Å
174	F	32.3	Very low	30	Very low	181 Å²	181	144.8 Å²	144.8	79%	0.794	74%	0.741	S	S	*	*			trans	-144.5	124.4	156.8	-81.8	-83.5	0	0	0	107	M172	M172-F174 HydrophobicContact CB-CD2 4.13Å; M172-F174 HydrophobicContact CB-CE2 4.16Å
175	Q	30	Very low	29.8	Very low	94 Å²	94	143 Å²	143	44%	0.439	74%	0.74	S	S	.	*			cis	64.3	83.7	38.4	-57.6	-149.6	6.5	0	0	115.1	P665 V667	Q175-P665 HydrophobicContact CG-CB 4.37Å; Q175-V667 HydrophobicContact CG-CG2 3.78Å
176	N	27.8	Very low	29.8	Very low	122 Å²	122	141.9 Å²	141.9	65%	0.652	74%	0.739	S	S	*	*			trans	27.9	99.9	143.5	-61	-4.1	0	0	0	119
177	V	30.8	Very low	29.9	Very low	130 Å²	130	144.7 Å²	144.7	79%	0.788	74%	0.743	S	S	*	*			trans	-139.4	121.1	142.3	-177.6	0	0	0	0	110.1
178	H	29.9	Very low	30	Very low	191 Å²	191	141.8 Å²	141.8	88%	0.884	74%	0.738	S	S	*	*			trans	-88.6	129.9	160.3	-106.9	-57.4	0	0	0	108.9
179	T	32.7	Very low	30.3	Very low	129 Å²	129	140.7 Å²	140.7	79%	0.791	73%	0.733	S	S	*	*			trans	-146.2	129.4	151.3	42.5	0	0	0	0	109.6
180	S	31.5	Very low	30.4	Very low	98 Å²	98	140.1 Å²	140.1	69%	0.685	73%	0.726	S	S	*	*			trans	-87.8	154.9	177.3	52.8	0	0	0	0	112.2
181	D	30.2	Very low	30.6	Very low	143 Å²	143	139.2 Å²	139.2	77%	0.765	73%	0.726	S	S	*	*			trans	39.7	130.9	145.2	-44.4	-31.2	0	0	0	120.8
182	I	32.4	Very low	30.7	Very low	162 Å²	162	136 Å²	136	83%	0.831	72%	0.721	S	S	*	*				-163.4	119.7	117.4	-100.1	155.2	0	0	0	112.1
183	E	29.7	Very low	30.8	Very low	160 Å²	160	135.8 Å²	135.8	75%	0.748	72%	0.718	S	S	*	*			trans	10.1	118.4	147.8	-59.3	-175.9	125	0	0	122.9
184	T	29.7	Very low	31.1	Very low	120 Å²	120	138.9 Å²	138.9	74%	0.736	73%	0.73	S	S	*	*				71.7	128.2	124.7	68.6	0	0	0	0	123.9
185	S	28.6	Very low	31.1	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	72%	0.721	S	S	*	*				96.9	161.3	125.6	75.5	0	0	0	0	122.6
186	I	31.5	Very low	31.3	Very low	149 Å²	149	139 Å²	139	76%	0.764	74%	0.736	S	S	*	*			trans	84.5	80.6	169	-49	177.7	0	0	0	117.3
187	Y	30	Very low	31.5	Very low	236 Å²	236	137.9 Å²	137.9	93%	0.925	74%	0.738	S	S	*	*				42.9	127.9	118.6	-91.9	-89.7	0	0	0	122.5
188	G	32.2	Very low	31.5	Very low	67 Å²	67	136 Å²	136	69%	0.691	73%	0.731	S	S	*	*			trans	98	159.7	146	0	0	0	0	0	116.6
189	N	32.6	Very low	31.7	Very low	140 Å²	140	134.5 Å²	134.5	75%	0.749	72%	0.724	S	S	*	*			cis	-164.8	163.8	-18	-143.1	3.6	0	0	0	110.2
190	H	34.1	Very low	31.8	Very low	144 Å²	144	136.1 Å²	136.1	67%	0.667	72%	0.722	S	S	*	*			trans	68.2	134.7	168.6	-67.4	-61.3	0	0	0	117.9
191	L	31.2	Very low	31.9	Very low	140 Å²	140	138.7 Å²	138.7	73%	0.733	72%	0.723	S	S	*	*				62.8	140.9	80.3	-51.6	-177.7	0	0	0	113.2
192	I	32	Very low	32.1	Very low	127 Å²	127	138.3 Å²	138.3	65%	0.651	72%	0.716	S	S	*	*			cis	-155.9	-177.6	6.2	-132	164.9	0	0	0	113.3
193	E	29.6	Very low	32.2	Very low	132 Å²	132	136.9 Å²	136.9	62%	0.617	71%	0.706	S	S	*	*			trans	-30.9	148.7	176.7	-54.9	140.2	138.2	0	0	120.3
194	H	35.2	Very low	32.3	Very low	146 Å²	146	136.9 Å²	136.9	68%	0.676	70%	0.7	S	S	*	*				173.9	127	93.8	-98.1	-60.6	0	0	0	117.2
195	N	31	Very low	32.5	Very low	114 Å²	114	137.7 Å²	137.7	61%	0.61	70%	0.695	S	S	*	*			trans	28	161.9	132.9	-55.7	-8.6	0	0	0	126
196	H	35.4	Very low	32.6	Very low	162 Å²	162	138.6 Å²	138.6	75%	0.75	69%	0.688	S	S	*	*			trans	83.9	121.4	159.5	-58.3	-61	0	0	0	116.7
197	S	30.3	Very low	32.6	Very low	99 Å²	99	138.7 Å²	138.7	69%	0.692	69%	0.685	S	S	*	*			cis	75.3	134.1	47.2	84.8	0	0	0	0	112.7
198	S	31.9	Very low	32.5	Very low	92 Å²	92	134.4 Å²	134.4	64%	0.643	67%	0.673	S	S	*	*			cis	-171.1	168.2	23.8	53.7	0	0	0	0	114.9
199	H	34	Very low	32.5	Very low	158 Å²	158	137.8 Å²	137.8	73%	0.731	67%	0.671	S	S	*	*			trans	86.9	149.8	136.2	-82.5	6.9	0	0	0	125.3
200	H	34.7	Very low	32.4	Very low	163 Å²	163	138 Å²	138	76%	0.755	67%	0.668	S	S	*	*			trans	70.8	162.3	159.6	-60.5	-53.4	0	0	0	122.3
201	H	32.9	Very low	32.2	Very low	153 Å²	153	136.7 Å²	136.7	71%	0.708	67%	0.665	S	S	*	*				-169.6	175.7	-63.7	-132.9	1.7	0	0	0	111.8
202	H	35	Very low	32	Very low	134 Å²	134	138.9 Å²	138.9	62%	0.62	67%	0.669	S	S	*	*			trans	69.6	118.8	160.3	-65.2	-22.3	0	0	0	117.5
203	H	34.3	Very low	31.8	Very low	132 Å²	132	138.3 Å²	138.3	61%	0.611	68%	0.675	S	S	*	*				96	153	71.4	-80.2	-32.9	0	0	0	112.2
204	Y	31.6	Very low	31.8	Very low	161 Å²	161	140 Å²	140	63%	0.631	69%	0.687	S	S	*	*			cis	-160.8	150.4	4.3	-125.5	-46.2	0	0	0	110.5
205	H	34.6	Very low	31.5	Very low	137 Å²	137	139.9 Å²	139.9	63%	0.634	69%	0.691	S	S	*	*			trans	61.6	158.6	142.9	-84.2	-0.6	0	0	0	121
206	Q	30.1	Very low	31.4	Very low	124 Å²	124	141.5 Å²	141.5	58%	0.579	70%	0.695	S	S	*	*			cis	-163.7	167.9	-16.7	-131.6	176.4	15.6	0	0	111.5
207	Q	31.4	Very low	31.1	Very low	151 Å²	151	139.8 Å²	139.8	71%	0.706	69%	0.691	S	S	*	*			trans	65.1	163.7	151.3	-70.2	177.5	48.2	0	0	119.6
208	Q	29.6	Very low	31.2	Very low	147 Å²	147	142.9 Å²	142.9	69%	0.687	70%	0.699	S	S	*	*				-167.6	166.2	-54.4	-123.1	-175.9	29.9	0	0	111
209	Q	30.4	Very low	31.1	Very low	137 Å²	137	149 Å²	149	64%	0.64	71%	0.708	S	S	*	*			trans	79.3	131.4	144.8	-84.6	-176.2	61.8	0	0	123.8
210	Q	30.6	Very low	30.9	Very low	146 Å²	146	150.3 Å²	150.3	68%	0.682	71%	0.711	S	S	*	*			trans	94.8	108.3	135.8	-74.9	-167.3	57	0	0	124.5
211	N	29.8	Very low	30.7	Very low	115 Å²	115	148.1 Å²	148.1	62%	0.615	71%	0.71	S	S	*	*				82.1	109.2	118.4	-72.7	-26.4	0	0	0	124.8
212	K	28.4	Very low	30.5	Very low	187 Å²	187	147 Å²	147	81%	0.813	71%	0.714	S	S	*	*				62.5	122	118.9	-70.5	-175.5	176.2	-177.7	0	122.7
213	C	27.6	Very low	30.3	Very low	114 Å²	114	146.1 Å²	146.1	77%	0.77	72%	0.722	S	S	*	*				72.3	124.6	127.3	-153.5	0	0	0	0	120.4
214	I	29.7	Very low	30	Very low	168 Å²	168	147.4 Å²	147.4	86%	0.862	73%	0.729	S	S	*	*				-169.4	164.4	109.7	-94.5	161.6	0	0	0	109
215	D	28.9	Very low	30.3	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	74%	0.736	S	S	*	*			trans	-111.1	-177.3	-166.1	-148.4	-27.2	0	0	0	112.8
216	E	29.4	Very low	30.1	Very low	148 Å²	148	143.6 Å²	143.6	69%	0.692	74%	0.738	S	S	*	*			trans	81.2	138.9	151.2	-104.3	-172.1	-143.8	0	0	122.3
217	N	28.7	Very low	30.2	Very low	126 Å²	126	145.8 Å²	145.8	67%	0.674	75%	0.753	S	S	*	*			trans	67.5	137.1	155.1	-59.8	-40.3	0	0	0	118.5
218	L	31.5	Very low	30.2	Very low	163 Å²	163	148.2 Å²	148.2	85%	0.853	76%	0.761	S	S	*	*			cis	-155.8	157.7	33.5	-126	137.8	0	0	0	113.3
219	R	29.5	Very low	30.3	Very low	221 Å²	221	150.3 Å²	150.3	83%	0.834	77%	0.773	S	S	*	*			trans	-73.2	142.2	169.8	-60.8	163.9	161.9	175.8	-8.3	111.8
220	K	31.4	Very low	30.4	Very low	185 Å²	185	155.1 Å²	155.1	80%	0.804	79%	0.785	S	S	*	*				162.5	156.3	112	-91.9	178.9	-177.5	178.4	0	116.4
221	T	29.3	Very low	30.5	Very low	118 Å²	118	153.6 Å²	153.6	72%	0.724	79%	0.791	S	S	*	*			trans	71.5	104.2	145.4	44.3	0	0	0	0	123.7
222	V	29.1	Very low	30.5	Very low	130 Å²	130	151.7 Å²	151.7	79%	0.788	80%	0.798	S	S	*	*				84.2	143.7	112.2	166.8	0	0	0	0	121.7
223	S	30.9	Very low	30.8	Very low	114 Å²	114	148.5 Å²	148.5	80%	0.797	80%	0.799	S	S	*	*			trans	90.4	136.7	156.2	61.2	0	0	0	0	121.1
224	E	27.5	Very low	31	Very low	160 Å²	160	147.1 Å²	147.1	75%	0.748	81%	0.805	S	S	*	*			trans	-80.7	163.2	174.1	-45.9	172.6	153.4	0	0	112.5
225	P	37.1	Very low	31	Very low	120 Å²	120	142.7 Å²	142.7	78%	0.779	80%	0.8	S	S	*	*			trans	-107.4	88.2	157.4	35.5	-25.9	0	0	0	112.1	L227	P225-L227 PolarHBondContact O-N 3.19Å
226	S	30.7	Very low	31.2	Very low	98 Å²	98	142.2 Å²	142.2	69%	0.685	80%	0.802	S	S	*	*			trans	-78.5	99.6	172.6	16	0	0	0	0	111.7	K228	S226-K228 PolarHBondContact O-N 3.16Å; S226-K228 VanDerWaalsContact O-N 3.14Å
227	L	32.2	Very low	31.3	Very low	169 Å²	169	142 Å²	142	89%	0.885	80%	0.801	S	S	*	*			trans	-78.2	94	-177.1	-81.3	169.6	0	0	0	113.7	P225	P225-L227 PolarHBondContact O-N 3.19Å
228	K	32.2	Very low	31.5	Very low	202 Å²	202	144 Å²	144	88%	0.878	80%	0.804	S	S	*	*			trans	-80.6	111.8	160.2	-80.2	177.8	175	170.6	0	110.5	S226 R230	S226-K228 PolarHBondContact O-N 3.16Å; S226-K228 VanDerWaalsContact O-N 3.14Å; K228-R230 PolarHBondContact O-N 3.44Å
229	M	31.3	Very low	31.5	Very low	191 Å²	191	141.1 Å²	141.1	94%	0.941	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-67.5	126.5	161.4	-77.4	-161.7	74.4	0	0	109.9
230	R	32.5	Very low	31.6	Very low	238 Å²	238	141.3 Å²	141.3	90%	0.898	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-93.2	125	177.2	-168.6	179.1	-173.4	-175	2.7	109.2	K228	K228-R230 PolarHBondContact O-N 3.44Å
231	S	33	Very low	31.6	Very low	115 Å²	115	143 Å²	143	80%	0.804	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.7	146	176	45.9	0	0	0	0	111.8
232	G	30	Very low	31.7	Very low	74 Å²	74	146.1 Å²	146.1	76%	0.763	81%	0.805	S	S	*	*			trans	-129.6	115.4	172.8	0	0	0	0	0	110.2
233	S	34.2	Very low	32	Very low	120 Å²	120	145.5 Å²	145.5	84%	0.839	80%	0.803	S	S	*	*			trans	-146.8	101.7	176.8	-57	0	0	0	0	109.9
234	G	32.5	Very low	31.9	Very low	86 Å²	86	145.5 Å²	145.5	89%	0.887	79%	0.794	S	S	*	*			trans	-74.7	127.7	160.4	0	0	0	0	0	108.8
235	G	29.2	Very low	32	Very low	74 Å²	74	147.7 Å²	147.7	76%	0.763	80%	0.796	S	S	*	*			trans	-95.8	-178.6	179.8	0	0	0	0	0	113.1
236	V	32.2	Very low	31.7	Very low	134 Å²	134	153.7 Å²	153.7	81%	0.812	80%	0.803	S	S	*	*			trans	-160.8	114.6	146.3	133.3	0	0	0	0	111.8
237	Q	32.7	Very low	31.7	Very low	143 Å²	143	157.8 Å²	157.8	67%	0.668	81%	0.811	S	S	*	*			trans	60.2	145.9	146.1	-59.4	-170.9	5.3	0	0	125.1
238	K	33	Very low	31.6	Very low	170 Å²	170	161.2 Å²	161.2	74%	0.739	81%	0.813	S	S	*	*			trans	73.7	108.9	157.4	-68.1	145.8	-177.4	163	0	116.3
239	S	31.8	Very low	31.4	Very low	101 Å²	101	157.9 Å²	157.9	71%	0.706	81%	0.805	S	S	*	*				76.7	139.5	50.8	84.2	0	0	0	0	113.3
240	R	31	Very low	31.2	Very low	226 Å²	226	156.3 Å²	156.3	85%	0.853	80%	0.796	S	S	*	*			cis	-167.3	140.4	16.6	-145.2	-177.7	-152.6	171.8	5	109.1
241	Y	31.9	Very low	31.1	Very low	219 Å²	219	153.7 Å²	153.7	86%	0.859	79%	0.793	S	S	*	*			trans	178.8	145.8	131.8	-116.1	-89.2	0	0	0	113.2
242	K	29.8	Very low	30.9	Very low	185 Å²	185	156 Å²	156	80%	0.804	79%	0.791	S	S	*	*			trans	-160.3	146.2	169.8	-108.7	-167.1	176.7	-169.1	0	106.8
243	P	36.4	Very low	30.9	Very low	116 Å²	116	161.1 Å²	161.1	75%	0.753	80%	0.795	S	S	*	*				-140.6	167.8	96.9	34.1	-17.9	0	0	0	112.5
244	D	29.7	Very low	30.7	Very low	114 Å²	114	162.7 Å²	162.7	61%	0.61	79%	0.789	S	S	*	*			cis	110.9	109.9	8.2	-157.7	60.4	0	0	0	115.7
245	R	29.1	Very low	30.6	Very low	207 Å²	207	167.4 Å²	167.4	78%	0.781	79%	0.787	S	S	*	*			trans	57.9	128.7	161.2	-61.1	167.3	-178.7	-150.7	-6.8	121
246	R	30.5	Very low	30.7	Very low	246 Å²	246	172.5 Å²	172.5	93%	0.928	79%	0.789	S	S	*	*				-174.2	168.9	94.6	-93.8	174	-151.6	-146.7	4.5	112.2
247	H	29.7	Very low	30.6	Very low	184 Å²	184	169.5 Å²	169.5	85%	0.852	78%	0.784	S	S	*	*			trans	-71.4	152.2	-175.8	-57.1	-89.1	0	0	0	114.2
248	Y	31.4	Very low	30.8	Very low	240 Å²	240	169 Å²	169	94%	0.941	78%	0.784	S	S	*	*				-144.7	165.9	127.6	-130.2	-94	0	0	0	110.2
249	N	26.8	Very low	31.3	Very low	133 Å²	133	166.8 Å²	166.8	71%	0.711	78%	0.78	S	S	*	*			trans	-107.5	161.3	-168.7	-128.4	-3.4	0	0	0	112.7
250	Q	27.8	Very low	31.9	Very low	158 Å²	158	168 Å²	168	74%	0.738	78%	0.783	S	S	*	*			trans	58.8	111.3	161.7	-65	167.5	-32	0	0	118.4
251	H	30.5	Very low	32.4	Very low	182 Å²	182	159.8 Å²	159.8	84%	0.843	76%	0.764	S	S	*	*				-167.6	146.2	93.3	-106.1	-83.9	0	0	0	111.3
252	H	28.5	Very low	33	Very low	164 Å²	164	152.9 Å²	152.9	76%	0.759	74%	0.744	S	S	*	*			trans	-82.3	136.2	176.8	-80.1	-95.9	0	0	0	111.8
253	H	31	Very low	33.7	Very low	181 Å²	181	146.3 Å²	146.3	84%	0.838	72%	0.724	S	S	*	*			trans	-129.2	119.8	151.6	-96.1	-80.7	0	0	0	109.7
254	H	28.4	Very low	34.1	Very low	154 Å²	154	143.8 Å²	143.8	71%	0.713	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-78.2	120.1	169.9	-90.2	-90.3	0	0	0	109.8
255	H	31.7	Very low	34.8	Very low	184 Å²	184	140.7 Å²	140.7	85%	0.852	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-103.2	117.9	156.7	-101.7	-78.9	0	0	0	109.5	G257	H255-G257 PolarHBondContact O-N 3.42Å
256	F	31.3	Very low	35.8	Very low	182 Å²	182	133.4 Å²	133.4	80%	0.798	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-77.1	118	172.2	-96.3	-101.4	0	0	0	109.8	M258	F256-M258 PolarHBondContact O-N 2.86Å
257	G	30.4	Very low	36.8	Very low	70 Å²	70	126.7 Å²	126.7	72%	0.722	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-71.3	119.4	166.3	0	0	0	0	0	110.4	H255	H255-G257 PolarHBondContact O-N 3.42Å
258	M	36.4	Very low	37.8	Very low	133 Å²	133	118.9 Å²	118.9	66%	0.655	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-77.4	128.2	175.1	-69.8	179.5	68.2	0	0	110.5	F256 T262	F256-M258 PolarHBondContact O-N 2.86Å; M258-T262 HydrophobicContact CE-CG2 3.66Å
259	N	43.3	Very low	38.7	Very low	124 Å²	124	110 Å²	110	66%	0.663	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-66.4	144.5	173.8	-69	-39.6	0	0	0	110.6	A261 T262 A263	N259-A261 PolarHBondContact O-N 3.48Å; N259-A261 VanDerWaalsContact O-N 3.11Å; N259-T262 WeakPolarHBondContact O-CA 3.21Å; N259-T262 WeakPolarHBondContact O-CB 3.4Å; N259-T262 PolarHBondContact O-N 3.11Å; N259-A263 PolarHBondContact O-N 2.94Å
260	T	43.5	Very low	40.1	Very low	126 Å²	126	106 Å²	106	77%	0.773	60%	0.603	S	S	*	*	H	α-helix	trans	-56.5	-31.8	-175.2	47.4	0	0	0	0	114.2	T262 A263 A264	T260-T262 VanDerWaalsContact C-N 3.3Å; T260-T262 PolarHBondContact O-N 2.74Å; T260-A263 PolarHBondContact O-N 2.82Å; T260-A264 PolarHBondContact O-N 2.84Å
261	A	41.5	Very low	41	Very low	54 Å²	54	100.5 Å²	100.5	45%	0.446	58%	0.584	S	S	.	*	H	α-helix	trans	-63.3	-33.3	173.5	0	0	0	0	0	113.2	N259 A265	N259-A261 PolarHBondContact O-N 3.48Å; N259-A261 VanDerWaalsContact O-N 3.11Å; A261-A265 WeakPolarHBondContact O-CB 3.48Å; A261-A265 PolarHBondContact O-N 3.45Å
262	T	45.6	Very low	41.9	Very low	73 Å²	73	94.8 Å²	94.8	45%	0.448	56%	0.56	S	S	.	*	H	α-helix	trans	-73.9	-35.9	176.1	-46.8	0	0	0	0	111.2	M258 N259 T260 A265 A266	M258-T262 HydrophobicContact CE-CG2 3.66Å; N259-T262 WeakPolarHBondContact O-CA 3.21Å; N259-T262 WeakPolarHBondContact O-CB 3.4Å; N259-T262 PolarHBondContact O-N 3.11Å; T260-T262 VanDerWaalsContact C-N 3.3Å; T260-T262 PolarHBondContact O-N 2.74Å; T262-A265 PolarHBondContact O-N 2.74Å; T262-A266 WeakPolarHBondContact O-CB 3.36Å; T262-A266 PolarHBondContact O-N 3.17Å
263	A	44.9	Very low	42.9	Very low	47 Å²	47	92.7 Å²	92.7	39%	0.388	56%	0.559	S	S	.	*	H	α-helix	trans	-64.6	-45.4	172.2	0	0	0	0	0	111.6	N259 T260 A265 A266 V267	N259-A263 PolarHBondContact O-N 2.94Å; T260-A263 PolarHBondContact O-N 2.82Å; A263-A265 PolarHBondContact O-N 3.36Å; A263-A266 PolarHBondContact O-N 3.37Å; A263-V267 WeakPolarHBondContact O-CG2 3.38Å; A263-V267 PolarHBondContact O-N 2.96Å
264	A	43.5	Very low	43.7	Very low	64 Å²	64	89.9 Å²	89.9	53%	0.529	55%	0.554	S	S	.	*	H	α-helix	trans	-60	-42.7	174.9	0	0	0	0	0	112.4	T260 A266 V267 A268	T260-A264 PolarHBondContact O-N 2.84Å; A264-A266 PolarHBondContact O-N 3.4Å; A264-V267 PolarHBondContact O-N 3.27Å; A264-A268 WeakPolarHBondContact O-CB 3.31Å; A264-A268 PolarHBondContact O-N 2.75Å
265	A	45.5	Very low	44.6	Very low	48 Å²	48	84.4 Å²	84.4	40%	0.397	53%	0.533	S	S	.	.	H	α-helix	trans	-63.9	-37.9	175.2	0	0	0	0	0	112.9	A261 T262 A263 A269	A261-A265 WeakPolarHBondContact O-CB 3.48Å; A261-A265 PolarHBondContact O-N 3.45Å; T262-A265 PolarHBondContact O-N 2.74Å; A263-A265 PolarHBondContact O-N 3.36Å; A265-A269 WeakPolarHBondContact O-CB 3.33Å; A265-A269 PolarHBondContact O-N 3Å
266	A	50.1	Low	45.4	Very low	55 Å²	55	83.7 Å²	83.7	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-67.6	-41.1	175.5	0	0	0	0	0	112.3	T262 A263 A264 A269 A270	T262-A266 WeakPolarHBondContact O-CB 3.36Å; T262-A266 PolarHBondContact O-N 3.17Å; A263-A266 PolarHBondContact O-N 3.37Å; A264-A266 PolarHBondContact O-N 3.4Å; A266-A269 PolarHBondContact O-N 2.95Å; A266-A270 WeakPolarHBondContact O-CB 3.39Å; A266-A270 PolarHBondContact O-N 3.36Å
267	V	50.4	Low	46.4	Very low	104 Å²	104	78.4 Å²	78.4	63%	0.63	52%	0.515	S	S	*	.	H	α-helix	trans	-65.7	-42	175.3	172.4	0	0	0	0	111.3	A263 A264 A270 A271	A263-V267 WeakPolarHBondContact O-CG2 3.38Å; A263-V267 PolarHBondContact O-N 2.96Å; A264-V267 PolarHBondContact O-N 3.27Å; V267-A270 PolarHBondContact O-N 3.14Å; V267-A271 PolarHBondContact O-N 2.9Å
268	A	51.7	Low	47.1	Very low	21 Å²	21	79.5 Å²	79.5	17%	0.174	51%	0.51	C	S	.	.	H	α-helix	trans	-63.6	-42.3	174.7	0	0	0	0	0	112.1	A264 A270 A271 I272 L288	A264-A268 WeakPolarHBondContact O-CB 3.31Å; A264-A268 PolarHBondContact O-N 2.75Å; A268-A270 VanDerWaalsContact C-N 3.33Å; A268-A270 PolarHBondContact O-N 2.92Å; A268-A271 PolarHBondContact O-N 3.47Å; A268-I272 WeakPolarHBondContact O-CD1 3.48Å; A268-I272 VanDerWaalsContact O-CG1 3.25Å; A268-I272 WeakPolarHBondContact O-CG1 3.42Å; A268-I272 PolarHBondContact O-N 3.24Å; A268-L288 HydrophobicContact CB-CD2 4.34Å
269	A	50.4	Low	47.7	Very low	52 Å²	52	78.5 Å²	78.5	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-36.3	175.1	0	0	0	0	0	112.7	A265 A266 I272 T273	A265-A269 WeakPolarHBondContact O-CB 3.33Å; A265-A269 PolarHBondContact O-N 3Å; A266-A269 PolarHBondContact O-N 2.95Å; A269-I272 PolarHBondContact O-N 2.86Å; A269-T273 PolarHBondContact O-N 3.15Å; A269-T273 VanDerWaalsContact O-N 3.15Å; A269-T273 PolarHBondContact O-OG1 3.42Å
270	A	55.1	Low	48.1	Very low	50 Å²	50	74.4 Å²	74.4	41%	0.413	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-42.2	173	0	0	0	0	0	111.9	A266 V267 A268 I272 T273 V274	A266-A270 WeakPolarHBondContact O-CB 3.39Å; A266-A270 PolarHBondContact O-N 3.36Å; V267-A270 PolarHBondContact O-N 3.14Å; A268-A270 VanDerWaalsContact C-N 3.33Å; A268-A270 PolarHBondContact O-N 2.92Å; A270-I272 VanDerWaalsContact C-N 3.32Å; A270-I272 PolarHBondContact O-N 3.41Å; A270-T273 WeakPolarHBondContact CA-OG1 3.37Å; A270-T273 PolarHBondContact O-N 3.03Å; A270-T273 PolarHBondContact O-OG1 3.5Å; A270-T273 VanDerWaalsContact O-OG1 3.13Å; A270-V274 WeakPolarHBondContact O-CG2 3.34Å; A270-V274 PolarHBondContact O-N 3.29Å; A270-V274 VanDerWaalsContact O-N 3.12Å
271	A	48.4	Very low	48.4	Very low	42 Å²	42	71.6 Å²	71.6	35%	0.347	47%	0.47	S	S	.	.	H	α-helix	trans	-61	-40.5	175.2	0	0	0	0	0	112.1	V267 A268 T273 V274 S275 L284	V267-A271 PolarHBondContact O-N 2.9Å; A268-A271 PolarHBondContact O-N 3.47Å; A271-T273 VanDerWaalsContact C-N 3.31Å; A271-T273 PolarHBondContact O-N 3.3Å; A271-V274 PolarHBondContact O-N 2.96Å; A271-S275 WeakPolarHBondContact O-CB 3.46Å; A271-S275 PolarHBondContact O-N 3.18Å; A271-L284 HydrophobicContact CB-CD1 4.39Å
272	I	49.2	Very low	49	Very low	63 Å²	63	73.1 Å²	73.1	32%	0.323	47%	0.473	S	S	.	.	H	α-helix	trans	-69.4	-25.5	177.6	-66.2	161.1	0	0	0	112.7	A268 A269 A270 L284 L288	A268-I272 WeakPolarHBondContact O-CD1 3.48Å; A268-I272 VanDerWaalsContact O-CG1 3.25Å; A268-I272 WeakPolarHBondContact O-CG1 3.42Å; A268-I272 PolarHBondContact O-N 3.24Å; A269-I272 PolarHBondContact O-N 2.86Å; A270-I272 VanDerWaalsContact C-N 3.32Å; A270-I272 PolarHBondContact O-N 3.41Å; I272-L284 HydrophobicContact CG1-CD1 4.3Å; I272-L288 HydrophobicContact CD1-CD1 3.84Å; I272-L288 HydrophobicContact CD1-CD2 3.83Å; I272-L288 HydrophobicContact CD1-CG 4.41Å
273	T	48.6	Very low	49.4	Very low	120 Å²	120	70.8 Å²	70.8	74%	0.736	46%	0.464	S	S	*	.	H	α-helix	trans	-90.6	-6	175.4	41.5	0	0	0	0	114	A269 A270 A271	A269-T273 PolarHBondContact O-N 3.15Å; A269-T273 VanDerWaalsContact O-N 3.15Å; A269-T273 PolarHBondContact O-OG1 3.42Å; A270-T273 WeakPolarHBondContact CA-OG1 3.37Å; A270-T273 PolarHBondContact O-N 3.03Å; A270-T273 PolarHBondContact O-OG1 3.5Å; A270-T273 VanDerWaalsContact O-OG1 3.13Å; A271-T273 VanDerWaalsContact C-N 3.31Å; A271-T273 PolarHBondContact O-N 3.3Å
274	V	48.1	Very low	50.2	Low	122 Å²	122	70.3 Å²	70.3	74%	0.739	45%	0.454	S	S	*	.	H	α-helix	trans	-110.2	-27.5	177.1	174.6	0	0	0	0	112.4	A270 A271	A270-V274 WeakPolarHBondContact O-CG2 3.34Å; A270-V274 PolarHBondContact O-N 3.29Å; A270-V274 VanDerWaalsContact O-N 3.12Å; A271-V274 PolarHBondContact O-N 2.96Å
275	S	46.6	Very low	51.1	Low	39 Å²	39	75.3 Å²	75.3	27%	0.273	46%	0.46	S	S	.	.			trans	-83.5	121.9	177.7	-171.2	0	0	0	0	112.8	A271 D277	A271-S275 WeakPolarHBondContact O-CB 3.46Å; A271-S275 PolarHBondContact O-N 3.18Å; S275-D277 VanDerWaalsContact C-N 3.35Å; S275-D277 PolarHBondContact OG-N 3.13Å; S275-D277 VanDerWaalsContact OG-N 3.11Å; S275-D277 PolarHBondContact OG-O 3.34Å
276	N	48.2	Very low	51.7	Low	169 Å²	169	76.2 Å²	76.2	90%	0.904	46%	0.462	S	S	*	.			trans	-90.2	3.8	164.5	-75.4	-42.4	0	0	0	112.9	P278	N276-P278 WeakPolarHBondContact O-CD 3.25Å
277	D	53.1	Low	52.3	Low	71 Å²	71	79.5 Å²	79.5	38%	0.38	47%	0.467	S	S	.	.			trans	-90.3	119.7	179.2	172.1	28.8	0	0	0	111.5	S275 L279 A280	S275-D277 VanDerWaalsContact C-N 3.35Å; S275-D277 PolarHBondContact OG-N 3.13Å; S275-D277 VanDerWaalsContact OG-N 3.11Å; S275-D277 PolarHBondContact OG-O 3.34Å; D277-L279 VanDerWaalsContact C-N 3.3Å; D277-L279 PolarHBondContact O-N 2.92Å; D277-L279 WeakPolarHBondContact OD1-CB 3.46Å; D277-L279 PolarHBondContact OD1-N 3.15Å; D277-A280 HydrophobicContact CB-CB 4.15Å; D277-A280 WeakPolarHBondContact OD2-CB 3.4Å; D277-A280 PolarHBondContact OD2-N 3.36Å
278	P	45.2	Very low	52.5	Low	93 Å²	93	75.9 Å²	75.9	60%	0.604	44%	0.444	S	S	*	.	H	α-helix	trans	-61.3	-32.4	174	-22.8	34.6	0	0	0	114.1	N276 I281 V282	N276-P278 WeakPolarHBondContact O-CD 3.25Å; P278-I281 PolarHBondContact O-N 2.76Å; P278-V282 PolarHBondContact O-N 3.16Å
279	L	48.2	Very low	52.9	Low	111 Å²	111	76.9 Å²	76.9	58%	0.581	45%	0.45	S	S	*	.	H	α-helix	trans	-69.7	-44.6	-176.9	-65.6	169.9	0	0	0	111	D277 I281 V282 G283	D277-L279 VanDerWaalsContact C-N 3.3Å; D277-L279 PolarHBondContact O-N 2.92Å; D277-L279 WeakPolarHBondContact OD1-CB 3.46Å; D277-L279 PolarHBondContact OD1-N 3.15Å; L279-I281 PolarHBondContact O-N 2.78Å; L279-I281 VanDerWaalsContact O-N 3.14Å; L279-V282 PolarHBondContact O-N 3.2Å; L279-G283 PolarHBondContact O-N 3.49Å
280	A	51.8	Low	53.1	Low	39 Å²	39	78 Å²	78	32%	0.322	46%	0.455	S	S	.	.	H	α-helix	trans	-53.8	-32.2	171.1	0	0	0	0	0	113.6	D277 L284	D277-A280 HydrophobicContact CB-CB 4.15Å; D277-A280 WeakPolarHBondContact OD2-CB 3.4Å; D277-A280 PolarHBondContact OD2-N 3.36Å; A280-L284 WeakPolarHBondContact O-CD1 3.43Å; A280-L284 VanDerWaalsContact O-CG 3.32Å; A280-L284 WeakPolarHBondContact O-CG 3.19Å; A280-L284 PolarHBondContact O-N 3.3Å
281	I	50.2	Low	53	Low	67 Å²	67	77.8 Å²	77.8	34%	0.344	45%	0.453	S	S	.	.	H	α-helix	trans	-75.3	-36.4	176.8	-61.8	172.8	0	0	0	111.3	P278 L279 L284 W285	P278-I281 PolarHBondContact O-N 2.76Å; L279-I281 PolarHBondContact O-N 2.78Å; L279-I281 VanDerWaalsContact O-N 3.14Å; I281-L284 PolarHBondContact O-N 3.32Å; I281-W285 PolarHBondContact O-N 3.17Å
282	V	55.3	Low	53.2	Low	86 Å²	86	82.1 Å²	82.1	52%	0.521	46%	0.464	S	S	.	.	H	α-helix	trans	-65.6	-46	174.1	175.3	0	0	0	0	110.9	P278 L279 L284 W285	P278-V282 PolarHBondContact O-N 3.16Å; L279-V282 PolarHBondContact O-N 3.2Å; V282-L284 PolarHBondContact O-N 3.31Å; V282-W285 WeakPolarHBondContact O-CB 3.28Å; V282-W285 PolarHBondContact O-N 2.75Å
283	G	53	Low	53.4	Low	24 Å²	24	84.9 Å²	84.9	25%	0.247	48%	0.476	C	S	.	.	H	α-helix	trans	-60.2	-28.1	177.2	0	0	0	0	0	114.3	L279	L279-G283 PolarHBondContact O-N 3.49Å
284	L	62.2	Low	53.5	Low	37 Å²	37	84.3 Å²	84.3	19%	0.194	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-13.7	174.9	-73.1	169.8	0	0	0	113.9	A271 I272 A280 I281 V282 Q287 L288	A271-L284 HydrophobicContact CB-CD1 4.39Å; I272-L284 HydrophobicContact CG1-CD1 4.3Å; A280-L284 WeakPolarHBondContact O-CD1 3.43Å; A280-L284 VanDerWaalsContact O-CG 3.32Å; A280-L284 WeakPolarHBondContact O-CG 3.19Å; A280-L284 PolarHBondContact O-N 3.3Å; I281-L284 PolarHBondContact O-N 3.32Å; V282-L284 PolarHBondContact O-N 3.31Å; L284-Q287 WeakPolarHBondContact O-CB 3.41Å; L284-Q287 PolarHBondContact O-N 2.85Å; L284-Q287 VanDerWaalsContact O-N 3.08Å; L284-L288 HydrophobicContact CB-CD1 4.15Å; L284-L288 WeakPolarHBondContact O-CG 3.21Å; L284-L288 PolarHBondContact O-N 3.1Å
285	W	62.6	Low	53.4	Low	168 Å²	168	80.9 Å²	80.9	64%	0.636	45%	0.449	S	S	*	.	H	α-helix	trans	-56.6	-41	-173	-172.8	-108	0	0	0	115.2	I281 V282 Q287 L288 S289	I281-W285 PolarHBondContact O-N 3.17Å; V282-W285 WeakPolarHBondContact O-CB 3.28Å; V282-W285 PolarHBondContact O-N 2.75Å; W285-Q287 VanDerWaalsContact C-N 3.3Å; W285-Q287 PolarHBondContact O-N 3.34Å; W285-L288 PolarHBondContact O-N 2.97Å; W285-S289 VanDerWaalsContact O-CB 3.27Å; W285-S289 WeakPolarHBondContact O-CB 3.26Å; W285-S289 PolarHBondContact O-N 3.42Å
286	P	57.7	Low	53.4	Low	68 Å²	68	83.1 Å²	83.1	44%	0.442	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-36.5	176.6	-22	34.5	0	0	0	112.7	S290	P286-S290 WeakPolarHBondContact O-CB 3.12Å; P286-S290 PolarHBondContact O-N 2.82Å
287	Q	62.1	Low	53.3	Low	123 Å²	123	80.1 Å²	80.1	58%	0.575	44%	0.441	S	S	*	.	H	α-helix	trans	-72.3	-43.5	-179.4	-54	-179	12.7	0	0	110.5	L284 W285 S290 A291	L284-Q287 WeakPolarHBondContact O-CB 3.41Å; L284-Q287 PolarHBondContact O-N 2.85Å; L284-Q287 VanDerWaalsContact O-N 3.08Å; W285-Q287 VanDerWaalsContact C-N 3.3Å; W285-Q287 PolarHBondContact O-N 3.34Å; Q287-S290 PolarHBondContact O-N 2.84Å; Q287-A291 WeakPolarHBondContact O-CB 3.39Å; Q287-A291 PolarHBondContact O-N 2.93Å
288	L	54.7	Low	52.9	Low	28 Å²	28	80.5 Å²	80.5	15%	0.147	44%	0.443	C	S	.	.	H	α-helix	trans	-61	-47.1	172.8	-69.6	167	0	0	0	111.7	A268 I272 L284 W285 S290 A291 F292	A268-L288 HydrophobicContact CB-CD2 4.34Å; I272-L288 HydrophobicContact CD1-CD1 3.84Å; I272-L288 HydrophobicContact CD1-CD2 3.83Å; I272-L288 HydrophobicContact CD1-CG 4.41Å; L284-L288 HydrophobicContact CB-CD1 4.15Å; L284-L288 WeakPolarHBondContact O-CG 3.21Å; L284-L288 PolarHBondContact O-N 3.1Å; W285-L288 PolarHBondContact O-N 2.97Å; L288-S290 PolarHBondContact O-N 2.97Å; L288-A291 PolarHBondContact O-N 3.3Å; L288-F292 HydrophobicContact CB-CD2 4.44Å; L288-F292 HydrophobicContact CB-CE2 4.49Å; L288-F292 WeakPolarHBondContact O-CB 3.46Å; L288-F292 WeakPolarHBondContact O-CD2 3.18Å; L288-F292 PolarHBondContact O-N 2.86Å
289	S	60.7	Low	52.6	Low	42 Å²	42	81.6 Å²	81.6	29%	0.294	44%	0.44	S	S	.	.	H	α-helix	trans	-58.9	-45.7	177.7	-175.4	0	0	0	0	111.5	W285 F292 Q293	W285-S289 VanDerWaalsContact O-CB 3.27Å; W285-S289 WeakPolarHBondContact O-CB 3.26Å; W285-S289 PolarHBondContact O-N 3.42Å; S289-F292 PolarHBondContact O-N 3.25Å; S289-Q293 WeakPolarHBondContact O-CB 3.2Å; S289-Q293 VanDerWaalsContact O-CG 3.28Å; S289-Q293 WeakPolarHBondContact O-CG 2.75Å; S289-Q293 PolarHBondContact O-N 2.99Å
290	S	54.5	Low	52.4	Low	75 Å²	75	82.6 Å²	82.6	52%	0.524	44%	0.44	S	S	.	.	H	α-helix	trans	-60.4	-46.5	174	-171.5	0	0	0	0	112.1	P286 Q287 L288 F292 Q293 H294	P286-S290 WeakPolarHBondContact O-CB 3.12Å; P286-S290 PolarHBondContact O-N 2.82Å; Q287-S290 PolarHBondContact O-N 2.84Å; L288-S290 PolarHBondContact O-N 2.97Å; S290-F292 PolarHBondContact O-N 3.06Å; S290-Q293 PolarHBondContact O-N 3.41Å; S290-H294 WeakPolarHBondContact O-CB 3.39Å; S290-H294 PolarHBondContact O-N 3.38Å
291	A	52.2	Low	51.9	Low	47 Å²	47	85.3 Å²	85.3	39%	0.388	45%	0.452	S	S	.	.	H	α-helix	trans	-62.1	-42.3	177.5	0	0	0	0	0	112.4	Q287 L288 H294 A295	Q287-A291 WeakPolarHBondContact O-CB 3.39Å; Q287-A291 PolarHBondContact O-N 2.93Å; L288-A291 PolarHBondContact O-N 3.3Å; A291-H294 PolarHBondContact O-N 3.14Å; A291-A295 WeakPolarHBondContact O-CB 3.32Å; A291-A295 PolarHBondContact O-N 2.68Å
292	F	53.4	Low	51.5	Low	132 Å²	132	87.5 Å²	87.5	58%	0.579	46%	0.464	S	S	*	.	H	α-helix	trans	-67.9	-37	175.8	-81.1	-62.1	0	0	0	112.8	L288 S289 S290 N296	L288-F292 HydrophobicContact CB-CD2 4.44Å; L288-F292 HydrophobicContact CB-CE2 4.49Å; L288-F292 WeakPolarHBondContact O-CB 3.46Å; L288-F292 WeakPolarHBondContact O-CD2 3.18Å; L288-F292 PolarHBondContact O-N 2.86Å; S289-F292 PolarHBondContact O-N 3.25Å; S290-F292 PolarHBondContact O-N 3.06Å; F292-N296 VanDerWaalsContact O-CB 3.31Å; F292-N296 WeakPolarHBondContact O-CB 3.31Å; F292-N296 PolarHBondContact O-N 2.72Å; F292-N296 PolarHBondContact O-ND2 3.23Å
293	Q	52.8	Low	50.7	Low	122 Å²	122	89.2 Å²	89.2	57%	0.57	47%	0.47	S	S	*	.	H	α-helix	trans	-65.1	-45.4	173	-73.2	176.3	20	0	0	111.1	S289 S290 N296 L297	S289-Q293 WeakPolarHBondContact O-CB 3.2Å; S289-Q293 VanDerWaalsContact O-CG 3.28Å; S289-Q293 WeakPolarHBondContact O-CG 2.75Å; S289-Q293 PolarHBondContact O-N 2.99Å; S290-Q293 PolarHBondContact O-N 3.41Å; Q293-N296 PolarHBondContact O-N 2.81Å; Q293-L297 PolarHBondContact O-N 3.29Å
294	H	50	Low	50	Low	108 Å²	108	96.1 Å²	96.1	50%	0.5	49%	0.493	S	S	.	.	H	α-helix	trans	-68.6	-38.1	179.9	-152.5	-111	0	0	0	112.1	S290 A291 L297 I298	S290-H294 WeakPolarHBondContact O-CB 3.39Å; S290-H294 PolarHBondContact O-N 3.38Å; A291-H294 PolarHBondContact O-N 3.14Å; H294-L297 WeakPolarHBondContact O-CB 3.48Å; H294-L297 PolarHBondContact O-N 2.86Å; H294-I298 VanDerWaalsContact O-CG1 3.32Å; H294-I298 WeakPolarHBondContact O-CG1 3.2Å; H294-I298 PolarHBondContact O-N 2.9Å
295	A	46.7	Very low	48.8	Very low	50 Å²	50	103.3 Å²	103.3	41%	0.413	52%	0.522	S	S	.	.	H	α-helix	trans	-63.6	-43.4	171.1	0	0	0	0	0	111.9	A291 L297 I298 Q299	A291-A295 WeakPolarHBondContact O-CB 3.32Å; A291-A295 PolarHBondContact O-N 2.68Å; A295-L297 VanDerWaalsContact C-N 3.33Å; A295-L297 PolarHBondContact O-N 2.75Å; A295-I298 PolarHBondContact O-N 2.85Å; A295-Q299 WeakPolarHBondContact O-CB 3.43Å; A295-Q299 PolarHBondContact O-N 2.92Å
296	N	47.8	Very low	47.5	Very low	86 Å²	86	99.9 Å²	99.9	46%	0.46	52%	0.522	S	S	.	.	H	α-helix	trans	-64.2	-35.5	174.6	-89.3	-76.5	0	0	0	112.8	F292 Q293 K300	F292-N296 VanDerWaalsContact O-CB 3.31Å; F292-N296 WeakPolarHBondContact O-CB 3.31Å; F292-N296 PolarHBondContact O-N 2.72Å; F292-N296 PolarHBondContact O-ND2 3.23Å; Q293-N296 PolarHBondContact O-N 2.81Å; N296-K300 VanDerWaalsContact O-CB 3.28Å; N296-K300 WeakPolarHBondContact O-CB 3.3Å; N296-K300 WeakPolarHBondContact O-CD 3.48Å; N296-K300 WeakPolarHBondContact O-CG 3.43Å; N296-K300 PolarHBondContact O-N 3.48Å
297	L	45.5	Very low	46.2	Very low	105 Å²	105	104.6 Å²	104.6	55%	0.55	54%	0.542	S	S	.	.	H	α-helix	trans	-63.4	-50.5	171.5	-91.7	156.6	0	0	0	111	Q293 H294 A295 Q299 K300 T301	Q293-L297 PolarHBondContact O-N 3.29Å; H294-L297 WeakPolarHBondContact O-CB 3.48Å; H294-L297 PolarHBondContact O-N 2.86Å; A295-L297 VanDerWaalsContact C-N 3.33Å; A295-L297 PolarHBondContact O-N 2.75Å; L297-Q299 PolarHBondContact O-N 3.41Å; L297-K300 CarbonylContact O-C 3.46Å; L297-K300 PolarHBondContact O-N 3.44Å; L297-K300 VanDerWaalsContact O-N 3.14Å; L297-T301 PolarHBondContact O-N 3.23Å; L297-T301 PolarHBondContact O-OG1 3.47Å
298	I	44.2	Very low	44.8	Very low	80 Å²	80	106.1 Å²	106.1	41%	0.41	55%	0.55	S	S	.	.	H	α-helix	trans	-59.3	-45.2	177.2	-69.4	164.9	0	0	0	111.1	H294 A295 K300 T301 I302	H294-I298 VanDerWaalsContact O-CG1 3.32Å; H294-I298 WeakPolarHBondContact O-CG1 3.2Å; H294-I298 PolarHBondContact O-N 2.9Å; A295-I298 PolarHBondContact O-N 2.85Å; I298-K300 VanDerWaalsContact C-N 3.32Å; I298-K300 PolarHBondContact O-N 2.69Å; I298-T301 PolarHBondContact O-N 2.8Å; I298-I302 HydrophobicContact CG2-CD1 3.67Å; I298-I302 HydrophobicContact CG2-CG1 4.32Å; I298-I302 WeakPolarHBondContact O-CB 3.17Å; I298-I302 VanDerWaalsContact O-CG1 3.3Å; I298-I302 WeakPolarHBondContact O-CG1 3.41Å; I298-I302 PolarHBondContact O-N 2.7Å
299	Q	38.9	Very low	43.8	Very low	116 Å²	116	113.8 Å²	113.8	54%	0.542	59%	0.585	S	S	.	*	H	α-helix	trans	-59.9	-41.7	176	-155.3	78.3	3.2	0	0	111.6	A295 L297 N303	A295-Q299 WeakPolarHBondContact O-CB 3.43Å; A295-Q299 PolarHBondContact O-N 2.92Å; L297-Q299 PolarHBondContact O-N 3.41Å; Q299-N303 VanDerWaalsContact O-CB 3.28Å; Q299-N303 WeakPolarHBondContact O-CB 3.45Å; Q299-N303 VanDerWaalsContact O-CG 3.27Å; Q299-N303 PolarHBondContact O-N 3Å; Q299-N303 PolarHBondContact O-ND2 3.29Å
300	K	43.2	Very low	42.3	Very low	132 Å²	132	119.4 Å²	119.4	57%	0.574	61%	0.611	S	S	*	*	H	α-helix	trans	-70.5	-30.9	176.6	-75.6	169.9	-177.6	176.9	0	113	N296 L297 I298 K304	N296-K300 VanDerWaalsContact O-CB 3.28Å; N296-K300 WeakPolarHBondContact O-CB 3.3Å; N296-K300 WeakPolarHBondContact O-CD 3.48Å; N296-K300 WeakPolarHBondContact O-CG 3.43Å; N296-K300 PolarHBondContact O-N 3.48Å; L297-K300 CarbonylContact O-C 3.46Å; L297-K300 PolarHBondContact O-N 3.44Å; L297-K300 VanDerWaalsContact O-N 3.14Å; I298-K300 VanDerWaalsContact C-N 3.32Å; I298-K300 PolarHBondContact O-N 2.69Å; K300-K304 WeakPolarHBondContact O-CB 3.34Å; K300-K304 WeakPolarHBondContact O-CG 3.33Å; K300-K304 PolarHBondContact O-N 3.45Å
301	T	42	Very low	41.3	Very low	95 Å²	95	123.7 Å²	123.7	58%	0.583	62%	0.622	S	S	*	*	H	α-helix	trans	-78.3	-38.8	176.6	-61.9	0	0	0	0	112	L297 I298 K304	L297-T301 PolarHBondContact O-N 3.23Å; L297-T301 PolarHBondContact O-OG1 3.47Å; I298-T301 PolarHBondContact O-N 2.8Å; T301-K304 PolarHBondContact O-N 2.91Å
302	I	41.1	Very low	40.4	Very low	114 Å²	114	128.5 Å²	128.5	59%	0.585	64%	0.642	S	S	*	*	H	α-helix	trans	-63.2	-44.1	173	-68	172	0	0	0	110.1	I298 K304	I298-I302 HydrophobicContact CG2-CD1 3.67Å; I298-I302 HydrophobicContact CG2-CG1 4.32Å; I298-I302 WeakPolarHBondContact O-CB 3.17Å; I298-I302 VanDerWaalsContact O-CG1 3.3Å; I298-I302 WeakPolarHBondContact O-CG1 3.41Å; I298-I302 PolarHBondContact O-N 2.7Å; I302-K304 PolarHBondContact O-N 3.04Å; I302-K304 VanDerWaalsContact O-N 3.17Å
303	N	39.7	Very low	39.2	Very low	121 Å²	121	131.1 Å²	131.1	65%	0.647	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	14.3	177.4	-66.3	-14.6	0	0	0	114.4	Q299	Q299-N303 VanDerWaalsContact O-CB 3.28Å; Q299-N303 WeakPolarHBondContact O-CB 3.45Å; Q299-N303 VanDerWaalsContact O-CG 3.27Å; Q299-N303 PolarHBondContact O-N 3Å; Q299-N303 PolarHBondContact O-ND2 3.29Å
304	K	38.1	Very low	38.2	Very low	169 Å²	169	132 Å²	132	74%	0.735	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.7	19.4	179.7	-83.1	-173.1	171.9	-165.4	0	115.2	K300 T301 I302 P306	K300-K304 WeakPolarHBondContact O-CB 3.34Å; K300-K304 WeakPolarHBondContact O-CG 3.33Å; K300-K304 PolarHBondContact O-N 3.45Å; T301-K304 PolarHBondContact O-N 2.91Å; I302-K304 PolarHBondContact O-N 3.04Å; I302-K304 VanDerWaalsContact O-N 3.17Å; K304-P306 WeakPolarHBondContact O-CD 3.39Å
305	K	36	Very low	37.5	Very low	188 Å²	188	134.1 Å²	134.1	82%	0.817	68%	0.682	S	S	*	*	S	Bend	trans	-72.2	121.6	160.1	-85.1	-169.3	170.2	-174.1	0	109.4	L307	K305-L307 PolarHBondContact O-N 3.38Å
306	P	35.8	Very low	36.9	Very low	97 Å²	97	139 Å²	139	63%	0.63	70%	0.7	S	S	*	*			trans	-64.9	132	-177.3	-22.6	34.3	0	0	0	112.3	K304 Q308	K304-P306 WeakPolarHBondContact O-CD 3.39Å; P306-Q308 HydrophobicContact CB-CB 4.22Å; P306-Q308 PolarHBondContact O-N 3.1Å
307	L	29.9	Very low	36.2	Very low	166 Å²	166	141.9 Å²	141.9	87%	0.869	72%	0.716	S	S	*	*	S	Bend	trans	-80.3	48.1	175.5	-160.5	80	0	0	0	111.1	K305	K305-L307 PolarHBondContact O-N 3.38Å
308	Q	32.8	Very low	35.8	Very low	156 Å²	156	143.7 Å²	143.7	73%	0.729	73%	0.726	S	S	*	*			trans	-142.9	41.7	-158.5	-154.1	154	12.8	0	0	114.2	P306	P306-Q308 HydrophobicContact CB-CB 4.22Å; P306-Q308 PolarHBondContact O-N 3.1Å
309	Q	33.8	Very low	35.4	Very low	188 Å²	188	145.8 Å²	145.8	88%	0.879	74%	0.738	S	S	*	*	S	Bend	trans	-138	34	165.5	-73.3	-168.2	-44.6	0	0	111.4
310	L	29.8	Very low	35.2	Very low	160 Å²	160	146.7 Å²	146.7	84%	0.838	75%	0.747	S	S	*	*	S	Bend	trans	-134.7	13.1	-172.2	-100.1	172.8	0	0	0	115
311	Q	33.1	Very low	34.7	Very low	165 Å²	165	147.3 Å²	147.3	77%	0.771	76%	0.756	S	S	*	*	S	Bend	trans	-126	-16.2	-178.2	-69.4	-176.6	-69.7	0	0	115.2	M313	Q311-M313 PolarHBondContact O-N 3.1Å
312	D	32.7	Very low	34.2	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	77%	0.767	S	S	*	*	S	Bend	trans	-91.3	17.6	-173.7	-53.3	-51	0	0	0	115.1
313	M	30	Very low	33.7	Very low	187 Å²	187	150 Å²	150	92%	0.921	77%	0.773	S	S	*	*	S	Bend	trans	-124.1	40.3	177.8	-67.9	-159.3	-59.8	0	0	113.1	Q311	Q311-M313 PolarHBondContact O-N 3.1Å
314	N	31.1	Very low	33.4	Very low	141 Å²	141	148.7 Å²	148.7	75%	0.754	77%	0.774	S	S	*	*			trans	-152.3	62.1	173.5	-162.5	54	0	0	0	114
315	N	35.2	Very low	33.1	Very low	152 Å²	152	147.8 Å²	147.8	81%	0.813	78%	0.775	S	S	*	*	S	Bend	trans	-156.4	139.6	155.9	-102.4	-29.9	0	0	0	112.7
316	N	34.5	Very low	32.9	Very low	151 Å²	151	145.8 Å²	145.8	81%	0.807	77%	0.773	S	S	*	*			trans	60.9	86.4	161.7	-60.6	-13.2	0	0	0	119.2
317	N	33.6	Very low	32.8	Very low	147 Å²	147	146.1 Å²	146.1	79%	0.786	78%	0.778	S	S	*	*			trans	-44.9	147.6	151.8	-53.5	-41.5	0	0	0	112.7
318	N	36.1	Very low	32.9	Very low	143 Å²	143	145.4 Å²	145.4	77%	0.765	78%	0.775	S	S	*	*				-173.4	136.7	109.6	-92.4	-22.1	0	0	0	114.1
319	N	35.8	Very low	33	Very low	124 Å²	124	146.9 Å²	146.9	66%	0.663	78%	0.782	S	S	*	*			trans	66.4	106.4	152.3	-58.5	-17.4	0	0	0	121.3
320	N	34.5	Very low	32.7	Very low	136 Å²	136	149.6 Å²	149.6	73%	0.727	78%	0.784	S	S	*	*				64.2	122.1	125.4	-50.1	-15.2	0	0	0	118
321	N	33.2	Very low	32.8	Very low	144 Å²	144	149.7 Å²	149.7	77%	0.77	79%	0.785	S	S	*	*			cis	-165.3	165.1	39.6	-108.9	-22	0	0	0	113.2
322	M	30.4	Very low	32.8	Very low	164 Å²	164	144.6 Å²	144.6	81%	0.808	77%	0.768	S	S	*	*			trans	62.3	98.4	161.3	-68.3	176.1	75.3	0	0	116.9
323	S	31.7	Very low	32.9	Very low	102 Å²	102	147.1 Å²	147.1	71%	0.713	77%	0.771	S	S	*	*				81.7	131.4	76.5	71.3	0	0	0	0	113.6
324	S	33.5	Very low	33.1	Very low	94 Å²	94	142 Å²	142	66%	0.657	76%	0.755	S	S	*	*			cis	-162.7	144.9	15.8	53.7	0	0	0	0	114
325	I	32.3	Very low	33.2	Very low	149 Å²	149	140.7 Å²	140.7	76%	0.764	74%	0.744	S	S	*	*			trans	60.7	137.5	134.2	-60.6	167.5	0	0	0	119.1
326	D	31.4	Very low	33.3	Very low	146 Å²	146	138.8 Å²	138.8	78%	0.781	74%	0.737	S	S	*	*			cis	-165.4	-166.2	-37	-80.8	-39.6	0	0	0	103.9
327	S	32.5	Very low	33.1	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	73%	0.733	S	S	*	*			cis	-162.6	171.7	6.3	66.2	0	0	0	0	106
328	D	32.7	Very low	33	Very low	150 Å²	150	136.6 Å²	136.6	80%	0.802	72%	0.724	S	S	*	*			cis	-157.8	-150.4	-5	-147	-70.6	0	0	0	109.2
329	E	34.1	Very low	32.6	Very low	188 Å²	188	136.7 Å²	136.7	88%	0.879	72%	0.724	S	S	*	*			trans	60.3	94.3	165.1	-66.3	-151.7	125.7	0	0	118.6
330	R	28.7	Very low	32.3	Very low	244 Å²	244	136.1 Å²	136.1	92%	0.921	73%	0.725	S	S	*	*			trans	-90.6	139.6	161.3	-66.2	168	166.4	170	-4.4	110.9
331	L	31.2	Very low	32.1	Very low	162 Å²	162	138.3 Å²	138.3	85%	0.848	73%	0.731	S	S	*	*			trans	-110.9	163.3	152.2	-85.8	168.9	0	0	0	111.4
332	S	33.7	Very low	31.9	Very low	59 Å²	59	135.6 Å²	135.6	41%	0.413	72%	0.723	S	S	.	*			trans	-105.1	151.7	-145.6	72.9	0	0	0	0	115.6	S334 E335	S332-S334 PolarHBondContact O-N 2.96Å; S332-S334 PolarHBondContact OG-OG 3.37Å; S332-E335 PolarHBondContact O-N 3.05Å
333	K	34	Very low	31.7	Very low	201 Å²	201	136.6 Å²	136.6	87%	0.874	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	3.4	-175.8	-71.7	-176.4	175.6	178.6	0	115.2
334	S	34.9	Very low	31.6	Very low	81 Å²	81	138 Å²	138	57%	0.566	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-35.5	176.1	24.5	0	0	0	0	113.4	S332 K337	S332-S334 PolarHBondContact O-N 2.96Å; S332-S334 PolarHBondContact OG-OG 3.37Å; S334-K337 PolarHBondContact O-N 2.67Å
335	E	34.1	Very low	31.6	Very low	112 Å²	112	138.4 Å²	138.4	52%	0.523	73%	0.733	S	S	.	*	G	3₁₀ helix	trans	-78.7	-24.2	-172.5	-66.2	168.8	111.2	0	0	112.7	S332 K337 S338	S332-E335 PolarHBondContact O-N 3.05Å; E335-K337 PolarHBondContact O-N 3.42Å; E335-S338 PolarHBondContact O-N 3.09Å; E335-S338 PolarHBondContact O-OG 3.1Å; E335-S338 VanDerWaalsContact O-OG 3.1Å
336	V	35.5	Very low	31.5	Very low	112 Å²	112	138.8 Å²	138.8	68%	0.679	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-67.8	-13.7	174.8	-174.6	0	0	0	0	112.3	T340	V336-T340 PolarHBondContact O-OG1 3.42Å
337	K	31.7	Very low	31.8	Very low	167 Å²	167	136 Å²	136	73%	0.726	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-92.8	-10.7	179.9	-84.3	-171.1	171.3	-174.9	0	115.7	S334 E335	S334-K337 PolarHBondContact O-N 2.67Å; E335-K337 PolarHBondContact O-N 3.42Å
338	S	31.1	Very low	31.9	Very low	85 Å²	85	138.3 Å²	138.3	59%	0.594	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-26.9	176.2	56	0	0	0	0	113.1	E335 T340	E335-S338 PolarHBondContact O-N 3.09Å; E335-S338 PolarHBondContact O-OG 3.1Å; E335-S338 VanDerWaalsContact O-OG 3.1Å; S338-T340 VanDerWaalsContact C-N 3.28Å; S338-T340 PolarHBondContact O-N 3.08Å
339	L	27.6	Very low	32.1	Very low	146 Å²	146	135.2 Å²	135.2	76%	0.764	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	2.6	-179.5	-81.8	157.8	0	0	0	114.7
340	T	30.3	Very low	32.1	Very low	112 Å²	112	133.2 Å²	133.2	69%	0.687	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	9.4	179.9	6.1	0	0	0	0	114.5	V336 S338	V336-T340 PolarHBondContact O-OG1 3.42Å; S338-T340 VanDerWaalsContact C-N 3.28Å; S338-T340 PolarHBondContact O-N 3.08Å
341	Q	29.9	Very low	32.5	Very low	181 Å²	181	128.3 Å²	128.3	85%	0.846	69%	0.688	S	S	*	*	S	Bend	trans	-117.1	19	-178.5	-72.1	-170.7	-31	0	0	114.9
342	S	27.8	Very low	33	Very low	87 Å²	87	125 Å²	125	61%	0.608	67%	0.671	S	S	*	*	S	Bend	trans	-128	160	162.2	67.3	0	0	0	0	110.2
343	M	27.1	Very low	33.4	Very low	185 Å²	185	126.2 Å²	126.2	91%	0.911	68%	0.676	S	S	*	*	S	Bend	trans	75	39.3	179.4	-45.7	-159.1	80.3	0	0	118.2
344	T	29.9	Very low	33.9	Very low	133 Å²	133	120.4 Å²	120.4	82%	0.816	65%	0.653	S	S	*	*			trans	-135.3	150.8	145.7	56.8	0	0	0	0	109.9
345	P	32.9	Very low	34.4	Very low	102 Å²	102	121.2 Å²	121.2	66%	0.662	65%	0.65	S	S	*	*	S	Bend	cis	-125.2	116.1	2.2	35.3	-17.2	0	0	0	113.7
346	L	29.8	Very low	35.2	Very low	156 Å²	156	119.2 Å²	119.2	82%	0.817	65%	0.646	S	S	*	*	S	Bend	trans	-114.4	-11	175.1	-99.5	164.1	0	0	0	114.8
347	S	37.7	Very low	35.8	Very low	87 Å²	87	117 Å²	117	61%	0.608	63%	0.628	S	S	*	*	H	α-helix	trans	-95.9	-23.8	-172.3	55.7	0	0	0	0	115.7	Q351	S347-Q351 WeakPolarHBondContact O-CG 3.38Å; S347-Q351 PolarHBondContact O-N 3.16Å
348	K	34.4	Very low	36.4	Very low	154 Å²	154	113 Å²	113	67%	0.67	61%	0.614	S	S	*	*	H	α-helix	trans	-75.5	-57.4	177.8	-77.2	-167.7	171.5	-171.5	0	111.8	F350 Q351 D352	K348-F350 PolarHBondContact O-N 2.92Å; K348-F350 VanDerWaalsContact O-N 3.12Å; K348-Q351 WeakPolarHBondContact O-CA 3.42Å; K348-Q351 PolarHBondContact O-N 3.21Å; K348-D352 PolarHBondContact O-N 2.84Å; K348-D352 VanDerWaalsContact O-OD2 3.14Å
349	T	38.2	Very low	37.4	Very low	86 Å²	86	114.2 Å²	114.2	53%	0.528	61%	0.612	S	S	.	*	H	α-helix	trans	-53.7	-34.9	177	22.5	0	0	0	0	113.4	V353	T349-V353 VanDerWaalsContact O-CB 3.27Å; T349-V353 WeakPolarHBondContact O-CB 3.28Å; T349-V353 WeakPolarHBondContact O-CG2 3.29Å; T349-V353 PolarHBondContact O-N 3.43Å
350	F	33.8	Very low	38.6	Very low	145 Å²	145	112.4 Å²	112.4	64%	0.636	60%	0.598	S	S	*	*	H	α-helix	trans	-71.9	-36.7	176.7	-159.2	-104.7	0	0	0	112.9	K348 I354	K348-F350 PolarHBondContact O-N 2.92Å; K348-F350 VanDerWaalsContact O-N 3.12Å; F350-I354 HydrophobicContact CD1-CD1 3.77Å; F350-I354 HydrophobicContact CE1-CD1 3.39Å; F350-I354 HydrophobicContact CZ-CD1 3.9Å; F350-I354 WeakPolarHBondContact O-CB 3.22Å; F350-I354 WeakPolarHBondContact O-CG1 3.44Å; F350-I354 PolarHBondContact O-N 3.03Å; F350-I354 VanDerWaalsContact O-N 3.11Å
351	Q	37.8	Very low	39.2	Very low	142 Å²	142	113.8 Å²	113.8	66%	0.664	59%	0.591	S	S	*	*	H	α-helix	trans	-69.1	-44.2	171.9	-74.2	-174	-40.3	0	0	111.6	S347 K348 I354 L355	S347-Q351 WeakPolarHBondContact O-CG 3.38Å; S347-Q351 PolarHBondContact O-N 3.16Å; K348-Q351 WeakPolarHBondContact O-CA 3.42Å; K348-Q351 PolarHBondContact O-N 3.21Å; Q351-I354 PolarHBondContact O-N 3.39Å; Q351-L355 VanDerWaalsContact O-CB 3.24Å; Q351-L355 WeakPolarHBondContact O-CB 3.3Å; Q351-L355 PolarHBondContact O-N 3.41Å
352	D	39.9	Very low	40	Very low	92 Å²	92	109.9 Å²	109.9	49%	0.492	58%	0.576	S	S	.	*	H	α-helix	trans	-65.3	-39.5	-179.9	-62.7	-38.9	0	0	0	111.8	K348 T356	K348-D352 PolarHBondContact O-N 2.84Å; K348-D352 VanDerWaalsContact O-OD2 3.14Å; D352-T356 WeakPolarHBondContact O-CB 3.34Å; D352-T356 PolarHBondContact O-N 3.22Å; D352-T356 PolarHBondContact O-OG1 2.98Å
353	V	44	Very low	40.8	Very low	85 Å²	85	111.5 Å²	111.5	52%	0.515	57%	0.573	S	S	.	*	H	α-helix	trans	-67.6	-45.6	174.3	167.7	0	0	0	0	111.6	T349 T356 E357	T349-V353 VanDerWaalsContact O-CB 3.27Å; T349-V353 WeakPolarHBondContact O-CB 3.28Å; T349-V353 WeakPolarHBondContact O-CG2 3.29Å; T349-V353 PolarHBondContact O-N 3.43Å; V353-T356 PolarHBondContact O-N 3.16Å; V353-E357 WeakPolarHBondContact O-CB 3.27Å; V353-E357 WeakPolarHBondContact O-CG 3.49Å; V353-E357 PolarHBondContact O-N 3.11Å
354	I	43.5	Very low	41.3	Very low	79 Å²	79	107.5 Å²	107.5	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-64.9	-41.2	177.4	-73.8	176.4	0	0	0	111.1	F350 Q351 E357 L358	F350-I354 HydrophobicContact CD1-CD1 3.77Å; F350-I354 HydrophobicContact CE1-CD1 3.39Å; F350-I354 HydrophobicContact CZ-CD1 3.9Å; F350-I354 WeakPolarHBondContact O-CB 3.22Å; F350-I354 WeakPolarHBondContact O-CG1 3.44Å; F350-I354 PolarHBondContact O-N 3.03Å; F350-I354 VanDerWaalsContact O-N 3.11Å; Q351-I354 PolarHBondContact O-N 3.39Å; I354-E357 PolarHBondContact O-N 3.41Å; I354-L358 HydrophobicContact CG2-CD1 3.78Å; I354-L358 HydrophobicContact CG2-CG 4.34Å; I354-L358 WeakPolarHBondContact O-CB 3.47Å; I354-L358 VanDerWaalsContact O-CG 3.27Å; I354-L358 WeakPolarHBondContact O-CG 3.49Å; I354-L358 PolarHBondContact O-N 3.28Å
355	L	45.7	Very low	41.9	Very low	97 Å²	97	105.5 Å²	105.5	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-66.7	-38.6	177.4	-168.5	68.1	0	0	0	111.3	Q351 L358 M359	Q351-L355 VanDerWaalsContact O-CB 3.24Å; Q351-L355 WeakPolarHBondContact O-CB 3.3Å; Q351-L355 PolarHBondContact O-N 3.41Å; L355-L358 PolarHBondContact O-N 3.32Å; L355-M359 HydrophobicContact CD1-CE 4.44Å; L355-M359 HydrophobicContact CD2-CE 4.4Å; L355-M359 HydrophobicContact CG-CE 4.19Å; L355-M359 WeakPolarHBondContact O-CB 3.44Å; L355-M359 VanDerWaalsContact O-CG 3.28Å; L355-M359 WeakPolarHBondContact O-CG 3.44Å; L355-M359 PolarHBondContact O-N 3.42Å
356	T	50.4	Low	42.2	Very low	70 Å²	70	106.8 Å²	106.8	43%	0.429	54%	0.536	S	S	.	.	H	α-helix	trans	-64.9	-43.8	174.4	-62.6	0	0	0	0	111.7	D352 V353 M359 K360	D352-T356 WeakPolarHBondContact O-CB 3.34Å; D352-T356 PolarHBondContact O-N 3.22Å; D352-T356 PolarHBondContact O-OG1 2.98Å; V353-T356 PolarHBondContact O-N 3.16Å; T356-M359 PolarHBondContact O-N 2.95Å; T356-K360 HydrophobicContact CG2-CD 4.25Å; T356-K360 WeakPolarHBondContact O-CB 3.42Å; T356-K360 VanDerWaalsContact O-CG 3.3Å; T356-K360 WeakPolarHBondContact O-CG 3.37Å; T356-K360 PolarHBondContact O-N 3.3Å
357	E	49.2	Very low	42.5	Very low	66 Å²	66	102.9 Å²	102.9	31%	0.308	52%	0.519	S	S	.	.	H	α-helix	trans	-73.9	-26.3	178.7	-73.9	-57.8	137.7	0	0	113.5	V353 I354 K360 R361	V353-E357 WeakPolarHBondContact O-CB 3.27Å; V353-E357 WeakPolarHBondContact O-CG 3.49Å; V353-E357 PolarHBondContact O-N 3.11Å; I354-E357 PolarHBondContact O-N 3.41Å; E357-K360 WeakPolarHBondContact OE1-CD 3.04Å; E357-K360 WeakPolarHBondContact OE1-CE 3.37Å; E357-K360 IonicContact OE1-NZ 3.54Å; E357-K360 PolarHBondContact OE1-NZ 3.03Å; E357-R361 VanDerWaalsContact O-CB 3.29Å; E357-R361 WeakPolarHBondContact O-CB 3.31Å; E357-R361 VanDerWaalsContact O-CG 3.28Å; E357-R361 WeakPolarHBondContact O-CG 3.38Å; E357-R361 PolarHBondContact O-N 3.13Å; E357-R361 IonicContact OE2-NH1 3.15Å; E357-R361 PolarHBondContact OE2-NH1 3.44Å; E357-R361 VanDerWaalsContact OE2-NH1 3.13Å
358	L	42.5	Very low	42.6	Very low	82 Å²	82	103 Å²	103	43%	0.429	51%	0.511	S	S	.	.	H	α-helix	trans	-73.7	-38.8	167.8	-73.2	170.9	0	0	0	111.9	I354 L355 R361 N362	I354-L358 HydrophobicContact CG2-CD1 3.78Å; I354-L358 HydrophobicContact CG2-CG 4.34Å; I354-L358 WeakPolarHBondContact O-CB 3.47Å; I354-L358 VanDerWaalsContact O-CG 3.27Å; I354-L358 WeakPolarHBondContact O-CG 3.49Å; I354-L358 PolarHBondContact O-N 3.28Å; L355-L358 PolarHBondContact O-N 3.32Å; L358-R361 PolarHBondContact O-N 3.49Å; L358-N362 WeakPolarHBondContact O-CB 3.4Å; L358-N362 PolarHBondContact O-N 2.94Å
359	M	53.8	Low	42.7	Very low	112 Å²	112	100.6 Å²	100.6	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-64.7	-44.9	172.9	-76.7	-179.5	173.9	0	0	111.6	L355 T356 R361 N362 Q363	L355-M359 HydrophobicContact CD1-CE 4.44Å; L355-M359 HydrophobicContact CD2-CE 4.4Å; L355-M359 HydrophobicContact CG-CE 4.19Å; L355-M359 WeakPolarHBondContact O-CB 3.44Å; L355-M359 VanDerWaalsContact O-CG 3.28Å; L355-M359 WeakPolarHBondContact O-CG 3.44Å; L355-M359 PolarHBondContact O-N 3.42Å; T356-M359 PolarHBondContact O-N 2.95Å; M359-R361 PolarHBondContact O-N 3.38Å; M359-N362 PolarHBondContact O-N 2.98Å; M359-Q363 WeakPolarHBondContact O-CB 3.34Å; M359-Q363 WeakPolarHBondContact O-CG 3.36Å; M359-Q363 PolarHBondContact O-N 3.08Å
360	K	51.4	Low	42.7	Very low	107 Å²	107	101 Å²	101	47%	0.465	51%	0.508	S	S	.	.	H	α-helix	trans	-60.1	-41.4	172.4	-74.4	170.7	179.1	178.7	0	112.4	T356 E357 Q363 L364	T356-K360 HydrophobicContact CG2-CD 4.25Å; T356-K360 WeakPolarHBondContact O-CB 3.42Å; T356-K360 VanDerWaalsContact O-CG 3.3Å; T356-K360 WeakPolarHBondContact O-CG 3.37Å; T356-K360 PolarHBondContact O-N 3.3Å; E357-K360 WeakPolarHBondContact OE1-CD 3.04Å; E357-K360 WeakPolarHBondContact OE1-CE 3.37Å; E357-K360 IonicContact OE1-NZ 3.54Å; E357-K360 PolarHBondContact OE1-NZ 3.03Å; K360-Q363 PolarHBondContact O-N 2.97Å; K360-L364 WeakPolarHBondContact O-CB 3.38Å; K360-L364 PolarHBondContact O-N 3.46Å
361	R	44.2	Very low	42.6	Very low	142 Å²	142	99 Å²	99	54%	0.536	51%	0.511	S	S	.	.	H	α-helix	trans	-70.2	-36.3	177	-80.6	175.9	172	75.9	-3.6	112.8	E357 L358 M359 L364 I365	E357-R361 VanDerWaalsContact O-CB 3.29Å; E357-R361 WeakPolarHBondContact O-CB 3.31Å; E357-R361 VanDerWaalsContact O-CG 3.28Å; E357-R361 WeakPolarHBondContact O-CG 3.38Å; E357-R361 PolarHBondContact O-N 3.13Å; E357-R361 IonicContact OE2-NH1 3.15Å; E357-R361 PolarHBondContact OE2-NH1 3.44Å; E357-R361 VanDerWaalsContact OE2-NH1 3.13Å; L358-R361 PolarHBondContact O-N 3.49Å; M359-R361 PolarHBondContact O-N 3.38Å; R361-L364 CarbonylContact O-C 3.56Å; R361-L364 WeakPolarHBondContact O-CB 3.48Å; R361-L364 PolarHBondContact O-N 2.92Å; R361-I365 WeakPolarHBondContact O-CG1 3.42Å; R361-I365 PolarHBondContact O-N 3.2Å
362	N	46	Very low	42.4	Very low	99 Å²	99	97.3 Å²	97.3	53%	0.529	51%	0.514	S	S	.	.	H	α-helix	trans	-65.9	-42.8	171.7	-77.9	-3.6	0	0	0	111.2	L358 M359 L364 I365 E366	L358-N362 WeakPolarHBondContact O-CB 3.4Å; L358-N362 PolarHBondContact O-N 2.94Å; M359-N362 PolarHBondContact O-N 2.98Å; N362-L364 VanDerWaalsContact C-N 3.26Å; N362-L364 PolarHBondContact O-N 3.21Å; N362-I365 PolarHBondContact O-N 3.42Å; N362-I365 VanDerWaalsContact O-N 3.11Å; N362-E366 PolarHBondContact O-N 3.47Å
363	Q	45.1	Very low	41.9	Very low	120 Å²	120	97 Å²	97	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-62.2	-33.2	171.2	-74.7	178.5	-21.9	0	0	112.2	M359 K360 T367	M359-Q363 WeakPolarHBondContact O-CB 3.34Å; M359-Q363 WeakPolarHBondContact O-CG 3.36Å; M359-Q363 PolarHBondContact O-N 3.08Å; K360-Q363 PolarHBondContact O-N 2.97Å; Q363-T367 VanDerWaalsContact O-CB 3.27Å; Q363-T367 WeakPolarHBondContact O-CB 3.34Å; Q363-T367 PolarHBondContact O-N 3.21Å; Q363-T367 PolarHBondContact O-OG1 2.84Å
364	L	37.2	Very low	41.2	Very low	101 Å²	101	96.2 Å²	96.2	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-68.8	-37.6	172.6	-164.6	75	0	0	0	111.7	K360 R361 N362 T367 I368	K360-L364 WeakPolarHBondContact O-CB 3.38Å; K360-L364 PolarHBondContact O-N 3.46Å; R361-L364 CarbonylContact O-C 3.56Å; R361-L364 WeakPolarHBondContact O-CB 3.48Å; R361-L364 PolarHBondContact O-N 2.92Å; N362-L364 VanDerWaalsContact C-N 3.26Å; N362-L364 PolarHBondContact O-N 3.21Å; L364-T367 CarbonylContact O-C 3.55Å; L364-T367 PolarHBondContact O-N 3.44Å; L364-I368 HydrophobicContact CD2-CD1 4.39Å; L364-I368 HydrophobicContact CG-CD1 4.04Å; L364-I368 WeakPolarHBondContact O-CB 3.31Å; L364-I368 WeakPolarHBondContact O-CD1 3.46Å; L364-I368 WeakPolarHBondContact O-CG1 3.47Å; L364-I368 PolarHBondContact O-N 3.34Å
365	I	41.3	Very low	40.8	Very low	91 Å²	91	98.2 Å²	98.2	47%	0.467	55%	0.549	S	S	.	.	H	α-helix	trans	-68	-41.9	174.5	-69.5	162.8	0	0	0	110.7	R361 N362 T367 I368 N369	R361-I365 WeakPolarHBondContact O-CG1 3.42Å; R361-I365 PolarHBondContact O-N 3.2Å; N362-I365 PolarHBondContact O-N 3.42Å; N362-I365 VanDerWaalsContact O-N 3.11Å; I365-T367 VanDerWaalsContact C-N 3.34Å; I365-I368 PolarHBondContact O-N 2.87Å; I365-N369 WeakPolarHBondContact O-CB 3.39Å; I365-N369 VanDerWaalsContact O-CG 3.3Å; I365-N369 PolarHBondContact O-N 2.99Å; I365-N369 PolarHBondContact O-ND2 2.92Å
366	E	39.8	Very low	40.2	Very low	130 Å²	130	101 Å²	101	61%	0.607	56%	0.56	S	S	*	*	H	α-helix	trans	-61.1	-42.3	170.3	-71.4	-179.2	137.6	0	0	111.3	N362 N369 T370	N362-E366 PolarHBondContact O-N 3.47Å; E366-N369 PolarHBondContact O-N 2.85Å; E366-T370 WeakPolarHBondContact O-CB 3.48Å; E366-T370 PolarHBondContact O-N 3.11Å; E366-T370 PolarHBondContact O-OG1 3.38Å
367	T	36.6	Very low	39.5	Very low	74 Å²	74	102.8 Å²	102.8	45%	0.454	57%	0.572	S	S	.	*	H	α-helix	trans	-64.5	-42.4	175.9	-58.6	0	0	0	0	111.5	Q363 L364 I365 T370 C371	Q363-T367 VanDerWaalsContact O-CB 3.27Å; Q363-T367 WeakPolarHBondContact O-CB 3.34Å; Q363-T367 PolarHBondContact O-N 3.21Å; Q363-T367 PolarHBondContact O-OG1 2.84Å; L364-T367 CarbonylContact O-C 3.55Å; L364-T367 PolarHBondContact O-N 3.44Å; I365-T367 VanDerWaalsContact C-N 3.34Å; T367-T370 CarbonylContact O-C 3.54Å; T367-T370 WeakPolarHBondContact O-CB 3.4Å; T367-T370 PolarHBondContact O-N 3.49Å; T367-C371 WeakPolarHBondContact O-CB 3.24Å; T367-C371 PolarHBondContact O-N 2.88Å; T367-C371 PolarHBondContact O-SG 3Å
368	I	39.1	Very low	38.5	Very low	88 Å²	88	107.5 Å²	107.5	45%	0.451	60%	0.596	S	S	.	*	H	α-helix	trans	-65.5	-44.3	177.5	-73.1	163.6	0	0	0	110.6	L364 I365 T370 C371 C372	L364-I368 HydrophobicContact CD2-CD1 4.39Å; L364-I368 HydrophobicContact CG-CD1 4.04Å; L364-I368 WeakPolarHBondContact O-CB 3.31Å; L364-I368 WeakPolarHBondContact O-CD1 3.46Å; L364-I368 WeakPolarHBondContact O-CG1 3.47Å; L364-I368 PolarHBondContact O-N 3.34Å; I365-I368 PolarHBondContact O-N 2.87Å; I368-T370 PolarHBondContact O-N 3.22Å; I368-C371 PolarHBondContact O-N 3.36Å; I368-C371 VanDerWaalsContact O-N 3.15Å; I368-C372 PolarHBondContact O-N 3.47Å; I368-C372 PolarHBondContact O-SG 2.67Å; I368-C372 VanDerWaalsContact O-SG 3.42Å
369	N	37.2	Very low	37.9	Very low	105 Å²	105	111.2 Å²	111.2	56%	0.561	62%	0.617	S	S	*	*	H	α-helix	trans	-62.1	-33	173.6	-71.8	-30.9	0	0	0	112.2	I365 E366 S373	I365-N369 WeakPolarHBondContact O-CB 3.39Å; I365-N369 VanDerWaalsContact O-CG 3.3Å; I365-N369 PolarHBondContact O-N 2.99Å; I365-N369 PolarHBondContact O-ND2 2.92Å; E366-N369 PolarHBondContact O-N 2.85Å; N369-S373 PolarHBondContact O-OG 3.46Å
370	T	37.1	Very low	36.7	Very low	93 Å²	93	110.5 Å²	110.5	57%	0.571	62%	0.623	S	S	*	*	H	α-helix	trans	-73.6	-36.7	174	-53.2	0	0	0	0	111.8	E366 T367 I368 C372 S373	E366-T370 WeakPolarHBondContact O-CB 3.48Å; E366-T370 PolarHBondContact O-N 3.11Å; E366-T370 PolarHBondContact O-OG1 3.38Å; T367-T370 CarbonylContact O-C 3.54Å; T367-T370 WeakPolarHBondContact O-CB 3.4Å; T367-T370 PolarHBondContact O-N 3.49Å; I368-T370 PolarHBondContact O-N 3.22Å; T370-C372 VanDerWaalsContact C-N 3.32Å; T370-C372 PolarHBondContact O-N 2.83Å; T370-S373 CarbonylContact O-C 3.53Å; T370-S373 PolarHBondContact O-N 2.9Å; T370-S373 VanDerWaalsContact O-N 3.16Å; T370-S373 PolarHBondContact O-OG 3.33Å
371	C	32.3	Very low	35.8	Very low	103 Å²	103	111.5 Å²	111.5	70%	0.696	64%	0.643	S	S	*	*	H	α-helix	trans	-72	-24.2	175.3	-72.9	0	0	0	0	112.9	T367 I368 S373	T367-C371 WeakPolarHBondContact O-CB 3.24Å; T367-C371 PolarHBondContact O-N 2.88Å; T367-C371 PolarHBondContact O-SG 3Å; I368-C371 PolarHBondContact O-N 3.36Å; I368-C371 VanDerWaalsContact O-N 3.15Å; C371-S373 VanDerWaalsContact C-N 3.28Å
372	C	33.3	Very low	34.9	Very low	108 Å²	108	112.5 Å²	112.5	73%	0.73	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	2.5	170	-67.3	0	0	0	0	113.9	I368 T370	I368-C372 PolarHBondContact O-N 3.47Å; I368-C372 PolarHBondContact O-SG 2.67Å; I368-C372 VanDerWaalsContact O-SG 3.42Å; T370-C372 VanDerWaalsContact C-N 3.32Å; T370-C372 PolarHBondContact O-N 2.83Å
373	S	29.8	Very low	34	Very low	84 Å²	84	112.8 Å²	112.8	59%	0.587	67%	0.667	S	S	*	*	S	Bend	trans	-135.5	51.8	-177.6	51.4	0	0	0	0	113.2	N369 T370 C371 S375	N369-S373 PolarHBondContact O-OG 3.46Å; T370-S373 CarbonylContact O-C 3.53Å; T370-S373 PolarHBondContact O-N 2.9Å; T370-S373 VanDerWaalsContact O-N 3.16Å; T370-S373 PolarHBondContact O-OG 3.33Å; C371-S373 VanDerWaalsContact C-N 3.28Å; S373-S375 PolarHBondContact O-N 2.82Å
374	G	28.8	Very low	33.1	Very low	69 Å²	69	116.5 Å²	116.5	71%	0.711	68%	0.682	S	S	*	*			trans	-76.8	106.1	-174.6	0	0	0	0	0	116.3
375	S	34.8	Very low	32.6	Very low	121 Å²	121	115.3 Å²	115.3	85%	0.846	69%	0.694	S	S	*	*			trans	-169.3	138.5	133.5	27.4	0	0	0	0	112.2	S373	S373-S375 PolarHBondContact O-N 2.82Å
376	Q	33.3	Very low	32.2	Very low	156 Å²	156	118.7 Å²	118.7	73%	0.729	71%	0.713	S	S	*	*			trans	-140.2	156.6	-178.6	-88.2	-93.8	-30.7	0	0	107.9
377	P	35.6	Very low	31.6	Very low	108 Å²	108	116.7 Å²	116.7	70%	0.701	71%	0.711	S	S	*	*				-143.7	167.1	103.5	37.3	-22.6	0	0	0	115.6
378	M	29	Very low	31.3	Very low	164 Å²	164	119.4 Å²	119.4	81%	0.808	72%	0.723	S	S	*	*			trans	-92.7	150.1	176.5	-75.9	-91.3	-160.3	0	0	112.9
379	D	30.6	Very low	31	Very low	161 Å²	161	123.7 Å²	123.7	86%	0.861	75%	0.745	S	S	*	*			trans	-160.8	144	152	-101.9	-29.5	0	0	0	107.7
380	S	28.6	Very low	30.5	Very low	97 Å²	97	124.3 Å²	124.3	68%	0.678	75%	0.748	S	S	*	*			cis	-163.5	132.5	-10.4	58.5	0	0	0	0	110.1
381	S	31.2	Very low	30	Very low	128 Å²	128	128.2 Å²	128.2	90%	0.895	76%	0.76	S	S	*	*			trans	-171.8	137.4	152.7	33.1	0	0	0	0	111.5
382	I	25.5	Very low	29.7	Very low	163 Å²	163	128.5 Å²	128.5	84%	0.836	76%	0.763	S	S	*	*			trans	-111.6	141.3	-165.7	-65.4	157.4	0	0	0	110.6
383	S	27.4	Very low	29.5	Very low	104 Å²	104	130 Å²	130	73%	0.727	76%	0.763	S	S	*	*			trans	-167.1	95.4	150.5	-178.9	0	0	0	0	115.6
384	F	26.1	Very low	29.2	Very low	199 Å²	199	135.8 Å²	135.8	87%	0.873	78%	0.777	S	S	*	*			trans	54.5	136.4	139.8	-69.3	-81.4	0	0	0	125
385	G	27.9	Very low	29.1	Very low	75 Å²	75	140.5 Å²	140.5	77%	0.773	79%	0.786	S	S	*	*			trans	95.8	130.9	152.1	0	0	0	0	0	115.8
386	D	31.6	Very low	28.7	Very low	162 Å²	162	138.7 Å²	138.7	87%	0.866	77%	0.773	S	S	*	*			cis	-151.5	149.5	-3.6	-160.6	38.6	0	0	0	109
387	P	28.4	Very low	28.4	Very low	89 Å²	89	137.8 Å²	137.8	58%	0.578	78%	0.779	S	S	*	*			trans	-104.2	170.1	-166.6	37.8	-30.9	0	0	0	115.6
388	N	28.8	Very low	28	Very low	131 Å²	131	140 Å²	140	70%	0.701	78%	0.783	S	S	*	*			trans	78.6	108.3	172.9	-46.9	-72.1	0	0	0	117
389	I	33.2	Very low	28	Very low	177 Å²	177	140.2 Å²	140.2	91%	0.908	79%	0.788	S	S	*	*				-144.6	147.5	108.2	-102.1	157.4	0	0	0	108.1
390	N	27.7	Very low	27.7	Very low	119 Å²	119	135.8 Å²	135.8	64%	0.636	78%	0.78	S	S	*	*			trans	-100.3	165.9	-161.1	-97.7	-59.8	0	0	0	114.1
391	Q	26.1	Very low	27.5	Very low	175 Å²	175	140.1 Å²	140.1	82%	0.818	79%	0.787	S	S	*	*			trans	59	95.9	148.5	-69.5	155.3	-31.5	0	0	118.5
392	S	26.4	Very low	27.2	Very low	109 Å²	109	140 Å²	140	76%	0.762	79%	0.785	S	S	*	*				-174.1	171.8	107.1	47.7	0	0	0	0	111.6
393	I	28	Very low	27.3	Very low	140 Å²	140	137.1 Å²	137.1	72%	0.718	79%	0.785	S	S	*	*			trans	59.9	60.1	171.5	-36.6	-179.1	0	0	0	114.8
394	F	25.1	Very low	27.3	Very low	204 Å²	204	136.3 Å²	136.3	90%	0.895	78%	0.78	S	S	*	*			trans	-120.8	60.1	160.4	-154.2	-84.3	0	0	0	109.8
395	N	25.8	Very low	27.3	Very low	168 Å²	168	133.4 Å²	133.4	90%	0.898	77%	0.772	S	S	*	*	S	Bend	trans	-166.8	44.8	170.6	-102.7	-25.2	0	0	0	113.8
396	S	25.4	Very low	27.6	Very low	83 Å²	83	136 Å²	136	58%	0.58	78%	0.776	S	S	*	*			trans	-169.7	137.1	164.2	53.3	0	0	0	0	105.9
397	T	27.2	Very low	27.3	Very low	137 Å²	137	134.8 Å²	134.8	84%	0.84	77%	0.769	S	S	*	*	S	Bend	cis	-145.5	67.5	29.6	-53.5	0	0	0	0	109.9
398	I	28.8	Very low	27.5	Very low	155 Å²	155	138.2 Å²	138.2	80%	0.795	78%	0.782	S	S	*	*	S	Bend	trans	-126.1	142.3	175.7	-60.4	-179.8	0	0	0	107.7
399	N	27.2	Very low	27.5	Very low	168 Å²	168	137.9 Å²	137.9	90%	0.898	79%	0.785	S	S	*	*	S	Bend	trans	69.6	76.1	-165.1	-56.9	-31.4	0	0	0	114.1
400	G	25.2	Very low	27.2	Very low	68 Å²	68	133.8 Å²	133.8	70%	0.701	78%	0.777	S	S	*	*			trans	178.3	64.5	172.4	0	0	0	0	0	115.7
401	F	24.6	Very low	27.2	Very low	188 Å²	188	135.9 Å²	135.9	83%	0.825	78%	0.783	S	S	*	*			trans	-172.6	73.6	141.6	-113.5	-76.9	0	0	0	111.3	S404	F401-S404 WeakPolarHBondContact CE1-OG 3.23Å
402	C	25.6	Very low	27.4	Very low	127 Å²	127	138 Å²	138	86%	0.858	79%	0.786	S	S	*	*	S	Bend	trans	-118	146.4	154.2	-90.8	0	0	0	0	107.7
403	A	26.1	Very low	27.7	Very low	102 Å²	102	139.8 Å²	139.8	84%	0.843	78%	0.781	S	S	*	*			trans	60.8	87.7	-179.9	0	0	0	0	0	116.9
404	S	28.3	Very low	27.6	Very low	87 Å²	87	144 Å²	144	61%	0.608	79%	0.788	S	S	*	*			trans	-154.9	121	140.1	28.9	0	0	0	0	110.8	F401	F401-S404 WeakPolarHBondContact CE1-OG 3.23Å
405	L	26.5	Very low	27.7	Very low	137 Å²	137	141 Å²	141	72%	0.717	79%	0.787	S	S	*	*			trans	-87.6	164.8	165.9	-82.7	81.2	0	0	0	109.3
406	P	32.9	Very low	28.1	Very low	130 Å²	130	137.5 Å²	137.5	84%	0.844	78%	0.781	S	S	*	*				-119.5	144.1	103	-7.2	26.4	0	0	0	114.3
407	N	27	Very low	28.1	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	80%	0.795	S	S	*	*			trans	-73.7	140.3	160.7	-76.6	-56.4	0	0	0	110.2
408	L	30.7	Very low	28.1	Very low	161 Å²	161	136.9 Å²	136.9	84%	0.843	79%	0.789	S	S	*	*			trans	-176.9	132.4	153.2	-95.3	146.9	0	0	0	106.8
409	T	30.5	Very low	28.2	Very low	124 Å²	124	136.1 Å²	136.1	76%	0.761	79%	0.792	S	S	*	*			cis	-144.1	142.6	3.5	-48.8	0	0	0	0	109
410	A	25.7	Very low	28.4	Very low	91 Å²	91	132.8 Å²	132.8	75%	0.752	78%	0.782	S	S	*	*			trans	-105.4	124.1	174.5	0	0	0	0	0	111.8
411	Q	28	Very low	28.8	Very low	163 Å²	163	134.7 Å²	134.7	76%	0.762	78%	0.784	S	S	*	*			trans	-171.2	113.5	155.4	-111.8	169.6	11.2	0	0	111.4
412	Y	29.7	Very low	29	Very low	220 Å²	220	130.5 Å²	130.5	86%	0.863	78%	0.778	S	S	*	*				-162.4	155.2	116.3	-108.5	-74.5	0	0	0	110.3
413	H	33.3	Very low	29.1	Very low	146 Å²	146	129.3 Å²	129.3	68%	0.676	77%	0.771	S	S	*	*			trans	-74.5	146.9	-163.5	-65.5	-116	0	0	0	111.9
414	R	25.7	Very low	29.4	Very low	229 Å²	229	129.6 Å²	129.6	86%	0.864	77%	0.767	S	S	*	*			cis	76.2	67.5	39.9	-161.7	-147.9	-85.8	-145.9	-4.1	115.4
415	T	28.2	Very low	29.4	Very low	141 Å²	141	132.1 Å²	132.1	87%	0.865	78%	0.779	S	S	*	*			trans	-160.5	142.1	152.8	33.7	0	0	0	0	108.6
416	A	32.7	Very low	29.6	Very low	94 Å²	94	130.5 Å²	130.5	78%	0.777	78%	0.779	S	S	*	*			cis	-150.7	139.9	-7.8	0	0	0	0	0	110.5
417	A	25.4	Very low	29.5	Very low	106 Å²	106	132.9 Å²	132.9	88%	0.876	78%	0.779	S	S	*	*			trans	-154.5	79.3	172.1	0	0	0	0	0	109.6
418	S	27.6	Very low	29.7	Very low	101 Å²	101	131.8 Å²	131.8	71%	0.706	78%	0.778	S	S	*	*			trans	-164.3	162.9	177.8	56.5	0	0	0	0	111.2
419	T	31.4	Very low	29.7	Very low	139 Å²	139	130.6 Å²	130.6	85%	0.853	77%	0.772	S	S	*	*			trans	70.1	130.5	-168.6	70.9	0	0	0	0	113.8
420	S	32.6	Very low	30.1	Very low	98 Å²	98	133.7 Å²	133.7	69%	0.685	78%	0.777	S	S	*	*			cis	-166	150.5	-10.3	44.9	0	0	0	0	111.2
421	S	31.5	Very low	30.3	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	78%	0.778	S	S	*	*			trans	49.4	141.6	147.1	58.2	0	0	0	0	121.3
422	S	30	Very low	30.7	Very low	100 Å²	100	136.5 Å²	136.5	70%	0.699	78%	0.783	S	S	*	*			cis	-177	166	-9.1	49.8	0	0	0	0	110.2
423	S	28.3	Very low	30.7	Very low	102 Å²	102	132.2 Å²	132.2	71%	0.713	78%	0.775	S	S	*	*			trans	63.8	140.2	143.9	57.8	0	0	0	0	123.1
424	S	32.2	Very low	30.9	Very low	109 Å²	109	133 Å²	133	76%	0.762	78%	0.783	S	S	*	*			trans	86.2	111.9	162.7	75.2	0	0	0	0	116.5
425	T	27.1	Very low	31.2	Very low	139 Å²	139	128.3 Å²	128.3	85%	0.853	78%	0.775	S	S	*	*			cis	93.3	87.7	21.5	-46.6	0	0	0	0	115.9
426	S	31.4	Very low	31.4	Very low	104 Å²	104	132.7 Å²	132.7	73%	0.727	78%	0.775	S	S	*	*			trans	-175.4	127.8	145.1	53.7	0	0	0	0	107.4
427	Q	29.8	Very low	31.4	Very low	179 Å²	179	133.4 Å²	133.4	84%	0.836	77%	0.77	S	S	*	*				51.4	130.4	72.1	-61.6	-172.2	-7.2	0	0	111.8
428	T	32.7	Very low	31.8	Very low	115 Å²	115	134.6 Å²	134.6	71%	0.706	77%	0.767	S	S	*	*			cis	-149.4	150.9	36.9	48.1	0	0	0	0	115.5
429	N	30.4	Very low	32.1	Very low	135 Å²	135	134.2 Å²	134.2	72%	0.722	76%	0.764	S	S	*	*			trans	14.7	138.8	139.8	-51	-16.8	0	0	0	120.5
430	H	37.5	Very low	32.3	Very low	190 Å²	190	133.2 Å²	133.2	88%	0.88	76%	0.758	S	S	*	*				-152.6	138.8	101.7	-115.2	-78.5	0	0	0	113.4
431	N	30.9	Very low	32.3	Very low	143 Å²	143	133.8 Å²	133.8	77%	0.765	76%	0.757	S	S	*	*			trans	-83	157.9	171.3	-66.5	-42.8	0	0	0	110.9
432	I	35.4	Very low	32.5	Very low	170 Å²	170	136.2 Å²	136.2	87%	0.872	76%	0.759	S	S	*	*				-156.4	144.4	120.3	-98.8	149.1	0	0	0	109
433	N	30.6	Very low	32.9	Very low	130 Å²	130	138.9 Å²	138.9	70%	0.695	76%	0.76	S	S	*	*			trans	-151.5	132.1	-175.8	174.6	6.5	0	0	0	107.9
434	I	36.7	Very low	33.1	Very low	162 Å²	162	139 Å²	139	83%	0.831	76%	0.756	S	S	*	*			trans	-151.5	133.7	168.5	-98	141.5	0	0	0	109.1
435	N	31.9	Very low	33.3	Very low	130 Å²	130	141.2 Å²	141.2	70%	0.695	76%	0.76	S	S	*	*			trans	-102.7	158.5	176.4	-74.7	-68	0	0	0	111.3
436	R	33.2	Very low	33.5	Very low	234 Å²	234	140.5 Å²	140.5	88%	0.883	76%	0.756	S	S	*	*			trans	145.7	144	140.1	-83.1	171.6	-179.7	-176.6	0.8	111.2
437	T	33	Very low	33.7	Very low	108 Å²	108	141.2 Å²	141.2	66%	0.663	76%	0.761	S	S	*	*			cis	157.6	155	-22.2	36.1	0	0	0	0	106.4
438	T	33.8	Very low	33.7	Very low	131 Å²	131	139.2 Å²	139.2	80%	0.804	76%	0.76	S	S	*	*			trans	64.8	145.5	160.5	54.1	0	0	0	0	118.9
439	S	33.6	Very low	34.1	Very low	93 Å²	93	138.7 Å²	138.7	65%	0.65	76%	0.759	S	S	*	*			cis	-169	163.4	-10.1	-100.1	0	0	0	0	114.2
440	T	35.1	Very low	34.1	Very low	118 Å²	118	138 Å²	138	72%	0.724	76%	0.76	S	S	*	*			trans	60.9	106.7	146.2	48.3	0	0	0	0	123.7
441	T	33.6	Very low	34	Very low	110 Å²	110	135.9 Å²	135.9	68%	0.675	75%	0.753	S	S	*	*				35	140.3	118.1	57.7	0	0	0	0	122.8
442	M	35.8	Very low	34.2	Very low	158 Å²	158	135.7 Å²	135.7	78%	0.778	75%	0.748	S	S	*	*				-172.8	150	104.9	-92.8	-49.1	172.3	0	0	116.3
443	H	37.2	Very low	34.1	Very low	157 Å²	157	135.4 Å²	135.4	73%	0.727	74%	0.742	S	S	*	*			trans	-10.4	125.6	162.8	-74.1	-57.1	0	0	0	121.6
444	T	33.7	Very low	34.4	Very low	104 Å²	104	135.7 Å²	135.7	64%	0.638	75%	0.749	S	S	*	*				72.8	120.7	76.3	62.5	0	0	0	0	118.1
445	N	35.3	Very low	34	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	74%	0.737	S	S	*	*				179.2	154	116.4	-91.7	-18.4	0	0	0	117.4
446	T	31.9	Very low	33.9	Very low	125 Å²	125	134.6 Å²	134.6	77%	0.767	74%	0.742	S	S	*	*			trans	-49.1	152.4	179	51.4	0	0	0	0	120.5
447	S	35.3	Very low	33.7	Very low	119 Å²	119	127.7 Å²	127.7	83%	0.832	73%	0.73	S	S	*	*				-174.1	162.9	126	33.1	0	0	0	0	114.6
448	T	29.9	Very low	33.5	Very low	136 Å²	136	127.6 Å²	127.6	83%	0.834	73%	0.734	S	S	*	*			trans	-152.2	178.6	-172.5	30.6	0	0	0	0	108.5
449	P	41.1	Very low	33.3	Very low	104 Å²	104	129.8 Å²	129.8	68%	0.675	73%	0.733	S	S	*	*			cis	-138	-174.9	-31.5	36.3	-16.5	0	0	0	114.7
450	T	31.3	Very low	33.2	Very low	120 Å²	120	132 Å²	132	74%	0.736	74%	0.737	S	S	*	*			trans	71.5	141.8	151.2	-36.5	0	0	0	0	120.7
451	I	35	Very low	32.9	Very low	146 Å²	146	130.2 Å²	130.2	75%	0.749	73%	0.729	S	S	*	*				164.8	116.9	124.7	-84.5	178	0	0	0	115.5
452	H	34.8	Very low	32.8	Very low	140 Å²	140	130.8 Å²	130.8	65%	0.648	73%	0.729	S	S	*	*			trans	58.1	138.6	141.7	-72	-113.1	0	0	0	127.6
453	H	33.9	Very low	32.6	Very low	163 Å²	163	129.8 Å²	129.8	76%	0.755	72%	0.722	S	S	*	*			trans	64.6	162.2	143.3	-65.2	-47.9	0	0	0	120.1
454	V	35.6	Very low	32.4	Very low	137 Å²	137	129.8 Å²	129.8	83%	0.83	72%	0.72	S	S	*	*			cis	-126.5	171.4	10.9	-177.5	0	0	0	0	111.4
455	T	29.3	Very low	32.4	Very low	97 Å²	97	130.5 Å²	130.5	60%	0.595	72%	0.72	S	S	*	*			trans	-92.1	178.2	-177.7	46.5	0	0	0	0	115.2
456	E	29	Very low	32.1	Very low	171 Å²	171	131.7 Å²	131.7	80%	0.799	72%	0.72	S	S	*	*			trans	70.1	156	154.5	-73.7	146.7	-111.2	0	0	118.7
457	S	28.5	Very low	32.4	Very low	90 Å²	90	130.3 Å²	130.3	63%	0.629	71%	0.714	S	S	*	*			cis	-169.9	177.3	-24.4	60.5	0	0	0	0	109.3
458	S	29.8	Very low	32	Very low	105 Å²	105	132.1 Å²	132.1	73%	0.734	71%	0.714	S	S	*	*			trans	69.6	161.2	156.5	84.9	0	0	0	0	116.3
459	F	28.8	Very low	32	Very low	178 Å²	178	129.4 Å²	129.4	78%	0.781	71%	0.705	S	S	*	*			cis	-157.4	175.8	-31.3	-131.1	-97	0	0	0	106.2
460	D	31.4	Very low	31.4	Very low	138 Å²	138	130.8 Å²	130.8	74%	0.738	71%	0.712	S	S	*	*			trans	64.9	154.8	157.5	-68.3	-36.6	0	0	0	119.6
461	S	29.6	Very low	31.3	Very low	81 Å²	81	133.2 Å²	133.2	57%	0.566	72%	0.717	S	S	*	*			cis	-167.5	175.1	-26.5	61.2	0	0	0	0	110.2
462	N	32.5	Very low	31.1	Very low	123 Å²	123	130.6 Å²	130.6	66%	0.658	71%	0.712	S	S	*	*			trans	68.4	151.7	154.4	-66	17	0	0	0	119
463	E	31	Very low	31.1	Very low	136 Å²	136	130.7 Å²	130.7	64%	0.636	72%	0.717	S	S	*	*			cis	-162.3	162.5	-16.5	-113.5	172.9	139.4	0	0	111.4
464	F	32.7	Very low	30.9	Very low	157 Å²	157	129.6 Å²	129.6	69%	0.689	72%	0.716	S	S	*	*			trans	73.6	121	143.6	-82.3	-151.2	0	0	0	124
465	N	33.1	Very low	30.9	Very low	120 Å²	120	131 Å²	131	64%	0.642	72%	0.717	S	S	*	*				75.1	108.7	125.7	-58	-1.1	0	0	0	123.3
466	Q	30.3	Very low	30.9	Very low	179 Å²	179	132.6 Å²	132.6	84%	0.836	72%	0.722	S	S	*	*				21.6	156.8	103	-71.6	-168.2	-5.5	0	0	120.6
467	P	37.7	Very low	31.2	Very low	96 Å²	96	131.2 Å²	131.2	62%	0.623	72%	0.719	S	S	*	*			cis	-140.9	-161.1	-46.9	40.2	-20.1	0	0	0	111.8
468	D	27	Very low	31.5	Very low	157 Å²	157	131.6 Å²	131.6	84%	0.84	72%	0.718	S	S	*	*			trans	71.4	144.6	153.5	-71.4	-25.3	0	0	0	124.1
469	A	28.9	Very low	31.7	Very low	79 Å²	79	133.4 Å²	133.4	65%	0.653	72%	0.719	S	S	*	*			trans	73.6	109	138.8	0	0	0	0	0	125.2
470	T	29.4	Very low	31.9	Very low	134 Å²	134	131.9 Å²	131.9	82%	0.822	72%	0.719	S	S	*	*				81.8	156.9	124.1	62.1	0	0	0	0	124.2
471	M	30	Very low	32.2	Very low	170 Å²	170	129.5 Å²	129.5	84%	0.837	71%	0.711	S	S	*	*			trans	73.2	121.2	168.2	-71.8	-168.1	165.2	0	0	117.3
472	S	30.5	Very low	32.4	Very low	92 Å²	92	132.3 Å²	132.3	64%	0.643	72%	0.72	S	S	*	*				81.2	144.2	81.4	-53.3	0	0	0	0	111.5
473	D	33.5	Very low	32.3	Very low	142 Å²	142	134.3 Å²	134.3	76%	0.759	73%	0.725	S	S	*	*			cis	-127.7	149.9	30.1	-73	-47.5	0	0	0	112.6
474	L	29.8	Very low	32.2	Very low	140 Å²	140	132.3 Å²	132.3	73%	0.733	73%	0.726	S	S	*	*				66.4	107.9	61.7	-84.6	174.4	0	0	0	115.8
475	I	35.2	Very low	32	Very low	166 Å²	166	131.6 Å²	131.6	85%	0.851	73%	0.73	S	S	*	*			trans	167.2	146.6	130.4	-88.7	155.3	0	0	0	110
476	N	31.1	Very low	31.7	Very low	130 Å²	130	131.7 Å²	131.7	70%	0.695	73%	0.734	S	S	*	*			cis	-168.7	-178.7	-39.1	-156.8	-14.8	0	0	0	107.7
477	I	34.7	Very low	31.5	Very low	142 Å²	142	131 Å²	131	73%	0.728	73%	0.731	S	S	*	*			trans	77.1	129.1	162.8	-59.3	163.1	0	0	0	116.7
478	T	34.1	Very low	31.2	Very low	99 Å²	99	134 Å²	134	61%	0.607	74%	0.735	S	S	*	*			cis	-168.3	158.8	-25.2	39	0	0	0	0	109.7
479	N	34.6	Very low	31.1	Very low	142 Å²	142	132.5 Å²	132.5	76%	0.759	73%	0.727	S	S	*	*			trans	71.8	113.6	157.4	-54.7	-26.3	0	0	0	117.5
480	N	33.4	Very low	31.2	Very low	147 Å²	147	136.8 Å²	136.8	79%	0.786	73%	0.733	S	S	*	*			cis	81.8	149.4	25.3	-147	45.6	0	0	0	113.5
481	P	37.5	Very low	31.1	Very low	88 Å²	88	135.8 Å²	135.8	57%	0.571	73%	0.727	S	S	*	*				-132.2	-148.9	-58.1	38.4	-21.6	0	0	0	112.9
482	N	33.4	Very low	31.1	Very low	140 Å²	140	136.1 Å²	136.1	75%	0.749	72%	0.724	S	S	*	*			trans	75.1	164.1	166.6	-64.2	0.4	0	0	0	117.6
483	E	30.8	Very low	31	Very low	165 Å²	165	139 Å²	139	77%	0.771	73%	0.727	S	S	*	*			cis	-170.5	147.6	-49.2	-126	-171.6	165.8	0	0	107.8
484	S	28.9	Very low	30.9	Very low	93 Å²	93	139.7 Å²	139.7	65%	0.65	73%	0.729	S	S	*	*			trans	62.9	131.5	157.6	77.5	0	0	0	0	122.3
485	N	27.2	Very low	31	Very low	143 Å²	143	137.7 Å²	137.7	77%	0.765	73%	0.727	S	S	*	*			trans	68.2	143.9	133.4	-60.8	-14.7	0	0	0	124.9
486	T	28.7	Very low	30.9	Very low	121 Å²	121	139.2 Å²	139.2	74%	0.742	73%	0.727	S	S	*	*			trans	65.4	104.5	146.3	42.2	0	0	0	0	122.2
487	E	25.8	Very low	31	Very low	164 Å²	164	137.3 Å²	137.3	77%	0.766	72%	0.722	S	S	*	*				74.7	151.2	119.8	-80.2	-162.4	122.5	0	0	124.4
488	F	29.9	Very low	31	Very low	160 Å²	160	138.7 Å²	138.7	70%	0.702	72%	0.723	S	S	*	*			trans	64.3	103.5	156.7	-93	-109.2	0	0	0	122
489	N	26.5	Very low	30.8	Very low	125 Å²	125	140.5 Å²	140.5	67%	0.668	72%	0.724	S	S	*	*				36.6	117.5	117	-61.2	-50.1	0	0	0	119.7
490	Q	30.2	Very low	30.5	Very low	170 Å²	170	141 Å²	141	79%	0.794	73%	0.727	S	S	*	*				175.8	112.6	99	-94	-175	24.6	0	0	115.9
491	T	26.8	Very low	30.3	Very low	112 Å²	112	142 Å²	142	69%	0.687	72%	0.724	S	S	*	*			trans	58.6	160.4	135.2	69	0	0	0	0	123.6
492	K	31	Very low	29.9	Very low	178 Å²	178	142 Å²	142	77%	0.774	73%	0.725	S	S	*	*			trans	77	139.3	161.9	-72.7	176.8	-177.4	171.2	0	117.2
493	Q	27.6	Very low	29.6	Very low	152 Å²	152	146.1 Å²	146.1	71%	0.71	73%	0.731	S	S	*	*			cis	-168.7	167	-16.1	-143.9	170.3	-4.8	0	0	109.8
494	I	31.3	Very low	29.4	Very low	156 Å²	156	146.6 Å²	146.6	80%	0.8	73%	0.726	S	S	*	*			trans	72.4	138.9	165	-53.9	148.4	0	0	0	113.5
495	S	33.2	Very low	29.3	Very low	98 Å²	98	150.3 Å²	150.3	69%	0.685	73%	0.725	S	S	*	*			cis	-145.2	134	-4.9	33.6	0	0	0	0	108.5
496	K	31.8	Very low	29.4	Very low	198 Å²	198	150.4 Å²	150.4	86%	0.861	72%	0.721	S	S	*	*				57.2	142.9	81.5	-95.1	-164.8	176.9	-175.9	0	115.3
497	P	34	Very low	29.4	Very low	91 Å²	91	151 Å²	151	59%	0.591	72%	0.716	S	S	*	*			cis	-138.8	-172.1	-42.4	37.4	-18.9	0	0	0	112.2
498	F	33.2	Very low	29.6	Very low	171 Å²	171	148.4 Å²	148.4	75%	0.75	72%	0.715	S	S	*	*				175	122.6	115	-105	-81.6	0	0	0	112.9
499	H	31.7	Very low	29.5	Very low	136 Å²	136	147.3 Å²	147.3	63%	0.63	72%	0.715	S	S	*	*			trans	37	125.9	146.4	-70.8	-123.7	0	0	0	119.9	F501	H499-F501 AromaticContact CE1-CD2 3.88Å; H499-F501 AromaticContact ND1-CD2 3.62Å
500	L	26.7	Very low	29.6	Very low	154 Å²	154	144.6 Å²	144.6	81%	0.806	72%	0.717	S	S	*	*			cis	54.5	96.5	15.5	-161.9	133.6	0	0	0	115.2
501	F	29.2	Very low	29.6	Very low	166 Å²	166	143.6 Å²	143.6	73%	0.728	72%	0.716	S	S	*	*			trans	-167.9	137.3	144.9	-118.9	-81.1	0	0	0	111.8	H499	H499-F501 AromaticContact CE1-CD2 3.88Å; H499-F501 AromaticContact ND1-CD2 3.62Å
502	P	29.4	Very low	29.8	Very low	90 Å²	90	144.2 Å²	144.2	58%	0.584	71%	0.714	S	S	*	*			trans	-103.8	149.6	-173.8	37.3	-34.9	0	0	0	115.5
503	Y	28.6	Very low	29.9	Very low	226 Å²	226	140 Å²	140	89%	0.886	71%	0.707	S	S	*	*			trans	-126.2	112	167.6	-88.7	-87.7	0	0	0	110.5
504	R	26.4	Very low	30.1	Very low	174 Å²	174	142.9 Å²	142.9	66%	0.657	71%	0.711	S	S	*	*			cis	94.6	109	13.1	-155.1	-168.2	-161.2	-159.2	11.2	115
505	R	26.1	Very low	30.3	Very low	171 Å²	171	141.3 Å²	141.3	65%	0.645	71%	0.709	S	S	*	*			trans	70.4	157.6	168.6	-63.4	159.2	178.7	-179.7	-3.6	115.2
506	H	29.5	Very low	30.2	Very low	145 Å²	145	147.5 Å²	147.5	67%	0.671	72%	0.717	S	S	*	*			cis	-111.6	150.7	3.1	-83.3	-86.2	0	0	0	110.4
507	Q	28.2	Very low	30.3	Very low	135 Å²	135	143.3 Å²	143.3	63%	0.631	71%	0.713	S	S	*	*				48.6	133.3	72.5	-56.7	175.4	-34.7	0	0	111.9	I509	Q507-I509 HydrophobicContact CG-CD1 4.18Å
508	S	30	Very low	30.1	Very low	109 Å²	109	143.3 Å²	143.3	76%	0.762	72%	0.721	S	S	*	*			cis	-120.5	141.7	24.8	51.8	0	0	0	0	112.4
509	I	28	Very low	30.2	Very low	137 Å²	137	140.9 Å²	140.9	70%	0.703	72%	0.722	S	S	*	*				59.4	101.7	59	-55.3	175.6	0	0	0	112.5	Q507	Q507-I509 HydrophobicContact CG-CD1 4.18Å
510	G	28.5	Very low	30.2	Very low	68 Å²	68	142.5 Å²	142.5	70%	0.701	73%	0.734	S	S	*	*			trans	130.1	146.3	149.1	0	0	0	0	0	116.7
511	L	30.8	Very low	30.1	Very low	149 Å²	149	139 Å²	139	78%	0.78	72%	0.723	S	S	*	*			cis	-157.1	154.8	-13.8	-91.5	-177.7	0	0	0	108.3
512	I	31.7	Very low	30	Very low	125 Å²	125	139 Å²	139	64%	0.641	73%	0.73	S	S	*	*			trans	45.5	118	140.1	-61.4	171.6	0	0	0	116.8
513	S	32.5	Very low	30	Very low	89 Å²	89	138 Å²	138	62%	0.622	73%	0.729	S	S	*	*			cis	-156.4	149.3	47.7	-116.5	0	0	0	0	110.4
514	R	31.7	Very low	30	Very low	213 Å²	213	133.5 Å²	133.5	80%	0.804	73%	0.725	S	S	*	*				52	135.1	77.6	-49.7	173.8	174.5	-177.4	-1.2	112.6
515	T	34.8	Very low	30.1	Very low	123 Å²	123	128.3 Å²	128.3	76%	0.755	73%	0.726	S	S	*	*			cis	-126	147.9	21.1	45	0	0	0	0	111.7
516	R	31	Very low	30.1	Very low	227 Å²	227	130.4 Å²	130.4	86%	0.857	74%	0.735	S	S	*	*				46.6	134	78.1	-63.2	-176	173.3	-165	-3.6	113
517	S	34	Very low	30.1	Very low	110 Å²	110	127.9 Å²	127.9	77%	0.769	73%	0.734	S	S	*	*			cis	-131.5	146.5	17.3	-62.9	0	0	0	0	110.5
518	A	30.1	Very low	30	Very low	91 Å²	91	127.7 Å²	127.7	75%	0.752	74%	0.742	S	S	*	*			cis	76.5	138.4	45.7	0	0	0	0	0	113.6
519	P	35.8	Very low	30	Very low	120 Å²	120	129.4 Å²	129.4	78%	0.779	74%	0.743	S	S	*	*			trans	-112.4	177.8	-150.8	42.8	-35	0	0	0	114.5
520	L	30.6	Very low	29.9	Very low	170 Å²	170	133.9 Å²	133.9	89%	0.89	75%	0.753	S	S	*	*			trans	-177	159.6	143	-88.3	145	0	0	0	106.1
521	S	25.5	Very low	29.9	Very low	82 Å²	82	141.9 Å²	141.9	57%	0.573	76%	0.762	S	S	*	*			cis	148.9	142.8	-19.4	-178.2	0	0	0	0	106.5
522	L	27.6	Very low	29.6	Very low	165 Å²	165	143.1 Å²	143.1	86%	0.864	76%	0.763	S	S	*	*			trans	64	154.6	173.5	-98.5	67.2	0	0	0	115.2
523	A	29.3	Very low	29.5	Very low	68 Å²	68	144.3 Å²	144.3	56%	0.562	77%	0.769	S	S	*	*			cis	-157.5	159.1	-0.2	0	0	0	0	0	111.6
524	T	27.9	Very low	29.2	Very low	132 Å²	132	148 Å²	148	81%	0.81	78%	0.776	S	S	*	*			trans	57	141.8	146.8	50.7	0	0	0	0	121.5
525	G	28.8	Very low	29.1	Very low	65 Å²	65	144.3 Å²	144.3	67%	0.67	77%	0.772	S	S	*	*			cis	167	-163.3	-2.7	0	0	0	0	0	115.1
526	Y	26.8	Very low	28.8	Very low	216 Å²	216	146 Å²	146	85%	0.847	77%	0.771	S	S	*	*			trans	1.1	132.6	167	-63.8	-88.1	0	0	0	119.7
527	S	28.7	Very low	28.6	Very low	92 Å²	92	141.7 Å²	141.7	64%	0.643	77%	0.765	S	S	*	*				-156	119.2	102.5	-155.3	0	0	0	0	112.7	N529	S527-N529 PolarHBondContact OG-ND2 2.76Å
528	T	26.3	Very low	28.4	Very low	131 Å²	131	143.4 Å²	143.4	80%	0.804	77%	0.765	S	S	*	*			trans	-74.1	140.8	143.9	41.1	0	0	0	0	107.6
529	N	29.8	Very low	28.4	Very low	145 Å²	145	145.3 Å²	145.3	78%	0.775	76%	0.763	S	S	*	*			trans	-138.3	111.5	173.9	-111.5	-38.2	0	0	0	111.7	S527	S527-N529 PolarHBondContact OG-ND2 2.76Å
530	Y	25.2	Very low	28.1	Very low	231 Å²	231	146.6 Å²	146.6	91%	0.906	76%	0.763	S	S	*	*			trans	-127.8	88.3	172.8	-140.2	-70	0	0	0	107.7
531	R	28.2	Very low	28.1	Very low	236 Å²	236	145 Å²	145	89%	0.891	76%	0.76	S	S	*	*			trans	-162.9	115.2	163	-112.7	165.1	-164	-161.7	2.9	112.9
532	H	25.8	Very low	28.4	Very low	175 Å²	175	149 Å²	149	81%	0.81	77%	0.769	S	S	*	*			trans	2.9	125.2	138.6	-85.6	-102	0	0	0	117.4
533	I	29.2	Very low	28.3	Very low	149 Å²	149	147.5 Å²	147.5	76%	0.764	76%	0.762	S	S	*	*				-172.5	112.3	103.1	-91.2	155.5	0	0	0	110.1
534	Q	25.7	Very low	28.1	Very low	167 Å²	167	152.6 Å²	152.6	78%	0.78	78%	0.779	S	S	*	*			trans	36.5	113.3	132.3	-155	174.4	-5.4	0	0	119.6
535	L	29.5	Very low	28.1	Very low	136 Å²	136	151.8 Å²	151.8	71%	0.712	78%	0.779	S	S	*	*				177	109.7	113.2	-91.6	168.6	0	0	0	113.9
536	Q	28.3	Very low	28	Very low	158 Å²	158	156.9 Å²	156.9	74%	0.738	79%	0.791	S	S	*	*			trans	51.4	126.6	139.6	-63.6	172.9	-2.9	0	0	122.9
537	N	27.3	Very low	27.9	Very low	137 Å²	137	152.1 Å²	152.1	73%	0.733	79%	0.789	S	S	*	*			trans	68.8	132.9	143.6	-64.5	-15.7	0	0	0	119
538	L	31.3	Very low	27.8	Very low	145 Å²	145	156.4 Å²	156.4	76%	0.759	80%	0.801	S	S	*	*			cis	-144.1	132.8	2.3	-90.7	131.1	0	0	0	111.9
539	N	28.8	Very low	27.8	Very low	132 Å²	132	158.3 Å²	158.3	71%	0.706	81%	0.806	S	S	*	*			trans	29.4	135.4	137.4	-59.7	-3.1	0	0	0	123
540	N	30	Very low	27.6	Very low	147 Å²	147	157.4 Å²	157.4	79%	0.786	81%	0.806	S	S	*	*			trans	102	105	135.1	-74.1	1.7	0	0	0	122.2
541	V	30.5	Very low	27.8	Very low	137 Å²	137	152.9 Å²	152.9	83%	0.83	81%	0.805	S	S	*	*				113.6	112.2	128.8	173	0	0	0	0	118.6
542	H	30.6	Very low	27.7	Very low	164 Å²	164	148.4 Å²	148.4	76%	0.759	80%	0.804	S	S	*	*			trans	-60.3	171.8	163.9	-81	-96.2	0	0	0	113
543	N	26.9	Very low	27.9	Very low	134 Å²	134	145.2 Å²	145.2	72%	0.717	80%	0.802	S	S	*	*			cis	-162.6	150.1	13.6	-123.6	-12	0	0	0	108.4
544	L	25.1	Very low	27.9	Very low	175 Å²	175	145 Å²	145	92%	0.916	81%	0.807	S	S	*	*			trans	158.8	89.2	146.9	-91.7	159.3	0	0	0	112.4
545	S	28.4	Very low	28.5	Very low	115 Å²	115	141.3 Å²	141.3	80%	0.804	80%	0.796	S	S	*	*			trans	-168.8	129.5	156	40.8	0	0	0	0	111.3
546	N	25.4	Very low	29.2	Very low	172 Å²	172	136.3 Å²	136.3	92%	0.92	77%	0.773	S	S	*	*			trans	179.6	82.9	157.7	-103.2	-15.6	0	0	0	110
547	S	25	Very low	29.9	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	76%	0.763	S	S	*	*			trans	172.5	88.6	151.2	-174.8	0	0	0	0	110.1
548	M	27	Very low	30.6	Very low	181 Å²	181	125.9 Å²	125.9	89%	0.892	73%	0.732	S	S	*	*			trans	-157.7	122.2	158.2	-83.3	-154.2	170.6	0	0	108.5
549	N	26.2	Very low	31.4	Very low	171 Å²	171	119.6 Å²	119.6	91%	0.914	70%	0.7	S	S	*	*			trans	-168.7	55	162.6	-104.5	-15.7	0	0	0	111.7
550	T	26.1	Very low	32.5	Very low	127 Å²	127	117.1 Å²	117.1	78%	0.779	69%	0.686	S	S	*	*	S	Bend	trans	-136.7	140.8	160.9	46.1	0	0	0	0	109
551	P	28.1	Very low	33.6	Very low	136 Å²	136	114.5 Å²	114.5	88%	0.883	67%	0.671	S	S	*	*			trans	-78.5	130	-169.5	29.9	-34.5	0	0	0	112.4
552	T	25.8	Very low	34.6	Very low	141 Å²	141	108.7 Å²	108.7	87%	0.865	64%	0.638	S	S	*	*			trans	-100.7	127.8	176.9	45.6	0	0	0	0	111.4
553	S	30.8	Very low	35.7	Very low	109 Å²	109	105.8 Å²	105.8	76%	0.762	63%	0.626	S	S	*	*			trans	-124.5	100.3	-178.4	61.9	0	0	0	0	113.5
554	V	29.8	Very low	37	Very low	145 Å²	145	104.1 Å²	104.1	88%	0.879	61%	0.613	S	S	*	*			trans	53.7	68.4	154.6	-157.2	0	0	0	0	116.9	S556	V554-S556 PolarHBondContact O-N 2.67Å
555	T	38.5	Very low	38.2	Very low	88 Å²	88	98 Å²	98	54%	0.54	59%	0.588	S	S	.	*			trans	-64.1	126.3	164	-54	0	0	0	0	110.8	N559 I560	T555-N559 HydrophobicContact CG2-CB 3.62Å; T555-I560 HydrophobicContact CG2-CG1 4.11Å
556	S	43.7	Very low	39.1	Very low	32 Å²	32	92.7 Å²	92.7	22%	0.224	55%	0.551	C	S	.	*			trans	-73.3	156.3	179.4	86.2	0	0	0	0	112.9	V554 A558 N559 I560	V554-S556 PolarHBondContact O-N 2.67Å; S556-A558 PolarHBondContact O-N 3.12Å; S556-A558 PolarHBondContact OG-N 3.15Å; S556-N559 WeakPolarHBondContact O-CA 3.46Å; S556-N559 WeakPolarHBondContact O-CB 3.3Å; S556-N559 PolarHBondContact O-N 3.42Å; S556-N559 PolarHBondContact OG-N 3.47Å; S556-N559 PolarHBondContact OG-OD1 2.86Å; S556-N559 VanDerWaalsContact OG-OD1 3.06Å; S556-I560 PolarHBondContact O-N 2.69Å; S556-I560 VanDerWaalsContact O-N 3.08Å
557	A	41.7	Very low	40.2	Very low	65 Å²	65	88.4 Å²	88.4	54%	0.537	53%	0.531	S	S	.	.	H	α-helix	trans	-58.3	-34.1	175.9	0	0	0	0	0	113.1	N559 I560 L561	A557-N559 VanDerWaalsContact C-N 3.29Å; A557-N559 PolarHBondContact O-N 3.42Å; A557-I560 PolarHBondContact O-N 3.35Å; A557-L561 WeakPolarHBondContact O-CG 3.41Å; A557-L561 PolarHBondContact O-N 3.05Å
558	A	44	Very low	41.3	Very low	11 Å²	11	86.9 Å²	86.9	9%	0.091	52%	0.517	C	S	.	.	H	α-helix	trans	-67.2	-28.6	173.6	0	0	0	0	0	112.9	S556 A562 R761 C762	S556-A558 PolarHBondContact O-N 3.12Å; S556-A558 PolarHBondContact OG-N 3.15Å; A558-A562 VanDerWaalsContact O-CB 3.29Å; A558-A562 WeakPolarHBondContact O-CB 3.37Å; A558-A562 PolarHBondContact O-N 2.82Å; A558-R761 HydrophobicContact CB-CB 4.3Å; A558-C762 VanDerWaalsContact CB-SG 3.56Å
559	N	47.1	Very low	41.9	Very low	13 Å²	13	82.4 Å²	82.4	7%	0.07	50%	0.497	C	S	.	.	H	α-helix	trans	-75.8	-35.7	174.6	-65.7	19.3	0	0	0	111.1	T555 S556 A557 A562 M563 T792	T555-N559 HydrophobicContact CG2-CB 3.62Å; S556-N559 WeakPolarHBondContact O-CA 3.46Å; S556-N559 WeakPolarHBondContact O-CB 3.3Å; S556-N559 PolarHBondContact O-N 3.42Å; S556-N559 PolarHBondContact OG-N 3.47Å; S556-N559 PolarHBondContact OG-OD1 2.86Å; S556-N559 VanDerWaalsContact OG-OD1 3.06Å; A557-N559 VanDerWaalsContact C-N 3.29Å; A557-N559 PolarHBondContact O-N 3.42Å; N559-A562 PolarHBondContact O-N 2.88Å; N559-M563 WeakPolarHBondContact O-CG 3.32Å; N559-M563 PolarHBondContact O-N 2.83Å; N559-T792 PolarHBondContact ND2-O 3.48Å; N559-T792 PolarHBondContact OD1-O 3.34Å
560	I	52.1	Low	42.5	Very low	80 Å²	80	79.7 Å²	79.7	41%	0.41	48%	0.477	S	S	.	.	H	α-helix	trans	-62.4	-52.6	172.1	-62.1	173.7	0	0	0	109.5	T555 S556 A557 A562 M563 E564	T555-I560 HydrophobicContact CG2-CG1 4.11Å; S556-I560 PolarHBondContact O-N 2.69Å; S556-I560 VanDerWaalsContact O-N 3.08Å; A557-I560 PolarHBondContact O-N 3.35Å; I560-A562 VanDerWaalsContact C-N 3.27Å; I560-A562 PolarHBondContact O-N 3.35Å; I560-M563 PolarHBondContact O-N 3.02Å; I560-E564 HydrophobicContact CG2-CG 4.27Å; I560-E564 WeakPolarHBondContact O-CG 3.4Å; I560-E564 PolarHBondContact O-N 3.1Å
561	L	53.2	Low	42.9	Very low	91 Å²	91	75.7 Å²	75.7	48%	0.476	46%	0.461	S	S	.	.	H	α-helix	trans	-57.5	-36.7	176.7	-72.1	168	0	0	0	112.9	A557 A565	A557-L561 WeakPolarHBondContact O-CG 3.41Å; A557-L561 PolarHBondContact O-N 3.05Å; L561-A565 VanDerWaalsContact O-CB 3.27Å; L561-A565 WeakPolarHBondContact O-CB 3.29Å; L561-A565 PolarHBondContact O-N 3.43Å
562	A	50.6	Low	43.2	Very low	16 Å²	16	75.7 Å²	75.7	13%	0.132	45%	0.454	C	S	.	.	H	α-helix	trans	-67.2	-38	175	0	0	0	0	0	112.8	A558 N559 I560 A566 L774	A558-A562 VanDerWaalsContact O-CB 3.29Å; A558-A562 WeakPolarHBondContact O-CB 3.37Å; A558-A562 PolarHBondContact O-N 2.82Å; N559-A562 PolarHBondContact O-N 2.88Å; I560-A562 VanDerWaalsContact C-N 3.27Å; I560-A562 PolarHBondContact O-N 3.35Å; A562-A566 WeakPolarHBondContact O-CB 3.43Å; A562-A566 PolarHBondContact O-N 2.96Å; A562-A566 VanDerWaalsContact O-N 3.16Å; A562-L774 HydrophobicContact CB-CD1 3.82Å
563	M	53.5	Low	43.6	Very low	103 Å²	103	77 Å²	77	51%	0.507	45%	0.45	S	S	.	.	H	α-helix	trans	-70.4	-42.2	174	-70.5	175.1	65.9	0	0	111.5	N559 I560 A566 T567	N559-M563 WeakPolarHBondContact O-CG 3.32Å; N559-M563 PolarHBondContact O-N 2.83Å; I560-M563 PolarHBondContact O-N 3.02Å; M563-A566 PolarHBondContact O-N 2.95Å; M563-T567 WeakPolarHBondContact O-CG2 3.49Å; M563-T567 PolarHBondContact O-N 2.88Å; M563-T567 PolarHBondContact O-OG1 2.97Å
564	E	54.4	Low	43.7	Very low	99 Å²	99	79 Å²	79	46%	0.463	45%	0.447	S	S	.	.	H	α-helix	trans	-60	-49.4	175.7	-72.3	174	160.2	0	0	110.9	I560 A566 T567 T568	I560-E564 HydrophobicContact CG2-CG 4.27Å; I560-E564 WeakPolarHBondContact O-CG 3.4Å; I560-E564 PolarHBondContact O-N 3.1Å; E564-A566 VanDerWaalsContact C-N 3.32Å; E564-A566 PolarHBondContact O-N 2.99Å; E564-T567 WeakPolarHBondContact CA-OG1 3.42Å; E564-T567 WeakPolarHBondContact O-CA 3.42Å; E564-T567 PolarHBondContact O-N 3.45Å; E564-T567 PolarHBondContact O-OG1 3.08Å; E564-T568 PolarHBondContact O-N 3.35Å; E564-T568 PolarHBondContact O-OG1 2.82Å
565	A	51.5	Low	43.8	Very low	45 Å²	45	80.7 Å²	80.7	37%	0.372	45%	0.445	S	S	.	.	H	α-helix	trans	-58.3	-40.6	176.3	0	0	0	0	0	113	L561 T567 T568 N569	L561-A565 VanDerWaalsContact O-CB 3.27Å; L561-A565 WeakPolarHBondContact O-CB 3.29Å; L561-A565 PolarHBondContact O-N 3.43Å; A565-T567 VanDerWaalsContact C-N 3.31Å; A565-T567 PolarHBondContact O-N 2.8Å; A565-T568 WeakPolarHBondContact CA-OG1 3.28Å; A565-T568 PolarHBondContact O-OG1 3.49Å; A565-N569 PolarHBondContact O-N 3.1Å; A565-N569 PolarHBondContact O-ND2 3.44Å
566	A	47	Very low	43.3	Very low	5 Å²	5	81.8 Å²	81.8	4%	0.041	45%	0.452	C	S	.	.	H	α-helix	trans	-65	-33.4	174.4	0	0	0	0	0	112.3	A562 M563 E564	A562-A566 WeakPolarHBondContact O-CB 3.43Å; A562-A566 PolarHBondContact O-N 2.96Å; A562-A566 VanDerWaalsContact O-N 3.16Å; M563-A566 PolarHBondContact O-N 2.95Å; E564-A566 VanDerWaalsContact C-N 3.32Å; E564-A566 PolarHBondContact O-N 2.99Å
567	T	48.5	Very low	42.5	Very low	81 Å²	81	88.3 Å²	88.3	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-77.4	-37.4	175.6	58.4	0	0	0	0	114	M563 E564 A565 N569 F570 G571	M563-T567 WeakPolarHBondContact O-CG2 3.49Å; M563-T567 PolarHBondContact O-N 2.88Å; M563-T567 PolarHBondContact O-OG1 2.97Å; E564-T567 WeakPolarHBondContact CA-OG1 3.42Å; E564-T567 WeakPolarHBondContact O-CA 3.42Å; E564-T567 PolarHBondContact O-N 3.45Å; E564-T567 PolarHBondContact O-OG1 3.08Å; A565-T567 VanDerWaalsContact C-N 3.31Å; A565-T567 PolarHBondContact O-N 2.8Å; T567-N569 VanDerWaalsContact C-N 3.28Å; T567-N569 PolarHBondContact O-N 2.97Å; T567-F570 PolarHBondContact O-N 3.42Å; T567-F570 VanDerWaalsContact O-N 3.14Å; T567-G571 PolarHBondContact O-N 2.88Å
568	T	47	Very low	41.8	Very low	85 Å²	85	88.9 Å²	88.9	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-65.3	-31.6	-178.6	47.3	0	0	0	0	112.9	E564 A565 F570 G571	E564-T568 PolarHBondContact O-N 3.35Å; E564-T568 PolarHBondContact O-OG1 2.82Å; A565-T568 WeakPolarHBondContact CA-OG1 3.28Å; A565-T568 PolarHBondContact O-OG1 3.49Å; T568-F570 VanDerWaalsContact C-N 3.26Å; T568-F570 PolarHBondContact O-N 3.27Å; T568-G571 PolarHBondContact O-N 3.31Å
569	N	40.3	Very low	41.2	Very low	88 Å²	88	97.1 Å²	97.1	47%	0.471	54%	0.538	S	S	.	.	H	α-helix	trans	-65.4	-27.7	175.9	-75.1	-31.1	0	0	0	113.1	A565 T567	A565-N569 PolarHBondContact O-N 3.1Å; A565-N569 PolarHBondContact O-ND2 3.44Å; T567-N569 VanDerWaalsContact C-N 3.28Å; T567-N569 PolarHBondContact O-N 2.97Å
570	F	38.7	Very low	40.3	Very low	114 Å²	114	103.6 Å²	103.6	50%	0.5	57%	0.573	S	S	.	*	H	α-helix	trans	-78.1	-36.4	178.2	-114.9	-86.5	0	0	0	113	T567 T568 N572 Q573	T567-F570 PolarHBondContact O-N 3.42Å; T567-F570 VanDerWaalsContact O-N 3.14Å; T568-F570 VanDerWaalsContact C-N 3.26Å; T568-F570 PolarHBondContact O-N 3.27Å; F570-N572 VanDerWaalsContact C-N 3.31Å; F570-N572 PolarHBondContact O-N 3.22Å; F570-Q573 PolarHBondContact O-N 3.07Å
571	G	34.5	Very low	39.2	Very low	42 Å²	42	103.7 Å²	103.7	43%	0.433	58%	0.58	S	S	.	*	H	α-helix	trans	-61.3	-37.6	-177.8	0	0	0	0	0	113.6	T567 T568 Q573	T567-G571 PolarHBondContact O-N 2.88Å; T568-G571 PolarHBondContact O-N 3.31Å; G571-Q573 PolarHBondContact O-N 2.86Å
572	N	34.2	Very low	38	Very low	137 Å²	137	106.6 Å²	106.6	73%	0.733	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-0.4	-175.6	-71.8	-16.7	0	0	0	114.8	F570	F570-N572 VanDerWaalsContact C-N 3.31Å; F570-N572 PolarHBondContact O-N 3.22Å
573	Q	34.2	Very low	37.2	Very low	168 Å²	168	114.4 Å²	114.4	79%	0.785	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-0.5	176.3	-67.9	-167.5	-12.4	0	0	114.1	F570 G571	F570-Q573 PolarHBondContact O-N 3.07Å; G571-Q573 PolarHBondContact O-N 2.86Å
574	Q	34.3	Very low	35.9	Very low	151 Å²	151	114.1 Å²	114.1	71%	0.706	64%	0.639	S	S	*	*	S	Bend	trans	-116.4	12.9	-178.4	-64.8	-169.3	-12.5	0	0	114.6
575	Q	30.5	Very low	34.6	Very low	180 Å²	180	117.1 Å²	117.1	84%	0.841	65%	0.654	S	S	*	*	S	Bend	trans	-125.7	5.2	178.6	-68	-165.3	-10.3	0	0	115.5
576	T	28.5	Very low	33.6	Very low	112 Å²	112	121.8 Å²	121.8	69%	0.687	67%	0.672	S	S	*	*	S	Bend	trans	-116.2	50.8	-178.5	60.2	0	0	0	0	112.9
577	N	27.2	Very low	32.6	Very low	169 Å²	169	129.1 Å²	129.1	90%	0.904	71%	0.705	S	S	*	*	S	Bend	trans	-152.7	95	169.1	-97.8	-37.1	0	0	0	109.8
578	G	26.6	Very low	31.8	Very low	77 Å²	77	132.5 Å²	132.5	79%	0.794	72%	0.72	S	S	*	*			trans	142.8	71.4	174.2	0	0	0	0	0	116.2
579	L	31.5	Very low	30.9	Very low	183 Å²	183	134.5 Å²	134.5	96%	0.958	73%	0.728	S	S	*	*			trans	-157.5	139.3	150.2	-106.7	170.7	0	0	0	107.5
580	N	29.1	Very low	30.5	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	74%	0.741	S	S	*	*			trans	-125.8	147.8	-157.7	-148.5	1.1	0	0	0	113.2
581	S	27.9	Very low	29.9	Very low	81 Å²	81	141 Å²	141	57%	0.566	76%	0.762	S	S	*	*			trans	50	114.5	154.9	65	0	0	0	0	120.2
582	N	27.7	Very low	29.5	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	78%	0.778	S	S	*	*				167.9	168	97.9	-87.7	-46.7	0	0	0	114.8
583	Q	33.2	Very low	29.3	Very low	180 Å²	180	142.5 Å²	142.5	84%	0.841	78%	0.782	S	S	*	*			trans	72.3	72.4	163.2	-73.2	176.2	-15	0	0	120.1
584	S	27.4	Very low	28.9	Very low	98 Å²	98	143.7 Å²	143.7	69%	0.685	79%	0.788	S	S	*	*				9.9	132.8	119.9	62.2	0	0	0	0	120.6
585	M	27	Very low	28.6	Very low	161 Å²	161	141.8 Å²	141.8	79%	0.793	79%	0.791	S	S	*	*				162.8	141.8	101.8	-88.2	-143.2	174.3	0	0	115.6
586	I	31.3	Very low	28.6	Very low	143 Å²	143	141 Å²	141	73%	0.733	79%	0.792	S	S	*	*			trans	76.5	136.5	150.9	-67	162.1	0	0	0	119.2
587	E	25.7	Very low	29	Very low	160 Å²	160	142 Å²	142	75%	0.748	79%	0.794	S	S	*	*			trans	-84.6	161.4	178.5	-55.9	123.9	120.5	0	0	113.5
588	N	31.9	Very low	29.4	Very low	151 Å²	151	141 Å²	141	81%	0.807	79%	0.788	S	S	*	*				179.9	106	114.5	-90.9	-45.9	0	0	0	113.8
589	D	27.4	Very low	29.8	Very low	127 Å²	127	143.2 Å²	143.2	68%	0.679	78%	0.777	S	S	*	*				65.3	158.1	120.9	-152	21.9	0	0	0	123.4
590	Q	32	Very low	29.9	Very low	160 Å²	160	137.5 Å²	137.5	75%	0.748	75%	0.753	S	S	*	*			trans	77.9	75.3	162.9	-47.9	-165.4	7.6	0	0	120.7
591	L	26.2	Very low	30.1	Very low	179 Å²	179	134.2 Å²	134.2	94%	0.937	74%	0.741	S	S	*	*				27.2	119.6	120	-66.6	164	0	0	0	119.3
592	G	26.9	Very low	30.6	Very low	75 Å²	75	134 Å²	134	77%	0.773	74%	0.736	S	S	*	*			trans	-169.5	51.3	176.4	0	0	0	0	0	119.9
593	V	28.1	Very low	31	Very low	136 Å²	136	131.5 Å²	131.5	82%	0.824	72%	0.723	S	S	*	*			trans	45.2	104.6	156.5	-171.6	0	0	0	0	119.2
594	Q	27.6	Very low	31.1	Very low	193 Å²	193	128 Å²	128	90%	0.902	71%	0.71	S	S	*	*			trans	-178.1	110.9	137.3	-107.1	170.4	71.6	0	0	112.9
595	S	27.6	Very low	31.6	Very low	111 Å²	111	128.1 Å²	128.1	78%	0.776	70%	0.7	S	S	*	*			trans	-159	56.8	-178.5	49.1	0	0	0	0	114.6
596	N	30.8	Very low	32.2	Very low	162 Å²	162	125.9 Å²	125.9	87%	0.866	69%	0.69	S	S	*	*			trans	-126.6	8.6	-176.8	-95.1	-36	0	0	0	116.3
597	N	35.6	Very low	32.6	Very low	135 Å²	135	121.8 Å²	121.8	72%	0.722	68%	0.675	S	S	*	*	S	Bend	trans	-114.6	3.6	-170.4	-100.5	-13.1	0	0	0	116.6
598	L	35	Very low	33.5	Very low	147 Å²	147	117.3 Å²	117.3	77%	0.77	66%	0.661	S	S	*	*	S	Bend	trans	-90	-33	-179.8	-82.2	123.7	0	0	0	114.5	S600 S601	L598-S600 PolarHBondContact O-N 3.02Å; L598-S601 WeakPolarHBondContact O-CB 3.37Å; L598-S601 PolarHBondContact O-N 3.07Å
599	Q	35.2	Very low	34.4	Very low	124 Å²	124	114.4 Å²	114.4	58%	0.579	64%	0.639	S	S	*	*	H	α-helix	trans	-65.3	-39	-171.7	-154.4	67.8	27.3	0	0	113.4	S601 V602 D603	Q599-S601 PolarHBondContact O-N 2.76Å; Q599-V602 PolarHBondContact O-N 2.77Å; Q599-D603 PolarHBondContact O-N 2.83Å
600	S	33.8	Very low	35.4	Very low	63 Å²	63	111.5 Å²	111.5	44%	0.441	63%	0.628	S	S	.	*	H	α-helix	trans	-68.8	-16.3	-178	53.3	0	0	0	0	114.1	L598 N604	L598-S600 PolarHBondContact O-N 3.02Å; S600-N604 PolarHBondContact O-ND2 3.03Å
601	S	33.7	Very low	36.7	Very low	81 Å²	81	110 Å²	110	57%	0.566	62%	0.619	S	S	*	*	H	α-helix	trans	-71.6	-47.9	172.1	-167.4	0	0	0	0	110.7	L598 Q599 D603 N604 E605	L598-S601 WeakPolarHBondContact O-CB 3.37Å; L598-S601 PolarHBondContact O-N 3.07Å; Q599-S601 PolarHBondContact O-N 2.76Å; S601-D603 PolarHBondContact O-N 3.46Å; S601-N604 PolarHBondContact O-N 2.82Å; S601-E605 PolarHBondContact O-N 2.86Å; S601-E605 VanDerWaalsContact O-N 3.12Å
602	V	39.3	Very low	38	Very low	76 Å²	76	104.2 Å²	104.2	46%	0.461	59%	0.591	S	S	.	*	H	α-helix	trans	-63.7	-44.1	-175.5	-173.7	0	0	0	0	111.4	Q599 N604 E605 L606	Q599-V602 PolarHBondContact O-N 2.77Å; V602-N604 VanDerWaalsContact C-N 3.31Å; V602-N604 PolarHBondContact O-N 3Å; V602-E605 PolarHBondContact O-N 3.44Å; V602-L606 PolarHBondContact O-N 3.07Å
603	D	34.4	Very low	39.1	Very low	100 Å²	100	101.8 Å²	101.8	54%	0.535	56%	0.561	S	S	.	*	H	α-helix	trans	-60.6	-38.5	179.1	-66.9	-23.6	0	0	0	112.5	Q599 S601 S607	Q599-D603 PolarHBondContact O-N 2.83Å; S601-D603 PolarHBondContact O-N 3.46Å; D603-S607 WeakPolarHBondContact O-CB 3.3Å; D603-S607 PolarHBondContact O-N 3.43Å
604	N	36.2	Very low	40.4	Very low	106 Å²	106	99.8 Å²	99.8	57%	0.567	55%	0.546	S	S	*	.	H	α-helix	trans	-72	-37.4	177.9	-81	-63.3	0	0	0	112.2	S600 S601 V602 S608	S600-N604 PolarHBondContact O-ND2 3.03Å; S601-N604 PolarHBondContact O-N 2.82Å; V602-N604 VanDerWaalsContact C-N 3.31Å; V602-N604 PolarHBondContact O-N 3Å; N604-S608 WeakPolarHBondContact O-CB 3.45Å; N604-S608 PolarHBondContact O-N 3Å; N604-S608 PolarHBondContact O-OG 3.19Å
605	E	37	Very low	41.8	Very low	101 Å²	101	96.7 Å²	96.7	47%	0.472	53%	0.531	S	S	.	.	H	α-helix	trans	-66.1	-42.9	174.7	-163	-172.9	158.8	0	0	111	S601 V602 S607 S608 R609	S601-E605 PolarHBondContact O-N 2.86Å; S601-E605 VanDerWaalsContact O-N 3.12Å; V602-E605 PolarHBondContact O-N 3.44Å; E605-S607 PolarHBondContact O-N 3.43Å; E605-S608 WeakPolarHBondContact O-CB 3.3Å; E605-S608 PolarHBondContact O-N 2.92Å; E605-R609 WeakPolarHBondContact O-CG 3.4Å; E605-R609 PolarHBondContact O-N 2.97Å; E605-R609 IonicContact OE1-CZ 3.29Å; E605-R609 IonicContact OE1-NE 2.7Å; E605-R609 PolarHBondContact OE1-NE 3.06Å; E605-R609 IonicContact OE1-NH2 3.36Å; E605-R609 PolarHBondContact OE1-NH2 3.23Å
606	L	40.7	Very low	43	Very low	113 Å²	113	92.9 Å²	92.9	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-61.2	-44	176.4	-131.1	73.6	0	0	0	112.1	V602 S608 R609 S610	V602-L606 PolarHBondContact O-N 3.07Å; L606-S608 VanDerWaalsContact C-N 3.31Å; L606-S608 PolarHBondContact O-N 2.94Å; L606-R609 PolarHBondContact O-N 2.85Å; L606-S610 PolarHBondContact O-N 2.82Å
607	S	40.2	Very low	44	Very low	58 Å²	58	89 Å²	89	41%	0.406	48%	0.475	S	S	.	.	H	α-helix	trans	-62.3	-37.8	174.8	-170.1	0	0	0	0	112.4	D603 E605 K611	D603-S607 WeakPolarHBondContact O-CB 3.3Å; D603-S607 PolarHBondContact O-N 3.43Å; E605-S607 PolarHBondContact O-N 3.43Å; S607-K611 PolarHBondContact O-N 2.67Å
608	S	43.4	Very low	45.2	Very low	65 Å²	65	88.9 Å²	88.9	46%	0.455	47%	0.468	S	S	.	.	H	α-helix	trans	-69.3	-45.3	178.1	-58.5	0	0	0	0	111.7	N604 E605 L606 S610 K611 V612	N604-S608 WeakPolarHBondContact O-CB 3.45Å; N604-S608 PolarHBondContact O-N 3Å; N604-S608 PolarHBondContact O-OG 3.19Å; E605-S608 WeakPolarHBondContact O-CB 3.3Å; E605-S608 PolarHBondContact O-N 2.92Å; L606-S608 VanDerWaalsContact C-N 3.31Å; L606-S608 PolarHBondContact O-N 2.94Å; S608-S610 VanDerWaalsContact C-N 3.33Å; S608-S610 PolarHBondContact O-N 3.05Å; S608-K611 PolarHBondContact O-N 3.15Å; S608-V612 PolarHBondContact O-N 3.2Å
609	R	50.4	Low	46.3	Very low	91 Å²	91	88.2 Å²	88.2	34%	0.343	46%	0.459	S	S	.	.	H	α-helix	trans	-57.8	-43.4	173.8	-75.1	174.5	172.3	-152.8	-4	112	E605 L606 K611 V612 V613	E605-R609 WeakPolarHBondContact O-CG 3.4Å; E605-R609 PolarHBondContact O-N 2.97Å; E605-R609 IonicContact OE1-CZ 3.29Å; E605-R609 IonicContact OE1-NE 2.7Å; E605-R609 PolarHBondContact OE1-NE 3.06Å; E605-R609 IonicContact OE1-NH2 3.36Å; E605-R609 PolarHBondContact OE1-NH2 3.23Å; L606-R609 PolarHBondContact O-N 2.85Å; R609-K611 VanDerWaalsContact C-N 3.33Å; R609-K611 PolarHBondContact O-N 2.69Å; R609-V612 PolarHBondContact O-N 3.24Å; R609-V613 WeakPolarHBondContact O-CG2 3.17Å; R609-V613 PolarHBondContact O-N 2.83Å
610	S	50.3	Low	47.3	Very low	66 Å²	66	83.4 Å²	83.4	46%	0.462	44%	0.437	S	S	.	.	H	α-helix	trans	-56.7	-43.5	176.1	-177.8	0	0	0	0	112.5	L606 S608 V612 V613 L614	L606-S610 PolarHBondContact O-N 2.82Å; S608-S610 VanDerWaalsContact C-N 3.33Å; S608-S610 PolarHBondContact O-N 3.05Å; S610-V612 PolarHBondContact O-N 3.18Å; S610-V613 PolarHBondContact O-N 3.26Å; S610-L614 WeakPolarHBondContact O-CB 3.29Å; S610-L614 WeakPolarHBondContact O-CG 3.43Å; S610-L614 PolarHBondContact O-N 3.47Å
611	K	57.6	Low	48	Very low	129 Å²	129	82.3 Å²	82.3	56%	0.561	43%	0.426	S	S	*	.	H	α-helix	trans	-63.9	-40.2	176.5	-68.4	168.8	-175.8	168.6	0	112.8	S607 S608 R609 L614 Q615	S607-K611 PolarHBondContact O-N 2.67Å; S608-K611 PolarHBondContact O-N 3.15Å; R609-K611 VanDerWaalsContact C-N 3.33Å; R609-K611 PolarHBondContact O-N 2.69Å; K611-L614 PolarHBondContact O-N 2.9Å; K611-Q615 WeakPolarHBondContact O-CG 3.41Å; K611-Q615 PolarHBondContact O-N 3.19Å
612	V	53.7	Low	48.8	Very low	57 Å²	57	83.2 Å²	83.2	35%	0.345	42%	0.421	S	S	.	.	H	α-helix	trans	-65.6	-43.6	176.4	175.9	0	0	0	0	110.8	S608 R609 S610 L614 Q615 L616	S608-V612 PolarHBondContact O-N 3.2Å; R609-V612 PolarHBondContact O-N 3.24Å; S610-V612 PolarHBondContact O-N 3.18Å; V612-L614 PolarHBondContact O-N 2.9Å; V612-Q615 PolarHBondContact O-N 3.03Å; V612-L616 HydrophobicContact CG1-CD1 4.16Å; V612-L616 WeakPolarHBondContact O-CB 3.47Å; V612-L616 PolarHBondContact O-N 3.18Å
613	V	50.5	Low	49.3	Very low	23 Å²	23	86.8 Å²	86.8	14%	0.139	43%	0.426	C	S	.	.	H	α-helix	trans	-61.4	-42.6	174.9	172.6	0	0	0	0	111.3	R609 S610 L616 R617 D748 V749 L768	R609-V613 WeakPolarHBondContact O-CG2 3.17Å; R609-V613 PolarHBondContact O-N 2.83Å; S610-V613 PolarHBondContact O-N 3.26Å; V613-L616 PolarHBondContact O-N 2.81Å; V613-R617 VanDerWaalsContact O-CB 3.3Å; V613-R617 WeakPolarHBondContact O-CB 3.07Å; V613-R617 PolarHBondContact O-N 2.91Å; V613-D748 HydrophobicContact CG1-CB 4.24Å; V613-V749 HydrophobicContact CB-CG2 4.48Å; V613-V749 HydrophobicContact CG1-CG2 3.89Å; V613-V749 HydrophobicContact CG2-CG2 3.7Å; V613-L768 HydrophobicContact CG2-CD1 3.86Å; V613-L768 HydrophobicContact CG2-CD2 4.3Å
614	L	54.8	Low	49.6	Very low	95 Å²	95	84.3 Å²	84.3	50%	0.497	42%	0.417	S	S	.	.	H	α-helix	trans	-66	-38.7	176.5	-73	168.8	0	0	0	112.8	S610 K611 V612 R617 K618	S610-L614 WeakPolarHBondContact O-CB 3.29Å; S610-L614 WeakPolarHBondContact O-CG 3.43Å; S610-L614 PolarHBondContact O-N 3.47Å; K611-L614 PolarHBondContact O-N 2.9Å; V612-L614 PolarHBondContact O-N 2.9Å; L614-R617 PolarHBondContact O-N 3.12Å; L614-K618 WeakPolarHBondContact O-CB 3.16Å; L614-K618 PolarHBondContact O-N 2.85Å
615	Q	58.4	Low	49.7	Very low	127 Å²	127	84.6 Å²	84.6	59%	0.593	42%	0.415	S	S	*	.	H	α-helix	trans	-67.4	-37.4	174	-74.1	-174	10.4	0	0	112.5	K611 V612 K619	K611-Q615 WeakPolarHBondContact O-CG 3.41Å; K611-Q615 PolarHBondContact O-N 3.19Å; V612-Q615 PolarHBondContact O-N 3.03Å; Q615-K619 WeakPolarHBondContact O-CB 3.12Å; Q615-K619 WeakPolarHBondContact O-CG 3.19Å; Q615-K619 PolarHBondContact O-N 2.98Å
616	L	51.7	Low	49.6	Very low	31 Å²	31	85.6 Å²	85.6	16%	0.162	42%	0.418	C	S	.	.	H	α-helix	trans	-67.7	-43.7	172.4	-81.2	168.2	0	0	0	111.6	V612 V613 K618 K619 I620 R763	V612-L616 HydrophobicContact CG1-CD1 4.16Å; V612-L616 WeakPolarHBondContact O-CB 3.47Å; V612-L616 PolarHBondContact O-N 3.18Å; V613-L616 PolarHBondContact O-N 2.81Å; L616-K618 VanDerWaalsContact C-N 3.34Å; L616-K618 PolarHBondContact O-N 3.33Å; L616-K619 PolarHBondContact O-N 3.23Å; L616-I620 HydrophobicContact CB-CD1 4.49Å; L616-I620 VanDerWaalsContact O-CB 3.29Å; L616-I620 WeakPolarHBondContact O-CB 3.25Å; L616-I620 WeakPolarHBondContact O-CG1 3.48Å; L616-I620 PolarHBondContact O-N 2.89Å; L616-R763 HydrophobicContact CD2-CB 4.49Å; L616-R763 WeakPolarHBondContact CD2-O 3.43Å
617	R	52.5	Low	49.4	Very low	80 Å²	80	87 Å²	87	30%	0.302	43%	0.426	S	S	.	.	H	α-helix	trans	-55.9	-48.9	175	-175.4	172.3	-173.7	-174.3	0.1	110.5	V613 L614 I620 L621 D748	V613-R617 VanDerWaalsContact O-CB 3.3Å; V613-R617 WeakPolarHBondContact O-CB 3.07Å; V613-R617 PolarHBondContact O-N 2.91Å; L614-R617 PolarHBondContact O-N 3.12Å; R617-I620 PolarHBondContact O-N 3.44Å; R617-L621 HydrophobicContact CG-CD1 3.8Å; R617-L621 HydrophobicContact CG-CG 4.36Å; R617-L621 WeakPolarHBondContact O-CB 3.44Å; R617-L621 VanDerWaalsContact O-CG 3.29Å; R617-L621 WeakPolarHBondContact O-CG 3.3Å; R617-L621 PolarHBondContact O-N 3.19Å; R617-D748 VanDerWaalsContact CD-OD2 3.26Å; R617-D748 WeakPolarHBondContact CD-OD2 3.13Å; R617-D748 IonicContact CZ-OD1 2.78Å; R617-D748 IonicContact CZ-OD2 3.54Å; R617-D748 IonicContact NE-OD1 3.64Å; R617-D748 IonicContact NE-OD2 3.68Å; R617-D748 VanDerWaalsContact NH1-CG 3.28Å; R617-D748 IonicContact NH1-OD1 3.54Å; R617-D748 PolarHBondContact NH1-OD1 2.74Å; R617-D748 VanDerWaalsContact NH1-OD1 3.15Å; R617-D748 IonicContact NH1-OD2 3.63Å; R617-D748 PolarHBondContact NH1-OD2 2.87Å; R617-D748 IonicContact NH2-OD1 3.72Å
618	K	61.1	Low	49.3	Very low	134 Å²	134	88.9 Å²	88.9	58%	0.583	44%	0.435	S	S	*	.	H	α-helix	trans	-56.3	-57.1	173.8	179.9	163.5	177.9	170.4	0	111.6	L614 L616 I620 L621 E622	L614-K618 WeakPolarHBondContact O-CB 3.16Å; L614-K618 PolarHBondContact O-N 2.85Å; L616-K618 VanDerWaalsContact C-N 3.34Å; L616-K618 PolarHBondContact O-N 3.33Å; K618-I620 PolarHBondContact O-N 2.94Å; K618-I620 VanDerWaalsContact O-N 3.12Å; K618-L621 PolarHBondContact O-N 3.27Å; K618-E622 WeakPolarHBondContact CE-OE1 3.43Å; K618-E622 HydrophobicContact CG-CG 4.17Å; K618-E622 WeakPolarHBondContact CG-OE1 3.43Å; K618-E622 IonicContact NZ-OE1 3.93Å; K618-E622 WeakPolarHBondContact O-CB 3.35Å; K618-E622 WeakPolarHBondContact O-CG 3.48Å; K618-E622 PolarHBondContact O-N 3.04Å
619	K	57.9	Low	48.8	Very low	132 Å²	132	89.1 Å²	89.1	57%	0.574	44%	0.436	S	S	*	.	H	α-helix	trans	-64	-17	-179.3	-72.8	179.3	178.9	176.3	0	115.4	Q615 L616 E622	Q615-K619 WeakPolarHBondContact O-CB 3.12Å; Q615-K619 WeakPolarHBondContact O-CG 3.19Å; Q615-K619 PolarHBondContact O-N 2.98Å; L616-K619 PolarHBondContact O-N 3.23Å; K619-E622 WeakPolarHBondContact CA-OE2 3.4Å
620	I	54.7	Low	47.8	Very low	24 Å²	24	90.9 Å²	90.9	12%	0.123	45%	0.452	C	S	.	.	H	α-helix	trans	-90.5	-46.4	175.2	-70.6	168.1	0	0	0	110.1	L616 R617 K618 R623 S624 L739 V752	L616-I620 HydrophobicContact CB-CD1 4.49Å; L616-I620 VanDerWaalsContact O-CB 3.29Å; L616-I620 WeakPolarHBondContact O-CB 3.25Å; L616-I620 WeakPolarHBondContact O-CG1 3.48Å; L616-I620 PolarHBondContact O-N 2.89Å; R617-I620 PolarHBondContact O-N 3.44Å; K618-I620 PolarHBondContact O-N 2.94Å; K618-I620 VanDerWaalsContact O-N 3.12Å; I620-R623 CarbonylContact O-C 3.55Å; I620-R623 PolarHBondContact O-N 2.98Å; I620-S624 PolarHBondContact O-N 2.96Å; I620-S624 PolarHBondContact O-OG 2.82Å; I620-L739 HydrophobicContact CG2-CD1 4.02Å; I620-V752 HydrophobicContact CD1-CG1 3.83Å
621	L	48.9	Very low	46.9	Very low	39 Å²	39	99.5 Å²	99.5	20%	0.204	48%	0.475	C	S	.	.	H	α-helix	trans	-59.6	-50.6	177	-71.6	172.1	0	0	0	111.5	R617 K618 R623 S624 E625 I740	R617-L621 HydrophobicContact CG-CD1 3.8Å; R617-L621 HydrophobicContact CG-CG 4.36Å; R617-L621 WeakPolarHBondContact O-CB 3.44Å; R617-L621 VanDerWaalsContact O-CG 3.29Å; R617-L621 WeakPolarHBondContact O-CG 3.3Å; R617-L621 PolarHBondContact O-N 3.19Å; K618-L621 PolarHBondContact O-N 3.27Å; L621-R623 PolarHBondContact O-N 3.33Å; L621-S624 WeakPolarHBondContact CA-OG 3.27Å; L621-S624 PolarHBondContact O-N 3.18Å; L621-S624 VanDerWaalsContact O-N 3.08Å; L621-S624 PolarHBondContact O-OG 3.3Å; L621-S624 VanDerWaalsContact O-OG 3.1Å; L621-E625 PolarHBondContact O-N 3.08Å; L621-E625 VanDerWaalsContact O-N 3.09Å; L621-I740 HydrophobicContact CD2-CG1 4.39Å
622	E	51.4	Low	45.4	Very low	101 Å²	101	98.9 Å²	98.9	47%	0.472	49%	0.487	S	S	.	.	H	α-helix	trans	-52.1	-15.5	173	-72.4	172.2	153.3	0	0	113.9	K618 K619	K618-E622 WeakPolarHBondContact CE-OE1 3.43Å; K618-E622 HydrophobicContact CG-CG 4.17Å; K618-E622 WeakPolarHBondContact CG-OE1 3.43Å; K618-E622 IonicContact NZ-OE1 3.93Å; K618-E622 WeakPolarHBondContact O-CB 3.35Å; K618-E622 WeakPolarHBondContact O-CG 3.48Å; K618-E622 PolarHBondContact O-N 3.04Å; K619-E622 WeakPolarHBondContact CA-OE2 3.4Å
623	R	48.9	Very low	44.2	Very low	150 Å²	150	99.9 Å²	99.9	57%	0.566	51%	0.508	S	S	*	.	H	α-helix	trans	-121.8	-12.5	-177.3	-141.5	179.8	-170.6	89.9	5.6	114.6	I620 L621 L627	I620-R623 CarbonylContact O-C 3.55Å; I620-R623 PolarHBondContact O-N 2.98Å; L621-R623 PolarHBondContact O-N 3.33Å; R623-L627 WeakPolarHBondContact O-CD1 3.48Å; R623-L627 WeakPolarHBondContact O-CG 3.17Å
624	S	40.6	Very low	43.3	Very low	48 Å²	48	105.1 Å²	105.1	34%	0.336	54%	0.54	S	S	.	.	H	α-helix	trans	-79.3	-37.6	165	45.8	0	0	0	0	111.2	I620 L621 F626 L627	I620-S624 PolarHBondContact O-N 2.96Å; I620-S624 PolarHBondContact O-OG 2.82Å; L621-S624 WeakPolarHBondContact CA-OG 3.27Å; L621-S624 PolarHBondContact O-N 3.18Å; L621-S624 VanDerWaalsContact O-N 3.08Å; L621-S624 PolarHBondContact O-OG 3.3Å; L621-S624 VanDerWaalsContact O-OG 3.1Å; S624-F626 VanDerWaalsContact C-N 3.28Å; S624-F626 PolarHBondContact O-N 2.75Å; S624-L627 PolarHBondContact O-N 2.68Å
625	E	39.7	Very low	42.1	Very low	112 Å²	112	107.7 Å²	107.7	52%	0.523	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-68.8	-29.2	176.1	-69.2	156.9	-159.2	0	0	111.7	L621 L627 S629	L621-E625 PolarHBondContact O-N 3.08Å; L621-E625 VanDerWaalsContact O-N 3.09Å; E625-L627 VanDerWaalsContact C-N 3.3Å; E625-L627 PolarHBondContact O-N 2.63Å; E625-S629 PolarHBondContact O-OG 2.96Å
626	F	34.6	Very low	40.7	Very low	122 Å²	122	108.9 Å²	108.9	54%	0.535	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-80	-3.1	175.1	-149.2	-89.6	0	0	0	114.2	S624 D630	S624-F626 VanDerWaalsContact C-N 3.28Å; S624-F626 PolarHBondContact O-N 2.75Å; F626-D630 WeakPolarHBondContact CE1-OD2 3.27Å
627	L	35.5	Very low	40	Very low	144 Å²	144	114.7 Å²	114.7	75%	0.754	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-114.2	7.6	-179.8	-73.1	174.6	0	0	0	113.8	R623 S624 E625	R623-L627 WeakPolarHBondContact O-CD1 3.48Å; R623-L627 WeakPolarHBondContact O-CG 3.17Å; S624-L627 PolarHBondContact O-N 2.68Å; E625-L627 VanDerWaalsContact C-N 3.3Å; E625-L627 PolarHBondContact O-N 2.63Å
628	T	37.9	Very low	39.1	Very low	97 Å²	97	117.1 Å²	117.1	60%	0.595	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-7.7	169.9	50.1	0	0	0	0	113.5
629	S	33.6	Very low	37.7	Very low	70 Å²	70	113.3 Å²	113.3	49%	0.49	61%	0.613	S	S	.	*	S	Bend	trans	-107.2	-32.8	-172.2	43.3	0	0	0	0	114.4	E625 R631	E625-S629 PolarHBondContact O-OG 2.96Å; S629-R631 VanDerWaalsContact C-N 3.29Å; S629-R631 PolarHBondContact O-N 2.75Å
630	D	29.9	Very low	36.6	Very low	127 Å²	127	112 Å²	112	68%	0.679	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	61	-168.4	-132.7	11.9	0	0	0	113.5	F626	F626-D630 WeakPolarHBondContact CE1-OD2 3.27Å
631	R	30.1	Very low	35.7	Very low	247 Å²	247	118 Å²	118	93%	0.932	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.7	16.8	169	-136.8	-176.5	-175.3	-163.2	-0.3	117.5	S629	S629-R631 VanDerWaalsContact C-N 3.29Å; S629-R631 PolarHBondContact O-N 2.75Å
632	S	27.6	Very low	35.1	Very low	116 Å²	116	121.4 Å²	121.4	81%	0.811	68%	0.68	S	S	*	*	S	Bend	trans	-159.7	107.6	168	52.5	0	0	0	0	111
633	G	28.8	Very low	34.4	Very low	78 Å²	78	121.4 Å²	121.4	80%	0.804	69%	0.689	S	S	*	*			trans	174.7	21.8	-176.3	0	0	0	0	0	120.7
634	V	31	Very low	33.8	Very low	134 Å²	134	121.2 Å²	121.2	81%	0.812	70%	0.699	S	S	*	*			trans	-139.9	142.7	167.3	-165	0	0	0	0	110.2
635	N	29.5	Very low	33.6	Very low	148 Å²	148	123.7 Å²	123.7	79%	0.791	72%	0.717	S	S	*	*			trans	86.3	90.4	-178.5	-54.3	-26.3	0	0	0	116.5
636	N	29.8	Very low	33.4	Very low	153 Å²	153	128.7 Å²	128.7	82%	0.818	73%	0.73	S	S	*	*			trans	-161.8	171.2	132.9	-105.7	-16	0	0	0	109.8
637	L	35	Very low	33.5	Very low	152 Å²	152	129.1 Å²	129.1	80%	0.796	74%	0.737	S	S	*	*			trans	71.8	135.4	-174.5	-54.1	163.5	0	0	0	115.7
638	D	33.7	Very low	33.5	Very low	132 Å²	132	127.3 Å²	127.3	71%	0.706	73%	0.728	S	S	*	*			cis	-161.8	-179.4	-40.3	-134	-51.8	0	0	0	110.2
639	G	33.3	Very low	33.3	Very low	54 Å²	54	130.5 Å²	130.5	56%	0.557	74%	0.736	S	S	*	*			trans	99.2	68	142.4	0	0	0	0	0	120.5
640	S	35	Very low	33.4	Very low	104 Å²	104	132.4 Å²	132.4	73%	0.727	75%	0.745	S	S	*	*			trans	80.2	153.8	137.2	82.3	0	0	0	0	122.9
641	N	34.6	Very low	33.6	Very low	149 Å²	149	133.1 Å²	133.1	80%	0.797	75%	0.754	S	S	*	*			trans	72.1	61.6	150.3	-58.1	-19	0	0	0	121.5
642	S	36.8	Very low	33.7	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	75%	0.747	S	S	*	*				16.5	152.7	110	-145.4	0	0	0	0	120.1
643	P	37.1	Very low	34.1	Very low	100 Å²	100	131.4 Å²	131.4	65%	0.649	75%	0.753	S	S	*	*				-139.1	170.3	-54.5	41.1	-26.7	0	0	0	113.1
644	N	36.3	Very low	34.4	Very low	146 Å²	146	134.9 Å²	134.9	78%	0.781	75%	0.752	S	S	*	*			trans	174.4	128.9	132.1	-101.3	-54.2	0	0	0	115.7
645	S	36	Very low	34.7	Very low	101 Å²	101	135.4 Å²	135.4	71%	0.706	75%	0.75	S	S	*	*			trans	66	151.9	145.4	79.6	0	0	0	0	119.8
646	R	35.4	Very low	35.2	Very low	216 Å²	216	133.3 Å²	133.3	82%	0.815	75%	0.745	S	S	*	*			cis	-170.8	146.4	-14.2	-112.6	175.1	-178.8	-164.4	2.9	108.6
647	I	37.5	Very low	35.4	Very low	131 Å²	131	133 Å²	133	67%	0.672	74%	0.742	S	S	*	*			trans	65.3	142.1	139.8	-67.8	172.6	0	0	0	118.3
648	N	35.1	Very low	35.5	Very low	106 Å²	106	132.4 Å²	132.4	57%	0.567	74%	0.739	S	S	*	*			cis	-167.9	145.8	-14.9	-105.7	0.1	0	0	0	110.5
649	Q	34.3	Very low	35.7	Very low	165 Å²	165	131.5 Å²	131.5	77%	0.771	73%	0.73	S	S	*	*			trans	58.4	170	138	-53	163.7	-17.6	0	0	118.1
650	T	34	Very low	35.8	Very low	110 Å²	110	138.5 Å²	138.5	68%	0.675	74%	0.74	S	S	*	*			cis	-145.3	140.4	11	45.5	0	0	0	0	113.5
651	T	33.8	Very low	35.9	Very low	141 Å²	141	139 Å²	139	87%	0.865	74%	0.739	S	S	*	*			trans	51	132.6	142.1	62.2	0	0	0	0	123.9
652	G	32.8	Very low	35.9	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	74%	0.738	S	S	*	*			trans	172.3	101.2	153.8	0	0	0	0	0	119.6
653	R	37.3	Very low	35.7	Very low	253 Å²	253	134.5 Å²	134.5	96%	0.955	73%	0.725	S	S	*	*			trans	66.7	165.9	163.5	-73.3	-173.7	172.3	-174.2	-2.4	119.5
654	I	34.8	Very low	35.4	Very low	151 Å²	151	135 Å²	135	77%	0.774	73%	0.731	S	S	*	*			trans	-151.7	156.8	-151.7	-78.7	172	0	0	0	110.3
655	N	37.2	Very low	35.5	Very low	145 Å²	145	131.1 Å²	131.1	78%	0.775	71%	0.713	S	S	*	*			trans	73.7	151.4	168.8	-76.1	-9.1	0	0	0	118.7
656	P	39	Very low	35.4	Very low	104 Å²	104	132.2 Å²	132.2	68%	0.675	72%	0.715	S	S	*	*			cis	-133.5	168.3	-23	36.8	-19.2	0	0	0	115.1
657	L	35.6	Very low	35.4	Very low	146 Å²	146	125 Å²	125	76%	0.764	70%	0.695	S	S	*	*				24.2	162.8	128.5	-44.5	165.4	0	0	0	119.6
658	L	36.4	Very low	35.2	Very low	139 Å²	139	125.6 Å²	125.6	73%	0.728	70%	0.7	S	S	*	*			cis	-175.8	146.2	34.5	-158.4	119.2	0	0	0	106.1
659	E	37	Very low	35	Very low	113 Å²	113	128.3 Å²	128.3	53%	0.528	71%	0.711	S	S	.	*			cis	-162.3	151.6	-12.1	-118.7	-178.2	152.7	0	0	110.2
660	R	35.8	Very low	35.2	Very low	202 Å²	202	124.3 Å²	124.3	76%	0.762	71%	0.706	S	S	*	*				59.8	147.4	103.2	-82	-169.6	174.7	123.6	-3.6	119.3
661	T	36.3	Very low	35.2	Very low	114 Å²	114	125.1 Å²	125.1	70%	0.699	71%	0.713	S	S	*	*			cis	-175.8	162.5	-29.6	20.3	0	0	0	0	110
662	A	35.8	Very low	35.2	Very low	93 Å²	93	123.8 Å²	123.8	77%	0.769	71%	0.705	S	S	*	*			trans	68.5	168.7	145.2	0	0	0	0	0	117.3
663	S	32.4	Very low	35.4	Very low	73 Å²	73	128.3 Å²	128.3	51%	0.51	71%	0.71	S	S	.	*			cis	-121.7	147.9	2.3	-76.2	0	0	0	0	113.9	D173	D173-S663 PolarHBondContact OD2-OG 2.88Å
664	S	31.1	Very low	35.3	Very low	111 Å²	111	124.2 Å²	124.2	78%	0.776	69%	0.694	S	S	*	*			trans	-159.7	97.1	155.7	-75.2	0	0	0	0	106.7	V666	S664-V666 PolarHBondContact O-N 3.42Å
665	P	37.3	Very low	35.2	Very low	65 Å²	65	123 Å²	123	42%	0.422	70%	0.699	S	S	.	*			trans	-78	92.7	-169.3	30.4	-36	0	0	0	112	D173 Q175 V667	D173-P665 WeakPolarHBondContact OD1-CD 3.22Å; D173-P665 WeakPolarHBondContact OD1-CG 3.34Å; Q175-P665 HydrophobicContact CG-CB 4.37Å; P665-V667 PolarHBondContact O-N 2.86Å
666	V	33.6	Very low	35.1	Very low	123 Å²	123	122 Å²	122	75%	0.745	69%	0.69	S	S	*	*			trans	-68.4	112.7	163.5	176.5	0	0	0	0	108.6	S664	S664-V666 PolarHBondContact O-N 3.42Å
667	V	36.3	Very low	34.7	Very low	64 Å²	64	123.1 Å²	123.1	39%	0.388	70%	0.695	S	S	.	*			trans	-90.2	117.5	169.3	-153.9	0	0	0	0	108.4	Q175 P665 M669	Q175-V667 HydrophobicContact CG-CG2 3.78Å; P665-V667 PolarHBondContact O-N 2.86Å; V667-M669 PolarHBondContact O-N 3.11Å
668	N	33.2	Very low	34.6	Very low	145 Å²	145	122.3 Å²	122.3	78%	0.775	70%	0.695	S	S	*	*			trans	-68.5	130.7	169.4	-75.1	-12.9	0	0	0	109.8
669	M	32	Very low	34.6	Very low	163 Å²	163	121 Å²	121	80%	0.803	70%	0.695	S	S	*	*			trans	-125.4	116.1	145.2	-71.1	-160	176.6	0	0	108.9	V667	V667-M669 PolarHBondContact O-N 3.11Å
670	A	37.1	Very low	34.8	Very low	81 Å²	81	124 Å²	124	67%	0.669	71%	0.709	S	S	*	*			trans	-65.6	152	167.9	0	0	0	0	0	109.4	T672	A670-T672 PolarHBondContact O-N 2.92Å
671	P	35.3	Very low	35.9	Very low	126 Å²	126	118.6 Å²	118.6	82%	0.818	71%	0.708	S	S	*	*			trans	-65.6	93.1	-177.2	27.1	-35.2	0	0	0	111.1	I673	P671-I673 PolarHBondContact O-N 3.04Å
672	T	33.5	Very low	37.7	Very low	113 Å²	113	117.2 Å²	117.2	69%	0.693	70%	0.699	S	S	*	*			trans	-73	114.5	162.5	-56.4	0	0	0	0	106.2	A670 R674	A670-T672 PolarHBondContact O-N 2.92Å; T672-R674 HydrophobicContact CG2-CG 4.08Å; T672-R674 PolarHBondContact O-N 3.21Å
673	I	35.7	Very low	40.2	Very low	170 Å²	170	116 Å²	116	87%	0.872	68%	0.677	S	S	*	*			trans	-70.8	82.9	174.4	-56.5	174.9	0	0	0	108.3	P671	P671-I673 PolarHBondContact O-N 3.04Å
674	R	35.3	Very low	43.1	Very low	168 Å²	168	113.4 Å²	113.4	63%	0.634	66%	0.658	S	S	*	*			trans	-87	135.2	157.2	-66.8	-170.4	175.5	-176.8	-0	107.4	T672 E676	T672-R674 HydrophobicContact CG2-CG 4.08Å; T672-R674 PolarHBondContact O-N 3.21Å; R674-E676 HydrophobicContact CB-CB 4.35Å; R674-E676 HydrophobicContact CB-CG 4.02Å; R674-E676 VanDerWaalsContact CD-CD 3.5Å; R674-E676 WeakPolarHBondContact CD-OE1 3.44Å; R674-E676 IonicContact CZ-OE1 3.86Å; R674-E676 IonicContact NE-OE1 3.02Å; R674-E676 IonicContact NH1-OE1 3.29Å; R674-E676 PolarHBondContact NH1-OE1 3.45Å; R674-E676 PolarHBondContact O-N 3.43Å
675	S	32.7	Very low	46.3	Very low	124 Å²	124	108.1 Å²	108.1	87%	0.867	62%	0.621	S	S	*	*			trans	-76.7	50.2	161.7	-176.5	0	0	0	0	110.1	T677	S675-T677 PolarHBondContact O-N 3.44Å
676	E	35	Very low	49.2	Very low	126 Å²	126	105.4 Å²	105.4	59%	0.589	60%	0.603	S	S	*	*			trans	-69.8	116.5	160.6	-81.2	165.9	-169.4	0	0	105.8	R674 V678	R674-E676 HydrophobicContact CB-CB 4.35Å; R674-E676 HydrophobicContact CB-CG 4.02Å; R674-E676 VanDerWaalsContact CD-CD 3.5Å; R674-E676 WeakPolarHBondContact CD-OE1 3.44Å; R674-E676 IonicContact CZ-OE1 3.86Å; R674-E676 IonicContact NE-OE1 3.02Å; R674-E676 IonicContact NH1-OE1 3.29Å; R674-E676 PolarHBondContact NH1-OE1 3.45Å; R674-E676 PolarHBondContact O-N 3.43Å; E676-V678 PolarHBondContact O-N 3.02Å
677	T	31.4	Very low	52.3	Low	126 Å²	126	99.6 Å²	99.6	77%	0.773	57%	0.568	S	S	*	*			trans	-57.6	113.7	173.1	45.3	0	0	0	0	107.5	S675 P679	S675-T677 PolarHBondContact O-N 3.44Å; T677-P679 VanDerWaalsContact O-CD 3.29Å; T677-P679 WeakPolarHBondContact O-CD 3.43Å; T677-P679 VanDerWaalsContact O-N 3.08Å
678	V	33.8	Very low	55.2	Low	129 Å²	129	96.6 Å²	96.6	78%	0.782	55%	0.55	S	S	*	.			trans	-49.9	120.2	168.7	177.3	0	0	0	0	106.3	E676 E680	E676-V678 PolarHBondContact O-N 3.02Å; V678-E680 PolarHBondContact O-N 3.39Å
679	P	36.1	Very low	58.3	Low	111 Å²	111	90.3 Å²	90.3	72%	0.721	52%	0.515	S	S	*	.			trans	-57.4	114	175.5	-23.7	34.4	0	0	0	107.3	T677 A681	T677-P679 VanDerWaalsContact O-CD 3.29Å; T677-P679 WeakPolarHBondContact O-CD 3.43Å; T677-P679 VanDerWaalsContact O-N 3.08Å; P679-A681 PolarHBondContact O-N 2.86Å
680	E	41.9	Very low	61.4	Low	177 Å²	177	84.3 Å²	84.3	83%	0.827	49%	0.486	S	S	*	.			trans	-54.9	116.7	-176.9	-175.2	164.2	-138.3	0	0	107.5	V678 T682	V678-E680 PolarHBondContact O-N 3.39Å; E680-T682 WeakPolarHBondContact O-CA 3.49Å; E680-T682 WeakPolarHBondContact O-CG2 3.19Å; E680-T682 PolarHBondContact O-N 2.82Å
681	A	57.8	Low	64.2	Low	88 Å²	88	86 Å²	86	73%	0.727	48%	0.484	S	S	*	.			trans	-62.7	98.4	-156.4	0	0	0	0	0	110.1	P679 F683	P679-A681 PolarHBondContact O-N 2.86Å; A681-F683 PolarHBondContact O-N 3.49Å
682	T	74	Confident	67.1	Low	86 Å²	86	80.9 Å²	80.9	53%	0.528	45%	0.454	S	S	.	.			trans	-59.7	131.7	-161.9	48	0	0	0	0	110.2	E680 T684 H730	E680-T682 WeakPolarHBondContact O-CA 3.49Å; E680-T682 WeakPolarHBondContact O-CG2 3.19Å; E680-T682 PolarHBondContact O-N 2.82Å; T682-T684 PolarHBondContact O-N 3.36Å; T682-H730 PolarHBondContact N-NE2 2.84Å; T682-H730 PolarHBondContact O-CD2 3.42Å; T682-H730 PolarHBondContact O-NE2 3.3Å; T682-H730 PolarHBondContact OG1-NE2 3.39Å; T682-H730 VanDerWaalsContact OG1-NE2 3.12Å
683	F	88.7	Confident	70.1	Confident	67 Å²	67	75.5 Å²	75.5	29%	0.294	42%	0.421	S	S	.	.			trans	-78.6	70.3	-173.6	-166.7	-105.2	0	0	0	110.5	A681 G817 P820 I1061 N1062	A681-F683 PolarHBondContact O-N 3.49Å; F683-G817 WeakPolarHBondContact CE2-O 3.27Å; F683-P820 HydrophobicContact CD1-CB 4.06Å; F683-P820 HydrophobicContact CD1-CG 4.03Å; F683-P820 HydrophobicContact CE1-CB 3.58Å; F683-P820 HydrophobicContact CE1-CG 4.01Å; F683-P820 HydrophobicContact CZ-CB 4.13Å; F683-I1061 HydrophobicContact CD1-CG2 4.19Å; F683-I1061 HydrophobicContact CE1-CG2 3.9Å; F683-N1062 PolarHBondContact O-ND2 2.91Å
684	T	94.3	Very high	73	Confident	19 Å²	19	68.8 Å²	68.8	12%	0.117	39%	0.386	C	S	.	.			trans	-118.3	167.3	-173.1	-169.7	0	0	0	0	111.7	T682 K728 H730 P820 L1055	T682-T684 PolarHBondContact O-N 3.36Å; T684-K728 WeakPolarHBondContact CG2-O 3.32Å; T684-K728 PolarHBondContact OG1-O 3.4Å; T684-H730 VanDerWaalsContact CG2-CD2 3.45Å; T684-H730 WeakPolarHBondContact CG2-CD2 3.26Å; T684-P820 WeakPolarHBondContact O-CD 3.18Å; T684-L1055 WeakPolarHBondContact OG1-CD2 3.28Å
685	T	97.3	Very high	75.7	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	37%	0.369	C	S	.	.			trans	-51.1	134.6	176.1	-57.9	0	0	0	0	112	C729 H730 N821 L1054 L1055	T685-C729 CarbonylContact O-C 3.59Å; T685-C729 WeakPolarHBondContact O-CA 3.43Å; T685-C729 WeakPolarHBondContact O-CB 3.41Å; T685-H730 PolarHBondContact O-N 3.29Å; T685-N821 WeakPolarHBondContact CA-OD1 3.38Å; T685-N821 VanDerWaalsContact CB-OD1 3.31Å; T685-N821 WeakPolarHBondContact CB-OD1 3.4Å; T685-N821 WeakPolarHBondContact CG2-OD1 3.45Å; T685-N821 PolarHBondContact OG1-OD1 2.86Å; T685-L1054 HydrophobicContact CG2-CB 3.64Å; T685-L1054 HydrophobicContact CG2-CD1 4.03Å; T685-L1054 HydrophobicContact CG2-CG 4.47Å; T685-L1054 PolarHBondContact OG1-O 2.89Å; T685-L1055 PolarHBondContact OG1-N 3.46Å
686	V	98.2	Very high	78.6	Confident	8 Å²	8	56.8 Å²	56.8	5%	0.048	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.8	176.1	176.8	0	0	0	0	110.9	H730 Q732 L810 C819 N821 G822 F823	V686-H730 CarbonylContact C-O 3.59Å; V686-H730 WeakPolarHBondContact CA-O 3.44Å; V686-H730 HydrophobicContact CG2-CB 4.22Å; V686-Q732 HydrophobicContact CG1-CB 3.51Å; V686-L810 HydrophobicContact CB-CD1 3.7Å; V686-L810 HydrophobicContact CG1-CD1 3.71Å; V686-C819 HydrophobicContact CG2-CB 3.54Å; V686-N821 PolarHBondContact N-O 2.95Å; V686-G822 CarbonylContact O-C 3.6Å; V686-G822 WeakPolarHBondContact O-CA 3.17Å; V686-F823 PolarHBondContact O-N 3.41Å
687	L	98.5	Very high	81.2	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	108.9	170.6	-63.2	177.5	0	0	0	109.6	W717 L720 A726 C729 H730 H731 Q732 F823 L825 V1051	L687-W717 HydrophobicContact CB-CZ3 4.36Å; L687-W717 HydrophobicContact CD1-CZ3 4.37Å; L687-L720 HydrophobicContact CD1-CD1 4.17Å; L687-A726 HydrophobicContact CD1-CB 4.48Å; L687-C729 HydrophobicContact CD1-CB 3.7Å; L687-C729 HydrophobicContact CG-CB 3.66Å; L687-H730 PolarHBondContact N-O 2.84Å; L687-H731 PolarHBondContact O-CD2 2.99Å; L687-Q732 PolarHBondContact O-N 2.88Å; L687-F823 WeakPolarHBondContact CA-O 3.39Å; L687-F823 HydrophobicContact CD2-CB 3.96Å; L687-L825 HydrophobicContact CD2-CD1 4.48Å; L687-V1051 HydrophobicContact CD2-CG2 3.89Å
688	A	98.4	Very high	84	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	116.3	175.6	0	0	0	0	0	110.2	Q732 C806 L810 F823 A824 L825	A688-Q732 WeakPolarHBondContact CA-O 3.41Å; A688-Q732 HydrophobicContact CB-CB 4.02Å; A688-Q732 HydrophobicContact CB-CG 3.97Å; A688-C806 HydrophobicContact CB-CB 4.12Å; A688-L810 HydrophobicContact CB-CB 4.47Å; A688-L810 HydrophobicContact CB-CD2 4.14Å; A688-F823 PolarHBondContact N-O 2.84Å; A688-A824 HydrophobicContact CB-CB 4.19Å; A688-L825 PolarHBondContact O-N 3.11Å
689	Y	97.1	Very high	86.6	Confident	14 Å²	14	44.4 Å²	44.4	6%	0.055	26%	0.257	C	S	.	.			trans	-149.9	140.1	-172.1	174.3	-95.9	0	0	0	110.5	L691 L713 W717 H731 Q732 L825	Y689-L691 HydrophobicContact CE1-CD2 3.84Å; Y689-L691 HydrophobicContact CE1-CG 4.26Å; Y689-L713 HydrophobicContact CE2-CB 4.16Å; Y689-L713 HydrophobicContact CE2-CD1 4.42Å; Y689-W717 AromaticContact CD1-CD2 3.79Å; Y689-W717 HydrophobicContact CD1-CD2 3.79Å; Y689-W717 AromaticContact CD1-CE3 3.8Å; Y689-W717 HydrophobicContact CD1-CE3 3.8Å; Y689-W717 HydrophobicContact CD1-CG 4.35Å; Y689-W717 HydrophobicContact CD1-CH2 4.33Å; Y689-W717 HydrophobicContact CD1-CZ2 4.32Å; Y689-W717 HydrophobicContact CD1-CZ3 4.08Å; Y689-W717 HydrophobicContact CD2-CD2 4.25Å; Y689-W717 AromaticContact CD2-CE3 3.85Å; Y689-W717 HydrophobicContact CD2-CE3 3.85Å; Y689-W717 HydrophobicContact CE1-CB 4.44Å; Y689-W717 AromaticContact CE1-CD2 3.77Å; Y689-W717 HydrophobicContact CE1-CD2 3.77Å; Y689-W717 HydrophobicContact CE1-CE3 4.22Å; Y689-W717 AromaticContact CE1-CG 3.85Å; Y689-W717 HydrophobicContact CE1-CG 3.85Å; Y689-W717 HydrophobicContact CE2-CB 3.8Å; Y689-W717 HydrophobicContact CE2-CD2 4.2Å; Y689-W717 HydrophobicContact CE2-CE3 4.22Å; Y689-W717 HydrophobicContact CE2-CG 4.04Å; Y689-W717 HydrophobicContact CG-CD2 4.04Å; Y689-W717 AromaticContact CG-CE3 3.6Å; Y689-W717 HydrophobicContact CG-CE3 3.6Å; Y689-W717 AromaticContact CG-CZ3 3.89Å; Y689-W717 HydrophobicContact CG-CZ3 3.89Å; Y689-W717 AromaticContact CZ-CD2 3.97Å; Y689-W717 AromaticContact CZ-CG 3.66Å; Y689-H731 PolarHBondContact O-NE2 3.47Å; Y689-Q732 PolarHBondContact N-O 2.88Å; Y689-Q732 VanDerWaalsContact N-O 3.1Å; Y689-L825 HydrophobicContact CD2-CB 4.07Å
690	D	97.1	Very high	89	Confident	36 Å²	36	40.4 Å²	40.4	19%	0.193	23%	0.232	C	C	.	.			trans	-147.7	126.3	-178.6	-163	-74	0	0	0	112.5	G692 M693 G734 L802	D690-G692 PolarHBondContact O-N 3.39Å; D690-G692 WeakPolarHBondContact OD1-CA 3.38Å; D690-G692 PolarHBondContact OD1-N 2.87Å; D690-M693 HydrophobicContact CB-CE 4Å; D690-M693 WeakPolarHBondContact O-CB 3.29Å; D690-M693 WeakPolarHBondContact O-CE 3.37Å; D690-M693 PolarHBondContact O-N 3.34Å; D690-M693 VanDerWaalsContact O-N 3.14Å; D690-G734 WeakPolarHBondContact OD2-CA 3.41Å; D690-G734 PolarHBondContact OD2-N 3.29Å; D690-L802 HydrophobicContact CB-CD1 4.36Å; D690-L802 WeakPolarHBondContact OD1-CD1 3.29Å
691	L	96.4	Very high	90.9	Very high	118 Å²	118	40 Å²	40	62%	0.618	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-63.2	-23.4	-179	-66	172.2	0	0	0	113.1	Y689 M693 L694	Y689-L691 HydrophobicContact CE1-CD2 3.84Å; Y689-L691 HydrophobicContact CE1-CG 4.26Å; L691-M693 PolarHBondContact O-N 3.12Å; L691-L694 HydrophobicContact CD2-CD1 3.76Å; L691-L694 VanDerWaalsContact O-CB 3.29Å; L691-L694 WeakPolarHBondContact O-CB 3.47Å; L691-L694 WeakPolarHBondContact O-CG 3.39Å; L691-L694 PolarHBondContact O-N 2.93Å
692	G	95.6	Very high	92.3	Very high	18 Å²	18	39 Å²	39	19%	0.186	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-66.3	-15	176	0	0	0	0	0	114	D690 L694	D690-G692 PolarHBondContact O-N 3.39Å; D690-G692 WeakPolarHBondContact OD1-CA 3.38Å; D690-G692 PolarHBondContact OD1-N 2.87Å; G692-L694 VanDerWaalsContact C-N 3.31Å
693	M	97.1	Very high	92.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-74.9	-20	170.9	-66.7	-176.4	-67.2	0	0	112.9	D690 L691 A695 L713 A799 L802 A803 L825 V826 R827	D690-M693 HydrophobicContact CB-CE 4Å; D690-M693 WeakPolarHBondContact O-CB 3.29Å; D690-M693 WeakPolarHBondContact O-CE 3.37Å; D690-M693 PolarHBondContact O-N 3.34Å; D690-M693 VanDerWaalsContact O-N 3.14Å; L691-M693 PolarHBondContact O-N 3.12Å; M693-A695 VanDerWaalsContact C-N 3.3Å; M693-A695 PolarHBondContact O-N 3.35Å; M693-L713 HydrophobicContact CB-CD1 4.17Å; M693-L713 HydrophobicContact CE-CD1 3.95Å; M693-A799 HydrophobicContact CB-CB 4.48Å; M693-L802 HydrophobicContact CG-CB 3.58Å; M693-L802 HydrophobicContact CG-CD1 3.97Å; M693-L802 HydrophobicContact CG-CG 4.47Å; M693-L802 HydrophobicContact SD-CB 4.18Å; M693-A803 HydrophobicContact SD-CB 4.01Å; M693-L825 VanDerWaalsContact CE-O 3.3Å; M693-L825 WeakPolarHBondContact CE-O 3.43Å; M693-V826 HydrophobicContact CE-CB 4.31Å; M693-V826 HydrophobicContact CE-CG1 4.02Å; M693-V826 HydrophobicContact SD-CB 3.81Å; M693-V826 HydrophobicContact SD-CG1 3.83Å; M693-R827 HydrophobicContact CB-CG 4.14Å; M693-R827 PolarHBondContact O-NH1 2.69Å
694	L	95.7	Very high	92.7	Very high	29 Å²	29	38.1 Å²	38.1	15%	0.152	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-30.9	176.7	-55.2	-178.8	0	0	0	111.6	L691 G692 H696 H697 P710 L713 I714	L691-L694 HydrophobicContact CD2-CD1 3.76Å; L691-L694 VanDerWaalsContact O-CB 3.29Å; L691-L694 WeakPolarHBondContact O-CB 3.47Å; L691-L694 WeakPolarHBondContact O-CG 3.39Å; L691-L694 PolarHBondContact O-N 2.93Å; G692-L694 VanDerWaalsContact C-N 3.31Å; L694-H696 PolarHBondContact O-N 2.89Å; L694-H697 PolarHBondContact O-NE2 2.85Å; L694-P710 HydrophobicContact CB-CB 4.2Å; L694-P710 HydrophobicContact CD2-CB 4.04Å; L694-P710 WeakPolarHBondContact O-CG 3.5Å; L694-L713 HydrophobicContact CD2-CB 3.81Å; L694-L713 HydrophobicContact CD2-CD1 4.46Å; L694-I714 HydrophobicContact CD1-CD1 4.3Å; L694-I714 HydrophobicContact CD1-CG1 3.97Å; L694-I714 HydrophobicContact CD2-CD1 4.45Å; L694-I714 HydrophobicContact CD2-CG1 3.92Å
695	A	92.7	Very high	92.4	Very high	32 Å²	32	41.9 Å²	41.9	26%	0.264	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.3	-178.1	0	0	0	0	0	114.8	M693 H697 H795	M693-A695 VanDerWaalsContact C-N 3.3Å; M693-A695 PolarHBondContact O-N 3.35Å; A695-H697 PolarHBondContact O-CD2 2.88Å; A695-H697 PolarHBondContact O-N 2.99Å; A695-H795 HydrophobicContact CB-CB 4.1Å; A695-H795 WeakPolarHBondContact O-CB 3.46Å
696	H	93.2	Very high	92.1	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.037	25%	0.248	C	C	.	.			trans	-75.9	90.1	170.3	174.9	17.4	0	0	0	111	L694 A789 T796 A799 R827	L694-H696 PolarHBondContact O-N 2.89Å; H696-A789 PolarHBondContact CE1-O 3.2Å; H696-A789 VanDerWaalsContact CE1-O 3.23Å; H696-T796 PolarHBondContact CE1-OG1 3.08Å; H696-T796 PolarHBondContact ND1-OG1 2.92Å; H696-A799 HydrophobicContact CB-CB 3.58Å; H696-R827 VanDerWaalsContact O-CZ 3.28Å; H696-R827 PolarHBondContact O-NH1 3.38Å; H696-R827 PolarHBondContact O-NH2 3.5Å
697	H	90.8	Very high	91.9	Very high	70 Å²	70	45 Å²	45	32%	0.324	26%	0.262	S	S	.	.			trans	-98.7	171.1	164.7	-57.5	-93.5	0	0	0	110.5	L694 A695 D703	L694-H697 PolarHBondContact O-NE2 2.85Å; A695-H697 PolarHBondContact O-CD2 2.88Å; A695-H697 PolarHBondContact O-N 2.99Å; H697-D703 IonicContact CE1-OD2 3.51Å; H697-D703 PolarHBondContact CE1-OD2 2.8Å; H697-D703 VanDerWaalsContact CE1-OD2 3.29Å; H697-D703 IonicContact CG-OD1 3.19Å; H697-D703 IonicContact CG-OD2 3.34Å; H697-D703 VanDerWaalsContact ND1-CG 3.32Å; H697-D703 IonicContact ND1-OD1 2.75Å; H697-D703 PolarHBondContact ND1-OD1 3.43Å; H697-D703 VanDerWaalsContact ND1-OD1 3.12Å; H697-D703 IonicContact ND1-OD2 3.48Å; H697-D703 PolarHBondContact ND1-OD2 3.22Å
698	C	90.2	Very high	91.7	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.034	26%	0.264	C	S	.	.			trans	-78	147.4	160.5	-176.8	0	0	0	0	110.4	C700 Q701 H706 A789	C698-C700 PolarHBondContact O-N 3.39Å; C698-Q701 PolarHBondContact O-N 2.75Å; C698-H706 WeakPolarHBondContact CB-NE2 3.26Å; C698-H706 PolarHBondContact SG-NE2 3.43Å; C698-A789 HydrophobicContact CB-CB 3.87Å
699	T	87.5	Confident	91.6	Very high	45 Å²	45	46.7 Å²	46.7	28%	0.276	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-10.1	178.2	-52	0	0	0	0	113.1	Q701 W790	T699-Q701 VanDerWaalsContact C-N 3.34Å; T699-W790 PolarHBondContact OG1-O 2.99Å
700	C	87.4	Confident	91.5	Very high	28 Å²	28	46.2 Å²	46.2	19%	0.189	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-15.6	172.1	69	0	0	0	0	114.5	C698 T702 C779	C698-C700 PolarHBondContact O-N 3.39Å; C700-T702 PolarHBondContact O-N 2.96Å; C700-T702 VanDerWaalsContact O-N 3.13Å; C700-T702 PolarHBondContact SG-N 3.25Å; C700-C779 HydrophobicContact CB-CB 4.02Å; C700-C779 VanDerWaalsContact CB-O 3.28Å; C700-C779 WeakPolarHBondContact CB-O 3.32Å
701	Q	81.3	Confident	91.5	Very high	167 Å²	167	48.3 Å²	48.3	78%	0.78	28%	0.277	S	S	*	.	S	Bend	trans	60.6	11.3	-176.7	-54.9	-179.6	-7.5	0	0	115.7	C698 T699	C698-Q701 PolarHBondContact O-N 2.75Å; T699-Q701 VanDerWaalsContact C-N 3.34Å
702	T	87.5	Confident	91.6	Very high	68 Å²	68	42.7 Å²	42.7	42%	0.417	25%	0.248	S	C	.	.			trans	-109.9	83.4	171.4	-50.2	0	0	0	0	109.9	C700 A704 N705	C700-T702 PolarHBondContact O-N 2.96Å; C700-T702 VanDerWaalsContact O-N 3.13Å; C700-T702 PolarHBondContact SG-N 3.25Å; T702-A704 PolarHBondContact O-N 3.03Å; T702-N705 WeakPolarHBondContact CG2-ND2 3.37Å; T702-N705 WeakPolarHBondContact O-CB 3.35Å; T702-N705 PolarHBondContact O-N 2.96Å; T702-N705 VanDerWaalsContact O-N 3.09Å
703	D	84.9	Confident	91.7	Very high	40 Å²	40	41.9 Å²	41.9	21%	0.214	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-58.2	-31	-178	-75.2	-18.7	0	0	0	113.3	H697 N705 H706 N709	H697-D703 IonicContact CE1-OD2 3.51Å; H697-D703 PolarHBondContact CE1-OD2 2.8Å; H697-D703 VanDerWaalsContact CE1-OD2 3.29Å; H697-D703 IonicContact CG-OD1 3.19Å; H697-D703 IonicContact CG-OD2 3.34Å; H697-D703 VanDerWaalsContact ND1-CG 3.32Å; H697-D703 IonicContact ND1-OD1 2.75Å; H697-D703 PolarHBondContact ND1-OD1 3.43Å; H697-D703 VanDerWaalsContact ND1-OD1 3.12Å; H697-D703 IonicContact ND1-OD2 3.48Å; H697-D703 PolarHBondContact ND1-OD2 3.22Å; D703-N705 PolarHBondContact O-N 2.73Å; D703-H706 PolarHBondContact O-N 2.97Å; D703-H706 VanDerWaalsContact O-O 3.1Å; D703-N709 HydrophobicContact CB-CB 4.06Å
704	A	86.5	Confident	91.7	Very high	95 Å²	95	44.1 Å²	44.1	79%	0.785	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-60.5	-16.2	176.7	0	0	0	0	0	114.4	T702 H706	T702-A704 PolarHBondContact O-N 3.03Å; A704-H706 VanDerWaalsContact C-N 3.3Å
705	N	86.4	Confident	91.8	Very high	98 Å²	98	43.5 Å²	43.5	52%	0.524	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-85	0.3	174.2	-65.5	-23.7	0	0	0	113.2	T702 D703 C779	T702-N705 WeakPolarHBondContact CG2-ND2 3.37Å; T702-N705 WeakPolarHBondContact O-CB 3.35Å; T702-N705 PolarHBondContact O-N 2.96Å; T702-N705 VanDerWaalsContact O-N 3.09Å; D703-N705 PolarHBondContact O-N 2.73Å; N705-C779 HydrophobicContact CB-CB 4.42Å
706	H	91	Very high	92.1	Very high	21 Å²	21	42.1 Å²	42.1	10%	0.097	24%	0.237	C	C	.	.			trans	-130.2	120.7	-174.1	-67.2	-76.5	0	0	0	110.8	C698 D703 A704 N709 C779	C698-H706 WeakPolarHBondContact CB-NE2 3.26Å; C698-H706 PolarHBondContact SG-NE2 3.43Å; D703-H706 PolarHBondContact O-N 2.97Å; D703-H706 VanDerWaalsContact O-O 3.1Å; A704-H706 VanDerWaalsContact C-N 3.3Å; H706-N709 WeakPolarHBondContact O-CB 3.45Å; H706-N709 PolarHBondContact O-ND2 3.21Å; H706-C779 VanDerWaalsContact CE1-SG 3.58Å; H706-C779 PolarHBondContact NE2-SG 2.9Å
707	P	94	Very high	92.3	Very high	53 Å²	53	43.7 Å²	43.7	34%	0.344	24%	0.243	S	C	.	.	S	Bend	trans	-60.2	-45.8	175.3	-25	35.1	0	0	0	112.3	N709 F841 L1003 Y1038	P707-N709 PolarHBondContact O-N 3.15Å; P707-N709 VanDerWaalsContact O-N 3.14Å; P707-N709 PolarHBondContact O-ND2 3.32Å; P707-F841 HydrophobicContact CB-CZ 4.49Å; P707-L1003 HydrophobicContact CB-CD2 4.19Å; P707-L1003 HydrophobicContact CG-CD2 4.37Å; P707-Y1038 HydrophobicContact CB-CD1 3.66Å; P707-Y1038 HydrophobicContact CB-CE1 4.24Å; P707-Y1038 HydrophobicContact CB-CG 3.91Å; P707-Y1038 WeakPolarHBondContact O-CD1 3.34Å
708	E	95.5	Very high	92.6	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.056	25%	0.248	C	C	.	.	S	Bend	trans	-79.5	94.9	171.9	-147.4	-55.1	108.6	0	0	109.9	R712 R827 P829 F841 Y1038	E708-R712 WeakPolarHBondContact OE1-CD 3.34Å; E708-R712 IonicContact OE1-CZ 2.69Å; E708-R712 IonicContact OE1-NE 3.31Å; E708-R712 IonicContact OE1-NH1 2.8Å; E708-R712 PolarHBondContact OE1-NH1 2.97Å; E708-R827 IonicContact OE1-CZ 3.89Å; E708-R827 IonicContact OE1-NE 3.16Å; E708-R827 PolarHBondContact OE1-NE 3.29Å; E708-R827 IonicContact OE1-NH2 3.92Å; E708-R827 IonicContact OE2-CZ 2.81Å; E708-R827 IonicContact OE2-NE 2.85Å; E708-R827 PolarHBondContact OE2-NE 3.43Å; E708-R827 IonicContact OE2-NH2 3.48Å; E708-R827 PolarHBondContact OE2-NH2 2.97Å; E708-P829 HydrophobicContact CG-CG 4.3Å; E708-F841 HydrophobicContact CB-CB 3.95Å; E708-F841 HydrophobicContact CB-CD1 3.74Å; E708-F841 HydrophobicContact CB-CD2 4.08Å; E708-F841 HydrophobicContact CB-CE1 4.26Å; E708-F841 HydrophobicContact CB-CG 3.64Å; E708-F841 HydrophobicContact CG-CB 3.9Å; E708-F841 HydrophobicContact CG-CD2 4.46Å; E708-F841 HydrophobicContact CG-CG 4.09Å; E708-Y1038 HydrophobicContact CB-CE1 4.26Å; E708-Y1038 HydrophobicContact CG-CE1 4.44Å
709	N	95	Very high	93	Very high	23 Å²	23	47.1 Å²	47.1	12%	0.123	26%	0.256	C	S	.	.	S	Bend	trans	-140.1	166.7	-179.8	74.8	64.9	0	0	0	111.8	D703 H706 P707 Q711 R712 R827	D703-N709 HydrophobicContact CB-CB 4.06Å; H706-N709 WeakPolarHBondContact O-CB 3.45Å; H706-N709 PolarHBondContact O-ND2 3.21Å; P707-N709 PolarHBondContact O-N 3.15Å; P707-N709 VanDerWaalsContact O-N 3.14Å; P707-N709 PolarHBondContact O-ND2 3.32Å; N709-Q711 PolarHBondContact O-N 3.28Å; N709-Q711 WeakPolarHBondContact OD1-CB 3.47Å; N709-Q711 PolarHBondContact OD1-N 3.27Å; N709-R712 WeakPolarHBondContact O-CB 3.49Å; N709-R712 WeakPolarHBondContact O-CG 3.3Å; N709-R712 PolarHBondContact O-N 3.14Å; N709-R827 PolarHBondContact O-NE 2.98Å
710	P	96.2	Very high	93.5	Very high	4 Å²	4	45 Å²	45	3%	0.026	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.4	-174.1	-22.8	33.9	0	0	0	115.3	L694 R712 L713 I714	L694-P710 HydrophobicContact CB-CB 4.2Å; L694-P710 HydrophobicContact CD2-CB 4.04Å; L694-P710 WeakPolarHBondContact O-CG 3.5Å; P710-R712 PolarHBondContact O-N 3.45Å; P710-L713 PolarHBondContact O-N 3.4Å; P710-L713 VanDerWaalsContact O-N 3.13Å; P710-I714 HydrophobicContact CB-CD1 4.39Å; P710-I714 WeakPolarHBondContact O-CG1 3.5Å; P710-I714 PolarHBondContact O-N 3.01Å
711	Q	96.3	Very high	94	Very high	81 Å²	81	48.9 Å²	48.9	38%	0.379	26%	0.258	S	S	.	.	H	α-helix	trans	-61.2	-27.9	-178	-169.1	57	46.9	0	0	111.8	N709 L713 I714 S715 M1040	N709-Q711 PolarHBondContact O-N 3.28Å; N709-Q711 WeakPolarHBondContact OD1-CB 3.47Å; N709-Q711 PolarHBondContact OD1-N 3.27Å; Q711-L713 PolarHBondContact O-N 3.46Å; Q711-I714 PolarHBondContact O-N 3.15Å; Q711-S715 PolarHBondContact NE2-OG 3.28Å; Q711-S715 WeakPolarHBondContact O-CB 3.2Å; Q711-S715 PolarHBondContact O-N 2.85Å; Q711-S715 PolarHBondContact O-OG 2.95Å; Q711-M1040 HydrophobicContact CB-SD 4.21Å; Q711-M1040 HydrophobicContact CG-SD 3.82Å
712	R	98.1	Very high	94.8	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-47.8	-55.4	171	-66.3	177.1	72.3	-125.6	-5.7	111.9	E708 N709 P710 I716 E1035 G1036 G1037 M1040 L1043	E708-R712 WeakPolarHBondContact OE1-CD 3.34Å; E708-R712 IonicContact OE1-CZ 2.69Å; E708-R712 IonicContact OE1-NE 3.31Å; E708-R712 IonicContact OE1-NH1 2.8Å; E708-R712 PolarHBondContact OE1-NH1 2.97Å; N709-R712 WeakPolarHBondContact O-CB 3.49Å; N709-R712 WeakPolarHBondContact O-CG 3.3Å; N709-R712 PolarHBondContact O-N 3.14Å; P710-R712 PolarHBondContact O-N 3.45Å; R712-I716 WeakPolarHBondContact O-CD1 3.48Å; R712-I716 VanDerWaalsContact O-CG1 3.24Å; R712-I716 WeakPolarHBondContact O-CG1 3.45Å; R712-I716 PolarHBondContact O-N 3.16Å; R712-E1035 PolarHBondContact NH1-O 3.37Å; R712-E1035 PolarHBondContact NH2-O 3.16Å; R712-G1036 VanDerWaalsContact NH2-C 3.26Å; R712-G1036 PolarHBondContact NH2-O 3.16Å; R712-G1037 PolarHBondContact NE-O 3.3Å; R712-G1037 PolarHBondContact NH2-O 2.87Å; R712-M1040 HydrophobicContact CG-CE 3.8Å; R712-L1043 HydrophobicContact CB-CD2 3.78Å; R712-L1043 HydrophobicContact CG-CD2 3.94Å
713	L	97.6	Very high	95.2	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-76.2	-28.8	-179.4	-75.2	-162.4	0	0	0	113.6	Y689 M693 L694 P710 Q711 I716 W717 L825 R827 L1034	Y689-L713 HydrophobicContact CE2-CB 4.16Å; Y689-L713 HydrophobicContact CE2-CD1 4.42Å; M693-L713 HydrophobicContact CB-CD1 4.17Å; M693-L713 HydrophobicContact CE-CD1 3.95Å; L694-L713 HydrophobicContact CD2-CB 3.81Å; L694-L713 HydrophobicContact CD2-CD1 4.46Å; P710-L713 PolarHBondContact O-N 3.4Å; P710-L713 VanDerWaalsContact O-N 3.13Å; Q711-L713 PolarHBondContact O-N 3.46Å; L713-I716 HydrophobicContact CD2-CD1 4.45Å; L713-W717 WeakPolarHBondContact O-CB 3.44Å; L713-W717 PolarHBondContact O-N 3.34Å; L713-W717 VanDerWaalsContact O-N 3.15Å; L713-L825 WeakPolarHBondContact CD1-O 3.4Å; L713-L825 HydrophobicContact CD2-CB 4.26Å; L713-L825 WeakPolarHBondContact CD2-O 3.46Å; L713-R827 HydrophobicContact CD1-CB 4.33Å; L713-R827 HydrophobicContact CD1-CG 3.68Å; L713-R827 HydrophobicContact CG-CB 4.42Å; L713-R827 HydrophobicContact CG-CG 3.97Å; L713-L1034 HydrophobicContact CD2-CD2 3.67Å
714	I	97.4	Very high	95.8	Very high	46 Å²	46	46.9 Å²	46.9	24%	0.236	26%	0.256	C	S	.	.	H	α-helix	trans	-68.4	-50.2	177.9	-64	168	0	0	0	109.9	L694 P710 Q711 I716 W717 Q718	L694-I714 HydrophobicContact CD1-CD1 4.3Å; L694-I714 HydrophobicContact CD1-CG1 3.97Å; L694-I714 HydrophobicContact CD2-CD1 4.45Å; L694-I714 HydrophobicContact CD2-CG1 3.92Å; P710-I714 HydrophobicContact CB-CD1 4.39Å; P710-I714 WeakPolarHBondContact O-CG1 3.5Å; P710-I714 PolarHBondContact O-N 3.01Å; Q711-I714 PolarHBondContact O-N 3.15Å; I714-I716 PolarHBondContact O-N 3.47Å; I714-W717 PolarHBondContact O-N 2.64Å; I714-Q718 HydrophobicContact CG2-CG 4.47Å; I714-Q718 WeakPolarHBondContact O-CB 3.38Å; I714-Q718 VanDerWaalsContact O-CG 3.29Å; I714-Q718 WeakPolarHBondContact O-CG 3.29Å; I714-Q718 PolarHBondContact O-N 2.83Å
715	S	98	Very high	96.3	Very high	17 Å²	17	42.6 Å²	42.6	12%	0.119	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-47.5	179.1	-57.3	0	0	0	0	111.8	Q711 W717 Q718 R719 M1040 C1044	Q711-S715 PolarHBondContact NE2-OG 3.28Å; Q711-S715 WeakPolarHBondContact O-CB 3.2Å; Q711-S715 PolarHBondContact O-N 2.85Å; Q711-S715 PolarHBondContact O-OG 2.95Å; S715-W717 PolarHBondContact O-N 2.99Å; S715-Q718 PolarHBondContact O-N 3.08Å; S715-R719 PolarHBondContact O-N 2.8Å; S715-M1040 PolarHBondContact OG-SD 3.45Å; S715-C1044 VanDerWaalsContact CB-SG 3.54Å
716	I	98.4	Very high	96.8	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-56.9	-52.4	177.1	-70.7	167	0	0	0	110.9	R712 L713 I714 Q718 R719 L720 L825 L1034 L1043 T1047	R712-I716 WeakPolarHBondContact O-CD1 3.48Å; R712-I716 VanDerWaalsContact O-CG1 3.24Å; R712-I716 WeakPolarHBondContact O-CG1 3.45Å; R712-I716 PolarHBondContact O-N 3.16Å; L713-I716 HydrophobicContact CD2-CD1 4.45Å; I714-I716 PolarHBondContact O-N 3.47Å; I716-Q718 VanDerWaalsContact C-N 3.33Å; I716-Q718 PolarHBondContact O-N 3.41Å; I716-R719 PolarHBondContact O-N 3Å; I716-L720 HydrophobicContact CG2-CD1 3.9Å; I716-L720 HydrophobicContact CG2-CG 4.38Å; I716-L720 WeakPolarHBondContact O-CG 3.35Å; I716-L720 PolarHBondContact O-N 3.11Å; I716-L825 HydrophobicContact CG2-CD1 3.93Å; I716-L825 HydrophobicContact CG2-CD2 4.1Å; I716-L1034 HydrophobicContact CD1-CD2 3.72Å; I716-L1043 HydrophobicContact CD1-CD1 3.88Å; I716-L1043 HydrophobicContact CD1-CD2 4.13Å; I716-L1043 HydrophobicContact CD1-CG 3.81Å; I716-L1043 HydrophobicContact CG1-CD2 4.41Å; I716-L1043 HydrophobicContact CG1-CG 3.97Å; I716-T1047 HydrophobicContact CG2-CG2 3.65Å
717	W	98	Very high	97	Very high	42 Å²	42	42.3 Å²	42.3	16%	0.159	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-41.2	-175	-170.9	-101.3	0	0	0	111.3	L687 Y689 L713 I714 S715 R719 L720 Q721 H731 L825	L687-W717 HydrophobicContact CB-CZ3 4.36Å; L687-W717 HydrophobicContact CD1-CZ3 4.37Å; Y689-W717 AromaticContact CD1-CD2 3.79Å; Y689-W717 HydrophobicContact CD1-CD2 3.79Å; Y689-W717 AromaticContact CD1-CE3 3.8Å; Y689-W717 HydrophobicContact CD1-CE3 3.8Å; Y689-W717 HydrophobicContact CD1-CG 4.35Å; Y689-W717 HydrophobicContact CD1-CH2 4.33Å; Y689-W717 HydrophobicContact CD1-CZ2 4.32Å; Y689-W717 HydrophobicContact CD1-CZ3 4.08Å; Y689-W717 HydrophobicContact CD2-CD2 4.25Å; Y689-W717 AromaticContact CD2-CE3 3.85Å; Y689-W717 HydrophobicContact CD2-CE3 3.85Å; Y689-W717 HydrophobicContact CE1-CB 4.44Å; Y689-W717 AromaticContact CE1-CD2 3.77Å; Y689-W717 HydrophobicContact CE1-CD2 3.77Å; Y689-W717 HydrophobicContact CE1-CE3 4.22Å; Y689-W717 AromaticContact CE1-CG 3.85Å; Y689-W717 HydrophobicContact CE1-CG 3.85Å; Y689-W717 HydrophobicContact CE2-CB 3.8Å; Y689-W717 HydrophobicContact CE2-CD2 4.2Å; Y689-W717 HydrophobicContact CE2-CE3 4.22Å; Y689-W717 HydrophobicContact CE2-CG 4.04Å; Y689-W717 HydrophobicContact CG-CD2 4.04Å; Y689-W717 AromaticContact CG-CE3 3.6Å; Y689-W717 HydrophobicContact CG-CE3 3.6Å; Y689-W717 AromaticContact CG-CZ3 3.89Å; Y689-W717 HydrophobicContact CG-CZ3 3.89Å; Y689-W717 AromaticContact CZ-CD2 3.97Å; Y689-W717 AromaticContact CZ-CG 3.66Å; L713-W717 WeakPolarHBondContact O-CB 3.44Å; L713-W717 PolarHBondContact O-N 3.34Å; L713-W717 VanDerWaalsContact O-N 3.15Å; I714-W717 PolarHBondContact O-N 2.64Å; S715-W717 PolarHBondContact O-N 2.99Å; W717-R719 PolarHBondContact O-N 2.75Å; W717-L720 PolarHBondContact O-N 3.15Å; W717-Q721 VanDerWaalsContact NE1-CD 3.3Å; W717-Q721 WeakPolarHBondContact O-CB 3.39Å; W717-Q721 VanDerWaalsContact O-CG 3.31Å; W717-Q721 WeakPolarHBondContact O-CG 3.41Å; W717-Q721 PolarHBondContact O-N 3.19Å; W717-H731 AromaticContact CH2-CD2 3.73Å; W717-L825 HydrophobicContact CE3-CD1 4.06Å; W717-L825 HydrophobicContact CZ3-CD1 4.34Å
718	Q	97.9	Very high	97	Very high	94 Å²	94	43.7 Å²	43.7	44%	0.439	24%	0.235	S	C	.	.	H	α-helix	trans	-60.1	-44.3	173.1	-72.7	176.1	-6.3	0	0	112.1	I714 S715 I716 Q721 Q722	I714-Q718 HydrophobicContact CG2-CG 4.47Å; I714-Q718 WeakPolarHBondContact O-CB 3.38Å; I714-Q718 VanDerWaalsContact O-CG 3.29Å; I714-Q718 WeakPolarHBondContact O-CG 3.29Å; I714-Q718 PolarHBondContact O-N 2.83Å; S715-Q718 PolarHBondContact O-N 3.08Å; I716-Q718 VanDerWaalsContact C-N 3.33Å; I716-Q718 PolarHBondContact O-N 3.41Å; Q718-Q721 PolarHBondContact O-N 2.94Å; Q718-Q722 WeakPolarHBondContact O-CB 3.45Å; Q718-Q722 WeakPolarHBondContact O-CG 3.35Å; Q718-Q722 PolarHBondContact O-N 2.86Å
719	R	98.3	Very high	97.1	Very high	53 Å²	53	43.7 Å²	43.7	20%	0.2	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-47.5	176.3	176.1	67.3	81.9	80.3	7.7	112.1	S715 I716 W717 Q721 Q722 T723 C1044 D1045 E1048	S715-R719 PolarHBondContact O-N 2.8Å; I716-R719 PolarHBondContact O-N 3Å; W717-R719 PolarHBondContact O-N 2.75Å; R719-Q721 VanDerWaalsContact C-N 3.27Å; R719-Q721 PolarHBondContact O-N 3.45Å; R719-Q722 PolarHBondContact O-N 3.27Å; R719-T723 HydrophobicContact CG-CG2 4.4Å; R719-T723 WeakPolarHBondContact O-CB 3.36Å; R719-T723 WeakPolarHBondContact O-CG2 3.4Å; R719-T723 PolarHBondContact O-N 2.67Å; R719-T723 PolarHBondContact O-OG1 3.49Å; R719-C1044 HydrophobicContact CB-CB 4.12Å; R719-C1044 HydrophobicContact CG-CB 4.12Å; R719-D1045 IonicContact CZ-OD1 2.74Å; R719-D1045 IonicContact NH1-OD1 2.68Å; R719-D1045 PolarHBondContact NH1-OD1 2.68Å; R719-D1045 IonicContact NH2-OD1 3.08Å; R719-D1045 PolarHBondContact NH2-OD1 3.46Å; R719-E1048 IonicContact CZ-OE2 3.13Å; R719-E1048 IonicContact NH1-OE2 3.94Å; R719-E1048 PolarHBondContact NH1-OE2 2.86Å
720	L	98.2	Very high	97.1	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-65.8	-30.6	-179.3	-66.2	177.1	0	0	0	112.1	L687 I716 W717 T723 L725 A726 L825 T1047 V1051	L687-L720 HydrophobicContact CD1-CD1 4.17Å; I716-L720 HydrophobicContact CG2-CD1 3.9Å; I716-L720 HydrophobicContact CG2-CG 4.38Å; I716-L720 WeakPolarHBondContact O-CG 3.35Å; I716-L720 PolarHBondContact O-N 3.11Å; W717-L720 PolarHBondContact O-N 3.15Å; L720-T723 PolarHBondContact O-OG1 2.95Å; L720-L725 HydrophobicContact CD2-CB 4.23Å; L720-L725 HydrophobicContact CD2-CD1 4.18Å; L720-L725 PolarHBondContact O-N 3.19Å; L720-L725 VanDerWaalsContact O-N 3.12Å; L720-A726 HydrophobicContact CB-CB 4.07Å; L720-A726 WeakPolarHBondContact O-CB 3.5Å; L720-A726 PolarHBondContact O-N 3.47Å; L720-L825 HydrophobicContact CD1-CD1 3.69Å; L720-T1047 HydrophobicContact CD1-CG2 4.2Å; L720-V1051 HydrophobicContact CD1-CG2 4.28Å; L720-V1051 HydrophobicContact CD2-CB 4.18Å; L720-V1051 HydrophobicContact CD2-CG1 4.32Å; L720-V1051 HydrophobicContact CD2-CG2 4.05Å
721	Q	97.8	Very high	97.2	Very high	108 Å²	108	50.6 Å²	50.6	51%	0.505	27%	0.267	S	S	.	.	H	α-helix	trans	-70.2	-49.3	169.8	-72	-179.6	-47.2	0	0	112.2	W717 Q718 R719 T723 G724 A726	W717-Q721 VanDerWaalsContact NE1-CD 3.3Å; W717-Q721 WeakPolarHBondContact O-CB 3.39Å; W717-Q721 VanDerWaalsContact O-CG 3.31Å; W717-Q721 WeakPolarHBondContact O-CG 3.41Å; W717-Q721 PolarHBondContact O-N 3.19Å; Q718-Q721 PolarHBondContact O-N 2.94Å; R719-Q721 VanDerWaalsContact C-N 3.27Å; R719-Q721 PolarHBondContact O-N 3.45Å; Q721-T723 VanDerWaalsContact C-N 3.3Å; Q721-T723 PolarHBondContact O-N 2.85Å; Q721-G724 PolarHBondContact O-N 2.83Å; Q721-A726 HydrophobicContact CG-CB 4.17Å
722	Q	97.4	Very high	97.1	Very high	150 Å²	150	46.8 Å²	46.8	70%	0.701	25%	0.249	S	C	*	.	H	α-helix	trans	-60.9	-36.3	-178.7	-74.3	165	8	0	0	113.2	Q718 R719 G724	Q718-Q722 WeakPolarHBondContact O-CB 3.45Å; Q718-Q722 WeakPolarHBondContact O-CG 3.35Å; Q718-Q722 PolarHBondContact O-N 2.86Å; R719-Q722 PolarHBondContact O-N 3.27Å; Q722-G724 VanDerWaalsContact C-N 3.28Å
723	T	97.1	Very high	96.9	Very high	50 Å²	50	50.7 Å²	50.7	31%	0.307	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-1.9	177.5	53.8	0	0	0	0	113.7	R719 L720 Q721 L725	R719-T723 HydrophobicContact CG-CG2 4.4Å; R719-T723 WeakPolarHBondContact O-CB 3.36Å; R719-T723 WeakPolarHBondContact O-CG2 3.4Å; R719-T723 PolarHBondContact O-N 2.67Å; R719-T723 PolarHBondContact O-OG1 3.49Å; L720-T723 PolarHBondContact O-OG1 2.95Å; Q721-T723 VanDerWaalsContact C-N 3.3Å; Q721-T723 PolarHBondContact O-N 2.85Å; T723-L725 PolarHBondContact O-N 3.35Å; T723-L725 VanDerWaalsContact O-N 3.15Å
724	G	96.4	Very high	96.6	Very high	34 Å²	34	51.6 Å²	51.6	35%	0.351	28%	0.284	S	S	.	.	S	Bend	trans	70.8	-2.7	-177.2	0	0	0	0	0	115.1	Q721 Q722 A726 A727 K728	Q721-G724 PolarHBondContact O-N 2.83Å; Q722-G724 VanDerWaalsContact C-N 3.28Å; G724-A726 VanDerWaalsContact C-N 3.33Å; G724-A726 PolarHBondContact O-N 2.83Å; G724-A727 PolarHBondContact O-N 2.83Å; G724-A727 VanDerWaalsContact O-N 3.1Å; G724-K728 PolarHBondContact O-N 3.14Å
725	L	96.9	Very high	96.6	Very high	5 Å²	5	52.3 Å²	52.3	3%	0.026	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-63.6	-37.9	-178.9	-65.4	176.9	0	0	0	112.1	L720 T723 A727 K728 C729 E1048 V1051 R1052 L1055 P1072	L720-L725 HydrophobicContact CD2-CB 4.23Å; L720-L725 HydrophobicContact CD2-CD1 4.18Å; L720-L725 PolarHBondContact O-N 3.19Å; L720-L725 VanDerWaalsContact O-N 3.12Å; T723-L725 PolarHBondContact O-N 3.35Å; T723-L725 VanDerWaalsContact O-N 3.15Å; L725-A727 PolarHBondContact O-N 3.44Å; L725-K728 PolarHBondContact O-N 3.23Å; L725-C729 PolarHBondContact O-N 3.09Å; L725-E1048 HydrophobicContact CD1-CB 4.48Å; L725-E1048 HydrophobicContact CD1-CG 3.77Å; L725-V1051 HydrophobicContact CB-CG1 4.1Å; L725-V1051 HydrophobicContact CD1-CG1 4.4Å; L725-R1052 HydrophobicContact CD1-CG 3.88Å; L725-R1052 HydrophobicContact CD2-CG 4.17Å; L725-L1055 HydrophobicContact CD2-CD1 3.98Å; L725-P1072 HydrophobicContact CD2-CB 4.04Å; L725-P1072 HydrophobicContact CD2-CG 4.23Å
726	A	96.5	Very high	96.5	Very high	20 Å²	20	57.9 Å²	57.9	17%	0.165	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-59.5	-26.4	175.1	0	0	0	0	0	113.1	L687 L720 Q721 G724	L687-A726 HydrophobicContact CD1-CB 4.48Å; L720-A726 HydrophobicContact CB-CB 4.07Å; L720-A726 WeakPolarHBondContact O-CB 3.5Å; L720-A726 PolarHBondContact O-N 3.47Å; Q721-A726 HydrophobicContact CG-CB 4.17Å; G724-A726 VanDerWaalsContact C-N 3.33Å; G724-A726 PolarHBondContact O-N 2.83Å
727	A	95.3	Very high	96.5	Very high	93 Å²	93	57.8 Å²	57.8	77%	0.769	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-86.4	-10.5	176.2	0	0	0	0	0	113.7	G724 L725	G724-A727 PolarHBondContact O-N 2.83Å; G724-A727 VanDerWaalsContact O-N 3.1Å; L725-A727 PolarHBondContact O-N 3.44Å
728	K	94.9	Very high	96.3	Very high	82 Å²	82	57.7 Å²	57.7	36%	0.357	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-12.3	169.5	-66.8	-166.1	173.5	-166.8	0	112.9	T684 G724 L725 L1055 S1070	T684-K728 WeakPolarHBondContact CG2-O 3.32Å; T684-K728 PolarHBondContact OG1-O 3.4Å; G724-K728 PolarHBondContact O-N 3.14Å; L725-K728 PolarHBondContact O-N 3.23Å; K728-L1055 HydrophobicContact CB-CD1 3.89Å; K728-L1055 HydrophobicContact CB-CD2 3.98Å; K728-L1055 WeakPolarHBondContact O-CD2 3.37Å; K728-S1070 PolarHBondContact NZ-O 3.5Å; K728-S1070 PolarHBondContact NZ-OG 3Å
729	C	96.6	Very high	96.1	Very high	12 Å²	12	54 Å²	54	8%	0.081	29%	0.291	C	S	.	.	S	Bend	trans	-104.2	160.7	178.8	-63.3	0	0	0	0	111.9	T685 L687 L725	T685-C729 CarbonylContact O-C 3.59Å; T685-C729 WeakPolarHBondContact O-CA 3.43Å; T685-C729 WeakPolarHBondContact O-CB 3.41Å; L687-C729 HydrophobicContact CD1-CB 3.7Å; L687-C729 HydrophobicContact CG-CB 3.66Å; L725-C729 PolarHBondContact O-N 3.09Å
730	H	96.7	Very high	95.9	Very high	75 Å²	75	54.3 Å²	54.3	35%	0.347	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	131.8	164.5	-77.5	-54.1	0	0	0	110.7	T682 T684 T685 V686 L687	T682-H730 PolarHBondContact N-NE2 2.84Å; T682-H730 PolarHBondContact O-CD2 3.42Å; T682-H730 PolarHBondContact O-NE2 3.3Å; T682-H730 PolarHBondContact OG1-NE2 3.39Å; T682-H730 VanDerWaalsContact OG1-NE2 3.12Å; T684-H730 VanDerWaalsContact CG2-CD2 3.45Å; T684-H730 WeakPolarHBondContact CG2-CD2 3.26Å; T685-H730 PolarHBondContact O-N 3.29Å; V686-H730 CarbonylContact C-O 3.59Å; V686-H730 WeakPolarHBondContact CA-O 3.44Å; V686-H730 HydrophobicContact CG2-CB 4.22Å; L687-H730 PolarHBondContact N-O 2.84Å
731	H	97	Very high	95.8	Very high	96 Å²	96	54.7 Å²	54.7	44%	0.444	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	131.6	169.4	176.1	-117.6	0	0	0	110.7	L687 Y689 W717	L687-H731 PolarHBondContact O-CD2 2.99Å; Y689-H731 PolarHBondContact O-NE2 3.47Å; W717-H731 AromaticContact CH2-CD2 3.73Å
732	Q	95.6	Very high	95.8	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.7	168.5	166.7	173.4	-46	0	0	109.2	V686 L687 A688 Y689 C806	V686-Q732 HydrophobicContact CG1-CB 3.51Å; L687-Q732 PolarHBondContact O-N 2.88Å; A688-Q732 WeakPolarHBondContact CA-O 3.41Å; A688-Q732 HydrophobicContact CB-CB 4.02Å; A688-Q732 HydrophobicContact CB-CG 3.97Å; Y689-Q732 PolarHBondContact N-O 2.88Å; Y689-Q732 VanDerWaalsContact N-O 3.1Å; Q732-C806 PolarHBondContact NE2-O 3.2Å; Q732-C806 VanDerWaalsContact NE2-O 3.14Å
733	P	92.9	Very high	95.8	Very high	82 Å²	82	44 Å²	44	53%	0.532	25%	0.248	S	C	.	.			trans	-67.4	155.1	171.7	30.3	-35.2	0	0	0	110.6
734	G	91.9	Very high	95.8	Very high	21 Å²	21	43.7 Å²	43.7	22%	0.216	24%	0.244	C	C	.	.			trans	-80.2	157.4	179.8	0	0	0	0	0	113.5	D690 C806	D690-G734 WeakPolarHBondContact OD2-CA 3.41Å; D690-G734 PolarHBondContact OD2-N 3.29Å; G734-C806 WeakPolarHBondContact CA-SG 3.37Å
735	R	96.3	Very high	95.8	Very high	61 Å²	61	42.7 Å²	42.7	23%	0.23	23%	0.231	C	C	.	.			trans	-128.2	157.8	160.2	69.9	167.4	176.2	93.3	4.4	109.8	A737 E741 L802 G805 D809	R735-A737 PolarHBondContact O-N 2.99Å; R735-E741 IonicContact CZ-OE1 2.73Å; R735-E741 VanDerWaalsContact CZ-OE1 3.31Å; R735-E741 IonicContact CZ-OE2 2.79Å; R735-E741 VanDerWaalsContact NH1-CD 3.34Å; R735-E741 IonicContact NH1-OE1 2.72Å; R735-E741 PolarHBondContact NH1-OE1 2.84Å; R735-E741 IonicContact NH1-OE2 3.64Å; R735-E741 PolarHBondContact NH1-OE2 3.28Å; R735-E741 IonicContact NH2-OE1 3.7Å; R735-E741 PolarHBondContact NH2-OE1 2.91Å; R735-E741 IonicContact NH2-OE2 3.07Å; R735-L802 WeakPolarHBondContact O-CA 3.09Å; R735-G805 WeakPolarHBondContact O-CA 3.12Å; R735-D809 WeakPolarHBondContact CD-OD2 3.44Å; R735-D809 WeakPolarHBondContact CG-OD2 3.49Å; R735-D809 IonicContact CZ-OD1 3.93Å; R735-D809 IonicContact CZ-OD2 3.74Å; R735-D809 IonicContact NE-OD1 3.81Å; R735-D809 PolarHBondContact NE-OD1 2.75Å; R735-D809 IonicContact NE-OD2 2.81Å; R735-D809 PolarHBondContact NE-OD2 3.25Å; R735-D809 IonicContact NH2-OD1 3.79Å; R735-D809 PolarHBondContact NH2-OD1 2.73Å
736	R	97.2	Very high	95.8	Very high	134 Å²	134	42.7 Å²	42.7	51%	0.506	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-76.5	123.8	169.5	-62.4	179.2	-170.7	131.9	1.4	108.7	S738 H798 R801 L802	R736-S738 PolarHBondContact O-N 2.93Å; R736-H798 PolarHBondContact NE-CE1 3.42Å; R736-H798 VanDerWaalsContact NE-CE1 3.27Å; R736-H798 PolarHBondContact NE-ND1 3.13Å; R736-H798 PolarHBondContact NH2-CD2 3.34Å; R736-H798 VanDerWaalsContact NH2-CD2 3.34Å; R736-H798 PolarHBondContact NH2-CE1 2.77Å; R736-H798 PolarHBondContact NH2-NE2 3.44Å; R736-R801 CarbonylContact C-O 3.6Å; R736-R801 WeakPolarHBondContact CA-O 3.43Å; R736-R801 HydrophobicContact CB-CB 4.14Å; R736-R801 HydrophobicContact CG-CB 4.43Å; R736-L802 HydrophobicContact CG-CD2 4.17Å; R736-L802 HydrophobicContact CG-CG 4.39Å
737	A	97.4	Very high	95.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-51.7	137.3	165.4	0	0	0	0	0	110.1	R735 E741 L742 R801 A804	R735-A737 PolarHBondContact O-N 2.99Å; A737-E741 HydrophobicContact CB-CB 4.49Å; A737-L742 HydrophobicContact CB-CD2 3.91Å; A737-L742 HydrophobicContact CB-CG 4.42Å; A737-R801 PolarHBondContact N-O 3.08Å; A737-R801 PolarHBondContact O-NE 3.41Å; A737-R801 PolarHBondContact O-NH2 3.27Å; A737-A804 HydrophobicContact CB-CB 3.89Å
738	S	95.2	Very high	95.2	Very high	40 Å²	40	45.9 Å²	45.9	28%	0.28	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-67.8	157.9	173.3	65.9	0	0	0	0	110.7	R736 I740 E741 L742	R736-S738 PolarHBondContact O-N 2.93Å; S738-I740 PolarHBondContact O-N 2.82Å; S738-E741 VanDerWaalsContact CB-OE2 3.28Å; S738-E741 WeakPolarHBondContact CB-OE2 3.43Å; S738-E741 PolarHBondContact N-OE2 3.25Å; S738-E741 PolarHBondContact O-N 3.29Å; S738-E741 VanDerWaalsContact OG-CG 3.29Å; S738-E741 WeakPolarHBondContact OG-CG 3.39Å; S738-E741 PolarHBondContact OG-N 3.04Å; S738-E741 VanDerWaalsContact OG-N 3.15Å; S738-E741 PolarHBondContact OG-OE2 2.83Å; S738-L742 WeakPolarHBondContact O-CG 3.28Å; S738-L742 PolarHBondContact O-N 3.34Å
739	L	92.5	Very high	94.7	Very high	17 Å²	17	44.4 Å²	44.4	9%	0.089	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-27.8	175.7	-62.6	-178.8	0	0	0	111.9	I620 L742 Q743	I620-L739 HydrophobicContact CG2-CD1 4.02Å; L739-L742 HydrophobicContact CD2-CD1 4.03Å; L739-L742 PolarHBondContact O-N 2.8Å; L739-Q743 WeakPolarHBondContact O-CB 3.25Å; L739-Q743 WeakPolarHBondContact O-CG 3.2Å; L739-Q743 PolarHBondContact O-N 2.9Å
740	I	94.1	Very high	94.4	Very high	59 Å²	59	44.4 Å²	44.4	30%	0.303	22%	0.222	S	C	.	.	H	α-helix	trans	-68.6	-40.8	176.9	-60.7	173.4	0	0	0	110.9	L621 S738 Q743 L744 F883	L621-I740 HydrophobicContact CD2-CG1 4.39Å; S738-I740 PolarHBondContact O-N 2.82Å; I740-Q743 WeakPolarHBondContact O-CB 3.29Å; I740-Q743 PolarHBondContact O-N 2.92Å; I740-L744 PolarHBondContact O-N 3.47Å; I740-F883 HydrophobicContact CG2-CD1 4.31Å; I740-F883 HydrophobicContact CG2-CE1 3.84Å; I740-F883 HydrophobicContact CG2-CE2 4.21Å; I740-F883 HydrophobicContact CG2-CZ 3.77Å
741	E	97	Very high	94.1	Very high	9 Å²	9	40.9 Å²	40.9	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-64.8	-43.5	174.4	-72.8	161.7	117.5	0	0	111.6	R735 A737 S738 Q743 L744 I849	R735-E741 IonicContact CZ-OE1 2.73Å; R735-E741 VanDerWaalsContact CZ-OE1 3.31Å; R735-E741 IonicContact CZ-OE2 2.79Å; R735-E741 VanDerWaalsContact NH1-CD 3.34Å; R735-E741 IonicContact NH1-OE1 2.72Å; R735-E741 PolarHBondContact NH1-OE1 2.84Å; R735-E741 IonicContact NH1-OE2 3.64Å; R735-E741 PolarHBondContact NH1-OE2 3.28Å; R735-E741 IonicContact NH2-OE1 3.7Å; R735-E741 PolarHBondContact NH2-OE1 2.91Å; R735-E741 IonicContact NH2-OE2 3.07Å; A737-E741 HydrophobicContact CB-CB 4.49Å; S738-E741 VanDerWaalsContact CB-OE2 3.28Å; S738-E741 WeakPolarHBondContact CB-OE2 3.43Å; S738-E741 PolarHBondContact N-OE2 3.25Å; S738-E741 PolarHBondContact O-N 3.29Å; S738-E741 VanDerWaalsContact OG-CG 3.29Å; S738-E741 WeakPolarHBondContact OG-CG 3.39Å; S738-E741 PolarHBondContact OG-N 3.04Å; S738-E741 VanDerWaalsContact OG-N 3.15Å; S738-E741 PolarHBondContact OG-OE2 2.83Å; E741-Q743 PolarHBondContact O-N 3Å; E741-L744 VanDerWaalsContact O-CB 3.28Å; E741-L744 WeakPolarHBondContact O-CB 3.16Å; E741-L744 WeakPolarHBondContact O-CG 3.36Å; E741-L744 PolarHBondContact O-N 3.48Å; E741-L744 VanDerWaalsContact O-N 3.09Å; E741-I849 HydrophobicContact CB-CG2 4.28Å; E741-I849 WeakPolarHBondContact O-CG2 3.49Å
742	L	97.5	Very high	93.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.6	-33.5	173.6	-54.2	175.9	0	0	0	111.8	A737 S738 L739 L744 V745 H746 T751 R801 A804 F844 I849	A737-L742 HydrophobicContact CB-CD2 3.91Å; A737-L742 HydrophobicContact CB-CG 4.42Å; S738-L742 WeakPolarHBondContact O-CG 3.28Å; S738-L742 PolarHBondContact O-N 3.34Å; L739-L742 HydrophobicContact CD2-CD1 4.03Å; L739-L742 PolarHBondContact O-N 2.8Å; L742-L744 PolarHBondContact O-N 3.31Å; L742-V745 PolarHBondContact O-N 2.98Å; L742-H746 PolarHBondContact O-N 3.49Å; L742-T751 HydrophobicContact CB-CG2 3.56Å; L742-R801 HydrophobicContact CD1-CG 3.99Å; L742-A804 HydrophobicContact CD2-CB 4.16Å; L742-F844 HydrophobicContact CB-CE1 4.46Å; L742-F844 HydrophobicContact CD1-CD1 4.4Å; L742-F844 HydrophobicContact CD1-CD2 4.3Å; L742-F844 HydrophobicContact CD1-CE1 3.98Å; L742-F844 HydrophobicContact CD1-CE2 3.88Å; L742-F844 HydrophobicContact CD1-CZ 3.71Å; L742-F844 HydrophobicContact CD2-CB 4.19Å; L742-F844 HydrophobicContact CD2-CD1 4.01Å; L742-F844 HydrophobicContact CD2-CD2 3.97Å; L742-F844 HydrophobicContact CD2-CE1 4.42Å; L742-F844 HydrophobicContact CD2-CE2 4.39Å; L742-F844 HydrophobicContact CD2-CG 3.79Å; L742-I849 HydrophobicContact CD2-CD1 3.87Å
743	Q	96.4	Very high	93	Very high	33 Å²	33	37.9 Å²	37.9	15%	0.154	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-5.5	177.9	-76.8	165.1	9.4	0	0	114.2	L739 I740 E741 V745 H746 T751	L739-Q743 WeakPolarHBondContact O-CB 3.25Å; L739-Q743 WeakPolarHBondContact O-CG 3.2Å; L739-Q743 PolarHBondContact O-N 2.9Å; I740-Q743 WeakPolarHBondContact O-CB 3.29Å; I740-Q743 PolarHBondContact O-N 2.92Å; E741-Q743 PolarHBondContact O-N 3Å; Q743-V745 PolarHBondContact O-N 3.29Å; Q743-H746 WeakPolarHBondContact CA-O 3.39Å; Q743-T751 HydrophobicContact CG-CG2 3.96Å; Q743-T751 WeakPolarHBondContact CG-OG1 3.22Å; Q743-T751 PolarHBondContact NE2-OG1 3.2Å; Q743-T751 VanDerWaalsContact NE2-OG1 3.08Å
744	L	96.8	Very high	92.8	Very high	44 Å²	44	34.2 Å²	34.2	23%	0.23	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-19	167.4	-60.3	178.6	0	0	0	112.7	I740 E741 L742 K852 R853 F856	I740-L744 PolarHBondContact O-N 3.47Å; E741-L744 VanDerWaalsContact O-CB 3.28Å; E741-L744 WeakPolarHBondContact O-CB 3.16Å; E741-L744 WeakPolarHBondContact O-CG 3.36Å; E741-L744 PolarHBondContact O-N 3.48Å; E741-L744 VanDerWaalsContact O-N 3.09Å; L742-L744 PolarHBondContact O-N 3.31Å; L744-K852 HydrophobicContact CB-CB 3.89Å; L744-K852 HydrophobicContact CD1-CB 4.27Å; L744-R853 HydrophobicContact CD1-CB 4.25Å; L744-F856 HydrophobicContact CD1-CE2 4.44Å; L744-F856 HydrophobicContact CD2-CE2 3.99Å; L744-F856 HydrophobicContact CD2-CZ 4.43Å
745	V	97.9	Very high	92.6	Very high	13 Å²	13	33.3 Å²	33.3	8%	0.079	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.4	-43.4	-173.3	174	0	0	0	0	112.4	L742 Q743 P835 N845 A848 I849 K852 V912	L742-V745 PolarHBondContact O-N 2.98Å; Q743-V745 PolarHBondContact O-N 3.29Å; V745-P835 WeakPolarHBondContact O-CA 3.49Å; V745-P835 WeakPolarHBondContact O-CB 3.28Å; V745-N845 HydrophobicContact CG1-CB 4.42Å; V745-A848 HydrophobicContact CG1-CB 4.28Å; V745-A848 HydrophobicContact CG2-CB 4.06Å; V745-I849 HydrophobicContact CB-CG1 3.79Å; V745-I849 HydrophobicContact CG1-CG1 4.48Å; V745-I849 HydrophobicContact CG2-CB 4.25Å; V745-I849 HydrophobicContact CG2-CG1 3.57Å; V745-K852 HydrophobicContact CG2-CG 3.99Å; V745-V912 HydrophobicContact CG1-CG1 4.19Å; V745-V912 HydrophobicContact CG1-CG2 3.62Å; V745-V912 HydrophobicContact CG2-CG1 4.16Å
746	H	96.9	Very high	91.9	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.019	15%	0.15	C	C	.	.	S	Bend	trans	-112.2	148.4	-173.7	-46.1	-95.4	0	0	0	113	L742 Q743 Y750 T751 A833 E834 P835 F844 N845	L742-H746 PolarHBondContact O-N 3.49Å; Q743-H746 WeakPolarHBondContact CA-O 3.39Å; H746-Y750 HydrophobicContact CB-CD1 3.46Å; H746-Y750 VanDerWaalsContact CB-CD1 3.46Å; H746-Y750 HydrophobicContact CB-CE1 3.88Å; H746-Y750 HydrophobicContact CB-CG 4.31Å; H746-Y750 AromaticContact CG-CD1 3.91Å; H746-Y750 AromaticContact CG-CE1 3.77Å; H746-Y750 AromaticContact ND1-CE1 3.58Å; H746-T751 HydrophobicContact CB-CG2 3.75Å; H746-T751 WeakPolarHBondContact O-CG2 3.46Å; H746-A833 PolarHBondContact CE1-O 3.41Å; H746-E834 PolarHBondContact ND1-O 2.71Å; H746-P835 WeakPolarHBondContact CA-O 3.36Å; H746-F844 AromaticContact CD2-CD1 3.72Å; H746-F844 AromaticContact NE2-CD1 3.89Å; H746-N845 PolarHBondContact CE1-N 3.35Å; H746-N845 PolarHBondContact NE2-N 3.27Å
747	K	93	Very high	90.9	Very high	139 Å²	139	29.2 Å²	29.2	60%	0.604	15%	0.153	S	C	*	.			trans	-59.2	148.8	-176.4	-68.6	158	-171.8	169.7	0	112.6	V749 Y750 T751 P835	K747-V749 VanDerWaalsContact C-N 3.33Å; K747-V749 PolarHBondContact O-N 3.16Å; K747-Y750 WeakPolarHBondContact O-CB 3.33Å; K747-Y750 PolarHBondContact O-N 3.02Å; K747-T751 PolarHBondContact O-N 3.48Å; K747-T751 PolarHBondContact O-OG1 2.7Å; K747-P835 WeakPolarHBondContact CB-O 3.43Å; K747-P835 WeakPolarHBondContact CD-O 3.37Å; K747-P835 WeakPolarHBondContact CG-O 3.29Å; K747-P835 PolarHBondContact N-O 2.65Å
748	D	86.4	Confident	89.6	Confident	42 Å²	42	29.8 Å²	29.8	23%	0.225	16%	0.156	C	C	.	.	H	α-helix	trans	-45.7	-50.2	178.6	-75.9	5.5	0	0	0	113.8	V613 R617 Y750 T751 V752	V613-D748 HydrophobicContact CG1-CB 4.24Å; R617-D748 VanDerWaalsContact CD-OD2 3.26Å; R617-D748 WeakPolarHBondContact CD-OD2 3.13Å; R617-D748 IonicContact CZ-OD1 2.78Å; R617-D748 IonicContact CZ-OD2 3.54Å; R617-D748 IonicContact NE-OD1 3.64Å; R617-D748 IonicContact NE-OD2 3.68Å; R617-D748 VanDerWaalsContact NH1-CG 3.28Å; R617-D748 IonicContact NH1-OD1 3.54Å; R617-D748 PolarHBondContact NH1-OD1 2.74Å; R617-D748 VanDerWaalsContact NH1-OD1 3.15Å; R617-D748 IonicContact NH1-OD2 3.63Å; R617-D748 PolarHBondContact NH1-OD2 2.87Å; R617-D748 IonicContact NH2-OD1 3.72Å; D748-Y750 VanDerWaalsContact C-N 3.34Å; D748-Y750 PolarHBondContact O-N 3.31Å; D748-T751 PolarHBondContact O-N 3.41Å; D748-T751 PolarHBondContact O-OG1 3.15Å; D748-V752 WeakPolarHBondContact O-CB 3.42Å; D748-V752 VanDerWaalsContact O-CG2 3.29Å; D748-V752 WeakPolarHBondContact O-CG2 3.29Å; D748-V752 PolarHBondContact O-N 3.23Å
749	V	84.2	Confident	88.2	Confident	51 Å²	51	31 Å²	31	31%	0.309	17%	0.169	S	C	.	.	H	α-helix	trans	-64.2	-40.3	-178.6	-178.9	0	0	0	0	111.6	V613 K747 L753 L768	V613-V749 HydrophobicContact CB-CG2 4.48Å; V613-V749 HydrophobicContact CG1-CG2 3.89Å; V613-V749 HydrophobicContact CG2-CG2 3.7Å; K747-V749 VanDerWaalsContact C-N 3.33Å; K747-V749 PolarHBondContact O-N 3.16Å; V749-L753 WeakPolarHBondContact O-CB 3.38Å; V749-L753 PolarHBondContact O-N 2.82Å; V749-L768 HydrophobicContact CG1-CB 4.37Å; V749-L768 HydrophobicContact CG1-CD2 4.18Å; V749-L768 HydrophobicContact CG2-CD2 4.48Å
750	Y	89.4	Confident	86.9	Confident	12 Å²	12	31.6 Å²	31.6	5%	0.047	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-48.6	179.6	-179.3	-84.4	0	0	0	111.2	H746 K747 D748 V752 L753 F754 G836 Q837 A838 Y843 F844	H746-Y750 HydrophobicContact CB-CD1 3.46Å; H746-Y750 VanDerWaalsContact CB-CD1 3.46Å; H746-Y750 HydrophobicContact CB-CE1 3.88Å; H746-Y750 HydrophobicContact CB-CG 4.31Å; H746-Y750 AromaticContact CG-CD1 3.91Å; H746-Y750 AromaticContact CG-CE1 3.77Å; H746-Y750 AromaticContact ND1-CE1 3.58Å; K747-Y750 WeakPolarHBondContact O-CB 3.33Å; K747-Y750 PolarHBondContact O-N 3.02Å; D748-Y750 VanDerWaalsContact C-N 3.34Å; D748-Y750 PolarHBondContact O-N 3.31Å; Y750-V752 VanDerWaalsContact C-N 3.34Å; Y750-V752 PolarHBondContact O-N 2.78Å; Y750-L753 PolarHBondContact O-N 3.3Å; Y750-F754 HydrophobicContact CD1-CD2 4.06Å; Y750-F754 AromaticContact CD2-CD2 3.55Å; Y750-F754 HydrophobicContact CD2-CD2 3.55Å; Y750-F754 AromaticContact CD2-CE2 3.51Å; Y750-F754 HydrophobicContact CD2-CE2 3.51Å; Y750-F754 HydrophobicContact CE1-CD2 4Å; Y750-F754 AromaticContact CE2-CD2 3.46Å; Y750-F754 HydrophobicContact CE2-CD2 3.46Å; Y750-F754 VanDerWaalsContact CE2-CD2 3.46Å; Y750-F754 AromaticContact CE2-CE2 3.37Å; Y750-F754 HydrophobicContact CE2-CE2 3.37Å; Y750-F754 HydrophobicContact CE2-CZ 4.47Å; Y750-F754 AromaticContact CG-CD2 3.86Å; Y750-F754 HydrophobicContact CG-CD2 3.86Å; Y750-F754 HydrophobicContact CG-CE2 4.26Å; Y750-F754 AromaticContact CZ-CD2 3.71Å; Y750-F754 WeakPolarHBondContact O-CD2 3.45Å; Y750-F754 PolarHBondContact O-N 2.98Å; Y750-G836 WeakPolarHBondContact CD2-O 3.3Å; Y750-Q837 PolarHBondContact OH-O 2.97Å; Y750-A838 HydrophobicContact CE2-CB 4.28Å; Y750-A838 WeakPolarHBondContact OH-CA 3.36Å; Y750-A838 WeakPolarHBondContact OH-CB 3.47Å; Y750-A838 PolarHBondContact OH-N 2.9Å; Y750-Y843 VanDerWaalsContact CE1-O 3.31Å; Y750-Y843 WeakPolarHBondContact CE1-O 3.47Å; Y750-Y843 PolarHBondContact OH-O 2.78Å; Y750-F844 HydrophobicContact CD1-CD1 4.49Å; Y750-F844 AromaticContact CD1-CE1 3.91Å; Y750-F844 HydrophobicContact CD1-CE1 3.91Å; Y750-F844 AromaticContact CE1-CD1 3.89Å; Y750-F844 HydrophobicContact CE1-CD1 3.89Å; Y750-F844 AromaticContact CE1-CE1 3.62Å; Y750-F844 HydrophobicContact CE1-CE1 3.62Å
751	T	90.6	Very high	85.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-36.7	178.2	57	0	0	0	0	112.5	L742 Q743 H746 K747 D748 G755 F844	L742-T751 HydrophobicContact CB-CG2 3.56Å; Q743-T751 HydrophobicContact CG-CG2 3.96Å; Q743-T751 WeakPolarHBondContact CG-OG1 3.22Å; Q743-T751 PolarHBondContact NE2-OG1 3.2Å; Q743-T751 VanDerWaalsContact NE2-OG1 3.08Å; H746-T751 HydrophobicContact CB-CG2 3.75Å; H746-T751 WeakPolarHBondContact O-CG2 3.46Å; K747-T751 PolarHBondContact O-N 3.48Å; K747-T751 PolarHBondContact O-OG1 2.7Å; D748-T751 PolarHBondContact O-N 3.41Å; D748-T751 PolarHBondContact O-OG1 3.15Å; T751-G755 WeakPolarHBondContact O-CA 3.1Å; T751-G755 PolarHBondContact O-N 2.94Å; T751-F844 HydrophobicContact CG2-CE1 4.34Å
752	V	85.7	Confident	83.7	Confident	19 Å²	19	32.3 Å²	32.3	12%	0.115	18%	0.183	C	C	.	.	H	α-helix	trans	-68.4	-41.8	173.5	169.7	0	0	0	0	111.6	I620 D748 Y750 S756 I764	I620-V752 HydrophobicContact CD1-CG1 3.83Å; D748-V752 WeakPolarHBondContact O-CB 3.42Å; D748-V752 VanDerWaalsContact O-CG2 3.29Å; D748-V752 WeakPolarHBondContact O-CG2 3.29Å; D748-V752 PolarHBondContact O-N 3.23Å; Y750-V752 VanDerWaalsContact C-N 3.34Å; Y750-V752 PolarHBondContact O-N 2.78Å; V752-S756 WeakPolarHBondContact O-CB 3.39Å; V752-S756 PolarHBondContact O-N 2.88Å; V752-S756 PolarHBondContact O-OG 3.38Å; V752-I764 HydrophobicContact CG1-CD1 3.8Å; V752-I764 HydrophobicContact CG1-CG1 4.05Å
753	L	83.4	Confident	81.8	Confident	15 Å²	15	39.3 Å²	39.3	8%	0.079	21%	0.21	C	C	.	.	H	α-helix	trans	-67.1	-57.4	179	176.9	60.8	0	0	0	112.1	V749 Y750 R761 I764 L769 V772	V749-L753 WeakPolarHBondContact O-CB 3.38Å; V749-L753 PolarHBondContact O-N 2.82Å; Y750-L753 PolarHBondContact O-N 3.3Å; L753-R761 PolarHBondContact O-NE 2.92Å; L753-I764 HydrophobicContact CD1-CD1 4.48Å; L753-L769 HydrophobicContact CD1-CD2 3.53Å; L753-V772 HydrophobicContact CD2-CB 3.68Å; L753-V772 HydrophobicContact CD2-CG1 4.11Å; L753-V772 HydrophobicContact CD2-CG2 3.39Å
754	F	89	Confident	80.1	Confident	6 Å²	6	38.4 Å²	38.4	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-81.1	-24.3	-172.2	-67.5	-66.4	0	0	0	113.3	Y750 V772 V784 W790 A797 A838 Y843 F844	Y750-F754 HydrophobicContact CD1-CD2 4.06Å; Y750-F754 AromaticContact CD2-CD2 3.55Å; Y750-F754 HydrophobicContact CD2-CD2 3.55Å; Y750-F754 AromaticContact CD2-CE2 3.51Å; Y750-F754 HydrophobicContact CD2-CE2 3.51Å; Y750-F754 HydrophobicContact CE1-CD2 4Å; Y750-F754 AromaticContact CE2-CD2 3.46Å; Y750-F754 HydrophobicContact CE2-CD2 3.46Å; Y750-F754 VanDerWaalsContact CE2-CD2 3.46Å; Y750-F754 AromaticContact CE2-CE2 3.37Å; Y750-F754 HydrophobicContact CE2-CE2 3.37Å; Y750-F754 HydrophobicContact CE2-CZ 4.47Å; Y750-F754 AromaticContact CG-CD2 3.86Å; Y750-F754 HydrophobicContact CG-CD2 3.86Å; Y750-F754 HydrophobicContact CG-CE2 4.26Å; Y750-F754 AromaticContact CZ-CD2 3.71Å; Y750-F754 WeakPolarHBondContact O-CD2 3.45Å; Y750-F754 PolarHBondContact O-N 2.98Å; F754-V772 HydrophobicContact CE2-CG2 4.23Å; F754-V772 HydrophobicContact CZ-CG1 3.82Å; F754-V772 HydrophobicContact CZ-CG2 4.17Å; F754-V784 HydrophobicContact CE1-CG1 3.62Å; F754-V784 HydrophobicContact CZ-CG1 3.8Å; F754-W790 HydrophobicContact CD1-CE3 4.32Å; F754-W790 AromaticContact CD1-CH2 3.7Å; F754-W790 HydrophobicContact CD1-CH2 3.7Å; F754-W790 HydrophobicContact CD1-CZ2 4.22Å; F754-W790 AromaticContact CD1-CZ3 3.75Å; F754-W790 HydrophobicContact CD1-CZ3 3.75Å; F754-W790 HydrophobicContact CE1-CH2 4.49Å; F754-W790 HydrophobicContact CE1-CZ3 4.48Å; F754-A797 VanDerWaalsContact O-CA 3.32Å; F754-A797 WeakPolarHBondContact O-CA 3.05Å; F754-A797 WeakPolarHBondContact O-CB 3.46Å; F754-A838 HydrophobicContact CE2-CB 4.48Å; F754-A838 HydrophobicContact CZ-CB 4.28Å; F754-Y843 AromaticContact CD1-CD1 3.69Å; F754-Y843 HydrophobicContact CD1-CD1 3.69Å; F754-Y843 AromaticContact CD1-CE1 3.71Å; F754-Y843 HydrophobicContact CD1-CE1 3.71Å; F754-Y843 HydrophobicContact CE1-CD1 4.13Å; F754-Y843 AromaticContact CE1-CE1 3.81Å; F754-Y843 HydrophobicContact CE1-CE1 3.81Å; F754-Y843 HydrophobicContact CG-CD1 4.2Å; F754-F844 HydrophobicContact CB-CE1 4.28Å; F754-F844 HydrophobicContact CB-CE2 4.28Å; F754-F844 HydrophobicContact CB-CZ 3.65Å
755	G	88.1	Confident	78.3	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-102.1	-11.4	-176.2	0	0	0	0	0	115.5	T751 R801	T751-G755 WeakPolarHBondContact O-CA 3.1Å; T751-G755 PolarHBondContact O-N 2.94Å; G755-R801 WeakPolarHBondContact O-CD 3.19Å; G755-R801 PolarHBondContact O-NH1 2.82Å
756	S	82.4	Confident	76.5	Confident	6 Å²	6	42.6 Å²	42.6	4%	0.042	23%	0.233	C	C	.	.	S	Bend	trans	-92.1	157.3	177.3	81.6	0	0	0	0	113.5	V752 S760 R761	V752-S756 WeakPolarHBondContact O-CB 3.39Å; V752-S756 PolarHBondContact O-N 2.88Å; V752-S756 PolarHBondContact O-OG 3.38Å; S756-S760 WeakPolarHBondContact CB-OG 3.42Å; S756-S760 PolarHBondContact OG-OG 2.89Å; S756-R761 PolarHBondContact O-NE 3.34Å; S756-R761 PolarHBondContact O-NH2 3.01Å
757	N	75	Confident	74.7	Confident	103 Å²	103	45.3 Å²	45.3	55%	0.551	25%	0.25	S	C	*	.			trans	-65.1	142.3	174.5	-179.9	-43.9	0	0	0	110.1	A759 S760 R761	N757-A759 PolarHBondContact O-N 3.02Å; N757-A759 VanDerWaalsContact O-N 3.08Å; N757-A759 WeakPolarHBondContact OD1-CB 3.34Å; N757-A759 PolarHBondContact OD1-N 2.71Å; N757-S760 PolarHBondContact N-OG 3.42Å; N757-S760 WeakPolarHBondContact O-CA 3.32Å; N757-S760 PolarHBondContact O-N 2.81Å; N757-S760 PolarHBondContact O-OG 3.3Å; N757-R761 PolarHBondContact O-N 3.47Å
758	P	69.8	Low	73	Confident	12 Å²	12	39.7 Å²	39.7	8%	0.078	23%	0.226	C	C	.	.	H	α-helix	trans	-46.7	-34.7	172.3	-29.1	33.6	0	0	0	115.4	S760 R761 C762 T792	P758-S760 VanDerWaalsContact C-N 3.29Å; P758-S760 PolarHBondContact O-N 2.61Å; P758-R761 WeakPolarHBondContact O-CB 3.26Å; P758-R761 PolarHBondContact O-N 2.82Å; P758-C762 PolarHBondContact O-N 2.9Å; P758-T792 WeakPolarHBondContact CG-O 3.25Å
759	A	66.2	Low	71.8	Confident	67 Å²	67	39.9 Å²	39.9	55%	0.554	23%	0.227	S	C	*	.	H	α-helix	trans	-63.7	-30.8	175.9	0	0	0	0	0	113.4	N757	N757-A759 PolarHBondContact O-N 3.02Å; N757-A759 VanDerWaalsContact O-N 3.08Å; N757-A759 WeakPolarHBondContact OD1-CB 3.34Å; N757-A759 PolarHBondContact OD1-N 2.71Å
760	S	65.6	Low	70.4	Confident	28 Å²	28	41.3 Å²	41.3	20%	0.196	24%	0.244	C	C	.	.	H	α-helix	trans	-78.3	-26.2	169.6	24.3	0	0	0	0	112.8	S756 N757 P758 C762 R763	S756-S760 WeakPolarHBondContact CB-OG 3.42Å; S756-S760 PolarHBondContact OG-OG 2.89Å; N757-S760 PolarHBondContact N-OG 3.42Å; N757-S760 WeakPolarHBondContact O-CA 3.32Å; N757-S760 PolarHBondContact O-N 2.81Å; N757-S760 PolarHBondContact O-OG 3.3Å; P758-S760 VanDerWaalsContact C-N 3.29Å; P758-S760 PolarHBondContact O-N 2.61Å; S760-C762 PolarHBondContact O-N 2.93Å; S760-R763 WeakPolarHBondContact O-CB 3.49Å; S760-R763 PolarHBondContact O-N 2.84Å
761	R	64.7	Low	68.8	Low	11 Å²	11	44.9 Å²	44.9	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-28.3	176.3	-57.3	-179.2	-164.4	150.7	3.3	112.8	A558 L753 S756 N757 P758 R763 I764 W790	A558-R761 HydrophobicContact CB-CB 4.3Å; L753-R761 PolarHBondContact O-NE 2.92Å; S756-R761 PolarHBondContact O-NE 3.34Å; S756-R761 PolarHBondContact O-NH2 3.01Å; N757-R761 PolarHBondContact O-N 3.47Å; P758-R761 WeakPolarHBondContact O-CB 3.26Å; P758-R761 PolarHBondContact O-N 2.82Å; R761-R763 PolarHBondContact O-N 3.38Å; R761-I764 HydrophobicContact CB-CD1 4.14Å; R761-I764 HydrophobicContact CG-CD1 3.98Å; R761-I764 WeakPolarHBondContact O-CB 3.36Å; R761-I764 PolarHBondContact O-N 2.86Å; R761-W790 VanDerWaalsContact NH1-CZ2 3.28Å; R761-W790 VanDerWaalsContact NH2-CH2 3.31Å; R761-W790 VanDerWaalsContact NH2-CZ2 3.34Å
762	C	57.9	Low	67.6	Low	72 Å²	72	46.8 Å²	46.8	49%	0.486	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-6.4	169.4	-59.7	0	0	0	0	114.2	A558 P758 S760	A558-C762 VanDerWaalsContact CB-SG 3.56Å; P758-C762 PolarHBondContact O-N 2.9Å; S760-C762 PolarHBondContact O-N 2.93Å
763	R	57.9	Low	67	Low	148 Å²	148	55.8 Å²	55.8	56%	0.558	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-8.5	174.2	-54.2	179.7	-175.9	169.4	1.8	113.1	L616 S760 R761	L616-R763 HydrophobicContact CD2-CB 4.49Å; L616-R763 WeakPolarHBondContact CD2-O 3.43Å; S760-R763 WeakPolarHBondContact O-CB 3.49Å; S760-R763 PolarHBondContact O-N 2.84Å; R761-R763 PolarHBondContact O-N 3.38Å
764	I	61.9	Low	67	Low	13 Å²	13	56 Å²	56	7%	0.067	31%	0.312	C	S	.	.	S	Bend	trans	-72.3	136.6	172.6	-61.6	173.5	0	0	0	107.2	V752 L753 R761 L768 L769	V752-I764 HydrophobicContact CG1-CD1 3.8Å; V752-I764 HydrophobicContact CG1-CG1 4.05Å; L753-I764 HydrophobicContact CD1-CD1 4.48Å; R761-I764 HydrophobicContact CB-CD1 4.14Å; R761-I764 HydrophobicContact CG-CD1 3.98Å; R761-I764 WeakPolarHBondContact O-CB 3.36Å; R761-I764 PolarHBondContact O-N 2.86Å; I764-L768 HydrophobicContact CG2-CB 3.84Å; I764-L768 HydrophobicContact CG2-CD1 4.23Å; I764-L769 HydrophobicContact CG2-CG 4.27Å
765	D	58.9	Low	66.8	Low	55 Å²	55	57.4 Å²	57.4	29%	0.294	32%	0.322	S	S	.	.			trans	-55.6	127	174.5	-172.8	-47.7	0	0	0	110.1	T767 L768 L769	D765-T767 VanDerWaalsContact CG-OG1 3.27Å; D765-T767 PolarHBondContact O-N 2.87Å; D765-T767 WeakPolarHBondContact OD1-CB 3.4Å; D765-T767 WeakPolarHBondContact OD1-CG2 3.28Å; D765-T767 PolarHBondContact OD1-N 3.36Å; D765-T767 PolarHBondContact OD1-OG1 3.48Å; D765-L768 HydrophobicContact CB-CD1 4.02Å; D765-L768 HydrophobicContact CB-CG 4.08Å; D765-L768 WeakPolarHBondContact O-CA 3.48Å; D765-L768 WeakPolarHBondContact O-CB 3.15Å; D765-L768 PolarHBondContact O-N 3.49Å; D765-L769 PolarHBondContact O-N 2.69Å
766	P	58.9	Low	66.8	Low	90 Å²	90	64.2 Å²	64.2	58%	0.584	35%	0.347	S	S	*	.	H	α-helix	trans	-54.7	-25.6	178.9	-28.6	36.6	0	0	0	114.5	L768 L769 A770	P766-L768 VanDerWaalsContact C-N 3.34Å; P766-L769 WeakPolarHBondContact O-CB 3.32Å; P766-L769 PolarHBondContact O-N 2.7Å; P766-A770 WeakPolarHBondContact O-CB 3.27Å; P766-A770 PolarHBondContact O-N 2.84Å
767	T	60.3	Low	67.2	Low	62 Å²	62	64.6 Å²	64.6	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-71.3	-27.1	174.7	66.4	0	0	0	0	113.1	D765 T771	D765-T767 VanDerWaalsContact CG-OG1 3.27Å; D765-T767 PolarHBondContact O-N 2.87Å; D765-T767 WeakPolarHBondContact OD1-CB 3.4Å; D765-T767 WeakPolarHBondContact OD1-CG2 3.28Å; D765-T767 PolarHBondContact OD1-N 3.36Å; D765-T767 PolarHBondContact OD1-OG1 3.48Å; T767-T771 PolarHBondContact O-N 2.98Å; T767-T771 PolarHBondContact O-OG1 3.21Å
768	L	57.5	Low	67.8	Low	20 Å²	20	65.2 Å²	65.2	11%	0.105	37%	0.368	C	S	.	.	H	α-helix	trans	-75.9	-36.2	170.8	-62.5	174	0	0	0	111	V613 V749 I764 D765 P766 T771	V613-L768 HydrophobicContact CG2-CD1 3.86Å; V613-L768 HydrophobicContact CG2-CD2 4.3Å; V749-L768 HydrophobicContact CG1-CB 4.37Å; V749-L768 HydrophobicContact CG1-CD2 4.18Å; V749-L768 HydrophobicContact CG2-CD2 4.48Å; I764-L768 HydrophobicContact CG2-CB 3.84Å; I764-L768 HydrophobicContact CG2-CD1 4.23Å; D765-L768 HydrophobicContact CB-CD1 4.02Å; D765-L768 HydrophobicContact CB-CG 4.08Å; D765-L768 WeakPolarHBondContact O-CA 3.48Å; D765-L768 WeakPolarHBondContact O-CB 3.15Å; D765-L768 PolarHBondContact O-N 3.49Å; P766-L768 VanDerWaalsContact C-N 3.34Å; L768-T771 VanDerWaalsContact O-CB 3.25Å; L768-T771 WeakPolarHBondContact O-CB 3.39Å; L768-T771 PolarHBondContact O-N 3.22Å; L768-T771 VanDerWaalsContact O-N 3.13Å
769	L	59.8	Low	68.8	Low	47 Å²	47	66.4 Å²	66.4	25%	0.246	38%	0.376	C	S	.	.	H	α-helix	trans	-61.8	-43.6	170.1	-78.8	162.4	0	0	0	111.1	L753 I764 D765 P766 T771 V772	L753-L769 HydrophobicContact CD1-CD2 3.53Å; I764-L769 HydrophobicContact CG2-CG 4.27Å; D765-L769 PolarHBondContact O-N 2.69Å; P766-L769 WeakPolarHBondContact O-CB 3.32Å; P766-L769 PolarHBondContact O-N 2.7Å; L769-T771 PolarHBondContact O-N 3.47Å; L769-T771 VanDerWaalsContact O-N 3.1Å; L769-V772 PolarHBondContact O-N 3.42Å; L769-V772 VanDerWaalsContact O-N 3.07Å
770	A	54.6	Low	69.9	Low	80 Å²	80	64.7 Å²	64.7	66%	0.661	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-9.2	174.1	0	0	0	0	0	114.5	P766	P766-A770 WeakPolarHBondContact O-CB 3.27Å; P766-A770 PolarHBondContact O-N 2.84Å
771	T	57.3	Low	70.9	Confident	88 Å²	88	63.4 Å²	63.4	54%	0.54	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-23.2	172.9	-53.4	0	0	0	0	111.9	T767 L768 L769	T767-T771 PolarHBondContact O-N 2.98Å; T767-T771 PolarHBondContact O-OG1 3.21Å; L768-T771 VanDerWaalsContact O-CB 3.25Å; L768-T771 WeakPolarHBondContact O-CB 3.39Å; L768-T771 PolarHBondContact O-N 3.22Å; L768-T771 VanDerWaalsContact O-N 3.13Å; L769-T771 PolarHBondContact O-N 3.47Å; L769-T771 VanDerWaalsContact O-N 3.1Å
772	V	64.9	Low	72.1	Confident	39 Å²	39	63.4 Å²	63.4	24%	0.236	36%	0.358	C	S	.	.	S	Bend	trans	-103.1	119.3	173.4	167.2	0	0	0	0	110.4	L753 F754 L769 L774 V784	L753-V772 HydrophobicContact CD2-CB 3.68Å; L753-V772 HydrophobicContact CD2-CG1 4.11Å; L753-V772 HydrophobicContact CD2-CG2 3.39Å; F754-V772 HydrophobicContact CE2-CG2 4.23Å; F754-V772 HydrophobicContact CZ-CG1 3.82Å; F754-V772 HydrophobicContact CZ-CG2 4.17Å; L769-V772 PolarHBondContact O-N 3.42Å; L769-V772 VanDerWaalsContact O-N 3.07Å; V772-L774 VanDerWaalsContact C-N 3.33Å; V772-L774 HydrophobicContact CG1-CD2 4.24Å; V772-L774 HydrophobicContact CG1-CG 4.45Å; V772-L774 PolarHBondContact O-N 3.13Å; V772-V784 HydrophobicContact CG1-CG1 4.35Å
773	R	72.5	Confident	73.6	Confident	209 Å²	209	60 Å²	60	79%	0.789	34%	0.335	S	S	*	.			trans	-79.2	78.3	-179.3	-67.1	-179.6	175.6	177.7	-1.5	110.9	C775	R773-C775 PolarHBondContact O-N 3.39Å
774	L	83	Confident	75.1	Confident	20 Å²	20	53.6 Å²	53.6	11%	0.105	31%	0.312	C	S	.	.			trans	-60.2	131.9	165.9	-64.8	-179.8	0	0	0	109.9	A562 V772 V782 G783 V784 W790	A562-L774 HydrophobicContact CB-CD1 3.82Å; V772-L774 VanDerWaalsContact C-N 3.33Å; V772-L774 HydrophobicContact CG1-CD2 4.24Å; V772-L774 HydrophobicContact CG1-CG 4.45Å; V772-L774 PolarHBondContact O-N 3.13Å; L774-V782 HydrophobicContact CB-CG1 4.33Å; L774-V782 HydrophobicContact CD2-CG1 4.47Å; L774-G783 WeakPolarHBondContact CA-O 3.2Å; L774-G783 WeakPolarHBondContact CD2-O 3.46Å; L774-V784 HydrophobicContact CD2-CG1 3.99Å; L774-W790 HydrophobicContact CD2-CG 4.36Å
775	C	86.3	Confident	76.4	Confident	34 Å²	34	54.7 Å²	54.7	23%	0.23	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	171.2	179.7	78.5	0	0	0	0	110.4	R773 V782 G783 D785	R773-C775 PolarHBondContact O-N 3.39Å; C775-V782 WeakPolarHBondContact O-CA 3.46Å; C775-G783 PolarHBondContact N-O 3.32Å; C775-G783 PolarHBondContact O-N 2.92Å; C775-D785 PolarHBondContact SG-O 3.18Å
776	R	88.3	Confident	77.7	Confident	145 Å²	145	57 Å²	57	55%	0.547	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.1	160.8	-162.9	178.7	-170.1	-176.4	-0.4	109.4	G780 G781	R776-G780 PolarHBondContact NE-O 2.89Å; R776-G780 PolarHBondContact NH2-O 3.4Å; R776-G781 WeakPolarHBondContact CA-O 3.41Å; R776-G781 VanDerWaalsContact CG-O 3.29Å; R776-G781 WeakPolarHBondContact CG-O 3.24Å
777	L	88.9	Confident	79.1	Confident	13 Å²	13	54.6 Å²	54.6	7%	0.068	32%	0.32	C	S	.	.			trans	-73.8	158.1	179.3	-62.5	171.2	0	0	0	111.3	C779 G780 G781 V782 D785 S786 A789	L777-C779 VanDerWaalsContact CB-SG 3.57Å; L777-C779 PolarHBondContact O-N 3.09Å; L777-G780 WeakPolarHBondContact O-CA 3.31Å; L777-G780 PolarHBondContact O-N 3.37Å; L777-G781 PolarHBondContact N-O 2.73Å; L777-V782 WeakPolarHBondContact CD1-O 3.41Å; L777-D785 WeakPolarHBondContact CD2-O 3.28Å; L777-S786 WeakPolarHBondContact CD2-O 3.22Å; L777-A789 HydrophobicContact CD1-CB 3.86Å
778	A	89.3	Confident	80.5	Confident	116 Å²	116	51.6 Å²	51.6	96%	0.959	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.8	177.1	0	0	0	0	0	113.1	G780	A778-G780 PolarHBondContact O-N 3.34Å; A778-G780 VanDerWaalsContact O-N 3.17Å
779	C	91	Very high	82	Confident	37 Å²	37	51.1 Å²	51.1	25%	0.25	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	3.3	172.5	65.3	0	0	0	0	114.4	C700 N705 H706 L777 G781	C700-C779 HydrophobicContact CB-CB 4.02Å; C700-C779 VanDerWaalsContact CB-O 3.28Å; C700-C779 WeakPolarHBondContact CB-O 3.32Å; N705-C779 HydrophobicContact CB-CB 4.42Å; H706-C779 VanDerWaalsContact CE1-SG 3.58Å; H706-C779 PolarHBondContact NE2-SG 2.9Å; L777-C779 VanDerWaalsContact CB-SG 3.57Å; L777-C779 PolarHBondContact O-N 3.09Å; C779-G781 VanDerWaalsContact C-N 3.29Å; C779-G781 PolarHBondContact O-N 3.34Å
780	G	87.2	Confident	83.2	Confident	31 Å²	31	49.3 Å²	49.3	32%	0.32	29%	0.291	S	S	.	.	S	Bend	trans	84.5	-9.2	-178.5	0	0	0	0	0	115.4	R776 L777 A778	R776-G780 PolarHBondContact NE-O 2.89Å; R776-G780 PolarHBondContact NH2-O 3.4Å; L777-G780 WeakPolarHBondContact O-CA 3.31Å; L777-G780 PolarHBondContact O-N 3.37Å; A778-G780 PolarHBondContact O-N 3.34Å; A778-G780 VanDerWaalsContact O-N 3.17Å
781	G	88.6	Confident	84.7	Confident	2 Å²	2	46.7 Å²	46.7	2%	0.021	27%	0.265	C	S	.	.			trans	-73.9	-168.9	175.7	0	0	0	0	0	114.3	R776 L777 C779	R776-G781 WeakPolarHBondContact CA-O 3.41Å; R776-G781 VanDerWaalsContact CG-O 3.29Å; R776-G781 WeakPolarHBondContact CG-O 3.24Å; L777-G781 PolarHBondContact N-O 2.73Å; C779-G781 VanDerWaalsContact C-N 3.29Å; C779-G781 PolarHBondContact O-N 3.34Å
782	V	89.3	Confident	85.6	Confident	11 Å²	11	43.2 Å²	43.2	7%	0.067	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	143.2	-179.9	-178.7	0	0	0	0	109.2	L774 C775 L777 W790 T792	L774-V782 HydrophobicContact CB-CG1 4.33Å; L774-V782 HydrophobicContact CD2-CG1 4.47Å; C775-V782 WeakPolarHBondContact O-CA 3.46Å; L777-V782 WeakPolarHBondContact CD1-O 3.41Å; V782-W790 PolarHBondContact O-N 3.19Å; V782-T792 HydrophobicContact CB-CG2 4.42Å; V782-T792 HydrophobicContact CG2-CG2 4.22Å
783	G	90.1	Very high	86.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	180	175.2	0	0	0	0	0	111.9	L774 C775 T788	L774-G783 WeakPolarHBondContact CA-O 3.2Å; L774-G783 WeakPolarHBondContact CD2-O 3.46Å; C775-G783 PolarHBondContact N-O 3.32Å; C775-G783 PolarHBondContact O-N 2.92Å; G783-T788 VanDerWaalsContact CA-O 3.23Å; G783-T788 WeakPolarHBondContact CA-O 3.39Å
784	V	88.8	Confident	86.9	Confident	14 Å²	14	34.3 Å²	34.3	9%	0.085	22%	0.22	C	C	.	.	S	Bend	trans	-93.5	-20.5	168.1	-64.7	0	0	0	0	112.7	F754 V772 L774 T788 A838 Y843	F754-V784 HydrophobicContact CE1-CG1 3.62Å; F754-V784 HydrophobicContact CZ-CG1 3.8Å; V772-V784 HydrophobicContact CG1-CG1 4.35Å; L774-V784 HydrophobicContact CD2-CG1 3.99Å; V784-T788 VanDerWaalsContact CG2-CB 3.49Å; V784-T788 HydrophobicContact CG2-CG2 3.47Å; V784-T788 VanDerWaalsContact CG2-CG2 3.47Å; V784-T788 PolarHBondContact N-O 3.03Å; V784-T788 VanDerWaalsContact N-O 3.13Å; V784-A838 HydrophobicContact CG2-CB 3.96Å; V784-Y843 HydrophobicContact CG1-CE1 4.28Å
785	D	88.8	Confident	87.3	Confident	35 Å²	35	36.9 Å²	36.9	19%	0.187	23%	0.231	C	C	.	.	S	Bend	trans	-150.8	-159.1	176.7	56.9	26.4	0	0	0	109.1	C775 L777 D787 T788 M839	C775-D785 PolarHBondContact SG-O 3.18Å; L777-D785 WeakPolarHBondContact CD2-O 3.28Å; D785-D787 VanDerWaalsContact C-N 3.26Å; D785-D787 PolarHBondContact O-N 2.85Å; D785-D787 PolarHBondContact OD1-N 3.43Å; D785-D787 VanDerWaalsContact OD1-N 3.07Å; D785-T788 WeakPolarHBondContact OD1-CA 3.24Å; D785-T788 WeakPolarHBondContact OD1-CB 3.36Å; D785-T788 PolarHBondContact OD1-N 3.26Å; D785-T788 PolarHBondContact OD1-OG1 3Å; D785-T788 PolarHBondContact OD2-OG1 3.14Å; D785-T788 VanDerWaalsContact OD2-OG1 3.07Å; D785-M839 VanDerWaalsContact OD2-CA 3.26Å; D785-M839 WeakPolarHBondContact OD2-CA 3.48Å
786	S	86.7	Confident	87.6	Confident	104 Å²	104	35.2 Å²	35.2	73%	0.727	22%	0.22	S	C	*	.	S	Bend	trans	-64.3	-20.6	-177.4	27.7	0	0	0	0	116	L777	L777-S786 WeakPolarHBondContact CD2-O 3.22Å
787	D	87.8	Confident	87.8	Confident	39 Å²	39	28.6 Å²	28.6	21%	0.209	20%	0.196	C	C	.	.	S	Bend	trans	-139.4	-39.1	-155.4	43.5	-80.7	0	0	0	112.1	D785 A789 G840 F841	D785-D787 VanDerWaalsContact C-N 3.26Å; D785-D787 PolarHBondContact O-N 2.85Å; D785-D787 PolarHBondContact OD1-N 3.43Å; D785-D787 VanDerWaalsContact OD1-N 3.07Å; D787-A789 PolarHBondContact O-N 3.28Å; D787-G840 PolarHBondContact OD2-N 2.94Å; D787-F841 HydrophobicContact CB-CD1 4.43Å; D787-F841 HydrophobicContact CB-CE1 3.86Å; D787-F841 HydrophobicContact CB-CZ 4.38Å; D787-F841 WeakPolarHBondContact O-CD1 3.15Å
788	T	89.7	Confident	88	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	21%	0.205	C	C	.	.			trans	-75	82.7	179.7	-51.4	0	0	0	0	110.9	G783 V784 D785 M839 G840 F841 Y843	G783-T788 VanDerWaalsContact CA-O 3.23Å; G783-T788 WeakPolarHBondContact CA-O 3.39Å; V784-T788 VanDerWaalsContact CG2-CB 3.49Å; V784-T788 HydrophobicContact CG2-CG2 3.47Å; V784-T788 VanDerWaalsContact CG2-CG2 3.47Å; V784-T788 PolarHBondContact N-O 3.03Å; V784-T788 VanDerWaalsContact N-O 3.13Å; D785-T788 WeakPolarHBondContact OD1-CA 3.24Å; D785-T788 WeakPolarHBondContact OD1-CB 3.36Å; D785-T788 PolarHBondContact OD1-N 3.26Å; D785-T788 PolarHBondContact OD1-OG1 3Å; D785-T788 PolarHBondContact OD2-OG1 3.14Å; D785-T788 VanDerWaalsContact OD2-OG1 3.07Å; T788-M839 VanDerWaalsContact OG1-C 3.32Å; T788-M839 WeakPolarHBondContact OG1-CA 3.35Å; T788-G840 PolarHBondContact OG1-N 3.35Å; T788-G840 VanDerWaalsContact OG1-N 3.1Å; T788-F841 PolarHBondContact OG1-N 3.18Å; T788-Y843 HydrophobicContact CG2-CD2 4.16Å; T788-Y843 HydrophobicContact CG2-CE1 4.32Å; T788-Y843 HydrophobicContact CG2-CE2 3.48Å; T788-Y843 VanDerWaalsContact CG2-CE2 3.48Å; T788-Y843 PolarHBondContact O-OH 3.11Å
789	A	88.8	Confident	88.3	Confident	10 Å²	10	25.1 Å²	25.1	8%	0.083	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-65.8	142.4	-176.9	0	0	0	0	0	113.5	H696 C698 L777 D787 Y843	H696-A789 PolarHBondContact CE1-O 3.2Å; H696-A789 VanDerWaalsContact CE1-O 3.23Å; C698-A789 HydrophobicContact CB-CB 3.87Å; L777-A789 HydrophobicContact CD1-CB 3.86Å; D787-A789 PolarHBondContact O-N 3.28Å; A789-Y843 VanDerWaalsContact C-OH 3.24Å; A789-Y843 PolarHBondContact O-OH 2.89Å
790	W	86	Confident	88.6	Confident	8 Å²	8	23.4 Å²	23.4	3%	0.03	15%	0.148	C	C	.	.			trans	-125.6	120.7	-174.5	-179.8	-123.2	0	0	0	111.1	T699 F754 R761 L774 V782 T796 A797 Y843	T699-W790 PolarHBondContact OG1-O 2.99Å; F754-W790 HydrophobicContact CD1-CE3 4.32Å; F754-W790 AromaticContact CD1-CH2 3.7Å; F754-W790 HydrophobicContact CD1-CH2 3.7Å; F754-W790 HydrophobicContact CD1-CZ2 4.22Å; F754-W790 AromaticContact CD1-CZ3 3.75Å; F754-W790 HydrophobicContact CD1-CZ3 3.75Å; F754-W790 HydrophobicContact CE1-CH2 4.49Å; F754-W790 HydrophobicContact CE1-CZ3 4.48Å; R761-W790 VanDerWaalsContact NH1-CZ2 3.28Å; R761-W790 VanDerWaalsContact NH2-CH2 3.31Å; R761-W790 VanDerWaalsContact NH2-CZ2 3.34Å; L774-W790 HydrophobicContact CD2-CG 4.36Å; V782-W790 PolarHBondContact O-N 3.19Å; W790-T796 HydrophobicContact CE3-CG2 3.65Å; W790-T796 HydrophobicContact CZ3-CG2 3.81Å; W790-A797 HydrophobicContact CH2-CB 4.29Å; W790-Y843 WeakPolarHBondContact CA-OH 3.5Å; W790-Y843 WeakPolarHBondContact CB-OH 3.45Å; W790-Y843 HydrophobicContact CD2-CE1 4.46Å; W790-Y843 HydrophobicContact CE3-CD1 4.36Å; W790-Y843 AromaticContact CE3-CE1 3.51Å; W790-Y843 HydrophobicContact CE3-CE1 3.51Å; W790-Y843 AromaticContact CE3-CZ 3.7Å; W790-Y843 HydrophobicContact CZ3-CD1 4.21Å; W790-Y843 AromaticContact CZ3-CE1 3.79Å; W790-Y843 HydrophobicContact CZ3-CE1 3.79Å
791	H	85.6	Confident	89.1	Confident	25 Å²	25	24.2 Å²	24.2	12%	0.116	14%	0.142	C	C	.	.			trans	-88.7	110.8	175.8	-157.7	-79.4	0	0	0	111.4	A793 G794 H795 T796	H791-A793 VanDerWaalsContact C-N 3.28Å; H791-A793 PolarHBondContact ND1-N 3.08Å; H791-A793 PolarHBondContact O-N 3.15Å; H791-G794 PolarHBondContact O-N 3.45Å; H791-H795 HydrophobicContact CB-CB 4.31Å; H791-H795 AromaticContact CE1-CD2 3.43Å; H791-H795 PolarHBondContact CE1-CD2 3.49Å; H791-H795 VanDerWaalsContact CE1-CD2 3.43Å; H791-H795 AromaticContact CE1-NE2 3.9Å; H791-H795 AromaticContact CG-CD2 3.83Å; H791-H795 AromaticContact ND1-CD2 3.26Å; H791-H795 PolarHBondContact ND1-CD2 3.38Å; H791-H795 VanDerWaalsContact ND1-CD2 3.26Å; H791-T796 WeakPolarHBondContact CB-OG1 3.36Å; H791-T796 PolarHBondContact N-OG1 3.35Å
792	T	75.9	Confident	89.5	Confident	16 Å²	16	24.4 Å²	24.4	10%	0.098	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-34.6	-173.1	61.2	0	0	0	0	113.2	N559 P758 V782 G794	N559-T792 PolarHBondContact ND2-O 3.48Å; N559-T792 PolarHBondContact OD1-O 3.34Å; P758-T792 WeakPolarHBondContact CG-O 3.25Å; V782-T792 HydrophobicContact CB-CG2 4.42Å; V782-T792 HydrophobicContact CG2-CG2 4.22Å; T792-G794 PolarHBondContact O-N 2.89Å
793	A	80.2	Confident	90	Very high	50 Å²	50	23.9 Å²	23.9	41%	0.413	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	0.3	174.3	0	0	0	0	0	114.7	H791	H791-A793 VanDerWaalsContact C-N 3.28Å; H791-A793 PolarHBondContact ND1-N 3.08Å; H791-A793 PolarHBondContact O-N 3.15Å
794	G	83.8	Confident	90.4	Very high	10 Å²	10	23.9 Å²	23.9	10%	0.103	14%	0.139	C	C	.	.	S	Bend	trans	92.1	5.5	170.6	0	0	0	0	0	115.4	H791 T792 T796 A797 H798	H791-G794 PolarHBondContact O-N 3.45Å; T792-G794 PolarHBondContact O-N 2.89Å; G794-T796 VanDerWaalsContact C-N 3.33Å; G794-T796 PolarHBondContact O-N 3.15Å; G794-A797 WeakPolarHBondContact O-CB 2.97Å; G794-A797 PolarHBondContact O-N 3.06Å; G794-A797 VanDerWaalsContact O-N 3.13Å; G794-H798 PolarHBondContact O-N 3.06Å
795	H	91.2	Very high	90.9	Very high	74 Å²	74	23.2 Å²	23.2	34%	0.343	14%	0.135	S	C	.	.	H	α-helix	trans	-63.5	-35.9	178.7	-54	-47.8	0	0	0	112.8	A695 H791 A797 H798 A799	A695-H795 HydrophobicContact CB-CB 4.1Å; A695-H795 WeakPolarHBondContact O-CB 3.46Å; H791-H795 HydrophobicContact CB-CB 4.31Å; H791-H795 AromaticContact CE1-CD2 3.43Å; H791-H795 PolarHBondContact CE1-CD2 3.49Å; H791-H795 VanDerWaalsContact CE1-CD2 3.43Å; H791-H795 AromaticContact CE1-NE2 3.9Å; H791-H795 AromaticContact CG-CD2 3.83Å; H791-H795 AromaticContact ND1-CD2 3.26Å; H791-H795 PolarHBondContact ND1-CD2 3.38Å; H791-H795 VanDerWaalsContact ND1-CD2 3.26Å; H795-A797 VanDerWaalsContact C-N 3.33Å; H795-A797 PolarHBondContact O-N 2.9Å; H795-H798 WeakPolarHBondContact O-CA 2.98Å; H795-H798 WeakPolarHBondContact O-CB 3.32Å; H795-H798 PolarHBondContact O-N 3.35Å; H795-H798 VanDerWaalsContact O-N 3.07Å; H795-A799 WeakPolarHBondContact O-CB 3.49Å; H795-A799 PolarHBondContact O-N 3.41Å
796	T	92.8	Very high	91.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.5	-42.3	171.5	-49	0	0	0	0	112	H696 W790 H791 G794 H798 A799 A800 Y843	H696-T796 PolarHBondContact CE1-OG1 3.08Å; H696-T796 PolarHBondContact ND1-OG1 2.92Å; W790-T796 HydrophobicContact CE3-CG2 3.65Å; W790-T796 HydrophobicContact CZ3-CG2 3.81Å; H791-T796 WeakPolarHBondContact CB-OG1 3.36Å; H791-T796 PolarHBondContact N-OG1 3.35Å; G794-T796 VanDerWaalsContact C-N 3.33Å; G794-T796 PolarHBondContact O-N 3.15Å; T796-H798 VanDerWaalsContact C-N 3.25Å; T796-H798 PolarHBondContact O-N 3.07Å; T796-A799 PolarHBondContact O-N 2.9Å; T796-A800 VanDerWaalsContact O-CB 3.31Å; T796-A800 WeakPolarHBondContact O-CB 3.37Å; T796-A800 PolarHBondContact O-N 3.33Å; T796-Y843 HydrophobicContact CG2-CD1 4.38Å; T796-Y843 HydrophobicContact CG2-CD2 3.62Å; T796-Y843 HydrophobicContact CG2-CE1 4.16Å; T796-Y843 HydrophobicContact CG2-CE2 3.35Å; T796-Y843 HydrophobicContact CG2-CG 4.11Å
797	A	92.6	Very high	91.9	Very high	5 Å²	5	16.6 Å²	16.6	4%	0.041	9%	0.092	C	C	.	.	H	α-helix	trans	-65.7	-27	175.3	0	0	0	0	0	113.2	F754 W790 G794 H795 R801	F754-A797 VanDerWaalsContact O-CA 3.32Å; F754-A797 WeakPolarHBondContact O-CA 3.05Å; F754-A797 WeakPolarHBondContact O-CB 3.46Å; W790-A797 HydrophobicContact CH2-CB 4.29Å; G794-A797 WeakPolarHBondContact O-CB 2.97Å; G794-A797 PolarHBondContact O-N 3.06Å; G794-A797 VanDerWaalsContact O-N 3.13Å; H795-A797 VanDerWaalsContact C-N 3.33Å; H795-A797 PolarHBondContact O-N 2.9Å; A797-R801 WeakPolarHBondContact O-CB 3.47Å; A797-R801 WeakPolarHBondContact O-CD 3.38Å; A797-R801 VanDerWaalsContact O-CG 3.29Å; A797-R801 WeakPolarHBondContact O-CG 3.41Å
798	H	93.9	Very high	92.4	Very high	56 Å²	56	14.8 Å²	14.8	26%	0.259	8%	0.082	S	C	.	.	H	α-helix	trans	-77.1	-47.8	172.7	-174	-17.6	0	0	0	111.6	R736 G794 H795 T796 R801 L802	R736-H798 PolarHBondContact NE-CE1 3.42Å; R736-H798 VanDerWaalsContact NE-CE1 3.27Å; R736-H798 PolarHBondContact NE-ND1 3.13Å; R736-H798 PolarHBondContact NH2-CD2 3.34Å; R736-H798 VanDerWaalsContact NH2-CD2 3.34Å; R736-H798 PolarHBondContact NH2-CE1 2.77Å; R736-H798 PolarHBondContact NH2-NE2 3.44Å; G794-H798 PolarHBondContact O-N 3.06Å; H795-H798 WeakPolarHBondContact O-CA 2.98Å; H795-H798 WeakPolarHBondContact O-CB 3.32Å; H795-H798 PolarHBondContact O-N 3.35Å; H795-H798 VanDerWaalsContact O-N 3.07Å; T796-H798 VanDerWaalsContact C-N 3.25Å; T796-H798 PolarHBondContact O-N 3.07Å; H798-R801 PolarHBondContact O-N 2.84Å; H798-L802 WeakPolarHBondContact CE1-CD1 3.43Å; H798-L802 PolarHBondContact O-N 2.79Å
799	A	96.6	Very high	92.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-66.3	-50.7	-177.4	0	0	0	0	0	111.6	M693 H696 H795 T796 R801 L802 A803	M693-A799 HydrophobicContact CB-CB 4.48Å; H696-A799 HydrophobicContact CB-CB 3.58Å; H795-A799 WeakPolarHBondContact O-CB 3.49Å; H795-A799 PolarHBondContact O-N 3.41Å; T796-A799 PolarHBondContact O-N 2.9Å; A799-R801 PolarHBondContact O-N 3.36Å; A799-R801 VanDerWaalsContact O-N 3.16Å; A799-L802 CarbonylContact O-C 3.55Å; A799-L802 WeakPolarHBondContact O-CA 3.45Å; A799-L802 WeakPolarHBondContact O-CB 3.29Å; A799-L802 PolarHBondContact O-N 3.22Å; A799-A803 PolarHBondContact O-N 3.12Å
800	A	96.9	Very high	93.3	Very high	2 Å²	2	14.9 Å²	14.9	2%	0.017	8%	0.081	C	C	.	.	H	α-helix	trans	-61	-28.8	178.9	0	0	0	0	0	112.8	T796 A804 P828 F844	T796-A800 VanDerWaalsContact O-CB 3.31Å; T796-A800 WeakPolarHBondContact O-CB 3.37Å; T796-A800 PolarHBondContact O-N 3.33Å; A800-A804 WeakPolarHBondContact O-CB 3.48Å; A800-A804 PolarHBondContact O-N 3.01Å; A800-P828 HydrophobicContact CB-CG 3.82Å; A800-F844 HydrophobicContact CB-CD2 3.7Å; A800-F844 HydrophobicContact CB-CE2 4.26Å
801	R	97.4	Very high	93.8	Very high	47 Å²	47	14.5 Å²	14.5	18%	0.177	8%	0.08	C	C	.	.	H	α-helix	trans	-79.1	-31.4	172.2	-73.5	-176.9	61.3	-166.1	-4.2	113.6	R736 A737 L742 G755 A797 H798 A799 G805 F844	R736-R801 CarbonylContact C-O 3.6Å; R736-R801 WeakPolarHBondContact CA-O 3.43Å; R736-R801 HydrophobicContact CB-CB 4.14Å; R736-R801 HydrophobicContact CG-CB 4.43Å; A737-R801 PolarHBondContact N-O 3.08Å; A737-R801 PolarHBondContact O-NE 3.41Å; A737-R801 PolarHBondContact O-NH2 3.27Å; L742-R801 HydrophobicContact CD1-CG 3.99Å; G755-R801 WeakPolarHBondContact O-CD 3.19Å; G755-R801 PolarHBondContact O-NH1 2.82Å; A797-R801 WeakPolarHBondContact O-CB 3.47Å; A797-R801 WeakPolarHBondContact O-CD 3.38Å; A797-R801 VanDerWaalsContact O-CG 3.29Å; A797-R801 WeakPolarHBondContact O-CG 3.41Å; H798-R801 PolarHBondContact O-N 2.84Å; A799-R801 PolarHBondContact O-N 3.36Å; A799-R801 VanDerWaalsContact O-N 3.16Å; R801-G805 PolarHBondContact O-N 3.09Å; R801-G805 VanDerWaalsContact O-N 3.14Å; R801-F844 HydrophobicContact CG-CD2 4.38Å; R801-F844 HydrophobicContact CG-CE2 4.09Å
802	L	97.8	Very high	94.4	Very high	6 Å²	6	13.6 Å²	13.6	3%	0.031	8%	0.076	C	C	.	.	H	α-helix	trans	-65.8	-49.2	169.4	-77.8	173.6	0	0	0	110.4	D690 M693 R735 R736 H798 A799 A804 G805 C806	D690-L802 HydrophobicContact CB-CD1 4.36Å; D690-L802 WeakPolarHBondContact OD1-CD1 3.29Å; M693-L802 HydrophobicContact CG-CB 3.58Å; M693-L802 HydrophobicContact CG-CD1 3.97Å; M693-L802 HydrophobicContact CG-CG 4.47Å; M693-L802 HydrophobicContact SD-CB 4.18Å; R735-L802 WeakPolarHBondContact O-CA 3.09Å; R736-L802 HydrophobicContact CG-CD2 4.17Å; R736-L802 HydrophobicContact CG-CG 4.39Å; H798-L802 WeakPolarHBondContact CE1-CD1 3.43Å; H798-L802 PolarHBondContact O-N 2.79Å; A799-L802 CarbonylContact O-C 3.55Å; A799-L802 WeakPolarHBondContact O-CA 3.45Å; A799-L802 WeakPolarHBondContact O-CB 3.29Å; A799-L802 PolarHBondContact O-N 3.22Å; L802-A804 PolarHBondContact O-N 2.96Å; L802-G805 PolarHBondContact O-N 3.25Å; L802-G805 VanDerWaalsContact O-N 3.08Å; L802-C806 WeakPolarHBondContact O-CB 3.28Å; L802-C806 PolarHBondContact O-N 2.88Å; L802-C806 PolarHBondContact O-SG 2.62Å
803	A	98.5	Very high	95.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-50.9	-55.8	177.1	0	0	0	0	0	111.6	M693 A799 G805 C806 V807 V826	M693-A803 HydrophobicContact SD-CB 4.01Å; A799-A803 PolarHBondContact O-N 3.12Å; A803-G805 VanDerWaalsContact C-N 3.33Å; A803-G805 PolarHBondContact O-N 3.36Å; A803-C806 PolarHBondContact O-N 3.39Å; A803-V807 WeakPolarHBondContact O-CG2 3.31Å; A803-V807 PolarHBondContact O-N 3.34Å; A803-V807 VanDerWaalsContact O-N 3.15Å; A803-V826 HydrophobicContact CB-CB 3.84Å; A803-V826 HydrophobicContact CB-CG1 4.34Å; A803-V826 HydrophobicContact CB-CG2 4.44Å
804	A	98.6	Very high	96.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.9	-41	177.2	0	0	0	0	0	112.9	A737 L742 A800 L802 V808 S846 I849	A737-A804 HydrophobicContact CB-CB 3.89Å; L742-A804 HydrophobicContact CD2-CB 4.16Å; A800-A804 WeakPolarHBondContact O-CB 3.48Å; A800-A804 PolarHBondContact O-N 3.01Å; L802-A804 PolarHBondContact O-N 2.96Å; A804-V808 WeakPolarHBondContact O-CB 3.2Å; A804-V808 WeakPolarHBondContact O-CG2 3.37Å; A804-V808 PolarHBondContact O-N 3.27Å; A804-S846 WeakPolarHBondContact CA-OG 3.4Å; A804-S846 PolarHBondContact N-OG 3.23Å; A804-I849 HydrophobicContact CB-CD1 4.21Å
805	G	98.5	Very high	96.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-70.1	-37.8	179.6	0	0	0	0	0	113.7	R735 R801 L802 A803 D809	R735-G805 WeakPolarHBondContact O-CA 3.12Å; R801-G805 PolarHBondContact O-N 3.09Å; R801-G805 VanDerWaalsContact O-N 3.14Å; L802-G805 PolarHBondContact O-N 3.25Å; L802-G805 VanDerWaalsContact O-N 3.08Å; A803-G805 VanDerWaalsContact C-N 3.33Å; A803-G805 PolarHBondContact O-N 3.36Å; G805-D809 PolarHBondContact O-N 3.36Å
806	C	98.5	Very high	97	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-58.2	-50.1	173.3	-72.3	0	0	0	0	111.5	A688 Q732 G734 L802 A803 L810 V826	A688-C806 HydrophobicContact CB-CB 4.12Å; Q732-C806 PolarHBondContact NE2-O 3.2Å; Q732-C806 VanDerWaalsContact NE2-O 3.14Å; G734-C806 WeakPolarHBondContact CA-SG 3.37Å; L802-C806 WeakPolarHBondContact O-CB 3.28Å; L802-C806 PolarHBondContact O-N 2.88Å; L802-C806 PolarHBondContact O-SG 2.62Å; A803-C806 PolarHBondContact O-N 3.39Å; C806-L810 VanDerWaalsContact O-CB 3.31Å; C806-L810 WeakPolarHBondContact O-CB 3.27Å; C806-L810 PolarHBondContact O-N 3.26Å; C806-L810 VanDerWaalsContact O-N 3.1Å; C806-V826 HydrophobicContact CB-CG1 3.67Å
807	V	98.7	Very high	97	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-67.8	-42.6	-178.9	-175.9	0	0	0	0	110.9	A803 L810 A811 A824 V826 V847 A850 S1033	A803-V807 WeakPolarHBondContact O-CG2 3.31Å; A803-V807 PolarHBondContact O-N 3.34Å; A803-V807 VanDerWaalsContact O-N 3.15Å; V807-L810 PolarHBondContact O-N 3.14Å; V807-A811 VanDerWaalsContact O-CB 3.3Å; V807-A811 WeakPolarHBondContact O-CB 3.49Å; V807-A811 PolarHBondContact O-N 3.01Å; V807-A824 HydrophobicContact CB-CB 4.46Å; V807-A824 HydrophobicContact CG2-CB 3.65Å; V807-V826 HydrophobicContact CG2-CG1 4.24Å; V807-V826 HydrophobicContact CG2-CG2 4.08Å; V807-V847 HydrophobicContact CG1-CG2 4.37Å; V807-A850 HydrophobicContact CG1-CB 3.81Å; V807-S1033 VanDerWaalsContact CG2-OG 3.28Å; V807-S1033 WeakPolarHBondContact CG2-OG 3.03Å
808	V	98.6	Very high	97.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.2	-50.9	176.8	170.1	0	0	0	0	111.5	A804 L810 A811 C812 I849 A850 R853	A804-V808 WeakPolarHBondContact O-CB 3.2Å; A804-V808 WeakPolarHBondContact O-CG2 3.37Å; A804-V808 PolarHBondContact O-N 3.27Å; V808-L810 VanDerWaalsContact C-N 3.33Å; V808-L810 PolarHBondContact O-N 2.93Å; V808-A811 PolarHBondContact O-N 2.91Å; V808-C812 WeakPolarHBondContact O-CB 3.16Å; V808-C812 PolarHBondContact O-N 2.99Å; V808-C812 PolarHBondContact O-SG 3.5Å; V808-I849 HydrophobicContact CG2-CB 4.41Å; V808-I849 HydrophobicContact CG2-CG2 3.69Å; V808-A850 HydrophobicContact CG2-CB 4.13Å; V808-R853 HydrophobicContact CG1-CB 4.21Å; V808-R853 HydrophobicContact CG1-CG 3.89Å
809	D	98	Very high	97.2	Very high	13 Å²	13	18.2 Å²	18.2	7%	0.07	9%	0.094	C	C	.	.	H	α-helix	trans	-65.9	-37.9	-178.1	-79.2	-2	0	0	0	112.1	R735 G805 C812 R813 F878	R735-D809 WeakPolarHBondContact CD-OD2 3.44Å; R735-D809 WeakPolarHBondContact CG-OD2 3.49Å; R735-D809 IonicContact CZ-OD1 3.93Å; R735-D809 IonicContact CZ-OD2 3.74Å; R735-D809 IonicContact NE-OD1 3.81Å; R735-D809 PolarHBondContact NE-OD1 2.75Å; R735-D809 IonicContact NE-OD2 2.81Å; R735-D809 PolarHBondContact NE-OD2 3.25Å; R735-D809 IonicContact NH2-OD1 3.79Å; R735-D809 PolarHBondContact NH2-OD1 2.73Å; G805-D809 PolarHBondContact O-N 3.36Å; D809-C812 PolarHBondContact O-N 2.92Å; D809-R813 WeakPolarHBondContact O-CB 3.49Å; D809-R813 WeakPolarHBondContact O-CD 3.36Å; D809-R813 WeakPolarHBondContact O-CG 3.35Å; D809-R813 PolarHBondContact O-N 2.97Å; D809-F878 HydrophobicContact CB-CE1 4.46Å; D809-F878 VanDerWaalsContact OD1-CE1 3.28Å; D809-F878 WeakPolarHBondContact OD1-CE1 3.36Å
810	L	98.5	Very high	97.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.8	-47	177.7	-177.2	55.5	0	0	0	111.6	V686 A688 C806 V807 V808 C812 R813 V814 A824 V1031	V686-L810 HydrophobicContact CB-CD1 3.7Å; V686-L810 HydrophobicContact CG1-CD1 3.71Å; A688-L810 HydrophobicContact CB-CB 4.47Å; A688-L810 HydrophobicContact CB-CD2 4.14Å; C806-L810 VanDerWaalsContact O-CB 3.31Å; C806-L810 WeakPolarHBondContact O-CB 3.27Å; C806-L810 PolarHBondContact O-N 3.26Å; C806-L810 VanDerWaalsContact O-N 3.1Å; V807-L810 PolarHBondContact O-N 3.14Å; V808-L810 VanDerWaalsContact C-N 3.33Å; V808-L810 PolarHBondContact O-N 2.93Å; L810-C812 VanDerWaalsContact C-N 3.33Å; L810-C812 PolarHBondContact O-N 2.97Å; L810-R813 PolarHBondContact O-N 3.01Å; L810-V814 HydrophobicContact CD1-CG2 4.33Å; L810-V814 PolarHBondContact O-N 2.95Å; L810-A824 HydrophobicContact CD2-CB 4Å; L810-V1031 HydrophobicContact CB-CG1 4.41Å; L810-V1031 HydrophobicContact CD2-CG1 3.77Å; L810-V1031 HydrophobicContact CG-CG1 3.81Å; L810-V1031 HydrophobicContact CG-CG2 4.03Å
811	A	98.3	Very high	97.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.9	-40.6	174.7	0	0	0	0	0	112.1	V807 V808 M815 A850 L988	V807-A811 VanDerWaalsContact O-CB 3.3Å; V807-A811 WeakPolarHBondContact O-CB 3.49Å; V807-A811 PolarHBondContact O-N 3.01Å; V808-A811 PolarHBondContact O-N 2.91Å; A811-M815 WeakPolarHBondContact O-CB 3.2Å; A811-M815 PolarHBondContact O-N 3.48Å; A811-A850 HydrophobicContact CB-CB 3.87Å; A811-L988 HydrophobicContact CB-CD2 3.94Å
812	C	97.4	Very high	97.2	Very high	6 Å²	6	16.1 Å²	16.1	4%	0.041	9%	0.086	C	C	.	.	H	α-helix	trans	-63.1	-45.8	175.5	-66.9	0	0	0	0	111.7	V808 D809 L810 M815 L816 L857 F878	V808-C812 WeakPolarHBondContact O-CB 3.16Å; V808-C812 PolarHBondContact O-N 2.99Å; V808-C812 PolarHBondContact O-SG 3.5Å; D809-C812 PolarHBondContact O-N 2.92Å; L810-C812 VanDerWaalsContact C-N 3.33Å; L810-C812 PolarHBondContact O-N 2.97Å; C812-M815 PolarHBondContact O-N 2.95Å; C812-L816 VanDerWaalsContact O-CB 3.31Å; C812-L816 WeakPolarHBondContact O-CB 3.41Å; C812-L816 WeakPolarHBondContact O-CG 3.42Å; C812-L816 PolarHBondContact O-N 3.02Å; C812-L857 HydrophobicContact CB-CD1 3.89Å; C812-F878 HydrophobicContact CB-CZ 4.27Å
813	R	97.2	Very high	97.2	Very high	76 Å²	76	15.8 Å²	15.8	29%	0.287	9%	0.085	S	C	.	.	H	α-helix	trans	-62.3	-46.7	179.5	-74	161.9	174.8	-149.3	-8	112.3	D809 L810 L816 G817 Q818 F878	D809-R813 WeakPolarHBondContact O-CB 3.49Å; D809-R813 WeakPolarHBondContact O-CD 3.36Å; D809-R813 WeakPolarHBondContact O-CG 3.35Å; D809-R813 PolarHBondContact O-N 2.97Å; L810-R813 PolarHBondContact O-N 3.01Å; R813-L816 PolarHBondContact O-N 2.92Å; R813-G817 PolarHBondContact O-N 3.24Å; R813-G817 VanDerWaalsContact O-N 3.11Å; R813-Q818 HydrophobicContact CB-CB 4.22Å; R813-Q818 WeakPolarHBondContact O-CB 3.48Å; R813-Q818 PolarHBondContact O-N 3.39Å; R813-F878 HydrophobicContact CG-CZ 4.36Å
814	V	97.3	Very high	97.2	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-66.3	-43.4	177.1	171.5	0	0	0	0	111.4	L810 L816 G817 C819 I986 K1029 V1031	L810-V814 HydrophobicContact CD1-CG2 4.33Å; L810-V814 PolarHBondContact O-N 2.95Å; V814-L816 VanDerWaalsContact C-N 3.33Å; V814-L816 PolarHBondContact O-N 3.43Å; V814-G817 PolarHBondContact O-N 3Å; V814-C819 WeakPolarHBondContact CG2-SG 3.4Å; V814-I986 HydrophobicContact CB-CD1 4.25Å; V814-I986 HydrophobicContact CG1-CD1 4.02Å; V814-I986 HydrophobicContact CG1-CG1 4.47Å; V814-K1029 HydrophobicContact CG1-CB 3.66Å; V814-K1029 HydrophobicContact CG1-CG 3.98Å; V814-K1029 WeakPolarHBondContact O-CD 3.36Å; V814-K1029 WeakPolarHBondContact O-CE 3.47Å; V814-V1031 HydrophobicContact CB-CG2 3.76Å; V814-V1031 HydrophobicContact CG1-CG2 4.06Å; V814-V1031 HydrophobicContact CG2-CG2 3.57Å
815	M	95.6	Very high	97.2	Very high	23 Å²	23	15.8 Å²	15.8	11%	0.113	9%	0.085	C	C	.	.	H	α-helix	trans	-58.5	-44.6	176.6	-176.8	60.9	-176.2	0	0	111.6	A811 C812 G817 L857 P894 I986 K1029	A811-M815 WeakPolarHBondContact O-CB 3.2Å; A811-M815 PolarHBondContact O-N 3.48Å; C812-M815 PolarHBondContact O-N 2.95Å; M815-G817 PolarHBondContact O-N 3.47Å; M815-L857 HydrophobicContact CB-CD1 4.41Å; M815-L857 HydrophobicContact CG-CB 4.3Å; M815-L857 HydrophobicContact CG-CD1 4.34Å; M815-P894 HydrophobicContact CE-CB 3.43Å; M815-P894 VanDerWaalsContact CE-CB 3.43Å; M815-P894 HydrophobicContact CE-CG 3.85Å; M815-I986 HydrophobicContact CB-CD1 4.08Å; M815-I986 HydrophobicContact SD-CB 4.02Å; M815-I986 HydrophobicContact SD-CG2 3.93Å; M815-K1029 PolarHBondContact O-NZ 3.03Å
816	L	95	Very high	97.3	Very high	78 Å²	78	15.9 Å²	15.9	41%	0.408	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-3.7	177	-66.3	170.8	0	0	0	114.2	C812 R813 V814 Q818 L857	C812-L816 VanDerWaalsContact O-CB 3.31Å; C812-L816 WeakPolarHBondContact O-CB 3.41Å; C812-L816 WeakPolarHBondContact O-CG 3.42Å; C812-L816 PolarHBondContact O-N 3.02Å; R813-L816 PolarHBondContact O-N 2.92Å; V814-L816 VanDerWaalsContact C-N 3.33Å; V814-L816 PolarHBondContact O-N 3.43Å; L816-Q818 VanDerWaalsContact C-N 3.32Å; L816-Q818 HydrophobicContact CB-CG 4.07Å; L816-Q818 PolarHBondContact O-N 2.84Å; L816-L857 HydrophobicContact CD1-CD1 4.46Å; L816-L857 HydrophobicContact CG-CD1 4.24Å
817	G	94	Very high	97.2	Very high	35 Å²	35	15.9 Å²	15.9	36%	0.361	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	22.5	-178.8	0	0	0	0	0	114.5	F683 R813 V814 M815 C819	F683-G817 WeakPolarHBondContact CE2-O 3.27Å; R813-G817 PolarHBondContact O-N 3.24Å; R813-G817 VanDerWaalsContact O-N 3.11Å; V814-G817 PolarHBondContact O-N 3Å; M815-G817 PolarHBondContact O-N 3.47Å; G817-C819 VanDerWaalsContact C-N 3.32Å
818	Q	94.5	Very high	97.2	Very high	87 Å²	87	16 Å²	16	41%	0.407	9%	0.086	S	C	.	.	S	Bend	trans	-78.6	-18.4	176.7	-63.1	178.7	-25	0	0	112.5	R813 L816	R813-Q818 HydrophobicContact CB-CB 4.22Å; R813-Q818 WeakPolarHBondContact O-CB 3.48Å; R813-Q818 PolarHBondContact O-N 3.39Å; L816-Q818 VanDerWaalsContact C-N 3.32Å; L816-Q818 HydrophobicContact CB-CG 4.07Å; L816-Q818 PolarHBondContact O-N 2.84Å
819	C	95.1	Very high	97.2	Very high	9 Å²	9	16.1 Å²	16.1	6%	0.061	9%	0.086	C	C	.	.	S	Bend	trans	-149	158.1	168	54.9	0	0	0	0	109	V686 V814 G817	V686-C819 HydrophobicContact CG2-CB 3.54Å; V814-C819 WeakPolarHBondContact CG2-SG 3.4Å; G817-C819 VanDerWaalsContact C-N 3.32Å
820	P	94.6	Very high	97.2	Very high	4 Å²	4	15.5 Å²	15.5	3%	0.026	8%	0.083	C	C	.	.	S	Bend	trans	-68.6	-46.7	-176.5	23.8	-32.2	0	0	0	112.6	F683 T684 A1058 I1061	F683-P820 HydrophobicContact CD1-CB 4.06Å; F683-P820 HydrophobicContact CD1-CG 4.03Å; F683-P820 HydrophobicContact CE1-CB 3.58Å; F683-P820 HydrophobicContact CE1-CG 4.01Å; F683-P820 HydrophobicContact CZ-CB 4.13Å; T684-P820 WeakPolarHBondContact O-CD 3.18Å; P820-A1058 HydrophobicContact CB-CB 4.22Å; P820-A1058 HydrophobicContact CG-CB 3.69Å; P820-I1061 HydrophobicContact CB-CD1 3.59Å
821	N	98	Very high	97.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.084	C	C	.	.			trans	-164.1	177.8	-171.3	60.1	30.5	0	0	0	110.3	T685 V686 V1030 L1054	T685-N821 WeakPolarHBondContact CA-OD1 3.38Å; T685-N821 VanDerWaalsContact CB-OD1 3.31Å; T685-N821 WeakPolarHBondContact CB-OD1 3.4Å; T685-N821 WeakPolarHBondContact CG2-OD1 3.45Å; T685-N821 PolarHBondContact OG1-OD1 2.86Å; V686-N821 PolarHBondContact N-O 2.95Å; N821-V1030 VanDerWaalsContact CA-O 3.25Å; N821-V1030 WeakPolarHBondContact CA-O 3.2Å; N821-V1030 VanDerWaalsContact CB-O 3.24Å; N821-V1030 WeakPolarHBondContact CB-O 3.46Å; N821-L1054 HydrophobicContact CB-CD2 4.02Å; N821-L1054 PolarHBondContact ND2-O 3.32Å
822	G	98.4	Very high	97.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	178.1	173.2	0	0	0	0	0	116.9	V686 V1030 V1031 L1032	V686-G822 CarbonylContact O-C 3.6Å; V686-G822 WeakPolarHBondContact O-CA 3.17Å; G822-V1030 PolarHBondContact N-O 3.12Å; G822-V1030 VanDerWaalsContact N-O 3.07Å; G822-V1031 WeakPolarHBondContact O-CA 3.29Å; G822-L1032 PolarHBondContact O-N 2.88Å
823	F	98.8	Very high	97.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	120.3	175.8	-156	-22.8	0	0	0	109.8	V686 L687 A688 L825 A991 F993 L1032 L1034 T1047 C1050 V1051 L1054	V686-F823 PolarHBondContact O-N 3.41Å; L687-F823 WeakPolarHBondContact CA-O 3.39Å; L687-F823 HydrophobicContact CD2-CB 3.96Å; A688-F823 PolarHBondContact N-O 2.84Å; F823-L825 HydrophobicContact CB-CD2 4.48Å; F823-L825 HydrophobicContact CD1-CD2 3.76Å; F823-L825 HydrophobicContact CD2-CD2 4.19Å; F823-L825 HydrophobicContact CE1-CD2 3.99Å; F823-L825 HydrophobicContact CE2-CD2 4.4Å; F823-L825 HydrophobicContact CG-CD2 3.88Å; F823-L825 HydrophobicContact CZ-CD2 4.31Å; F823-A991 HydrophobicContact CE1-CB 4.36Å; F823-A991 HydrophobicContact CZ-CB 4.28Å; F823-F993 HydrophobicContact CE2-CE2 4.35Å; F823-F993 HydrophobicContact CE2-CZ 4.09Å; F823-F993 AromaticContact CZ-CE2 3.78Å; F823-F993 HydrophobicContact CZ-CE2 3.78Å; F823-F993 AromaticContact CZ-CZ 3.76Å; F823-F993 HydrophobicContact CZ-CZ 3.76Å; F823-L1032 CarbonylContact C-O 3.57Å; F823-L1032 WeakPolarHBondContact CA-O 3.28Å; F823-L1032 HydrophobicContact CB-CB 4.31Å; F823-L1032 HydrophobicContact CD1-CB 3.44Å; F823-L1032 VanDerWaalsContact CD1-CB 3.44Å; F823-L1032 HydrophobicContact CD2-CB 4.11Å; F823-L1032 HydrophobicContact CD2-CD2 3.77Å; F823-L1032 HydrophobicContact CE1-CB 3.65Å; F823-L1032 HydrophobicContact CE1-CD2 4.39Å; F823-L1032 HydrophobicContact CE2-CB 4.28Å; F823-L1032 HydrophobicContact CE2-CD2 3.61Å; F823-L1032 HydrophobicContact CG-CB 3.69Å; F823-L1032 HydrophobicContact CG-CD2 4.24Å; F823-L1032 HydrophobicContact CZ-CB 4.06Å; F823-L1032 HydrophobicContact CZ-CD2 3.94Å; F823-L1034 HydrophobicContact CE1-CB 4.22Å; F823-T1047 HydrophobicContact CD2-CG2 4.24Å; F823-T1047 HydrophobicContact CE2-CG2 3.8Å; F823-T1047 HydrophobicContact CZ-CG2 4.36Å; F823-C1050 HydrophobicContact CD2-CB 4.18Å; F823-C1050 HydrophobicContact CE2-CB 3.78Å; F823-V1051 HydrophobicContact CD2-CG2 4.04Å; F823-L1054 HydrophobicContact CB-CD1 4.03Å; F823-L1054 HydrophobicContact CD2-CD1 4.5Å
824	A	98.8	Very high	97.2	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	110.9	167.3	0	0	0	0	0	110.6	A688 V807 L810 V826 L1032 L1034	A688-A824 HydrophobicContact CB-CB 4.19Å; V807-A824 HydrophobicContact CB-CB 4.46Å; V807-A824 HydrophobicContact CG2-CB 3.65Å; L810-A824 HydrophobicContact CD2-CB 4Å; A824-V826 HydrophobicContact CB-CG1 3.93Å; A824-V826 PolarHBondContact O-N 2.91Å; A824-L1032 PolarHBondContact N-O 2.99Å; A824-L1034 PolarHBondContact O-N 2.92Å
825	L	98.7	Very high	97.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.093	C	C	.	.			trans	-91.5	81.7	179.4	-56.5	178.9	0	0	0	108.4	L687 A688 Y689 M693 L713 I716 W717 L720 F823 T1047	L687-L825 HydrophobicContact CD2-CD1 4.48Å; A688-L825 PolarHBondContact O-N 3.11Å; Y689-L825 HydrophobicContact CD2-CB 4.07Å; M693-L825 VanDerWaalsContact CE-O 3.3Å; M693-L825 WeakPolarHBondContact CE-O 3.43Å; L713-L825 WeakPolarHBondContact CD1-O 3.4Å; L713-L825 HydrophobicContact CD2-CB 4.26Å; L713-L825 WeakPolarHBondContact CD2-O 3.46Å; I716-L825 HydrophobicContact CG2-CD1 3.93Å; I716-L825 HydrophobicContact CG2-CD2 4.1Å; W717-L825 HydrophobicContact CE3-CD1 4.06Å; W717-L825 HydrophobicContact CZ3-CD1 4.34Å; L720-L825 HydrophobicContact CD1-CD1 3.69Å; F823-L825 HydrophobicContact CB-CD2 4.48Å; F823-L825 HydrophobicContact CD1-CD2 3.76Å; F823-L825 HydrophobicContact CD2-CD2 4.19Å; F823-L825 HydrophobicContact CE1-CD2 3.99Å; F823-L825 HydrophobicContact CE2-CD2 4.4Å; F823-L825 HydrophobicContact CG-CD2 3.88Å; F823-L825 HydrophobicContact CZ-CD2 4.31Å; L825-T1047 HydrophobicContact CD2-CG2 3.81Å
826	V	98.6	Very high	97.1	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	10%	0.103	C	C	.	.			trans	-120.1	157.1	-164.1	-66.6	0	0	0	0	113.7	M693 A803 C806 V807 A824	M693-V826 HydrophobicContact CE-CB 4.31Å; M693-V826 HydrophobicContact CE-CG1 4.02Å; M693-V826 HydrophobicContact SD-CB 3.81Å; M693-V826 HydrophobicContact SD-CG1 3.83Å; A803-V826 HydrophobicContact CB-CB 3.84Å; A803-V826 HydrophobicContact CB-CG1 4.34Å; A803-V826 HydrophobicContact CB-CG2 4.44Å; C806-V826 HydrophobicContact CB-CG1 3.67Å; V807-V826 HydrophobicContact CG2-CG1 4.24Å; V807-V826 HydrophobicContact CG2-CG2 4.08Å; A824-V826 HydrophobicContact CB-CG1 3.93Å; A824-V826 PolarHBondContact O-N 2.91Å
827	R	98	Very high	97	Very high	1 Å²	1	17.4 Å²	17.4	0%	0.004	10%	0.103	C	C	.	.	S	Bend	trans	-156.5	156.2	165.5	69.1	177.5	-72.1	-90.1	2.4	111.8	M693 H696 E708 N709 L713	M693-R827 HydrophobicContact CB-CG 4.14Å; M693-R827 PolarHBondContact O-NH1 2.69Å; H696-R827 VanDerWaalsContact O-CZ 3.28Å; H696-R827 PolarHBondContact O-NH1 3.38Å; H696-R827 PolarHBondContact O-NH2 3.5Å; E708-R827 IonicContact OE1-CZ 3.89Å; E708-R827 IonicContact OE1-NE 3.16Å; E708-R827 PolarHBondContact OE1-NE 3.29Å; E708-R827 IonicContact OE1-NH2 3.92Å; E708-R827 IonicContact OE2-CZ 2.81Å; E708-R827 IonicContact OE2-NE 2.85Å; E708-R827 PolarHBondContact OE2-NE 3.43Å; E708-R827 IonicContact OE2-NH2 3.48Å; E708-R827 PolarHBondContact OE2-NH2 2.97Å; N709-R827 PolarHBondContact O-NE 2.98Å; L713-R827 HydrophobicContact CD1-CB 4.33Å; L713-R827 HydrophobicContact CD1-CG 3.68Å; L713-R827 HydrophobicContact CG-CB 4.42Å; L713-R827 HydrophobicContact CG-CG 3.97Å
828	P	97.8	Very high	97	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.013	9%	0.086	C	C	.	.	S	Bend	cis	-63.7	165.5	-6.6	29.2	-33.9	0	0	0	112.1	A800 Y843	A800-P828 HydrophobicContact CB-CG 3.82Å; P828-Y843 HydrophobicContact CB-CD2 4.48Å; P828-Y843 HydrophobicContact CG-CD2 4.07Å
829	P	98.4	Very high	97.1	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.019	8%	0.075	C	C	.	.			trans	-61.9	173.7	172.4	27.9	-36.1	0	0	0	112.5	E708 F841 C842 E1035	E708-P829 HydrophobicContact CG-CG 4.3Å; P829-F841 HydrophobicContact CG-CB 3.84Å; P829-C842 WeakPolarHBondContact O-CA 3.35Å; P829-E1035 HydrophobicContact CB-CB 4.37Å
830	G	98.4	Very high	97	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.074	C	C	.	.			trans	-132.8	-31.2	-173.3	0	0	0	0	0	116.8	H832 A833 C842 F844 N845 E1035	G830-H832 VanDerWaalsContact C-N 3.3Å; G830-H832 PolarHBondContact O-N 2.85Å; G830-H832 VanDerWaalsContact O-N 3.14Å; G830-A833 WeakPolarHBondContact O-CB 3.49Å; G830-A833 PolarHBondContact O-N 3.43Å; G830-C842 PolarHBondContact N-SG 2.96Å; G830-C842 VanDerWaalsContact N-SG 3.43Å; G830-F844 WeakPolarHBondContact CA-O 3.5Å; G830-N845 VanDerWaalsContact O-CA 3.28Å; G830-N845 WeakPolarHBondContact O-CA 3.39Å; G830-N845 VanDerWaalsContact O-CB 3.29Å; G830-N845 WeakPolarHBondContact O-CB 3.34Å; G830-E1035 PolarHBondContact N-OE2 3.33Å
831	H	98.6	Very high	97.1	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.009	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.7	-165.9	72	145.2	0	0	0	115.9	N845 D900 D902 H904 G906 G908 T909 E1035	H831-N845 PolarHBondContact O-ND2 3.02Å; H831-D900 IonicContact CE1-OD2 3.99Å; H831-D900 IonicContact CG-OD2 2.67Å; H831-D900 IonicContact ND1-OD1 3.82Å; H831-D900 IonicContact ND1-OD2 3.58Å; H831-D900 PolarHBondContact ND1-OD2 3.01Å; H831-D902 VanDerWaalsContact CE1-CB 3.45Å; H831-D902 WeakPolarHBondContact CE1-CB 3.41Å; H831-D902 IonicContact CE1-OD1 2.7Å; H831-D902 IonicContact CE1-OD2 3.52Å; H831-D902 IonicContact NE2-OD1 3.87Å; H831-D902 IonicContact NE2-OD2 3.62Å; H831-H904 PolarHBondContact CE1-O 3.19Å; H831-G906 WeakPolarHBondContact ND1-CA 3.3Å; H831-G906 CarbonylContact O-C 3.59Å; H831-G908 CarbonylContact O-C 3.59Å; H831-G908 WeakPolarHBondContact O-CA 3.28Å; H831-G908 PolarHBondContact O-N 3.32Å; H831-T909 PolarHBondContact O-N 3.44Å; H831-T909 VanDerWaalsContact O-N 3.14Å; H831-E1035 HydrophobicContact CB-CG 4.41Å; H831-E1035 IonicContact CD2-OE2 2.77Å; H831-E1035 IonicContact CG-OE2 2.8Å; H831-E1035 PolarHBondContact N-OE2 3.1Å
832	H	98.5	Very high	97.1	Very high	6 Å²	6	14.2 Å²	14.2	3%	0.028	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.9	173.9	-64.7	-53.6	0	0	0	115	G830 E834 M839 C842 H904 H905 N907 F933	G830-H832 VanDerWaalsContact C-N 3.3Å; G830-H832 PolarHBondContact O-N 2.85Å; G830-H832 VanDerWaalsContact O-N 3.14Å; H832-E834 PolarHBondContact O-N 2.9Å; H832-E834 VanDerWaalsContact O-N 3.16Å; H832-M839 HydrophobicContact CB-CG 4.25Å; H832-M839 WeakPolarHBondContact CB-O 3.5Å; H832-C842 HydrophobicContact CB-CB 3.94Å; H832-H904 VanDerWaalsContact CE1-CB 3.45Å; H832-H904 WeakPolarHBondContact CE1-CB 3.38Å; H832-H904 WeakPolarHBondContact NE2-CB 3.31Å; H832-H905 PolarHBondContact CE1-O 3.17Å; H832-H905 PolarHBondContact ND1-O 3.37Å; H832-H905 VanDerWaalsContact ND1-O 3.14Å; H832-N907 WeakPolarHBondContact CA-OD1 3.36Å; H832-N907 PolarHBondContact ND1-OD1 2.95Å; H832-F933 AromaticContact CD2-CE1 3.9Å; H832-F933 AromaticContact CE1-CE1 3.86Å; H832-F933 AromaticContact NE2-CE1 3.55Å
833	A	97.7	Very high	97	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.			trans	-74.6	108.6	-176.7	0	0	0	0	0	111.2	H746 G830 C842 N845	H746-A833 PolarHBondContact CE1-O 3.41Å; G830-A833 WeakPolarHBondContact O-CB 3.49Å; G830-A833 PolarHBondContact O-N 3.43Å; A833-C842 HydrophobicContact CB-CB 3.83Å; A833-N845 HydrophobicContact CB-CB 4.42Å
834	E	97.3	Very high	97	Very high	64 Å²	64	14.4 Å²	14.4	30%	0.299	8%	0.08	S	C	.	.	B	Isolated β-bridge	trans	-77.7	167.7	178.4	-68.4	-171.7	-179.9	0	0	112.3	H746 H832 G836 Q837 N907	H746-E834 PolarHBondContact ND1-O 2.71Å; H832-E834 PolarHBondContact O-N 2.9Å; H832-E834 VanDerWaalsContact O-N 3.16Å; E834-G836 PolarHBondContact O-N 3.03Å; E834-Q837 HydrophobicContact CB-CB 4.24Å; E834-Q837 PolarHBondContact N-O 2.94Å; E834-Q837 PolarHBondContact O-N 3.09Å; E834-N907 PolarHBondContact OE1-ND2 3.21Å
835	P	96.4	Very high	97	Very high	30 Å²	30	14.4 Å²	14.4	20%	0.195	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-8.6	175.9	-30.8	37.8	0	0	0	116.7	V745 H746 K747 T911 V912	V745-P835 WeakPolarHBondContact O-CA 3.49Å; V745-P835 WeakPolarHBondContact O-CB 3.28Å; H746-P835 WeakPolarHBondContact CA-O 3.36Å; K747-P835 WeakPolarHBondContact CB-O 3.43Å; K747-P835 WeakPolarHBondContact CD-O 3.37Å; K747-P835 WeakPolarHBondContact CG-O 3.29Å; K747-P835 PolarHBondContact N-O 2.65Å; P835-T911 HydrophobicContact CG-CG2 4.16Å; P835-V912 HydrophobicContact CG-CG2 3.85Å
836	G	93.2	Very high	97	Very high	31 Å²	31	14.5 Å²	14.5	32%	0.32	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-153	12.6	174.1	0	0	0	0	0	116.4	Y750 E834	Y750-G836 WeakPolarHBondContact CD2-O 3.3Å; E834-G836 PolarHBondContact O-N 3.03Å
837	Q	93.3	Very high	97	Very high	90 Å²	90	14.5 Å²	14.5	42%	0.421	8%	0.08	S	C	.	.	B	Isolated β-bridge	trans	-137.7	133.8	-178	-177.5	62	40.7	0	0	110.1	Y750 E834 M839	Y750-Q837 PolarHBondContact OH-O 2.97Å; E834-Q837 HydrophobicContact CB-CB 4.24Å; E834-Q837 PolarHBondContact N-O 2.94Å; E834-Q837 PolarHBondContact O-N 3.09Å; Q837-M839 HydrophobicContact CG-CG 4.49Å
838	A	94.5	Very high	97	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.008	8%	0.08	C	C	.	.			trans	-98.4	133.7	169.5	0	0	0	0	0	107.6	Y750 F754 V784 C842 Y843	Y750-A838 HydrophobicContact CE2-CB 4.28Å; Y750-A838 WeakPolarHBondContact OH-CA 3.36Å; Y750-A838 WeakPolarHBondContact OH-CB 3.47Å; Y750-A838 PolarHBondContact OH-N 2.9Å; F754-A838 HydrophobicContact CE2-CB 4.48Å; F754-A838 HydrophobicContact CZ-CB 4.28Å; V784-A838 HydrophobicContact CG2-CB 3.96Å; A838-C842 WeakPolarHBondContact CA-O 3.35Å; A838-C842 WeakPolarHBondContact CB-O 3.29Å; A838-Y843 HydrophobicContact CB-CD1 3.94Å; A838-Y843 HydrophobicContact CB-CE1 4.18Å
839	M	95.3	Very high	97.1	Very high	34 Å²	34	14.3 Å²	14.3	17%	0.167	8%	0.08	C	C	.	.	B	Isolated β-bridge	trans	-167	161.4	-178.4	56.1	176.7	-77.1	0	0	111.4	D785 T788 H832 Q837 F841 C842 F933 P934	D785-M839 VanDerWaalsContact OD2-CA 3.26Å; D785-M839 WeakPolarHBondContact OD2-CA 3.48Å; T788-M839 VanDerWaalsContact OG1-C 3.32Å; T788-M839 WeakPolarHBondContact OG1-CA 3.35Å; H832-M839 HydrophobicContact CB-CG 4.25Å; H832-M839 WeakPolarHBondContact CB-O 3.5Å; Q837-M839 HydrophobicContact CG-CG 4.49Å; M839-F841 PolarHBondContact O-N 3.2Å; M839-C842 PolarHBondContact N-O 3.21Å; M839-C842 VanDerWaalsContact O-CB 3.3Å; M839-C842 WeakPolarHBondContact O-CB 3.41Å; M839-C842 PolarHBondContact O-N 3.48Å; M839-F933 HydrophobicContact CE-CE2 4.12Å; M839-F933 HydrophobicContact CE-CZ 3.72Å; M839-P934 HydrophobicContact CE-CB 3.83Å
840	G	94.6	Very high	97.1	Very high	4 Å²	4	14.2 Å²	14.2	4%	0.041	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	47.7	176.7	0	0	0	0	0	111.9	D787 T788 C842	D787-G840 PolarHBondContact OD2-N 2.94Å; T788-G840 PolarHBondContact OG1-N 3.35Å; T788-G840 VanDerWaalsContact OG1-N 3.1Å; G840-C842 PolarHBondContact O-N 3.37Å; G840-C842 PolarHBondContact O-SG 2.89Å
841	F	96.2	Very high	97.1	Very high	30 Å²	30	14.2 Å²	14.2	13%	0.132	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	-9.2	-169.8	-38.7	-68.2	0	0	0	116.2	P707 E708 D787 T788 P829 M839 Y1038	P707-F841 HydrophobicContact CB-CZ 4.49Å; E708-F841 HydrophobicContact CB-CB 3.95Å; E708-F841 HydrophobicContact CB-CD1 3.74Å; E708-F841 HydrophobicContact CB-CD2 4.08Å; E708-F841 HydrophobicContact CB-CE1 4.26Å; E708-F841 HydrophobicContact CB-CG 3.64Å; E708-F841 HydrophobicContact CG-CB 3.9Å; E708-F841 HydrophobicContact CG-CD2 4.46Å; E708-F841 HydrophobicContact CG-CG 4.09Å; D787-F841 HydrophobicContact CB-CD1 4.43Å; D787-F841 HydrophobicContact CB-CE1 3.86Å; D787-F841 HydrophobicContact CB-CZ 4.38Å; D787-F841 WeakPolarHBondContact O-CD1 3.15Å; T788-F841 PolarHBondContact OG1-N 3.18Å; P829-F841 HydrophobicContact CG-CB 3.84Å; M839-F841 PolarHBondContact O-N 3.2Å; F841-Y1038 HydrophobicContact CD2-CE1 4.35Å; F841-Y1038 WeakPolarHBondContact CD2-OH 3.31Å; F841-Y1038 HydrophobicContact CE2-CE1 4.14Å; F841-Y1038 AromaticContact CE2-CZ 3.91Å
842	C	97.7	Very high	97	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.084	C	C	.	.	B	Isolated β-bridge	trans	-87.5	137.3	-169.2	-61.3	0	0	0	0	113.6	P829 G830 H832 A833 A838 M839 G840	P829-C842 WeakPolarHBondContact O-CA 3.35Å; G830-C842 PolarHBondContact N-SG 2.96Å; G830-C842 VanDerWaalsContact N-SG 3.43Å; H832-C842 HydrophobicContact CB-CB 3.94Å; A833-C842 HydrophobicContact CB-CB 3.83Å; A838-C842 WeakPolarHBondContact CA-O 3.35Å; A838-C842 WeakPolarHBondContact CB-O 3.29Å; M839-C842 PolarHBondContact N-O 3.21Å; M839-C842 VanDerWaalsContact O-CB 3.3Å; M839-C842 WeakPolarHBondContact O-CB 3.41Å; M839-C842 PolarHBondContact O-N 3.48Å; G840-C842 PolarHBondContact O-N 3.37Å; G840-C842 PolarHBondContact O-SG 2.89Å
843	Y	96.4	Very high	96.9	Very high	1 Å²	1	18.4 Å²	18.4	0%	0.004	10%	0.095	C	C	.	.	S	Bend	trans	-119.2	-39.1	178.8	-78.8	-84.4	0	0	0	114.7	Y750 F754 V784 T788 A789 W790 T796 P828 A838	Y750-Y843 VanDerWaalsContact CE1-O 3.31Å; Y750-Y843 WeakPolarHBondContact CE1-O 3.47Å; Y750-Y843 PolarHBondContact OH-O 2.78Å; F754-Y843 AromaticContact CD1-CD1 3.69Å; F754-Y843 HydrophobicContact CD1-CD1 3.69Å; F754-Y843 AromaticContact CD1-CE1 3.71Å; F754-Y843 HydrophobicContact CD1-CE1 3.71Å; F754-Y843 HydrophobicContact CE1-CD1 4.13Å; F754-Y843 AromaticContact CE1-CE1 3.81Å; F754-Y843 HydrophobicContact CE1-CE1 3.81Å; F754-Y843 HydrophobicContact CG-CD1 4.2Å; V784-Y843 HydrophobicContact CG1-CE1 4.28Å; T788-Y843 HydrophobicContact CG2-CD2 4.16Å; T788-Y843 HydrophobicContact CG2-CE1 4.32Å; T788-Y843 HydrophobicContact CG2-CE2 3.48Å; T788-Y843 VanDerWaalsContact CG2-CE2 3.48Å; T788-Y843 PolarHBondContact O-OH 3.11Å; A789-Y843 VanDerWaalsContact C-OH 3.24Å; A789-Y843 PolarHBondContact O-OH 2.89Å; W790-Y843 WeakPolarHBondContact CA-OH 3.5Å; W790-Y843 WeakPolarHBondContact CB-OH 3.45Å; W790-Y843 HydrophobicContact CD2-CE1 4.46Å; W790-Y843 HydrophobicContact CE3-CD1 4.36Å; W790-Y843 AromaticContact CE3-CE1 3.51Å; W790-Y843 HydrophobicContact CE3-CE1 3.51Å; W790-Y843 AromaticContact CE3-CZ 3.7Å; W790-Y843 HydrophobicContact CZ3-CD1 4.21Å; W790-Y843 AromaticContact CZ3-CE1 3.79Å; W790-Y843 HydrophobicContact CZ3-CE1 3.79Å; T796-Y843 HydrophobicContact CG2-CD1 4.38Å; T796-Y843 HydrophobicContact CG2-CD2 3.62Å; T796-Y843 HydrophobicContact CG2-CE1 4.16Å; T796-Y843 HydrophobicContact CG2-CE2 3.35Å; T796-Y843 HydrophobicContact CG2-CG 4.11Å; P828-Y843 HydrophobicContact CB-CD2 4.48Å; P828-Y843 HydrophobicContact CG-CD2 4.07Å; A838-Y843 HydrophobicContact CB-CD1 3.94Å; A838-Y843 HydrophobicContact CB-CE1 4.18Å
844	F	98.2	Very high	96.8	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.009	10%	0.095	C	C	.	.	S	Bend	trans	-138.7	131.4	175.3	-67.5	-56.8	0	0	0	108.6	L742 H746 Y750 T751 F754 A800 R801 G830 S846 I849	L742-F844 HydrophobicContact CB-CE1 4.46Å; L742-F844 HydrophobicContact CD1-CD1 4.4Å; L742-F844 HydrophobicContact CD1-CD2 4.3Å; L742-F844 HydrophobicContact CD1-CE1 3.98Å; L742-F844 HydrophobicContact CD1-CE2 3.88Å; L742-F844 HydrophobicContact CD1-CZ 3.71Å; L742-F844 HydrophobicContact CD2-CB 4.19Å; L742-F844 HydrophobicContact CD2-CD1 4.01Å; L742-F844 HydrophobicContact CD2-CD2 3.97Å; L742-F844 HydrophobicContact CD2-CE1 4.42Å; L742-F844 HydrophobicContact CD2-CE2 4.39Å; L742-F844 HydrophobicContact CD2-CG 3.79Å; H746-F844 AromaticContact CD2-CD1 3.72Å; H746-F844 AromaticContact NE2-CD1 3.89Å; Y750-F844 HydrophobicContact CD1-CD1 4.49Å; Y750-F844 AromaticContact CD1-CE1 3.91Å; Y750-F844 HydrophobicContact CD1-CE1 3.91Å; Y750-F844 AromaticContact CE1-CD1 3.89Å; Y750-F844 HydrophobicContact CE1-CD1 3.89Å; Y750-F844 AromaticContact CE1-CE1 3.62Å; Y750-F844 HydrophobicContact CE1-CE1 3.62Å; T751-F844 HydrophobicContact CG2-CE1 4.34Å; F754-F844 HydrophobicContact CB-CE1 4.28Å; F754-F844 HydrophobicContact CB-CE2 4.28Å; F754-F844 HydrophobicContact CB-CZ 3.65Å; A800-F844 HydrophobicContact CB-CD2 3.7Å; A800-F844 HydrophobicContact CB-CE2 4.26Å; R801-F844 HydrophobicContact CG-CD2 4.38Å; R801-F844 HydrophobicContact CG-CE2 4.09Å; G830-F844 WeakPolarHBondContact CA-O 3.5Å; F844-S846 VanDerWaalsContact C-N 3.33Å; F844-S846 PolarHBondContact O-N 3.09Å; F844-S846 PolarHBondContact O-OG 3.14Å; F844-I849 HydrophobicContact CB-CD1 4.06Å
845	N	98.7	Very high	96.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.082	C	C	.	.			trans	-79.5	85.7	-176.6	-170.5	-36.7	0	0	0	110	V745 H746 G830 H831 A833 V847 A848 I849 T909	V745-N845 HydrophobicContact CG1-CB 4.42Å; H746-N845 PolarHBondContact CE1-N 3.35Å; H746-N845 PolarHBondContact NE2-N 3.27Å; G830-N845 VanDerWaalsContact O-CA 3.28Å; G830-N845 WeakPolarHBondContact O-CA 3.39Å; G830-N845 VanDerWaalsContact O-CB 3.29Å; G830-N845 WeakPolarHBondContact O-CB 3.34Å; H831-N845 PolarHBondContact O-ND2 3.02Å; A833-N845 HydrophobicContact CB-CB 4.42Å; N845-V847 VanDerWaalsContact C-N 3.28Å; N845-V847 PolarHBondContact O-N 3.14Å; N845-A848 HydrophobicContact CB-CB 3.94Å; N845-A848 PolarHBondContact O-N 3.48Å; N845-A848 WeakPolarHBondContact OD1-CB 3.43Å; N845-A848 PolarHBondContact OD1-N 3.24Å; N845-I849 WeakPolarHBondContact O-CB 3.44Å; N845-I849 WeakPolarHBondContact O-CD1 3.3Å; N845-I849 WeakPolarHBondContact O-CG1 3.47Å; N845-I849 PolarHBondContact O-N 3.24Å; N845-T909 WeakPolarHBondContact ND2-CA 3.21Å; N845-T909 PolarHBondContact ND2-N 3.31Å; N845-T909 VanDerWaalsContact ND2-N 3.12Å; N845-T909 PolarHBondContact ND2-OG1 3.2Å
846	S	98.8	Very high	96.4	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.014	10%	0.095	C	C	.	.	H	α-helix	trans	-54.5	-41.7	-174.3	-57.1	0	0	0	0	112.8	A804 F844 A850	A804-S846 WeakPolarHBondContact CA-OG 3.4Å; A804-S846 PolarHBondContact N-OG 3.23Å; F844-S846 VanDerWaalsContact C-N 3.33Å; F844-S846 PolarHBondContact O-N 3.09Å; F844-S846 PolarHBondContact O-OG 3.14Å; S846-A850 VanDerWaalsContact O-CB 3.3Å; S846-A850 WeakPolarHBondContact O-CB 3.42Å; S846-A850 PolarHBondContact O-N 2.69Å
847	V	98.8	Very high	96.1	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.006	9%	0.087	C	C	.	.	H	α-helix	trans	-70.4	-44.2	178.7	175.7	0	0	0	0	111.5	V807 N845 I849 A850 A851 I898 L988 S990 S1033	V807-V847 HydrophobicContact CG1-CG2 4.37Å; N845-V847 VanDerWaalsContact C-N 3.28Å; N845-V847 PolarHBondContact O-N 3.14Å; V847-I849 PolarHBondContact O-N 3.36Å; V847-A850 PolarHBondContact O-N 2.87Å; V847-A851 WeakPolarHBondContact O-CB 3.28Å; V847-A851 PolarHBondContact O-N 3.42Å; V847-I898 HydrophobicContact CG1-CD1 4.27Å; V847-I898 HydrophobicContact CG1-CG1 4.41Å; V847-I898 HydrophobicContact CG1-CG2 3.88Å; V847-L988 HydrophobicContact CG1-CB 3.93Å; V847-L988 HydrophobicContact CG1-CD1 4.16Å; V847-S990 WeakPolarHBondContact CG2-OG 3.37Å; V847-S1033 VanDerWaalsContact CG2-CB 3.45Å
848	A	98.8	Very high	94.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.3	-37.4	176.3	0	0	0	0	0	112.6	V745 N845 A851 K852 V912 F913	V745-A848 HydrophobicContact CG1-CB 4.28Å; V745-A848 HydrophobicContact CG2-CB 4.06Å; N845-A848 HydrophobicContact CB-CB 3.94Å; N845-A848 PolarHBondContact O-N 3.48Å; N845-A848 WeakPolarHBondContact OD1-CB 3.43Å; N845-A848 PolarHBondContact OD1-N 3.24Å; A848-A851 PolarHBondContact O-N 2.83Å; A848-K852 WeakPolarHBondContact O-CG 3.28Å; A848-K852 PolarHBondContact O-N 3.14Å; A848-V912 HydrophobicContact CB-CB 4.44Å; A848-V912 HydrophobicContact CB-CG1 4.13Å; A848-F913 HydrophobicContact CB-CE2 3.62Å; A848-F913 HydrophobicContact CB-CZ 4.07Å
849	I	98.7	Very high	92.6	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.1	-43.1	175.6	-65.3	160.9	0	0	0	109.9	E741 L742 V745 A804 V808 F844 N845 V847 K852 R853	E741-I849 HydrophobicContact CB-CG2 4.28Å; E741-I849 WeakPolarHBondContact O-CG2 3.49Å; L742-I849 HydrophobicContact CD2-CD1 3.87Å; V745-I849 HydrophobicContact CB-CG1 3.79Å; V745-I849 HydrophobicContact CG1-CG1 4.48Å; V745-I849 HydrophobicContact CG2-CB 4.25Å; V745-I849 HydrophobicContact CG2-CG1 3.57Å; A804-I849 HydrophobicContact CB-CD1 4.21Å; V808-I849 HydrophobicContact CG2-CB 4.41Å; V808-I849 HydrophobicContact CG2-CG2 3.69Å; F844-I849 HydrophobicContact CB-CD1 4.06Å; N845-I849 WeakPolarHBondContact O-CB 3.44Å; N845-I849 WeakPolarHBondContact O-CD1 3.3Å; N845-I849 WeakPolarHBondContact O-CG1 3.47Å; N845-I849 PolarHBondContact O-N 3.24Å; V847-I849 PolarHBondContact O-N 3.36Å; I849-K852 PolarHBondContact O-N 3.1Å; I849-R853 WeakPolarHBondContact O-CB 3.46Å; I849-R853 PolarHBondContact O-N 3.03Å
850	A	98.6	Very high	90.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.5	-42.9	174.5	0	0	0	0	0	112.5	V807 V808 A811 S846 V847 R853 A854 L988	V807-A850 HydrophobicContact CG1-CB 3.81Å; V808-A850 HydrophobicContact CG2-CB 4.13Å; A811-A850 HydrophobicContact CB-CB 3.87Å; S846-A850 VanDerWaalsContact O-CB 3.3Å; S846-A850 WeakPolarHBondContact O-CB 3.42Å; S846-A850 PolarHBondContact O-N 2.69Å; V847-A850 PolarHBondContact O-N 2.87Å; A850-R853 PolarHBondContact O-N 3.19Å; A850-A854 WeakPolarHBondContact O-CB 3.49Å; A850-A854 PolarHBondContact O-N 3.4Å; A850-L988 HydrophobicContact CB-CD1 4.42Å
851	A	98.4	Very high	87.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-49.8	174.5	0	0	0	0	0	112.1	V847 A848 R853 A854 Q855 I896 I898 F913 L988	V847-A851 WeakPolarHBondContact O-CB 3.28Å; V847-A851 PolarHBondContact O-N 3.42Å; A848-A851 PolarHBondContact O-N 2.83Å; A851-R853 PolarHBondContact O-N 2.96Å; A851-A854 PolarHBondContact O-N 2.89Å; A851-Q855 PolarHBondContact O-N 3.3Å; A851-I896 HydrophobicContact CB-CD1 4.13Å; A851-I896 HydrophobicContact CB-CG2 4.2Å; A851-I896 WeakPolarHBondContact O-CD1 3.3Å; A851-I898 HydrophobicContact CB-CD1 4.03Å; A851-F913 HydrophobicContact CB-CE1 4.28Å; A851-F913 HydrophobicContact CB-CE2 4.36Å; A851-F913 HydrophobicContact CB-CZ 3.66Å; A851-L988 HydrophobicContact CB-CD1 3.82Å
852	K	97.7	Very high	84.9	Confident	30 Å²	30	31.4 Å²	31.4	13%	0.13	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-31.7	175.5	-68.7	-62.5	-172.3	-156.2	0	112	L744 V745 A848 I849 F856 V912 F913 D916	L744-K852 HydrophobicContact CB-CB 3.89Å; L744-K852 HydrophobicContact CD1-CB 4.27Å; V745-K852 HydrophobicContact CG2-CG 3.99Å; A848-K852 WeakPolarHBondContact O-CG 3.28Å; A848-K852 PolarHBondContact O-N 3.14Å; I849-K852 PolarHBondContact O-N 3.1Å; K852-F856 WeakPolarHBondContact O-CD2 3.18Å; K852-F856 WeakPolarHBondContact O-CE2 3.47Å; K852-V912 PolarHBondContact NZ-O 2.84Å; K852-F913 HydrophobicContact CD-CE1 3.63Å; K852-F913 HydrophobicContact CD-CZ 4.15Å; K852-F913 HydrophobicContact CG-CE1 4.04Å; K852-F913 HydrophobicContact CG-CZ 4.03Å; K852-F913 VanDerWaalsContact NZ-CD1 3.26Å; K852-D916 IonicContact NZ-OD2 3.71Å; K852-D916 PolarHBondContact NZ-OD2 3.14Å
853	R	96.5	Very high	81.6	Confident	67 Å²	67	34.7 Å²	34.7	25%	0.253	20%	0.202	S	C	.	.	H	α-helix	trans	-70.8	-44.1	172.7	-175.2	57.9	172.5	174.1	-1.4	112.1	L744 V808 I849 A850 A851 Q855 F856 F883	L744-R853 HydrophobicContact CD1-CB 4.25Å; V808-R853 HydrophobicContact CG1-CB 4.21Å; V808-R853 HydrophobicContact CG1-CG 3.89Å; I849-R853 WeakPolarHBondContact O-CB 3.46Å; I849-R853 PolarHBondContact O-N 3.03Å; A850-R853 PolarHBondContact O-N 3.19Å; A851-R853 PolarHBondContact O-N 2.96Å; R853-Q855 VanDerWaalsContact C-N 3.3Å; R853-Q855 PolarHBondContact O-N 3.46Å; R853-F856 PolarHBondContact O-N 3.3Å; R853-F856 VanDerWaalsContact O-N 3.16Å; R853-F883 VanDerWaalsContact NH1-CZ 3.32Å
854	A	95.3	Very high	78.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-31	178.9	0	0	0	0	0	113	A850 A851 F856 L857 P894 I896	A850-A854 WeakPolarHBondContact O-CB 3.49Å; A850-A854 PolarHBondContact O-N 3.4Å; A851-A854 PolarHBondContact O-N 2.89Å; A854-F856 PolarHBondContact O-N 3.42Å; A854-F856 VanDerWaalsContact O-N 3.11Å; A854-L857 PolarHBondContact O-N 3.04Å; A854-P894 WeakPolarHBondContact O-CG 3.16Å; A854-I896 HydrophobicContact CB-CD1 3.88Å
855	Q	94.8	Very high	75.2	Confident	6 Å²	6	45.2 Å²	45.2	3%	0.028	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-29.8	171.8	-78.1	-172.9	-8.7	0	0	113.6	A851 R853 K893 P894 I896 D916 T918 V919	A851-Q855 PolarHBondContact O-N 3.3Å; R853-Q855 VanDerWaalsContact C-N 3.3Å; R853-Q855 PolarHBondContact O-N 3.46Å; Q855-K893 HydrophobicContact CB-CD 4.42Å; Q855-K893 HydrophobicContact CG-CD 4.39Å; Q855-P894 VanDerWaalsContact O-CD 3.3Å; Q855-P894 WeakPolarHBondContact O-CD 3.43Å; Q855-I896 HydrophobicContact CG-CD1 3.93Å; Q855-D916 PolarHBondContact NE2-OD2 3.35Å; Q855-T918 PolarHBondContact NE2-OG1 3.2Å; Q855-V919 VanDerWaalsContact NE2-CG2 3.3Å
856	F	90	Very high	71.9	Confident	106 Å²	106	54.2 Å²	54.2	47%	0.465	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-17.8	178.3	-60.9	-75.6	0	0	0	113.9	L744 K852 R853 A854	L744-F856 HydrophobicContact CD1-CE2 4.44Å; L744-F856 HydrophobicContact CD2-CE2 3.99Å; L744-F856 HydrophobicContact CD2-CZ 4.43Å; K852-F856 WeakPolarHBondContact O-CD2 3.18Å; K852-F856 WeakPolarHBondContact O-CE2 3.47Å; R853-F856 PolarHBondContact O-N 3.3Å; R853-F856 VanDerWaalsContact O-N 3.16Å; A854-F856 PolarHBondContact O-N 3.42Å; A854-F856 VanDerWaalsContact O-N 3.11Å
857	L	86.4	Confident	68.6	Low	30 Å²	30	60.3 Å²	60.3	16%	0.157	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-82.1	-21.8	-175.9	-62.4	179.6	0	0	0	113.5	C812 M815 L816 A854 S859 T860	C812-L857 HydrophobicContact CB-CD1 3.89Å; M815-L857 HydrophobicContact CB-CD1 4.41Å; M815-L857 HydrophobicContact CG-CB 4.3Å; M815-L857 HydrophobicContact CG-CD1 4.34Å; L816-L857 HydrophobicContact CD1-CD1 4.46Å; L816-L857 HydrophobicContact CG-CD1 4.24Å; A854-L857 PolarHBondContact O-N 3.04Å; L857-S859 PolarHBondContact O-N 3.1Å; L857-T860 PolarHBondContact O-OG1 3.18Å
858	G	63.2	Low	65.2	Low	9 Å²	9	64.9 Å²	64.9	9%	0.093	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-71	-17.8	175.4	0	0	0	0	0	113.9	T860	G858-T860 PolarHBondContact O-N 3.43Å
859	S	51.2	Low	61.8	Low	38 Å²	38	71.3 Å²	71.3	27%	0.266	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-72.7	-9.3	179.8	-55.9	0	0	0	0	114.2	L857	L857-S859 PolarHBondContact O-N 3.1Å
860	T	47.3	Very low	58.8	Low	110 Å²	110	79.1 Å²	79.1	68%	0.675	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-107.5	-0.4	-172.9	34.3	0	0	0	0	115.7	L857 G858	L857-T860 PolarHBondContact O-OG1 3.18Å; G858-T860 PolarHBondContact O-N 3.43Å
861	T	43.7	Very low	55.5	Low	96 Å²	96	82.4 Å²	82.4	59%	0.589	50%	0.501	S	S	*	.			trans	-114.3	-1.4	-169.5	47.9	0	0	0	0	116.5	G863	T861-G863 VanDerWaalsContact C-N 3.26Å; T861-G863 PolarHBondContact O-N 3.35Å
862	L	34.1	Very low	52.3	Low	162 Å²	162	88.2 Å²	88.2	85%	0.848	54%	0.541	S	S	*	.			trans	-81.3	71.1	169.9	-89.3	77.8	0	0	0	111.4
863	G	28.5	Very low	49.2	Very low	68 Å²	68	90.6 Å²	90.6	70%	0.701	56%	0.562	S	S	*	*			trans	-130.5	109.1	169.7	0	0	0	0	0	110.2	T861	T861-G863 VanDerWaalsContact C-N 3.26Å; T861-G863 PolarHBondContact O-N 3.35Å
864	T	31.5	Very low	46.1	Very low	149 Å²	149	89.6 Å²	89.6	91%	0.914	57%	0.567	S	S	*	*			trans	-80.6	131	-170.7	40.6	0	0	0	0	113.6
865	G	27.7	Very low	43.3	Very low	75 Å²	75	95.4 Å²	95.4	77%	0.773	60%	0.603	S	S	*	*	S	Bend	trans	90.3	35.2	141	0	0	0	0	0	119.7
866	Q	30.3	Very low	40.5	Very low	189 Å²	189	100.3 Å²	100.3	88%	0.883	63%	0.634	S	S	*	*			trans	-132.1	96.5	156.4	-71.2	-163.5	3.2	0	0	112.1	S868	Q866-S868 PolarHBondContact O-N 3.21Å
867	S	28.2	Very low	37.9	Very low	130 Å²	130	102.1 Å²	102.1	91%	0.909	65%	0.648	S	S	*	*			trans	-91.3	89.7	169.9	-172.6	0	0	0	0	110.2
868	S	27.8	Very low	35.7	Very low	98 Å²	98	104.6 Å²	104.6	69%	0.685	66%	0.657	S	S	*	*	S	Bend	trans	-170.7	144.3	154.1	52.8	0	0	0	0	111.5	Q866	Q866-S868 PolarHBondContact O-N 3.21Å
869	V	28.8	Very low	34.3	Very low	135 Å²	135	109.7 Å²	109.7	82%	0.818	68%	0.682	S	S	*	*			trans	55.9	67.6	169.2	-157.9	0	0	0	0	116.6
870	I	34.3	Very low	33.8	Very low	163 Å²	163	114.6 Å²	114.6	84%	0.836	70%	0.701	S	S	*	*			trans	-82.9	109.1	147.1	-62.1	-178.5	0	0	0	107
871	S	29.6	Very low	33.3	Very low	70 Å²	70	113.4 Å²	113.4	49%	0.49	70%	0.697	S	S	.	*			trans	-69.6	162.9	179.9	75	0	0	0	0	112.7	S873	S871-S873 PolarHBondContact O-N 2.91Å; S871-S873 PolarHBondContact OG-OG 2.97Å
872	S	32.4	Very low	32.8	Very low	122 Å²	122	114 Å²	114	85%	0.853	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	18.8	-179.4	-36.2	0	0	0	0	116
873	S	31.2	Very low	33.1	Very low	80 Å²	80	110.8 Å²	110.8	56%	0.559	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-2.8	-168.8	-44.9	0	0	0	0	113.9	S871 T875	S871-S873 PolarHBondContact O-N 2.91Å; S871-S873 PolarHBondContact OG-OG 2.97Å; S873-T875 PolarHBondContact O-N 3.44Å; S873-T875 VanDerWaalsContact O-N 3.12Å
874	A	32	Very low	33.4	Very low	45 Å²	45	115.1 Å²	115.1	37%	0.372	69%	0.686	S	S	.	*	G	3₁₀ helix	trans	-69.9	-4.5	-175.3	0	0	0	0	0	114.8	T876 L877	A874-T876 PolarHBondContact O-N 3.29Å; A874-T876 VanDerWaalsContact O-N 3.07Å; A874-L877 PolarHBondContact O-N 3.38Å
875	T	35.8	Very low	33.6	Very low	122 Å²	122	113.3 Å²	113.3	75%	0.748	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-64.9	-9.6	-174.5	-31.6	0	0	0	0	114.4	S873	S873-T875 PolarHBondContact O-N 3.44Å; S873-T875 VanDerWaalsContact O-N 3.12Å
876	T	36	Very low	33.9	Very low	110 Å²	110	119.6 Å²	119.6	68%	0.675	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-98.2	-2.4	-175	50.2	0	0	0	0	115.1	A874 F878 D879	A874-T876 PolarHBondContact O-N 3.29Å; A874-T876 VanDerWaalsContact O-N 3.07Å; T876-F878 PolarHBondContact O-N 2.73Å; T876-D879 PolarHBondContact O-N 3.12Å
877	L	36	Very low	34	Very low	144 Å²	144	115.9 Å²	115.9	75%	0.754	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	11.7	-179.8	-93	164.8	0	0	0	115.6	A874	A874-L877 PolarHBondContact O-N 3.38Å
878	F	39.7	Very low	34.4	Very low	82 Å²	82	115.5 Å²	115.5	36%	0.36	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106	11.6	173.9	-80.3	-85.5	0	0	0	113.7	D809 C812 R813 T876	D809-F878 HydrophobicContact CB-CE1 4.46Å; D809-F878 VanDerWaalsContact OD1-CE1 3.28Å; D809-F878 WeakPolarHBondContact OD1-CE1 3.36Å; C812-F878 HydrophobicContact CB-CZ 4.27Å; R813-F878 HydrophobicContact CG-CZ 4.36Å; T876-F878 PolarHBondContact O-N 2.73Å
879	D	34.4	Very low	34.9	Very low	115 Å²	115	115.9 Å²	115.9	62%	0.615	65%	0.647	S	S	*	*			trans	-66	147.2	170.4	-174.7	39.4	0	0	0	112.2	T876 S881	T876-D879 PolarHBondContact O-N 3.12Å; D879-S881 VanDerWaalsContact C-N 3.26Å; D879-S881 PolarHBondContact O-N 3.31Å; D879-S881 VanDerWaalsContact O-N 3.17Å; D879-S881 PolarHBondContact OD2-OG 2.91Å
880	Q	40.8	Very low	35.2	Very low	141 Å²	141	115.3 Å²	115.3	66%	0.659	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	12.6	-160.7	-61	-173	-13.9	0	0	114.5
881	S	35.8	Very low	36.1	Very low	86 Å²	86	109.5 Å²	109.5	60%	0.601	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-21	-158.7	53.5	0	0	0	0	115.9	D879	D879-S881 VanDerWaalsContact C-N 3.26Å; D879-S881 PolarHBondContact O-N 3.31Å; D879-S881 VanDerWaalsContact O-N 3.17Å; D879-S881 PolarHBondContact OD2-OG 2.91Å
882	T	34.5	Very low	38.2	Very low	109 Å²	109	112.5 Å²	112.5	67%	0.669	64%	0.635	S	S	*	*			trans	-111.1	66.7	-175.4	44.2	0	0	0	0	114.6	L884	T882-L884 PolarHBondContact O-N 3.17Å
883	F	39.3	Very low	40.8	Very low	94 Å²	94	110.8 Å²	110.8	41%	0.412	61%	0.612	S	S	.	*			trans	-82.7	90.6	156.7	-107.1	-91.5	0	0	0	109.3	I740 R853 P885	I740-F883 HydrophobicContact CG2-CD1 4.31Å; I740-F883 HydrophobicContact CG2-CE1 3.84Å; I740-F883 HydrophobicContact CG2-CE2 4.21Å; I740-F883 HydrophobicContact CG2-CZ 3.77Å; R853-F883 VanDerWaalsContact NH1-CZ 3.32Å; F883-P885 WeakPolarHBondContact O-CD 3.28Å
884	L	34.3	Very low	43.7	Very low	158 Å²	158	107.3 Å²	107.3	83%	0.827	59%	0.588	S	S	*	*			trans	-70.5	121.9	172.7	-70.5	176.8	0	0	0	110.2	T882 Y886	T882-L884 PolarHBondContact O-N 3.17Å; L884-Y886 PolarHBondContact O-N 3.49Å
885	P	35.6	Very low	46.8	Very low	111 Å²	111	109.3 Å²	109.3	72%	0.721	59%	0.586	S	S	*	*			trans	-83.9	113.7	-175.2	31.8	-33.3	0	0	0	112.6	F883 T887	F883-P885 WeakPolarHBondContact O-CD 3.28Å; P885-T887 PolarHBondContact O-N 3.42Å
886	Y	35.7	Very low	49.8	Very low	208 Å²	208	103.5 Å²	103.5	82%	0.816	55%	0.55	S	S	*	*	S	Bend	trans	46.3	60.1	145.1	-155.9	-93.1	0	0	0	118	L884	L884-Y886 PolarHBondContact O-N 3.49Å
887	T	31.5	Very low	52.8	Low	110 Å²	110	98.3 Å²	98.3	68%	0.675	52%	0.518	S	S	*	.			trans	-155.9	86.7	152.9	20.4	0	0	0	0	110.5	P885	P885-T887 PolarHBondContact O-N 3.42Å
888	I	37.4	Very low	55.8	Low	123 Å²	123	91.4 Å²	91.4	63%	0.631	48%	0.482	S	S	*	.			trans	-131.3	113.2	160	-60.5	-179.6	0	0	0	106.4	A891	I888-A891 HydrophobicContact CG2-CB 3.74Å
889	E	38.2	Very low	58.6	Low	106 Å²	106	87.5 Å²	87.5	50%	0.495	47%	0.465	S	S	.	.			trans	-76.6	131.6	175.6	-66	-178.2	120.1	0	0	110.1	A891	E889-A891 PolarHBondContact O-N 3.11Å
890	S	35.5	Very low	61.7	Low	122 Å²	122	82 Å²	82	85%	0.853	44%	0.436	S	S	*	.	S	Bend	trans	45.1	14	163.1	60.4	0	0	0	0	120.7	L892	S890-L892 PolarHBondContact O-N 3.2Å
891	A	51.8	Low	64.5	Low	41 Å²	41	75.3 Å²	75.3	34%	0.339	40%	0.404	S	S	.	.			trans	-58.1	111.6	158.7	0	0	0	0	0	108.4	I888 E889 K893	I888-A891 HydrophobicContact CG2-CB 3.74Å; E889-A891 PolarHBondContact O-N 3.11Å; A891-K893 PolarHBondContact O-N 3.39Å; A891-K893 VanDerWaalsContact O-N 3.13Å
892	L	74.4	Confident	67.4	Low	134 Å²	134	71.2 Å²	71.2	70%	0.702	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-60.2	118.6	-168.8	-163.7	77.4	0	0	0	110.2	S890	S890-L892 PolarHBondContact O-N 3.2Å
893	K	86.4	Confident	70.5	Confident	85 Å²	85	66 Å²	66	37%	0.37	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-55.6	141.9	177.1	-80.5	-171	175.8	-170.5	0	110.3	Q855 A891 T918	Q855-K893 HydrophobicContact CB-CD 4.42Å; Q855-K893 HydrophobicContact CG-CD 4.39Å; A891-K893 PolarHBondContact O-N 3.39Å; A891-K893 VanDerWaalsContact O-N 3.13Å; K893-T918 HydrophobicContact CB-CG2 3.91Å; K893-T918 HydrophobicContact CD-CG2 4.06Å
894	P	93.3	Very high	73.3	Confident	8 Å²	8	62.1 Å²	62.1	5%	0.052	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-66.2	142.3	174.8	30.6	-32.6	0	0	0	109.5	M815 A854 Q855	M815-P894 HydrophobicContact CE-CB 3.43Å; M815-P894 VanDerWaalsContact CE-CB 3.43Å; M815-P894 HydrophobicContact CE-CG 3.85Å; A854-P894 WeakPolarHBondContact O-CG 3.16Å; Q855-P894 VanDerWaalsContact O-CD 3.3Å; Q855-P894 WeakPolarHBondContact O-CD 3.43Å
895	R	97.2	Very high	76.4	Confident	87 Å²	87	54.6 Å²	54.6	33%	0.328	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-81.1	129.6	176.6	-70.6	-175.3	-56.6	-101.8	-1.8	109.1	T918 F982 Q983 P984 S985	R895-T918 WeakPolarHBondContact CA-O 3.38Å; R895-F982 HydrophobicContact CB-CD1 4.48Å; R895-F982 HydrophobicContact CB-CE1 3.79Å; R895-F982 HydrophobicContact CB-CE2 4.17Å; R895-F982 HydrophobicContact CB-CZ 3.63Å; R895-F982 VanDerWaalsContact CD-O 3.3Å; R895-F982 WeakPolarHBondContact CD-O 3.23Å; R895-F982 HydrophobicContact CG-CE2 4.13Å; R895-F982 HydrophobicContact CG-CZ 4.05Å; R895-F982 PolarHBondContact NE-O 3.06Å; R895-Q983 PolarHBondContact NE-O 3.37Å; R895-Q983 VanDerWaalsContact NE-O 3.08Å; R895-Q983 VanDerWaalsContact NH2-CB 3.33Å; R895-Q983 PolarHBondContact NH2-O 3.46Å; R895-P984 CarbonylContact O-C 3.6Å; R895-S985 PolarHBondContact N-OG 2.67Å; R895-S985 PolarHBondContact O-N 2.94Å
896	I	98.4	Very high	79.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.4	-177.8	-56.8	176.9	0	0	0	108.5	A851 A854 Q855 I898 T918 V919 L920 F982 I986 L988	A851-I896 HydrophobicContact CB-CD1 4.13Å; A851-I896 HydrophobicContact CB-CG2 4.2Å; A851-I896 WeakPolarHBondContact O-CD1 3.3Å; A854-I896 HydrophobicContact CB-CD1 3.88Å; Q855-I896 HydrophobicContact CG-CD1 3.93Å; I896-I898 HydrophobicContact CG2-CG1 4.26Å; I896-T918 PolarHBondContact N-O 3.16Å; I896-V919 HydrophobicContact CB-CG1 4.29Å; I896-V919 HydrophobicContact CB-CG2 4.16Å; I896-V919 HydrophobicContact CD1-CG2 4.48Å; I896-V919 HydrophobicContact CG2-CG1 4.41Å; I896-V919 CarbonylContact O-C 3.59Å; I896-V919 VanDerWaalsContact O-CA 3.29Å; I896-V919 WeakPolarHBondContact O-CA 2.99Å; I896-L920 PolarHBondContact O-N 2.85Å; I896-F982 WeakPolarHBondContact O-CE1 3.11Å; I896-I986 HydrophobicContact CG1-CG2 4.09Å; I896-I986 HydrophobicContact CG2-CG2 4.24Å; I896-L988 HydrophobicContact CG2-CD1 4.09Å; I896-L988 HydrophobicContact CG2-CG 4.2Å
897	L	98.7	Very high	82.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.4	168.4	172.4	61.3	0	0	0	108	V899 L920 I922 A979 F982 P984 I986 V987 L988 L1020	L897-V899 HydrophobicContact CD1-CG2 4.09Å; L897-V899 HydrophobicContact CD2-CG2 4.01Å; L897-V899 HydrophobicContact CG-CG2 3.91Å; L897-L920 HydrophobicContact CD1-CB 4.3Å; L897-L920 HydrophobicContact CD1-CD2 3.76Å; L897-L920 HydrophobicContact CD1-CG 3.77Å; L897-I922 HydrophobicContact CD1-CD1 4.04Å; L897-I922 HydrophobicContact CD1-CG1 4.12Å; L897-A979 HydrophobicContact CD2-CB 3.71Å; L897-F982 HydrophobicContact CB-CD1 4.48Å; L897-P984 HydrophobicContact CB-CB 3.68Å; L897-P984 HydrophobicContact CB-CG 3.83Å; L897-P984 HydrophobicContact CD2-CG 4.28Å; L897-I986 PolarHBondContact N-O 2.68Å; L897-V987 HydrophobicContact CB-CG1 4.47Å; L897-V987 HydrophobicContact CB-CG2 4.39Å; L897-V987 HydrophobicContact CD2-CG1 4.13Å; L897-V987 HydrophobicContact CD2-CG2 4.16Å; L897-V987 HydrophobicContact CG-CG1 4.2Å; L897-V987 WeakPolarHBondContact O-CA 3.43Å; L897-L988 PolarHBondContact O-N 3.26Å; L897-L1020 HydrophobicContact CD2-CD2 4.24Å
898	I	98.9	Very high	85.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.1	165	-54.3	175.3	0	0	0	107.5	V847 A851 I896 T909 F913 V919 L920 Y921 I922 L988	V847-I898 HydrophobicContact CG1-CD1 4.27Å; V847-I898 HydrophobicContact CG1-CG1 4.41Å; V847-I898 HydrophobicContact CG1-CG2 3.88Å; A851-I898 HydrophobicContact CB-CD1 4.03Å; I896-I898 HydrophobicContact CG2-CG1 4.26Å; I898-T909 HydrophobicContact CD1-CG2 3.9Å; I898-T909 HydrophobicContact CG2-CG2 4.13Å; I898-F913 HydrophobicContact CD1-CD2 3.98Å; I898-F913 HydrophobicContact CD1-CE2 3.67Å; I898-F913 HydrophobicContact CD1-CZ 4.3Å; I898-V919 HydrophobicContact CD1-CG1 3.61Å; I898-V919 HydrophobicContact CG1-CG1 3.84Å; I898-L920 PolarHBondContact N-O 3.31Å; I898-Y921 HydrophobicContact CB-CD2 4.26Å; I898-Y921 HydrophobicContact CG2-CD2 4.09Å; I898-Y921 WeakPolarHBondContact O-CA 3.29Å; I898-I922 PolarHBondContact O-N 3.46Å; I898-L988 WeakPolarHBondContact CA-O 3.41Å; I898-L988 HydrophobicContact CG1-CB 4.45Å
899	V	98.9	Very high	88.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.1	167.5	-176.6	0	0	0	0	107.9	L897 I922 L924 I975 L988 I989 S990 L1020	L897-V899 HydrophobicContact CD1-CG2 4.09Å; L897-V899 HydrophobicContact CD2-CG2 4.01Å; L897-V899 HydrophobicContact CG-CG2 3.91Å; V899-I922 CarbonylContact C-O 3.56Å; V899-I922 WeakPolarHBondContact CA-O 3.48Å; V899-L924 HydrophobicContact CG1-CD1 4.09Å; V899-I975 HydrophobicContact CG2-CG2 4.24Å; V899-L988 PolarHBondContact N-O 3.42Å; V899-I989 CarbonylContact O-C 3.19Å; V899-I989 VanDerWaalsContact O-CA 3.25Å; V899-I989 WeakPolarHBondContact O-CA 3.49Å; V899-S990 PolarHBondContact O-N 2.97Å; V899-L1020 HydrophobicContact CB-CD1 4.36Å; V899-L1020 HydrophobicContact CG1-CD1 4.49Å; V899-L1020 HydrophobicContact CG2-CD1 3.98Å; V899-L1020 HydrophobicContact CG2-CD2 4.39Å
900	D	98.9	Very high	91.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	114.4	173.2	-164.3	-9.9	0	0	0	109.1	H831 D902 G906 Y921 I922 S923 L924 S990	H831-D900 IonicContact CE1-OD2 3.99Å; H831-D900 IonicContact CG-OD2 2.67Å; H831-D900 IonicContact ND1-OD1 3.82Å; H831-D900 IonicContact ND1-OD2 3.58Å; H831-D900 PolarHBondContact ND1-OD2 3.01Å; D900-D902 WeakPolarHBondContact OD1-CB 3.44Å; D900-D902 PolarHBondContact OD1-N 3.05Å; D900-G906 VanDerWaalsContact OD2-CA 3.3Å; D900-G906 WeakPolarHBondContact OD2-CA 3.47Å; D900-G906 PolarHBondContact OD2-N 3.21Å; D900-Y921 HydrophobicContact CB-CE2 3.89Å; D900-I922 PolarHBondContact N-O 3.44Å; D900-S923 CarbonylContact O-C 3.54Å; D900-S923 VanDerWaalsContact O-CA 3.31Å; D900-S923 WeakPolarHBondContact O-CA 3.47Å; D900-L924 PolarHBondContact O-N 3.44Å; D900-S990 VanDerWaalsContact CG-CB 3.49Å; D900-S990 WeakPolarHBondContact OD1-CB 3.14Å
901	W	98.8	Very high	94.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.112	C	C	.	.			trans	-117.1	9.2	-179.8	70.6	39.6	0	0	0	113.4	L924 F971 I989 S990 A991 G992 F993 F1013 M1016 T1017 L1020 L1032	W901-L924 HydrophobicContact CB-CD1 4.15Å; W901-F971 HydrophobicContact CE3-CZ 4.1Å; W901-F971 HydrophobicContact CZ3-CZ 4.22Å; W901-I989 HydrophobicContact CD2-CG2 3.75Å; W901-I989 HydrophobicContact CE3-CG2 3.8Å; W901-I989 HydrophobicContact CG-CG2 4.47Å; W901-I989 HydrophobicContact CH2-CD1 3.79Å; W901-I989 HydrophobicContact CH2-CG2 3.84Å; W901-I989 HydrophobicContact CZ2-CG2 3.81Å; W901-I989 HydrophobicContact CZ3-CD1 3.77Å; W901-I989 HydrophobicContact CZ3-CG2 3.85Å; W901-S990 PolarHBondContact N-O 2.82Å; W901-S990 VanDerWaalsContact N-O 3.14Å; W901-A991 HydrophobicContact CZ2-CB 4.28Å; W901-G992 PolarHBondContact NE1-O 3.4Å; W901-F993 AromaticContact NE1-CE1 3.87Å; W901-F1013 AromaticContact CD1-CD1 3.96Å; W901-F1013 AromaticContact CD1-CE1 3.6Å; W901-F1013 HydrophobicContact CD2-CD1 4.27Å; W901-F1013 HydrophobicContact CD2-CE1 4.48Å; W901-F1013 AromaticContact CE2-CD1 3.78Å; W901-F1013 HydrophobicContact CG-CD1 4.39Å; W901-F1013 HydrophobicContact CG-CE1 4.12Å; W901-F1013 HydrophobicContact CZ2-CD1 4.23Å; W901-F1013 AromaticContact NE1-CD1 3.55Å; W901-F1013 AromaticContact NE1-CE1 3.65Å; W901-M1016 HydrophobicContact CE3-CB 4.24Å; W901-M1016 HydrophobicContact CE3-CE 4.48Å; W901-M1016 HydrophobicContact CH2-CB 4.38Å; W901-M1016 HydrophobicContact CZ3-CB 3.77Å; W901-T1017 WeakPolarHBondContact CH2-OG1 3.44Å; W901-L1020 HydrophobicContact CZ3-CD1 4.31Å; W901-L1032 HydrophobicContact CZ2-CD2 4.22Å
902	D	98.8	Very high	96.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-54.9	145.2	160.6	-166	-72.1	0	0	0	109.2	H831 D900 H904 G992 G1036	H831-D902 VanDerWaalsContact CE1-CB 3.45Å; H831-D902 WeakPolarHBondContact CE1-CB 3.41Å; H831-D902 IonicContact CE1-OD1 2.7Å; H831-D902 IonicContact CE1-OD2 3.52Å; H831-D902 IonicContact NE2-OD1 3.87Å; H831-D902 IonicContact NE2-OD2 3.62Å; D900-D902 WeakPolarHBondContact OD1-CB 3.44Å; D900-D902 PolarHBondContact OD1-N 3.05Å; D902-H904 PolarHBondContact O-N 2.68Å; D902-H904 WeakPolarHBondContact OD1-CB 3.38Å; D902-H904 IonicContact OD1-CE1 3.42Å; D902-H904 IonicContact OD1-CG 2.97Å; D902-H904 PolarHBondContact OD1-N 2.85Å; D902-H904 IonicContact OD1-ND1 2.73Å; D902-H904 PolarHBondContact OD1-ND1 2.85Å; D902-G992 VanDerWaalsContact OD2-CA 3.26Å; D902-G992 WeakPolarHBondContact OD2-CA 3.36Å; D902-G1036 WeakPolarHBondContact OD2-CA 3.42Å; D902-G1036 PolarHBondContact OD2-N 3.07Å
903	I	98.3	Very high	97.8	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.068	C	C	.	.	S	Bend	trans	-69.1	-15.7	-176.7	-152.3	-165.7	0	0	0	112.2	H925 R926 F932 D994 A995 G1004 Y1006	I903-H925 CarbonylContact O-C 3.6Å; I903-H925 WeakPolarHBondContact O-CA 3.42Å; I903-H925 WeakPolarHBondContact O-CB 3.35Å; I903-R926 HydrophobicContact CD1-CB 3.95Å; I903-R926 HydrophobicContact CG1-CB 3.86Å; I903-R926 PolarHBondContact O-N 2.79Å; I903-F932 HydrophobicContact CG2-CE1 4.22Å; I903-D994 HydrophobicContact CG2-CB 3.91Å; I903-D994 WeakPolarHBondContact CG2-OD1 3.27Å; I903-D994 PolarHBondContact N-OD1 2.98Å; I903-A995 HydrophobicContact CB-CB 3.96Å; I903-A995 HydrophobicContact CD1-CB 4.43Å; I903-A995 HydrophobicContact CG1-CB 3.95Å; I903-G1004 VanDerWaalsContact CD1-C 3.47Å; I903-G1004 VanDerWaalsContact CD1-CA 3.45Å; I903-G1004 WeakPolarHBondContact CD1-O 3.41Å; I903-Y1006 HydrophobicContact CD1-CD1 4.2Å; I903-Y1006 HydrophobicContact CD1-CD2 3.57Å; I903-Y1006 HydrophobicContact CD1-CE2 4.06Å; I903-Y1006 HydrophobicContact CD1-CG 3.67Å; I903-Y1006 HydrophobicContact CG1-CD2 3.78Å; I903-Y1006 HydrophobicContact CG1-CE2 4.1Å; I903-Y1006 HydrophobicContact CG1-CG 4.37Å
904	H	98.7	Very high	98.3	Very high	11 Å²	11	13.2 Å²	13.2	5%	0.051	6%	0.062	C	C	.	.	S	Bend	trans	-97.6	143.9	176.8	-45.7	88.4	0	0	0	111.1	H831 H832 D902 G906 F932 F933 D994 L1003	H831-H904 PolarHBondContact CE1-O 3.19Å; H832-H904 VanDerWaalsContact CE1-CB 3.45Å; H832-H904 WeakPolarHBondContact CE1-CB 3.38Å; H832-H904 WeakPolarHBondContact NE2-CB 3.31Å; D902-H904 PolarHBondContact O-N 2.68Å; D902-H904 WeakPolarHBondContact OD1-CB 3.38Å; D902-H904 IonicContact OD1-CE1 3.42Å; D902-H904 IonicContact OD1-CG 2.97Å; D902-H904 PolarHBondContact OD1-N 2.85Å; D902-H904 IonicContact OD1-ND1 2.73Å; D902-H904 PolarHBondContact OD1-ND1 2.85Å; H904-G906 PolarHBondContact O-N 3.05Å; H904-F932 AromaticContact CD2-CE1 3.41Å; H904-F932 VanDerWaalsContact CD2-CE1 3.41Å; H904-F932 WeakPolarHBondContact CD2-CE1 3.26Å; H904-F932 AromaticContact CD2-CZ 4Å; H904-F932 AromaticContact NE2-CE1 3.69Å; H904-F932 AromaticContact NE2-CZ 3.8Å; H904-F933 HydrophobicContact CB-CD1 4.5Å; H904-F933 AromaticContact CD2-CD1 3.89Å; H904-D994 IonicContact CE1-OD2 3.04Å; H904-D994 IonicContact ND1-OD2 3.19Å; H904-L1003 PolarHBondContact CE1-O 3.14Å; H904-L1003 VanDerWaalsContact CE1-O 3.29Å; H904-L1003 PolarHBondContact NE2-O 3Å
905	H	98.7	Very high	98.6	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.005	8%	0.084	C	C	.	.			trans	-67.1	123.5	177.2	175.4	-122.8	0	0	0	112.1	H832 N907 Q910 Y921 H925 P934 T936 G937	H832-H905 PolarHBondContact CE1-O 3.17Å; H832-H905 PolarHBondContact ND1-O 3.37Å; H832-H905 VanDerWaalsContact ND1-O 3.14Å; H905-N907 PolarHBondContact O-N 2.73Å; H905-Q910 VanDerWaalsContact CE1-CD 3.47Å; H905-Q910 PolarHBondContact CE1-NE2 3.4Å; H905-Q910 PolarHBondContact NE2-OE1 3.27Å; H905-Y921 PolarHBondContact CD2-OH 3.46Å; H905-Y921 AromaticContact NE2-CE1 3.65Å; H905-Y921 AromaticContact NE2-CZ 3.8Å; H905-Y921 PolarHBondContact NE2-OH 3.26Å; H905-H925 HydrophobicContact CB-CB 4.25Å; H905-H925 AromaticContact CD2-CE1 3.62Å; H905-H925 AromaticContact CD2-ND1 3.65Å; H905-H925 AromaticContact CG-CE1 3.85Å; H905-H925 AromaticContact CG-ND1 3.95Å; H905-P934 HydrophobicContact CB-CG 4.29Å; H905-P934 WeakPolarHBondContact O-CG 3.33Å; H905-T936 WeakPolarHBondContact CB-O 3.42Å; H905-T936 PolarHBondContact ND1-O 2.81Å; H905-T936 PolarHBondContact ND1-OG1 3.49Å; H905-G937 WeakPolarHBondContact ND1-CA 3.39Å; H905-G937 PolarHBondContact ND1-N 2.92Å
906	G	98.7	Very high	98.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.074	C	C	.	.			trans	-67.7	62.7	172.6	0	0	0	0	0	114.6	H831 D900 H904 G908 T909 Q910 Y921	H831-G906 WeakPolarHBondContact ND1-CA 3.3Å; H831-G906 CarbonylContact O-C 3.59Å; D900-G906 VanDerWaalsContact OD2-CA 3.3Å; D900-G906 WeakPolarHBondContact OD2-CA 3.47Å; D900-G906 PolarHBondContact OD2-N 3.21Å; H904-G906 PolarHBondContact O-N 3.05Å; G906-G908 PolarHBondContact O-N 2.83Å; G906-G908 VanDerWaalsContact O-N 3.14Å; G906-T909 WeakPolarHBondContact O-CA 3.2Å; G906-T909 WeakPolarHBondContact O-CB 3.41Å; G906-T909 PolarHBondContact O-N 3.07Å; G906-Q910 PolarHBondContact O-N 2.78Å; G906-Y921 WeakPolarHBondContact CA-OH 3.48Å; G906-Y921 PolarHBondContact N-OH 3.08Å; G906-Y921 PolarHBondContact O-OH 2.96Å; G906-Y921 VanDerWaalsContact O-OH 3.13Å
907	N	98.7	Very high	98.6	Very high	5 Å²	5	15.5 Å²	15.5	3%	0.027	9%	0.086	C	C	.	.	H	α-helix	trans	-53	-35.4	-177.8	65.8	-69.1	0	0	0	113.6	H832 E834 H905 T911 P934 T936	H832-N907 WeakPolarHBondContact CA-OD1 3.36Å; H832-N907 PolarHBondContact ND1-OD1 2.95Å; E834-N907 PolarHBondContact OE1-ND2 3.21Å; H905-N907 PolarHBondContact O-N 2.73Å; N907-T911 VanDerWaalsContact O-CB 3.27Å; N907-T911 WeakPolarHBondContact O-CB 3.26Å; N907-T911 PolarHBondContact O-N 3.2Å; N907-T911 PolarHBondContact O-OG1 2.95Å; N907-P934 HydrophobicContact CB-CG 4.22Å; N907-T936 WeakPolarHBondContact CB-OG1 3.4Å
908	G	98.5	Very high	98.5	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.7	-45.5	174.2	0	0	0	0	0	111.8	H831 G906 T911 V912	H831-G908 CarbonylContact O-C 3.59Å; H831-G908 WeakPolarHBondContact O-CA 3.28Å; H831-G908 PolarHBondContact O-N 3.32Å; G906-G908 PolarHBondContact O-N 2.83Å; G906-G908 VanDerWaalsContact O-N 3.14Å; G908-T911 PolarHBondContact O-N 3.16Å; G908-V912 WeakPolarHBondContact O-CG2 3.21Å; G908-V912 PolarHBondContact O-N 3.48Å
909	T	98.9	Very high	98.5	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.6	-49.9	177	-51.2	0	0	0	0	110.9	H831 N845 I898 G906 T911 V912 F913 Y921	H831-T909 PolarHBondContact O-N 3.44Å; H831-T909 VanDerWaalsContact O-N 3.14Å; N845-T909 WeakPolarHBondContact ND2-CA 3.21Å; N845-T909 PolarHBondContact ND2-N 3.31Å; N845-T909 VanDerWaalsContact ND2-N 3.12Å; N845-T909 PolarHBondContact ND2-OG1 3.2Å; I898-T909 HydrophobicContact CD1-CG2 3.9Å; I898-T909 HydrophobicContact CG2-CG2 4.13Å; G906-T909 WeakPolarHBondContact O-CA 3.2Å; G906-T909 WeakPolarHBondContact O-CB 3.41Å; G906-T909 PolarHBondContact O-N 3.07Å; T909-T911 VanDerWaalsContact C-N 3.35Å; T909-T911 PolarHBondContact O-N 3.14Å; T909-V912 PolarHBondContact O-N 3.13Å; T909-V912 VanDerWaalsContact O-N 3.17Å; T909-F913 HydrophobicContact CG2-CD2 4.24Å; T909-F913 HydrophobicContact CG2-CE2 4.36Å; T909-F913 WeakPolarHBondContact O-CD2 3.27Å; T909-F913 PolarHBondContact O-N 2.66Å; T909-Y921 HydrophobicContact CG2-CD2 3.45Å; T909-Y921 VanDerWaalsContact CG2-CD2 3.45Å; T909-Y921 HydrophobicContact CG2-CE2 3.56Å; T909-Y921 HydrophobicContact CG2-CG 4.42Å
910	Q	98.8	Very high	98.5	Very high	12 Å²	12	17 Å²	17	6%	0.056	10%	0.095	C	C	.	.	H	α-helix	trans	-52.5	-51.4	174.7	-179.5	171.9	-87.9	0	0	111.4	H905 G906 V912 F913 Y914 Y921 E941 T951 N953	H905-Q910 VanDerWaalsContact CE1-CD 3.47Å; H905-Q910 PolarHBondContact CE1-NE2 3.4Å; H905-Q910 PolarHBondContact NE2-OE1 3.27Å; G906-Q910 PolarHBondContact O-N 2.78Å; Q910-V912 PolarHBondContact O-N 3.25Å; Q910-V912 VanDerWaalsContact O-N 3.14Å; Q910-F913 PolarHBondContact O-N 2.98Å; Q910-Y914 HydrophobicContact CG-CD2 3.64Å; Q910-Y914 HydrophobicContact CG-CE2 4.08Å; Q910-Y914 WeakPolarHBondContact O-CB 3.43Å; Q910-Y914 PolarHBondContact O-N 2.78Å; Q910-Y921 HydrophobicContact CB-CD1 4.23Å; Q910-Y921 HydrophobicContact CB-CE1 3.73Å; Q910-Y921 HydrophobicContact CG-CE1 4.35Å; Q910-E941 PolarHBondContact NE2-OE2 3.23Å; Q910-T951 HydrophobicContact CG-CG2 3.79Å; Q910-N953 PolarHBondContact OE1-ND2 2.7Å
911	T	98.5	Very high	98.5	Very high	69 Å²	69	17 Å²	17	42%	0.423	10%	0.095	S	C	.	.	H	α-helix	trans	-59	-28.7	-177.5	-63.7	0	0	0	0	113.7	P835 N907 G908 T909	P835-T911 HydrophobicContact CG-CG2 4.16Å; N907-T911 VanDerWaalsContact O-CB 3.27Å; N907-T911 WeakPolarHBondContact O-CB 3.26Å; N907-T911 PolarHBondContact O-N 3.2Å; N907-T911 PolarHBondContact O-OG1 2.95Å; G908-T911 PolarHBondContact O-N 3.16Å; T909-T911 VanDerWaalsContact C-N 3.35Å; T909-T911 PolarHBondContact O-N 3.14Å
912	V	98.5	Very high	98.5	Very high	19 Å²	19	17 Å²	17	12%	0.115	10%	0.095	C	C	.	.	H	α-helix	trans	-83.9	-22.3	-176.1	173.6	0	0	0	0	113.3	V745 P835 A848 K852 G908 T909 Q910	V745-V912 HydrophobicContact CG1-CG1 4.19Å; V745-V912 HydrophobicContact CG1-CG2 3.62Å; V745-V912 HydrophobicContact CG2-CG1 4.16Å; P835-V912 HydrophobicContact CG-CG2 3.85Å; A848-V912 HydrophobicContact CB-CB 4.44Å; A848-V912 HydrophobicContact CB-CG1 4.13Å; K852-V912 PolarHBondContact NZ-O 2.84Å; G908-V912 WeakPolarHBondContact O-CG2 3.21Å; G908-V912 PolarHBondContact O-N 3.48Å; T909-V912 PolarHBondContact O-N 3.13Å; T909-V912 VanDerWaalsContact O-N 3.17Å; Q910-V912 PolarHBondContact O-N 3.25Å; Q910-V912 VanDerWaalsContact O-N 3.14Å
913	F	98.6	Very high	98.5	Very high	1 Å²	1	17 Å²	17	0%	0.004	10%	0.095	C	C	.	.	H	α-helix	trans	-119.6	0.5	-177.3	-59.2	-73.3	0	0	0	114.5	A848 A851 K852 I898 T909 Q910 T915 D916 V919	A848-F913 HydrophobicContact CB-CE2 3.62Å; A848-F913 HydrophobicContact CB-CZ 4.07Å; A851-F913 HydrophobicContact CB-CE1 4.28Å; A851-F913 HydrophobicContact CB-CE2 4.36Å; A851-F913 HydrophobicContact CB-CZ 3.66Å; K852-F913 HydrophobicContact CD-CE1 3.63Å; K852-F913 HydrophobicContact CD-CZ 4.15Å; K852-F913 HydrophobicContact CG-CE1 4.04Å; K852-F913 HydrophobicContact CG-CZ 4.03Å; K852-F913 VanDerWaalsContact NZ-CD1 3.26Å; I898-F913 HydrophobicContact CD1-CD2 3.98Å; I898-F913 HydrophobicContact CD1-CE2 3.67Å; I898-F913 HydrophobicContact CD1-CZ 4.3Å; T909-F913 HydrophobicContact CG2-CD2 4.24Å; T909-F913 HydrophobicContact CG2-CE2 4.36Å; T909-F913 WeakPolarHBondContact O-CD2 3.27Å; T909-F913 PolarHBondContact O-N 2.66Å; Q910-F913 PolarHBondContact O-N 2.98Å; F913-T915 PolarHBondContact O-N 2.89Å; F913-D916 HydrophobicContact CD1-CB 4.34Å; F913-D916 PolarHBondContact O-N 3.15Å; F913-V919 HydrophobicContact CB-CB 4.2Å; F913-V919 HydrophobicContact CB-CG1 4.35Å; F913-V919 HydrophobicContact CD1-CB 3.45Å; F913-V919 VanDerWaalsContact CD1-CB 3.45Å; F913-V919 HydrophobicContact CD1-CG1 3.78Å; F913-V919 HydrophobicContact CD1-CG2 3.41Å; F913-V919 VanDerWaalsContact CD1-CG2 3.41Å; F913-V919 HydrophobicContact CD2-CG1 4.14Å; F913-V919 HydrophobicContact CE1-CB 3.97Å; F913-V919 HydrophobicContact CE1-CG1 4.09Å; F913-V919 HydrophobicContact CE1-CG2 3.48Å; F913-V919 VanDerWaalsContact CE1-CG2 3.48Å; F913-V919 HydrophobicContact CE2-CG1 4.44Å; F913-V919 HydrophobicContact CG-CB 3.85Å; F913-V919 HydrophobicContact CG-CG1 3.82Å; F913-V919 HydrophobicContact CG-CG2 4.29Å; F913-V919 HydrophobicContact CZ-CG1 4.44Å; F913-V919 HydrophobicContact CZ-CG2 4.41Å
914	Y	98.6	Very high	98.5	Very high	64 Å²	64	17 Å²	17	25%	0.251	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-6.9	-178.6	-151.1	-102.8	0	0	0	116.7	Q910 E941 G943 S944 T951	Q910-Y914 HydrophobicContact CG-CD2 3.64Å; Q910-Y914 HydrophobicContact CG-CE2 4.08Å; Q910-Y914 WeakPolarHBondContact O-CB 3.43Å; Q910-Y914 PolarHBondContact O-N 2.78Å; Y914-E941 HydrophobicContact CE2-CB 4.29Å; Y914-E941 WeakPolarHBondContact CE2-O 3.11Å; Y914-E941 VanDerWaalsContact OH-C 3.32Å; Y914-E941 WeakPolarHBondContact OH-CA 3.38Å; Y914-G943 VanDerWaalsContact CE1-O 3.32Å; Y914-G943 WeakPolarHBondContact CE1-O 3.5Å; Y914-G943 VanDerWaalsContact CE2-CA 3.48Å; Y914-G943 CarbonylContact O-C 3.56Å; Y914-G943 PolarHBondContact OH-N 3.45Å; Y914-G943 PolarHBondContact OH-O 3.4Å; Y914-S944 VanDerWaalsContact CD1-OG 3.28Å; Y914-S944 WeakPolarHBondContact CD1-OG 3.33Å; Y914-S944 PolarHBondContact O-N 3.01Å; Y914-S944 PolarHBondContact O-OG 3.16Å; Y914-T951 HydrophobicContact CD2-CG2 4.31Å; Y914-T951 HydrophobicContact CE2-CG2 4.23Å
915	T	98.3	Very high	98.5	Very high	83 Å²	83	16.5 Å²	16.5	51%	0.509	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.6	6.9	176.9	56.6	0	0	0	0	114.1	F913 P917 S944 G947	F913-T915 PolarHBondContact O-N 2.89Å; T915-P917 WeakPolarHBondContact O-CD 3.45Å; T915-S944 WeakPolarHBondContact CA-O 3.46Å; T915-S944 WeakPolarHBondContact CG2-OG 3.34Å; T915-G947 PolarHBondContact O-N 2.92Å
916	D	97.8	Very high	98.5	Very high	21 Å²	21	18.4 Å²	18.4	11%	0.112	10%	0.1	C	C	.	.			trans	-117.4	88.9	-167.4	-172.5	-8.3	0	0	0	111.6	K852 Q855 F913 T918 V919	K852-D916 IonicContact NZ-OD2 3.71Å; K852-D916 PolarHBondContact NZ-OD2 3.14Å; Q855-D916 PolarHBondContact NE2-OD2 3.35Å; F913-D916 HydrophobicContact CD1-CB 4.34Å; F913-D916 PolarHBondContact O-N 3.15Å; D916-T918 PolarHBondContact O-N 3.18Å; D916-T918 PolarHBondContact OD1-N 3.06Å; D916-T918 PolarHBondContact OD1-OG1 3.3Å; D916-V919 PolarHBondContact O-N 3.41Å; D916-V919 VanDerWaalsContact O-O 3.12Å
917	P	97.4	Very high	98.4	Very high	39 Å²	39	19.4 Å²	19.4	25%	0.253	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-0.9	-176.3	28.7	-35.9	0	0	0	114.3	T915 V919 P946 Y950	T915-P917 WeakPolarHBondContact O-CD 3.45Å; P917-V919 VanDerWaalsContact C-N 3.26Å; P917-P946 VanDerWaalsContact CB-O 3.27Å; P917-P946 WeakPolarHBondContact CB-O 3.37Å; P917-P946 HydrophobicContact CG-CB 3.95Å; P917-P946 VanDerWaalsContact CG-O 3.28Å; P917-P946 WeakPolarHBondContact CG-O 3.34Å; P917-Y950 HydrophobicContact CB-CD1 4.06Å; P917-Y950 HydrophobicContact CB-CD2 3.71Å; P917-Y950 HydrophobicContact CB-CE1 3.96Å; P917-Y950 HydrophobicContact CB-CE2 3.62Å; P917-Y950 HydrophobicContact CB-CG 3.94Å; P917-Y950 WeakPolarHBondContact O-CD1 3.34Å; P917-Y950 WeakPolarHBondContact O-CE1 3.3Å
918	T	97.3	Very high	98.3	Very high	31 Å²	31	20.2 Å²	20.2	19%	0.19	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-6.7	171.8	69.6	0	0	0	0	112.2	Q855 K893 R895 I896 D916	Q855-T918 PolarHBondContact NE2-OG1 3.2Å; K893-T918 HydrophobicContact CB-CG2 3.91Å; K893-T918 HydrophobicContact CD-CG2 4.06Å; R895-T918 WeakPolarHBondContact CA-O 3.38Å; I896-T918 PolarHBondContact N-O 3.16Å; D916-T918 PolarHBondContact O-N 3.18Å; D916-T918 PolarHBondContact OD1-N 3.06Å; D916-T918 PolarHBondContact OD1-OG1 3.3Å
919	V	98.4	Very high	98.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.1	169.7	-172	0	0	0	0	109.7	Q855 I896 I898 F913 D916 P917	Q855-V919 VanDerWaalsContact NE2-CG2 3.3Å; I896-V919 HydrophobicContact CB-CG1 4.29Å; I896-V919 HydrophobicContact CB-CG2 4.16Å; I896-V919 HydrophobicContact CD1-CG2 4.48Å; I896-V919 HydrophobicContact CG2-CG1 4.41Å; I896-V919 CarbonylContact O-C 3.59Å; I896-V919 VanDerWaalsContact O-CA 3.29Å; I896-V919 WeakPolarHBondContact O-CA 2.99Å; I898-V919 HydrophobicContact CD1-CG1 3.61Å; I898-V919 HydrophobicContact CG1-CG1 3.84Å; F913-V919 HydrophobicContact CB-CB 4.2Å; F913-V919 HydrophobicContact CB-CG1 4.35Å; F913-V919 HydrophobicContact CD1-CB 3.45Å; F913-V919 VanDerWaalsContact CD1-CB 3.45Å; F913-V919 HydrophobicContact CD1-CG1 3.78Å; F913-V919 HydrophobicContact CD1-CG2 3.41Å; F913-V919 VanDerWaalsContact CD1-CG2 3.41Å; F913-V919 HydrophobicContact CD2-CG1 4.14Å; F913-V919 HydrophobicContact CE1-CB 3.97Å; F913-V919 HydrophobicContact CE1-CG1 4.09Å; F913-V919 HydrophobicContact CE1-CG2 3.48Å; F913-V919 VanDerWaalsContact CE1-CG2 3.48Å; F913-V919 HydrophobicContact CE2-CG1 4.44Å; F913-V919 HydrophobicContact CG-CB 3.85Å; F913-V919 HydrophobicContact CG-CG1 3.82Å; F913-V919 HydrophobicContact CG-CG2 4.29Å; F913-V919 HydrophobicContact CZ-CG1 4.44Å; F913-V919 HydrophobicContact CZ-CG2 4.41Å; D916-V919 PolarHBondContact O-N 3.41Å; D916-V919 VanDerWaalsContact O-O 3.12Å; P917-V919 VanDerWaalsContact C-N 3.26Å
920	L	98.8	Very high	98	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.9	168.6	167.7	60.9	0	0	0	108.1	I896 L897 I898 I922 I952 V978 F982 W1105	I896-L920 PolarHBondContact O-N 2.85Å; L897-L920 HydrophobicContact CD1-CB 4.3Å; L897-L920 HydrophobicContact CD1-CD2 3.76Å; L897-L920 HydrophobicContact CD1-CG 3.77Å; I898-L920 PolarHBondContact N-O 3.31Å; L920-I922 HydrophobicContact CD1-CG1 4.03Å; L920-I922 HydrophobicContact CD2-CD1 4.23Å; L920-I922 HydrophobicContact CD2-CG1 4.45Å; L920-I922 HydrophobicContact CG-CD1 4.39Å; L920-I922 HydrophobicContact CG-CG1 4.07Å; L920-I952 HydrophobicContact CD1-CD1 4.04Å; L920-I952 HydrophobicContact CD1-CG1 4.12Å; L920-V978 HydrophobicContact CD2-CG1 3.54Å; L920-F982 HydrophobicContact CB-CD1 3.78Å; L920-F982 HydrophobicContact CB-CD2 4.2Å; L920-F982 HydrophobicContact CB-CE1 3.52Å; L920-F982 HydrophobicContact CB-CE2 3.96Å; L920-F982 HydrophobicContact CB-CG 4.11Å; L920-F982 HydrophobicContact CB-CZ 3.6Å; L920-F982 HydrophobicContact CD2-CB 3.83Å; L920-F982 HydrophobicContact CD2-CD1 3.76Å; L920-F982 HydrophobicContact CD2-CD2 4.33Å; L920-F982 HydrophobicContact CD2-CE1 4.37Å; L920-F982 HydrophobicContact CD2-CG 3.72Å; L920-F982 HydrophobicContact CG-CD1 4.44Å; L920-W1105 HydrophobicContact CD1-CZ2 4.01Å; L920-W1105 HydrophobicContact CD2-CH2 4.01Å; L920-W1105 HydrophobicContact CD2-CZ2 4.26Å
921	Y	98.9	Very high	97.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127	173.3	167.4	-97.5	0	0	0	109.8	I898 D900 H905 G906 T909 Q910 S923 Y950 T951 I952	I898-Y921 HydrophobicContact CB-CD2 4.26Å; I898-Y921 HydrophobicContact CG2-CD2 4.09Å; I898-Y921 WeakPolarHBondContact O-CA 3.29Å; D900-Y921 HydrophobicContact CB-CE2 3.89Å; H905-Y921 PolarHBondContact CD2-OH 3.46Å; H905-Y921 AromaticContact NE2-CE1 3.65Å; H905-Y921 AromaticContact NE2-CZ 3.8Å; H905-Y921 PolarHBondContact NE2-OH 3.26Å; G906-Y921 WeakPolarHBondContact CA-OH 3.48Å; G906-Y921 PolarHBondContact N-OH 3.08Å; G906-Y921 PolarHBondContact O-OH 2.96Å; G906-Y921 VanDerWaalsContact O-OH 3.13Å; T909-Y921 HydrophobicContact CG2-CD2 3.45Å; T909-Y921 VanDerWaalsContact CG2-CD2 3.45Å; T909-Y921 HydrophobicContact CG2-CE2 3.56Å; T909-Y921 HydrophobicContact CG2-CG 4.42Å; Q910-Y921 HydrophobicContact CB-CD1 4.23Å; Q910-Y921 HydrophobicContact CB-CE1 3.73Å; Q910-Y921 HydrophobicContact CG-CE1 4.35Å; Y921-S923 WeakPolarHBondContact OH-CB 3.46Å; Y921-Y950 PolarHBondContact N-O 2.92Å; Y921-T951 HydrophobicContact CD1-CG2 4.06Å; Y921-T951 CarbonylContact O-C 3.55Å; Y921-T951 WeakPolarHBondContact O-CA 3.42Å; Y921-I952 PolarHBondContact O-N 3.43Å
922	I	98.9	Very high	97.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131	173.7	-46.8	-178.4	0	0	0	108.7	L897 I898 V899 D900 L920 I952 I954 I975 V978	L897-I922 HydrophobicContact CD1-CD1 4.04Å; L897-I922 HydrophobicContact CD1-CG1 4.12Å; I898-I922 PolarHBondContact O-N 3.46Å; V899-I922 CarbonylContact C-O 3.56Å; V899-I922 WeakPolarHBondContact CA-O 3.48Å; D900-I922 PolarHBondContact N-O 3.44Å; L920-I922 HydrophobicContact CD1-CG1 4.03Å; L920-I922 HydrophobicContact CD2-CD1 4.23Å; L920-I922 HydrophobicContact CD2-CG1 4.45Å; L920-I922 HydrophobicContact CG-CD1 4.39Å; L920-I922 HydrophobicContact CG-CG1 4.07Å; I922-I952 VanDerWaalsContact CA-O 3.3Å; I922-I952 WeakPolarHBondContact CA-O 3Å; I922-I952 HydrophobicContact CB-CB 4.43Å; I922-I952 HydrophobicContact CD1-CD1 4.29Å; I922-I952 HydrophobicContact CG1-CB 4.14Å; I922-I952 HydrophobicContact CG1-CD1 4.3Å; I922-I952 HydrophobicContact CG1-CG1 4.4Å; I922-I952 HydrophobicContact CG2-CB 4.09Å; I922-I952 HydrophobicContact CG2-CG2 4.27Å; I922-I954 HydrophobicContact CG2-CD1 4.49Å; I922-I975 HydrophobicContact CD1-CG1 4.3Å; I922-I975 HydrophobicContact CD1-CG2 4.44Å; I922-I975 HydrophobicContact CG2-CG1 3.96Å; I922-V978 HydrophobicContact CD1-CG1 4.31Å
923	S	98.9	Very high	97.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	139	177.7	-179.6	0	0	0	0	112.2	D900 Y921 H925 I952 I954	D900-S923 CarbonylContact O-C 3.54Å; D900-S923 VanDerWaalsContact O-CA 3.31Å; D900-S923 WeakPolarHBondContact O-CA 3.47Å; Y921-S923 WeakPolarHBondContact OH-CB 3.46Å; S923-H925 PolarHBondContact OG-ND1 2.86Å; S923-I952 PolarHBondContact N-O 3.37Å; S923-I954 WeakPolarHBondContact O-CB 3.38Å; S923-I954 PolarHBondContact O-N 3.23Å
924	L	98.7	Very high	97.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	100.1	171	-42.5	85.5	0	0	0	109.6	V899 D900 W901 I954 Y967 A970 F971 I975	V899-L924 HydrophobicContact CG1-CD1 4.09Å; D900-L924 PolarHBondContact O-N 3.44Å; W901-L924 HydrophobicContact CB-CD1 4.15Å; L924-I954 HydrophobicContact CB-CB 4.47Å; L924-I954 HydrophobicContact CD2-CD1 4.39Å; L924-I954 HydrophobicContact CG-CB 4.39Å; L924-I954 HydrophobicContact CG-CD1 4.25Å; L924-Y967 HydrophobicContact CB-CE1 4.07Å; L924-Y967 HydrophobicContact CD2-CD1 4.02Å; L924-Y967 HydrophobicContact CD2-CE1 4.26Å; L924-A970 HydrophobicContact CD2-CB 3.58Å; L924-F971 HydrophobicContact CD1-CE2 4.45Å; L924-F971 HydrophobicContact CD2-CD2 4.44Å; L924-F971 HydrophobicContact CD2-CE2 4.31Å; L924-I975 HydrophobicContact CD1-CD1 3.73Å; L924-I975 HydrophobicContact CD2-CD1 3.78Å; L924-I975 HydrophobicContact CG-CD1 3.99Å
925	H	98.6	Very high	97.5	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	153.1	-170.4	56.2	-99.7	0	0	0	111.8	I903 H905 S923 H927 G937 I954 W956	I903-H925 CarbonylContact O-C 3.6Å; I903-H925 WeakPolarHBondContact O-CA 3.42Å; I903-H925 WeakPolarHBondContact O-CB 3.35Å; H905-H925 HydrophobicContact CB-CB 4.25Å; H905-H925 AromaticContact CD2-CE1 3.62Å; H905-H925 AromaticContact CD2-ND1 3.65Å; H905-H925 AromaticContact CG-CE1 3.85Å; H905-H925 AromaticContact CG-ND1 3.95Å; S923-H925 PolarHBondContact OG-ND1 2.86Å; H925-H927 PolarHBondContact O-N 3.37Å; H925-G937 PolarHBondContact CE1-O 2.82Å; H925-G937 PolarHBondContact NE2-O 3.37Å; H925-I954 PolarHBondContact N-O 3.45Å; H925-W956 VanDerWaalsContact O-CD1 3.32Å; H925-W956 PolarHBondContact O-N 2.96Å
926	R	98.1	Very high	97.5	Very high	41 Å²	41	29.7 Å²	29.7	16%	0.155	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	120	169.3	-180	172.5	173.8	-154.9	-13.1	108.7	I903 D928 F932 A1001 G1004 Y1006	I903-R926 HydrophobicContact CD1-CB 3.95Å; I903-R926 HydrophobicContact CG1-CB 3.86Å; I903-R926 PolarHBondContact O-N 2.79Å; R926-D928 WeakPolarHBondContact CG-OD1 3.31Å; R926-D928 IonicContact CZ-OD1 3.84Å; R926-D928 IonicContact CZ-OD2 3.42Å; R926-D928 IonicContact NE-OD1 2.91Å; R926-D928 PolarHBondContact NE-OD1 3.23Å; R926-D928 IonicContact NE-OD2 3.26Å; R926-D928 PolarHBondContact NE-OD2 2.94Å; R926-D928 IonicContact NH2-OD1 3.88Å; R926-D928 IonicContact NH2-OD2 2.74Å; R926-D928 PolarHBondContact NH2-OD2 2.93Å; R926-F932 HydrophobicContact CB-CD1 3.78Å; R926-F932 HydrophobicContact CB-CE1 4.07Å; R926-F932 HydrophobicContact CB-CG 4.22Å; R926-F932 HydrophobicContact CG-CB 4.05Å; R926-F932 HydrophobicContact CG-CD1 3.88Å; R926-F932 HydrophobicContact CG-CD2 4.22Å; R926-F932 HydrophobicContact CG-CE1 4.38Å; R926-F932 HydrophobicContact CG-CG 3.78Å; R926-F932 VanDerWaalsContact O-CD1 3.3Å; R926-F932 WeakPolarHBondContact O-CD1 3.18Å; R926-A1001 PolarHBondContact NH1-O 3.43Å; R926-G1004 PolarHBondContact NH1-O 2.69Å; R926-Y1006 HydrophobicContact CB-CE1 4.46Å; R926-Y1006 HydrophobicContact CB-CE2 3.93Å; R926-Y1006 HydrophobicContact CG-CE1 4.22Å; R926-Y1006 WeakPolarHBondContact CG-OH 3.38Å
927	H	97.5	Very high	97.6	Very high	22 Å²	22	28.7 Å²	28.7	10%	0.102	18%	0.181	C	C	.	.			trans	-109.6	-35.4	-176	-176.6	-103.3	0	0	0	112.1	H925 E929 G930 G931 F932 A955 W956	H925-H927 PolarHBondContact O-N 3.37Å; H927-E929 VanDerWaalsContact C-N 3.25Å; H927-E929 PolarHBondContact ND1-N 3.45Å; H927-E929 PolarHBondContact O-N 3.22Å; H927-G930 PolarHBondContact CE1-N 3.41Å; H927-G930 PolarHBondContact ND1-N 2.84Å; H927-G930 CarbonylContact O-C 3.53Å; H927-G930 WeakPolarHBondContact O-CA 3.43Å; H927-G930 PolarHBondContact O-N 2.92Å; H927-G931 PolarHBondContact O-N 2.85Å; H927-F932 PolarHBondContact O-N 2.99Å; H927-A955 HydrophobicContact CB-CB 3.6Å; H927-W956 WeakPolarHBondContact CB-O 3.45Å; H927-W956 PolarHBondContact N-O 2.85Å
928	D	96.2	Very high	97.6	Very high	22 Å²	22	28.1 Å²	28.1	12%	0.118	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	47.3	46.6	-177.7	-71.2	27.1	0	0	0	112.3	R926 G930 G931 F932 W956 S958	R926-D928 WeakPolarHBondContact CG-OD1 3.31Å; R926-D928 IonicContact CZ-OD1 3.84Å; R926-D928 IonicContact CZ-OD2 3.42Å; R926-D928 IonicContact NE-OD1 2.91Å; R926-D928 PolarHBondContact NE-OD1 3.23Å; R926-D928 IonicContact NE-OD2 3.26Å; R926-D928 PolarHBondContact NE-OD2 2.94Å; R926-D928 IonicContact NH2-OD1 3.88Å; R926-D928 IonicContact NH2-OD2 2.74Å; R926-D928 PolarHBondContact NH2-OD2 2.93Å; D928-G930 PolarHBondContact O-N 2.59Å; D928-G931 WeakPolarHBondContact O-CA 3.41Å; D928-G931 PolarHBondContact O-N 3.3Å; D928-F932 HydrophobicContact CB-CB 4.11Å; D928-W956 PolarHBondContact N-O 2.83Å; D928-S958 PolarHBondContact OD2-OG 3.43Å
929	E	95.6	Very high	97.6	Very high	130 Å²	130	27 Å²	27	61%	0.607	17%	0.171	S	C	*	.	G	3₁₀ helix	trans	56.1	22.4	-175.3	-71.8	59.2	-113.5	0	0	114.7	H927 P957 S958	H927-E929 VanDerWaalsContact C-N 3.25Å; H927-E929 PolarHBondContact ND1-N 3.45Å; H927-E929 PolarHBondContact O-N 3.22Å; E929-P957 WeakPolarHBondContact OE1-CA 3.38Å; E929-P957 WeakPolarHBondContact OE1-CB 3.11Å; E929-S958 WeakPolarHBondContact OE2-CB 3.37Å; E929-S958 PolarHBondContact OE2-N 3.41Å
930	G	95.6	Very high	97.6	Very high	36 Å²	36	31.9 Å²	31.9	37%	0.371	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	99.3	4.6	-174.9	0	0	0	0	0	113.7	H927 D928	H927-G930 PolarHBondContact CE1-N 3.41Å; H927-G930 PolarHBondContact ND1-N 2.84Å; H927-G930 CarbonylContact O-C 3.53Å; H927-G930 WeakPolarHBondContact O-CA 3.43Å; H927-G930 PolarHBondContact O-N 2.92Å; D928-G930 PolarHBondContact O-N 2.59Å
931	G	95.9	Very high	97.6	Very high	68 Å²	68	34.6 Å²	34.6	70%	0.701	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-13.1	-179.2	0	0	0	0	0	115.5	H927 D928	H927-G931 PolarHBondContact O-N 2.85Å; D928-G931 WeakPolarHBondContact O-CA 3.41Å; D928-G931 PolarHBondContact O-N 3.3Å
932	F	97.1	Very high	97.5	Very high	16 Å²	16	35.9 Å²	35.9	7%	0.07	21%	0.213	C	C	.	.	S	Bend	trans	-102.5	154.7	176.7	-164.6	-103.9	0	0	0	111.7	I903 H904 R926 H927 D928 G935	I903-F932 HydrophobicContact CG2-CE1 4.22Å; H904-F932 AromaticContact CD2-CE1 3.41Å; H904-F932 VanDerWaalsContact CD2-CE1 3.41Å; H904-F932 WeakPolarHBondContact CD2-CE1 3.26Å; H904-F932 AromaticContact CD2-CZ 4Å; H904-F932 AromaticContact NE2-CE1 3.69Å; H904-F932 AromaticContact NE2-CZ 3.8Å; R926-F932 HydrophobicContact CB-CD1 3.78Å; R926-F932 HydrophobicContact CB-CE1 4.07Å; R926-F932 HydrophobicContact CB-CG 4.22Å; R926-F932 HydrophobicContact CG-CB 4.05Å; R926-F932 HydrophobicContact CG-CD1 3.88Å; R926-F932 HydrophobicContact CG-CD2 4.22Å; R926-F932 HydrophobicContact CG-CE1 4.38Å; R926-F932 HydrophobicContact CG-CG 3.78Å; R926-F932 VanDerWaalsContact O-CD1 3.3Å; R926-F932 WeakPolarHBondContact O-CD1 3.18Å; H927-F932 PolarHBondContact O-N 2.99Å; D928-F932 HydrophobicContact CB-CB 4.11Å; F932-G935 WeakPolarHBondContact O-CA 3.49Å; F932-G935 PolarHBondContact O-N 3.28Å
933	F	96.9	Very high	97.5	Very high	83 Å²	83	36.2 Å²	36.2	36%	0.364	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	138	-176.8	-179.1	-91.3	0	0	0	111.4	H832 M839 H904	H832-F933 AromaticContact CD2-CE1 3.9Å; H832-F933 AromaticContact CE1-CE1 3.86Å; H832-F933 AromaticContact NE2-CE1 3.55Å; M839-F933 HydrophobicContact CE-CE2 4.12Å; M839-F933 HydrophobicContact CE-CZ 3.72Å; H904-F933 HydrophobicContact CB-CD1 4.5Å; H904-F933 AromaticContact CD2-CD1 3.89Å
934	P	97.3	Very high	97.5	Very high	28 Å²	28	37.8 Å²	37.8	18%	0.182	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	cis	-92.6	13.9	3	37	-36.6	0	0	0	115.2	M839 H905 N907	M839-P934 HydrophobicContact CE-CB 3.83Å; H905-P934 HydrophobicContact CB-CG 4.29Å; H905-P934 WeakPolarHBondContact O-CG 3.33Å; N907-P934 HydrophobicContact CB-CG 4.22Å
935	G	96.4	Very high	97.4	Very high	38 Å²	38	40.3 Å²	40.3	39%	0.392	25%	0.253	S	S	.	.	S	Bend	trans	75.4	24.4	179	0	0	0	0	0	114.8	F932	F932-G935 WeakPolarHBondContact O-CA 3.49Å; F932-G935 PolarHBondContact O-N 3.28Å
936	T	98.2	Very high	97.3	Very high	48 Å²	48	44.9 Å²	44.9	29%	0.294	28%	0.284	S	S	.	.			trans	-135	175	176.5	60.2	0	0	0	0	109.7	H905 N907	H905-T936 WeakPolarHBondContact CB-O 3.42Å; H905-T936 PolarHBondContact ND1-O 2.81Å; H905-T936 PolarHBondContact ND1-OG1 3.49Å; N907-T936 WeakPolarHBondContact CB-OG1 3.4Å
937	G	98.3	Very high	97.3	Very high	0 Å²	0	43 Å²	43	0%	0	28%	0.276	C	S	.	.			trans	95.2	30	-179	0	0	0	0	0	113.1	H905 H925 E941 N953 A955	H905-G937 WeakPolarHBondContact ND1-CA 3.39Å; H905-G937 PolarHBondContact ND1-N 2.92Å; H925-G937 PolarHBondContact CE1-O 2.82Å; H925-G937 PolarHBondContact NE2-O 3.37Å; G937-E941 VanDerWaalsContact CA-OE2 3.3Å; G937-E941 WeakPolarHBondContact CA-OE2 3.45Å; G937-E941 PolarHBondContact N-OE2 3.42Å; G937-N953 WeakPolarHBondContact CA-ND2 3.43Å; G937-N953 WeakPolarHBondContact O-CB 3.3Å; G937-N953 PolarHBondContact O-ND2 2.92Å; G937-A955 WeakPolarHBondContact O-CB 3.3Å
938	S	98.1	Very high	97.3	Very high	26 Å²	26	46 Å²	46	18%	0.182	29%	0.291	C	S	.	.			trans	-64	153.3	179.5	105.3	0	0	0	0	111.3	E940 E941 N953	S938-E940 WeakPolarHBondContact CB-OE2 3.31Å; S938-E940 PolarHBondContact O-N 2.98Å; S938-E940 PolarHBondContact OG-N 3.36Å; S938-E940 PolarHBondContact OG-OE2 3.4Å; S938-E941 WeakPolarHBondContact O-CB 3.25Å; S938-E941 PolarHBondContact O-N 3.24Å; S938-N953 PolarHBondContact O-ND2 3.14Å
939	P	97.8	Very high	97.4	Very high	9 Å²	9	45 Å²	45	6%	0.058	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-19.1	178.3	-27.7	37.3	0	0	0	114.4	A955 K1096 V1097 L1100	P939-A955 HydrophobicContact CG-CB 3.87Å; P939-K1096 HydrophobicContact CB-CD 4.5Å; P939-V1097 HydrophobicContact CB-CG2 4.31Å; P939-L1100 HydrophobicContact CB-CD1 3.88Å; P939-L1100 WeakPolarHBondContact O-CD1 3.37Å
940	E	97.6	Very high	97.5	Very high	102 Å²	102	42.3 Å²	42.3	48%	0.477	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-7.2	178	-58.5	78.2	-169.2	0	0	113.6	S938 I942 K1096	S938-E940 WeakPolarHBondContact CB-OE2 3.31Å; S938-E940 PolarHBondContact O-N 2.98Å; S938-E940 PolarHBondContact OG-N 3.36Å; S938-E940 PolarHBondContact OG-OE2 3.4Å; E940-I942 PolarHBondContact O-N 2.66Å; E940-K1096 WeakPolarHBondContact OE1-CE 3.47Å; E940-K1096 IonicContact OE1-NZ 3.15Å; E940-K1096 PolarHBondContact OE1-NZ 2.84Å; E940-K1096 IonicContact OE2-NZ 3.81Å
941	E	98.4	Very high	97.7	Very high	56 Å²	56	40.7 Å²	40.7	26%	0.262	25%	0.253	S	S	.	.			trans	-81.5	53.7	178.8	-61.8	-173.8	166.7	0	0	112	Q910 Y914 G937 S938 G943 T951	Q910-E941 PolarHBondContact NE2-OE2 3.23Å; Y914-E941 HydrophobicContact CE2-CB 4.29Å; Y914-E941 WeakPolarHBondContact CE2-O 3.11Å; Y914-E941 VanDerWaalsContact OH-C 3.32Å; Y914-E941 WeakPolarHBondContact OH-CA 3.38Å; G937-E941 VanDerWaalsContact CA-OE2 3.3Å; G937-E941 WeakPolarHBondContact CA-OE2 3.45Å; G937-E941 PolarHBondContact N-OE2 3.42Å; S938-E941 WeakPolarHBondContact O-CB 3.25Å; S938-E941 PolarHBondContact O-N 3.24Å; E941-G943 PolarHBondContact O-N 2.79Å; E941-T951 WeakPolarHBondContact O-CG2 3.27Å
942	I	98.3	Very high	97.8	Very high	28 Å²	28	37.4 Å²	37.4	14%	0.144	22%	0.219	C	C	.	.			trans	-73.8	16.5	-168.6	65.4	168.6	0	0	0	116.3	E940 E948 G949 T951 Y1104	E940-I942 PolarHBondContact O-N 2.66Å; I942-E948 HydrophobicContact CD1-CG 4.09Å; I942-E948 HydrophobicContact CG1-CG 4.36Å; I942-G949 PolarHBondContact O-N 3.04Å; I942-T951 WeakPolarHBondContact CA-O 3.19Å; I942-Y1104 HydrophobicContact CD1-CE2 3.77Å; I942-Y1104 VanDerWaalsContact CD1-OH 3.31Å; I942-Y1104 WeakPolarHBondContact CD1-OH 3.19Å
943	G	98.2	Very high	97.9	Very high	6 Å²	6	36.8 Å²	36.8	6%	0.062	22%	0.217	C	C	.	.			trans	87.4	-166.8	-169.9	0	0	0	0	0	112.7	Y914 E941	Y914-G943 VanDerWaalsContact CE1-O 3.32Å; Y914-G943 WeakPolarHBondContact CE1-O 3.5Å; Y914-G943 VanDerWaalsContact CE2-CA 3.48Å; Y914-G943 CarbonylContact O-C 3.56Å; Y914-G943 PolarHBondContact OH-N 3.45Å; Y914-G943 PolarHBondContact OH-O 3.4Å; E941-G943 PolarHBondContact O-N 2.79Å
944	S	98.1	Very high	98	Very high	33 Å²	33	32.8 Å²	32.8	23%	0.231	20%	0.199	C	C	.	.			trans	-163.6	153	178.5	61.8	0	0	0	0	114.6	Y914 T915 G947	Y914-S944 VanDerWaalsContact CD1-OG 3.28Å; Y914-S944 WeakPolarHBondContact CD1-OG 3.33Å; Y914-S944 PolarHBondContact O-N 3.01Å; Y914-S944 PolarHBondContact O-OG 3.16Å; T915-S944 WeakPolarHBondContact CA-O 3.46Å; T915-S944 WeakPolarHBondContact CG2-OG 3.34Å; S944-G947 PolarHBondContact O-N 3.14Å; S944-G947 VanDerWaalsContact O-N 3.14Å
945	G	97.6	Very high	98.1	Very high	53 Å²	53	31.8 Å²	31.8	55%	0.546	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	63.7	-131.3	177.5	0	0	0	0	0	110.3	G947 E948	G945-G947 PolarHBondContact O-N 3.14Å; G945-E948 WeakPolarHBondContact O-CB 3.39Å; G945-E948 PolarHBondContact O-N 3.13Å
946	P	96.8	Very high	98.2	Very high	98 Å²	98	30 Å²	30	64%	0.636	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-59.5	-28.6	175.2	-23.6	35.2	0	0	0	113.8	P917	P917-P946 VanDerWaalsContact CB-O 3.27Å; P917-P946 WeakPolarHBondContact CB-O 3.37Å; P917-P946 HydrophobicContact CG-CB 3.95Å; P917-P946 VanDerWaalsContact CG-O 3.28Å; P917-P946 WeakPolarHBondContact CG-O 3.34Å
947	G	97.7	Very high	98	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-90.2	9.6	-179.5	0	0	0	0	0	114.9	T915 S944 G945 G949 Y950	T915-G947 PolarHBondContact O-N 2.92Å; S944-G947 PolarHBondContact O-N 3.14Å; S944-G947 VanDerWaalsContact O-N 3.14Å; G945-G947 PolarHBondContact O-N 3.14Å; G947-G949 PolarHBondContact O-N 3.03Å; G947-Y950 PolarHBondContact O-N 3.14Å; G947-Y950 VanDerWaalsContact O-N 3.11Å
948	E	98	Very high	97.8	Very high	87 Å²	87	31.2 Å²	31.2	41%	0.407	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	123.8	176.1	-160.8	-179.9	119.2	0	0	110.3	I942 G945 Y1104	I942-E948 HydrophobicContact CD1-CG 4.09Å; I942-E948 HydrophobicContact CG1-CG 4.36Å; G945-E948 WeakPolarHBondContact O-CB 3.39Å; G945-E948 PolarHBondContact O-N 3.13Å; E948-Y1104 HydrophobicContact CB-CE1 4.29Å; E948-Y1104 HydrophobicContact CG-CE1 3.82Å; E948-Y1104 WeakPolarHBondContact O-CD1 3.49Å; E948-Y1104 PolarHBondContact OE1-OH 3.28Å
949	G	97.8	Very high	97.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.01	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.7	-13.1	-171.7	0	0	0	0	0	115.1	I942 G947 W1105	I942-G949 PolarHBondContact O-N 3.04Å; G947-G949 PolarHBondContact O-N 3.03Å; G949-W1105 PolarHBondContact O-NE1 3.42Å
950	Y	98.6	Very high	97	Very high	73 Å²	73	35 Å²	35	29%	0.286	22%	0.222	S	C	.	.	S	Bend	trans	-100.2	11.5	-173.8	-65.1	-98.8	0	0	0	114.2	P917 Y921 G947 F982 W1105	P917-Y950 HydrophobicContact CB-CD1 4.06Å; P917-Y950 HydrophobicContact CB-CD2 3.71Å; P917-Y950 HydrophobicContact CB-CE1 3.96Å; P917-Y950 HydrophobicContact CB-CE2 3.62Å; P917-Y950 HydrophobicContact CB-CG 3.94Å; P917-Y950 WeakPolarHBondContact O-CD1 3.34Å; P917-Y950 WeakPolarHBondContact O-CE1 3.3Å; Y921-Y950 PolarHBondContact N-O 2.92Å; G947-Y950 PolarHBondContact O-N 3.14Å; G947-Y950 VanDerWaalsContact O-N 3.11Å; Y950-F982 HydrophobicContact CD1-CD2 4.43Å; Y950-F982 AromaticContact CD1-CE2 3.97Å; Y950-F982 HydrophobicContact CD1-CE2 3.97Å; Y950-F982 HydrophobicContact CE1-CD2 4.13Å; Y950-F982 AromaticContact CE1-CE2 3.83Å; Y950-F982 HydrophobicContact CE1-CE2 3.83Å; Y950-W1105 HydrophobicContact CD1-CH2 4.43Å; Y950-W1105 HydrophobicContact CD1-CZ2 4.24Å; Y950-W1105 HydrophobicContact CE1-CH2 4.26Å; Y950-W1105 HydrophobicContact CE1-CZ2 4.35Å
951	T	98.8	Very high	97	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120.7	169.8	-62.9	0	0	0	0	106.7	Q910 Y914 Y921 E941 I942 H1101	Q910-T951 HydrophobicContact CG-CG2 3.79Å; Y914-T951 HydrophobicContact CD2-CG2 4.31Å; Y914-T951 HydrophobicContact CE2-CG2 4.23Å; Y921-T951 HydrophobicContact CD1-CG2 4.06Å; Y921-T951 CarbonylContact O-C 3.55Å; Y921-T951 WeakPolarHBondContact O-CA 3.42Å; E941-T951 WeakPolarHBondContact O-CG2 3.27Å; I942-T951 WeakPolarHBondContact CA-O 3.19Å; T951-H1101 PolarHBondContact O-CE1 2.95Å
952	I	98.8	Very high	96.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	114.9	-174.9	-51.2	-174.4	0	0	0	109.5	L920 Y921 I922 S923 I974 V978 V1097	L920-I952 HydrophobicContact CD1-CD1 4.04Å; L920-I952 HydrophobicContact CD1-CG1 4.12Å; Y921-I952 PolarHBondContact O-N 3.43Å; I922-I952 VanDerWaalsContact CA-O 3.3Å; I922-I952 WeakPolarHBondContact CA-O 3Å; I922-I952 HydrophobicContact CB-CB 4.43Å; I922-I952 HydrophobicContact CD1-CD1 4.29Å; I922-I952 HydrophobicContact CG1-CB 4.14Å; I922-I952 HydrophobicContact CG1-CD1 4.3Å; I922-I952 HydrophobicContact CG1-CG1 4.4Å; I922-I952 HydrophobicContact CG2-CB 4.09Å; I922-I952 HydrophobicContact CG2-CG2 4.27Å; S923-I952 PolarHBondContact N-O 3.37Å; I952-I974 HydrophobicContact CG2-CG2 3.98Å; I952-V978 HydrophobicContact CD1-CG1 3.87Å; I952-V978 HydrophobicContact CD1-CG2 4.26Å; I952-V1097 HydrophobicContact CG2-CG1 3.6Å
953	N	98.9	Very high	96.9	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.011	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	111.1	-178.3	-71.9	-36.4	0	0	0	112.3	Q910 G937 S938 A955 V1097	Q910-N953 PolarHBondContact OE1-ND2 2.7Å; G937-N953 WeakPolarHBondContact CA-ND2 3.43Å; G937-N953 WeakPolarHBondContact O-CB 3.3Å; G937-N953 PolarHBondContact O-ND2 2.92Å; S938-N953 PolarHBondContact O-ND2 3.14Å; N953-A955 PolarHBondContact O-N 3.02Å; N953-A955 VanDerWaalsContact O-N 3.14Å; N953-V1097 WeakPolarHBondContact O-CG2 3.34Å
954	I	98.7	Very high	96.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	71.6	168.9	-51.6	-176.4	0	0	0	107.5	I922 S923 L924 H925 W956 A970 I974 I975 L1094	I922-I954 HydrophobicContact CG2-CD1 4.49Å; S923-I954 WeakPolarHBondContact O-CB 3.38Å; S923-I954 PolarHBondContact O-N 3.23Å; L924-I954 HydrophobicContact CB-CB 4.47Å; L924-I954 HydrophobicContact CD2-CD1 4.39Å; L924-I954 HydrophobicContact CG-CB 4.39Å; L924-I954 HydrophobicContact CG-CD1 4.25Å; H925-I954 PolarHBondContact N-O 3.45Å; I954-W956 HydrophobicContact CG2-CD2 4.24Å; I954-W956 HydrophobicContact CG2-CE3 4.22Å; I954-W956 HydrophobicContact CG2-CH2 3.8Å; I954-W956 HydrophobicContact CG2-CZ2 3.79Å; I954-W956 HydrophobicContact CG2-CZ3 3.99Å; I954-W956 PolarHBondContact O-N 2.89Å; I954-A970 HydrophobicContact CD1-CB 3.92Å; I954-A970 HydrophobicContact CG2-CB 4.44Å; I954-I974 HydrophobicContact CD1-CB 3.89Å; I954-I974 HydrophobicContact CD1-CG1 4.06Å; I954-I974 HydrophobicContact CD1-CG2 3.95Å; I954-I975 HydrophobicContact CD1-CD1 4.29Å; I954-I975 HydrophobicContact CD1-CG1 4.32Å; I954-L1094 HydrophobicContact CD1-CD2 4Å; I954-L1094 HydrophobicContact CG1-CD2 4.43Å; I954-L1094 HydrophobicContact CG2-CD2 3.64Å
955	A	98.4	Very high	96.9	Very high	6 Å²	6	29.7 Å²	29.7	5%	0.05	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	104.8	-179.3	0	0	0	0	0	110.8	H927 G937 P939 N953 T1093	H927-A955 HydrophobicContact CB-CB 3.6Å; G937-A955 WeakPolarHBondContact O-CB 3.3Å; P939-A955 HydrophobicContact CG-CB 3.87Å; N953-A955 PolarHBondContact O-N 3.02Å; N953-A955 VanDerWaalsContact O-N 3.14Å; A955-T1093 WeakPolarHBondContact O-CG2 3.39Å
956	W	98.3	Very high	96.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	137	-176.3	-63	123.7	0	0	0	112.4	H925 H927 D928 I954 M962 E966 Y967 A970 Y1006 A1090 T1093 L1094	H925-W956 VanDerWaalsContact O-CD1 3.32Å; H925-W956 PolarHBondContact O-N 2.96Å; H927-W956 WeakPolarHBondContact CB-O 3.45Å; H927-W956 PolarHBondContact N-O 2.85Å; D928-W956 PolarHBondContact N-O 2.83Å; I954-W956 HydrophobicContact CG2-CD2 4.24Å; I954-W956 HydrophobicContact CG2-CE3 4.22Å; I954-W956 HydrophobicContact CG2-CH2 3.8Å; I954-W956 HydrophobicContact CG2-CZ2 3.79Å; I954-W956 HydrophobicContact CG2-CZ3 3.99Å; I954-W956 PolarHBondContact O-N 2.89Å; W956-M962 HydrophobicContact CB-CE 3.9Å; W956-M962 HydrophobicContact CB-CG 4.34Å; W956-M962 HydrophobicContact CD2-CE 4.12Å; W956-M962 HydrophobicContact CD2-CG 4.15Å; W956-M962 HydrophobicContact CE3-CE 3.9Å; W956-M962 HydrophobicContact CE3-SD 4.48Å; W956-M962 HydrophobicContact CG-CE 4.18Å; W956-M962 HydrophobicContact CG-CG 4.03Å; W956-E966 HydrophobicContact CH2-CB 4.2Å; W956-E966 HydrophobicContact CZ2-CB 4.42Å; W956-Y967 HydrophobicContact CZ2-CD2 4.29Å; W956-Y967 HydrophobicContact CZ2-CE2 4.34Å; W956-Y967 AromaticContact NE1-CE2 3.46Å; W956-Y967 AromaticContact NE1-CZ 3.64Å; W956-A970 HydrophobicContact CH2-CB 4.03Å; W956-A970 HydrophobicContact CZ2-CB 4.06Å; W956-Y1006 HydrophobicContact CB-CE2 4.35Å; W956-Y1006 WeakPolarHBondContact CB-OH 3.06Å; W956-Y1006 AromaticContact CD1-CE2 3.74Å; W956-Y1006 HydrophobicContact CG-CE2 4.26Å; W956-A1090 HydrophobicContact CE3-CB 4.15Å; W956-A1090 HydrophobicContact CH2-CB 4.37Å; W956-A1090 HydrophobicContact CZ3-CB 3.63Å; W956-T1093 HydrophobicContact CE3-CG2 4.26Å; W956-L1094 HydrophobicContact CH2-CD1 4.24Å; W956-L1094 HydrophobicContact CH2-CD2 4.17Å; W956-L1094 HydrophobicContact CH2-CG 4.23Å; W956-L1094 HydrophobicContact CZ3-CD2 4.42Å; W956-L1094 HydrophobicContact CZ3-CG 4.22Å
957	P	95.5	Very high	97	Very high	17 Å²	17	22.7 Å²	22.7	11%	0.11	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-77	160.2	-174.1	32	-36.8	0	0	0	113.3	E929 I960 M962	E929-P957 WeakPolarHBondContact OE1-CA 3.38Å; E929-P957 WeakPolarHBondContact OE1-CB 3.11Å; P957-I960 HydrophobicContact CG-CD1 4.2Å; P957-M962 HydrophobicContact CG-CE 4.23Å
958	S	93.9	Very high	97	Very high	58 Å²	58	22.8 Å²	22.8	41%	0.406	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	158.6	-177.7	-163.3	0	0	0	0	113.7	D928 E929 I960	D928-S958 PolarHBondContact OD2-OG 3.43Å; E929-S958 WeakPolarHBondContact OE2-CB 3.37Å; E929-S958 PolarHBondContact OE2-N 3.41Å; S958-I960 VanDerWaalsContact C-N 3.32Å; S958-I960 PolarHBondContact O-N 3.16Å
959	G	88.7	Confident	97	Very high	82 Å²	82	18.8 Å²	18.8	85%	0.845	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.3	2.9	171.5	0	0	0	0	0	115.8
960	I	91	Very high	97	Very high	33 Å²	33	18.7 Å²	18.7	17%	0.169	13%	0.126	C	C	.	.			trans	-124.7	131.4	-176.1	-60.8	159	0	0	0	110.1	P957 S958 M962 Y1006 S1089	P957-I960 HydrophobicContact CG-CD1 4.2Å; S958-I960 VanDerWaalsContact C-N 3.32Å; S958-I960 PolarHBondContact O-N 3.16Å; I960-M962 HydrophobicContact CB-CE 3.95Å; I960-M962 HydrophobicContact CB-SD 4.45Å; I960-M962 HydrophobicContact CG2-CE 3.7Å; I960-M962 HydrophobicContact CG2-SD 3.61Å; I960-Y1006 WeakPolarHBondContact O-CE1 3.26Å; I960-S1089 VanDerWaalsContact CD1-CB 3.45Å; I960-S1089 WeakPolarHBondContact CD1-OG 3.41Å
961	V	96.2	Very high	97	Very high	91 Å²	91	15.2 Å²	15.2	55%	0.552	11%	0.112	S	C	*	.			trans	-88.5	111.9	172.1	173.2	0	0	0	0	107.9
962	M	97.8	Very high	96.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	11%	0.113	C	C	.	.			trans	-82.5	152.6	178.4	-53.8	-56.7	179.3	0	0	111.6	W956 P957 I960 E966 Y967 Y1006 S1007 A1090	W956-M962 HydrophobicContact CB-CE 3.9Å; W956-M962 HydrophobicContact CB-CG 4.34Å; W956-M962 HydrophobicContact CD2-CE 4.12Å; W956-M962 HydrophobicContact CD2-CG 4.15Å; W956-M962 HydrophobicContact CE3-CE 3.9Å; W956-M962 HydrophobicContact CE3-SD 4.48Å; W956-M962 HydrophobicContact CG-CE 4.18Å; W956-M962 HydrophobicContact CG-CG 4.03Å; P957-M962 HydrophobicContact CG-CE 4.23Å; I960-M962 HydrophobicContact CB-CE 3.95Å; I960-M962 HydrophobicContact CB-SD 4.45Å; I960-M962 HydrophobicContact CG2-CE 3.7Å; I960-M962 HydrophobicContact CG2-SD 3.61Å; M962-E966 HydrophobicContact CB-CB 4.29Å; M962-E966 HydrophobicContact SD-CB 4.18Å; M962-E966 HydrophobicContact SD-CG 3.75Å; M962-Y967 HydrophobicContact CB-CD2 4.36Å; M962-Y967 HydrophobicContact CB-CE2 4Å; M962-Y1006 HydrophobicContact CB-CD1 4.33Å; M962-Y1006 HydrophobicContact CB-CD2 3.69Å; M962-Y1006 HydrophobicContact CB-CE1 4.35Å; M962-Y1006 HydrophobicContact CB-CE2 3.72Å; M962-Y1006 HydrophobicContact CB-CG 4.01Å; M962-Y1006 HydrophobicContact CG-CD2 4.08Å; M962-Y1006 HydrophobicContact CG-CE1 4.05Å; M962-Y1006 HydrophobicContact CG-CE2 3.55Å; M962-Y1006 WeakPolarHBondContact O-CB 3.47Å; M962-S1007 PolarHBondContact O-N 3.01Å; M962-A1090 HydrophobicContact CE-CB 4.17Å; M962-A1090 HydrophobicContact SD-CB 4.1Å
963	S	97.9	Very high	96.7	Very high	18 Å²	18	15.8 Å²	15.8	13%	0.126	11%	0.114	C	C	.	.			trans	-145.5	-167.3	-179.7	-177.1	0	0	0	0	110	A965 E966 Y967 E1081	S963-A965 VanDerWaalsContact C-N 3.33Å; S963-A965 PolarHBondContact O-N 2.83Å; S963-E966 PolarHBondContact N-OE2 3.02Å; S963-E966 VanDerWaalsContact N-OE2 3.08Å; S963-E966 PolarHBondContact O-N 3.17Å; S963-Y967 PolarHBondContact O-N 2.69Å; S963-E1081 VanDerWaalsContact CB-OE2 3.3Å; S963-E1081 WeakPolarHBondContact CB-OE2 3.46Å; S963-E1081 PolarHBondContact OG-OE2 3.27Å
964	D	98.3	Very high	96.7	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-48.7	-47.5	-172.5	-65.7	2.6	0	0	0	113.3	E966 Y967 L968 S1009 A1012 L1077 E1081	D964-E966 VanDerWaalsContact C-N 3.34Å; D964-E966 PolarHBondContact O-N 2.96Å; D964-Y967 PolarHBondContact O-N 2.64Å; D964-L968 HydrophobicContact CB-CD1 4.41Å; D964-L968 VanDerWaalsContact O-CB 3.27Å; D964-L968 WeakPolarHBondContact O-CB 3.5Å; D964-L968 WeakPolarHBondContact O-CG 3.26Å; D964-L968 PolarHBondContact O-N 2.83Å; D964-S1009 VanDerWaalsContact CG-OG 3.26Å; D964-S1009 WeakPolarHBondContact OD1-CB 3.35Å; D964-S1009 PolarHBondContact OD1-N 3.17Å; D964-S1009 PolarHBondContact OD1-OG 2.87Å; D964-S1009 VanDerWaalsContact OD1-OG 3.13Å; D964-S1009 WeakPolarHBondContact OD2-CB 3.49Å; D964-S1009 PolarHBondContact OD2-OG 3.08Å; D964-A1012 HydrophobicContact CB-CB 4.18Å; D964-A1012 WeakPolarHBondContact OD1-CB 3.4Å; D964-L1077 HydrophobicContact CB-CD2 4.32Å; D964-L1077 VanDerWaalsContact OD2-CD2 3.26Å; D964-L1077 WeakPolarHBondContact OD2-CD2 3.46Å; D964-E1081 HydrophobicContact CB-CB 3.89Å; D964-E1081 HydrophobicContact CB-CG 4.11Å; D964-E1081 PolarHBondContact N-OE2 3.48Å
965	A	97.7	Very high	96.7	Very high	3 Å²	3	15.7 Å²	15.7	3%	0.025	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-37.7	-175.4	0	0	0	0	0	112.9	S963 A969 R1084 P1086	S963-A965 VanDerWaalsContact C-N 3.33Å; S963-A965 PolarHBondContact O-N 2.83Å; A965-A969 WeakPolarHBondContact O-CB 3.45Å; A965-A969 PolarHBondContact O-N 2.97Å; A965-R1084 HydrophobicContact CB-CB 4.26Å; A965-P1086 HydrophobicContact CB-CG 4.38Å
966	E	98.1	Very high	96.6	Very high	3 Å²	3	15.6 Å²	15.6	1%	0.014	11%	0.113	C	C	.	.	H	α-helix	trans	-71.1	-42.5	179	-68.7	71.8	-145.7	0	0	112	W956 M962 S963 D964 A969 A970 R1084 P1086 H1087 A1090	W956-E966 HydrophobicContact CH2-CB 4.2Å; W956-E966 HydrophobicContact CZ2-CB 4.42Å; M962-E966 HydrophobicContact CB-CB 4.29Å; M962-E966 HydrophobicContact SD-CB 4.18Å; M962-E966 HydrophobicContact SD-CG 3.75Å; S963-E966 PolarHBondContact N-OE2 3.02Å; S963-E966 VanDerWaalsContact N-OE2 3.08Å; S963-E966 PolarHBondContact O-N 3.17Å; D964-E966 VanDerWaalsContact C-N 3.34Å; D964-E966 PolarHBondContact O-N 2.96Å; E966-A969 PolarHBondContact O-N 3.27Å; E966-A970 WeakPolarHBondContact O-CB 3.28Å; E966-A970 PolarHBondContact O-N 2.88Å; E966-R1084 IonicContact OE1-CZ 3.57Å; E966-R1084 IonicContact OE1-NH1 3.42Å; E966-R1084 PolarHBondContact OE1-NH1 3.42Å; E966-R1084 IonicContact OE1-NH2 3.67Å; E966-R1084 IonicContact OE2-CZ 3.98Å; E966-R1084 IonicContact OE2-NH1 2.67Å; E966-R1084 IonicContact OE2-NH2 2.86Å; E966-R1084 PolarHBondContact OE2-NH2 3.36Å; E966-P1086 HydrophobicContact CG-CB 4.41Å; E966-P1086 WeakPolarHBondContact OE1-CA 3.44Å; E966-H1087 HydrophobicContact CG-CB 4.36Å; E966-H1087 PolarHBondContact OE1-N 3.24Å; E966-A1090 HydrophobicContact CB-CB 4.22Å; E966-A1090 HydrophobicContact CG-CB 3.58Å
967	Y	98.5	Very high	96.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-69.1	-41.3	177.1	-86.6	-113.4	0	0	0	111.5	L924 W956 M962 S963 D964 A969 A970 F971 Y1006 V1008 M1016	L924-Y967 HydrophobicContact CB-CE1 4.07Å; L924-Y967 HydrophobicContact CD2-CD1 4.02Å; L924-Y967 HydrophobicContact CD2-CE1 4.26Å; W956-Y967 HydrophobicContact CZ2-CD2 4.29Å; W956-Y967 HydrophobicContact CZ2-CE2 4.34Å; W956-Y967 AromaticContact NE1-CE2 3.46Å; W956-Y967 AromaticContact NE1-CZ 3.64Å; M962-Y967 HydrophobicContact CB-CD2 4.36Å; M962-Y967 HydrophobicContact CB-CE2 4Å; S963-Y967 PolarHBondContact O-N 2.69Å; D964-Y967 PolarHBondContact O-N 2.64Å; Y967-A969 VanDerWaalsContact C-N 3.35Å; Y967-A969 PolarHBondContact O-N 3.06Å; Y967-A970 WeakPolarHBondContact O-CB 3.32Å; Y967-A970 PolarHBondContact O-N 3.46Å; Y967-F971 WeakPolarHBondContact O-CD2 3.46Å; Y967-F971 PolarHBondContact O-N 2.82Å; Y967-Y1006 HydrophobicContact CE2-CD2 4.2Å; Y967-V1008 HydrophobicContact CD1-CG1 4.47Å; Y967-V1008 HydrophobicContact CD1-CG2 4.26Å; Y967-V1008 HydrophobicContact CD2-CG2 3.49Å; Y967-V1008 VanDerWaalsContact CD2-CG2 3.49Å; Y967-V1008 HydrophobicContact CE1-CG2 4.33Å; Y967-V1008 HydrophobicContact CE2-CG2 3.58Å; Y967-V1008 HydrophobicContact CG-CG1 4.35Å; Y967-V1008 HydrophobicContact CG-CG2 3.87Å; Y967-M1016 HydrophobicContact CD1-CE 4.13Å; Y967-M1016 HydrophobicContact CD1-SD 3.93Å; Y967-M1016 HydrophobicContact CG-SD 4.46Å
968	L	98	Very high	96.5	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-66.2	-35.3	174.3	-69.2	170.7	0	0	0	112.1	D964 F971 R972 L1019 L1077 A1121 W1124	D964-L968 HydrophobicContact CB-CD1 4.41Å; D964-L968 VanDerWaalsContact O-CB 3.27Å; D964-L968 WeakPolarHBondContact O-CB 3.5Å; D964-L968 WeakPolarHBondContact O-CG 3.26Å; D964-L968 PolarHBondContact O-N 2.83Å; L968-F971 PolarHBondContact O-N 2.74Å; L968-R972 PolarHBondContact O-N 3.43Å; L968-L1019 HydrophobicContact CD2-CD1 4.36Å; L968-L1077 HydrophobicContact CD1-CD1 3.9Å; L968-L1077 HydrophobicContact CD1-CD2 4.37Å; L968-A1121 HydrophobicContact CD1-CB 3.93Å; L968-W1124 HydrophobicContact CB-CZ2 4.25Å; L968-W1124 WeakPolarHBondContact O-CZ2 3.3Å
969	A	97.6	Very high	96.7	Very high	3 Å²	3	12.8 Å²	12.8	3%	0.025	9%	0.093	C	C	.	.	H	α-helix	trans	-67.2	-40.2	172	0	0	0	0	0	112.4	A965 E966 Y967 F971 R972 L973 P1086 I1091 L1094	A965-A969 WeakPolarHBondContact O-CB 3.45Å; A965-A969 PolarHBondContact O-N 2.97Å; E966-A969 PolarHBondContact O-N 3.27Å; Y967-A969 VanDerWaalsContact C-N 3.35Å; Y967-A969 PolarHBondContact O-N 3.06Å; A969-F971 VanDerWaalsContact C-N 3.28Å; A969-F971 PolarHBondContact O-N 3.29Å; A969-R972 PolarHBondContact O-N 3.27Å; A969-L973 VanDerWaalsContact O-CB 3.25Å; A969-L973 WeakPolarHBondContact O-CB 3.3Å; A969-L973 WeakPolarHBondContact O-CG 3.23Å; A969-L973 PolarHBondContact O-N 3.19Å; A969-P1086 HydrophobicContact CB-CB 3.98Å; A969-P1086 HydrophobicContact CB-CG 3.55Å; A969-I1091 HydrophobicContact CB-CD1 4.49Å; A969-L1094 HydrophobicContact CB-CD1 4.08Å
970	A	98.2	Very high	97	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60	-38.9	172.5	0	0	0	0	0	112.1	L924 I954 W956 E966 Y967 I974 I975 L1094	L924-A970 HydrophobicContact CD2-CB 3.58Å; I954-A970 HydrophobicContact CD1-CB 3.92Å; I954-A970 HydrophobicContact CG2-CB 4.44Å; W956-A970 HydrophobicContact CH2-CB 4.03Å; W956-A970 HydrophobicContact CZ2-CB 4.06Å; E966-A970 WeakPolarHBondContact O-CB 3.28Å; E966-A970 PolarHBondContact O-N 2.88Å; Y967-A970 WeakPolarHBondContact O-CB 3.32Å; Y967-A970 PolarHBondContact O-N 3.46Å; A970-I974 PolarHBondContact O-N 3.14Å; A970-I975 PolarHBondContact O-N 3.16Å; A970-I975 VanDerWaalsContact O-N 3.16Å; A970-L1094 HydrophobicContact CB-CD1 4.31Å; A970-L1094 HydrophobicContact CB-CD2 3.78Å
971	F	98	Very high	97.3	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.074	C	C	.	.	I	π-helix	trans	-63	-50.7	173.2	-92.1	-117.4	0	0	0	112.1	W901 L924 Y967 L968 A969 I975 L976 M1016 L1019 L1020	W901-F971 HydrophobicContact CE3-CZ 4.1Å; W901-F971 HydrophobicContact CZ3-CZ 4.22Å; L924-F971 HydrophobicContact CD1-CE2 4.45Å; L924-F971 HydrophobicContact CD2-CD2 4.44Å; L924-F971 HydrophobicContact CD2-CE2 4.31Å; Y967-F971 WeakPolarHBondContact O-CD2 3.46Å; Y967-F971 PolarHBondContact O-N 2.82Å; L968-F971 PolarHBondContact O-N 2.74Å; A969-F971 VanDerWaalsContact C-N 3.28Å; A969-F971 PolarHBondContact O-N 3.29Å; F971-I975 HydrophobicContact CD2-CD1 3.52Å; F971-I975 HydrophobicContact CE2-CD1 3.52Å; F971-I975 HydrophobicContact CG-CD1 4.23Å; F971-I975 HydrophobicContact CZ-CD1 4.25Å; F971-I975 PolarHBondContact O-N 2.88Å; F971-L976 HydrophobicContact CB-CD1 4.28Å; F971-L976 HydrophobicContact CB-CG 4.46Å; F971-L976 HydrophobicContact CD1-CG 4.41Å; F971-L976 VanDerWaalsContact O-CB 3.3Å; F971-L976 WeakPolarHBondContact O-CB 3.34Å; F971-L976 VanDerWaalsContact O-CG 3.28Å; F971-L976 WeakPolarHBondContact O-CG 3.23Å; F971-L976 PolarHBondContact O-N 3.25Å; F971-M1016 HydrophobicContact CD1-CB 4.33Å; F971-M1016 HydrophobicContact CD1-CG 4.13Å; F971-M1016 HydrophobicContact CD2-CG 3.93Å; F971-M1016 HydrophobicContact CD2-SD 3.8Å; F971-M1016 HydrophobicContact CE1-CB 3.65Å; F971-M1016 HydrophobicContact CE1-CG 3.85Å; F971-M1016 HydrophobicContact CE2-CB 4.11Å; F971-M1016 HydrophobicContact CE2-CG 3.68Å; F971-M1016 HydrophobicContact CE2-SD 3.36Å; F971-M1016 WeakPolarHBondContact CE2-SD 3.16Å; F971-M1016 HydrophobicContact CG-CG 4.17Å; F971-M1016 HydrophobicContact CZ-CB 3.55Å; F971-M1016 HydrophobicContact CZ-CG 3.64Å; F971-M1016 HydrophobicContact CZ-SD 3.83Å; F971-L1019 HydrophobicContact CD1-CB 4.26Å; F971-L1019 HydrophobicContact CD1-CD1 4.23Å; F971-L1020 HydrophobicContact CE1-CD1 3.75Å; F971-L1020 HydrophobicContact CE1-CG 3.88Å; F971-L1020 HydrophobicContact CZ-CD1 3.95Å
972	R	96	Very high	97.3	Very high	7 Å²	7	8.7 Å²	8.7	3%	0.026	5%	0.049	C	C	.	.	I	π-helix	trans	-65.2	-40	179.6	176.4	170.9	55.1	73.6	-1	113.8	L968 A969 P977 Y1116 A1117 M1119 W1124	L968-R972 PolarHBondContact O-N 3.43Å; A969-R972 PolarHBondContact O-N 3.27Å; R972-P977 WeakPolarHBondContact O-CD 3.2Å; R972-Y1116 VanDerWaalsContact CG-OH 3.31Å; R972-Y1116 WeakPolarHBondContact CG-OH 3.5Å; R972-Y1116 VanDerWaalsContact CZ-O 3.27Å; R972-Y1116 PolarHBondContact NH1-O 3.33Å; R972-Y1116 PolarHBondContact NH2-O 3.45Å; R972-A1117 PolarHBondContact NH2-O 3.34Å; R972-M1119 PolarHBondContact NH2-O 3.32Å; R972-W1124 HydrophobicContact CB-CD2 4.45Å; R972-W1124 HydrophobicContact CB-CH2 4Å; R972-W1124 HydrophobicContact CB-CZ2 3.74Å; R972-W1124 HydrophobicContact CB-CZ3 4.46Å; R972-W1124 HydrophobicContact CG-CD2 4.36Å; R972-W1124 VanDerWaalsContact NE-NE1 3.19Å
973	L	96.2	Very high	97.3	Very high	5 Å²	5	14.6 Å²	14.6	3%	0.026	8%	0.077	C	C	.	.	I	π-helix	trans	-90.2	-29.6	-170.6	-68.6	177.4	0	0	0	114	A969 I1091 L1094 F1108 I1112 Y1116 A1117	A969-L973 VanDerWaalsContact O-CB 3.25Å; A969-L973 WeakPolarHBondContact O-CB 3.3Å; A969-L973 WeakPolarHBondContact O-CG 3.23Å; A969-L973 PolarHBondContact O-N 3.19Å; L973-I1091 HydrophobicContact CD1-CD1 4.26Å; L973-L1094 HydrophobicContact CD1-CB 4.3Å; L973-L1094 HydrophobicContact CD1-CD1 3.98Å; L973-F1108 WeakPolarHBondContact O-CE1 3.5Å; L973-I1112 HydrophobicContact CD2-CG2 3.93Å; L973-Y1116 HydrophobicContact CD2-CD1 3.79Å; L973-Y1116 HydrophobicContact CD2-CE1 3.55Å; L973-A1117 HydrophobicContact CD1-CB 4.2Å
974	I	97.6	Very high	97.3	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	I	π-helix	trans	-121.6	-62.2	-176	-55.8	-63.7	0	0	0	111.3	I952 I954 A970 P977 V978 L1094 V1097 A1098 F1108	I952-I974 HydrophobicContact CG2-CG2 3.98Å; I954-I974 HydrophobicContact CD1-CB 3.89Å; I954-I974 HydrophobicContact CD1-CG1 4.06Å; I954-I974 HydrophobicContact CD1-CG2 3.95Å; A970-I974 PolarHBondContact O-N 3.14Å; I974-P977 WeakPolarHBondContact O-CD 3.48Å; I974-P977 WeakPolarHBondContact O-CG 3.35Å; I974-V978 WeakPolarHBondContact O-CB 3.46Å; I974-V978 VanDerWaalsContact O-CG2 3.29Å; I974-V978 WeakPolarHBondContact O-CG2 3.14Å; I974-V978 PolarHBondContact O-N 2.76Å; I974-V978 VanDerWaalsContact O-N 3.09Å; I974-L1094 HydrophobicContact CG1-CD2 3.85Å; I974-V1097 HydrophobicContact CD1-CB 4.36Å; I974-V1097 HydrophobicContact CD1-CG1 4.03Å; I974-V1097 HydrophobicContact CG1-CG1 4.42Å; I974-V1097 HydrophobicContact CG2-CG1 4.46Å; I974-A1098 HydrophobicContact CD1-CB 3.92Å; I974-F1108 HydrophobicContact CB-CZ 4.47Å; I974-F1108 HydrophobicContact CD1-CE1 3.97Å; I974-F1108 HydrophobicContact CD1-CE2 4.43Å; I974-F1108 HydrophobicContact CD1-CZ 3.68Å; I974-F1108 HydrophobicContact CG2-CZ 4.2Å
975	I	98.2	Very high	97.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.086	C	C	.	.	I	π-helix	trans	-70.8	-46.7	-161.1	-62.7	157.3	0	0	0	112.1	V899 I922 L924 I954 A970 F971 A979 L1020	V899-I975 HydrophobicContact CG2-CG2 4.24Å; I922-I975 HydrophobicContact CD1-CG1 4.3Å; I922-I975 HydrophobicContact CD1-CG2 4.44Å; I922-I975 HydrophobicContact CG2-CG1 3.96Å; L924-I975 HydrophobicContact CD1-CD1 3.73Å; L924-I975 HydrophobicContact CD2-CD1 3.78Å; L924-I975 HydrophobicContact CG-CD1 3.99Å; I954-I975 HydrophobicContact CD1-CD1 4.29Å; I954-I975 HydrophobicContact CD1-CG1 4.32Å; A970-I975 PolarHBondContact O-N 3.16Å; A970-I975 VanDerWaalsContact O-N 3.16Å; F971-I975 HydrophobicContact CD2-CD1 3.52Å; F971-I975 HydrophobicContact CE2-CD1 3.52Å; F971-I975 HydrophobicContact CG-CD1 4.23Å; F971-I975 HydrophobicContact CZ-CD1 4.25Å; F971-I975 PolarHBondContact O-N 2.88Å; I975-A979 WeakPolarHBondContact O-CB 3.35Å; I975-A979 PolarHBondContact O-N 3.02Å; I975-L1020 HydrophobicContact CG2-CD2 4.15Å
976	L	96.7	Very high	97.2	Very high	5 Å²	5	15.7 Å²	15.7	3%	0.026	9%	0.085	C	C	.	.	H	α-helix	trans	-68	-45.8	179.9	-62.4	171.4	0	0	0	113.1	F971 V978 A979 C980 L1019 I1025 W1124 I1136	F971-L976 HydrophobicContact CB-CD1 4.28Å; F971-L976 HydrophobicContact CB-CG 4.46Å; F971-L976 HydrophobicContact CD1-CG 4.41Å; F971-L976 VanDerWaalsContact O-CB 3.3Å; F971-L976 WeakPolarHBondContact O-CB 3.34Å; F971-L976 VanDerWaalsContact O-CG 3.28Å; F971-L976 WeakPolarHBondContact O-CG 3.23Å; F971-L976 PolarHBondContact O-N 3.25Å; L976-V978 PolarHBondContact O-N 3.2Å; L976-A979 PolarHBondContact O-N 3.44Å; L976-C980 WeakPolarHBondContact O-CB 3.43Å; L976-C980 PolarHBondContact O-N 3.01Å; L976-C980 PolarHBondContact O-SG 2.88Å; L976-L1019 HydrophobicContact CD1-CB 4.31Å; L976-L1019 HydrophobicContact CD1-CD1 4.35Å; L976-L1019 HydrophobicContact CD1-CD2 4.17Å; L976-L1019 HydrophobicContact CD2-CB 4.16Å; L976-I1025 HydrophobicContact CD2-CD1 3.71Å; L976-W1124 HydrophobicContact CD1-CZ3 4.44Å; L976-I1136 HydrophobicContact CD1-CD1 4.16Å
977	P	95.4	Very high	97.2	Very high	15 Å²	15	15.6 Å²	15.6	10%	0.097	8%	0.084	C	C	.	.	H	α-helix	trans	-55.5	-50.4	172	-0.6	-7.5	0	0	0	112.7	R972 I974 C980 E981 L1139	R972-P977 WeakPolarHBondContact O-CD 3.2Å; I974-P977 WeakPolarHBondContact O-CD 3.48Å; I974-P977 WeakPolarHBondContact O-CG 3.35Å; P977-C980 PolarHBondContact O-N 3.06Å; P977-E981 PolarHBondContact O-N 3.44Å; P977-L1139 HydrophobicContact CB-CD2 3.81Å; P977-L1139 HydrophobicContact CG-CD2 3.79Å
978	V	97.2	Very high	97.3	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-69	-37.3	-177.2	174.6	0	0	0	0	111.8	L920 I922 I952 I974 L976 C980 E981 F982 W1105 F1108	L920-V978 HydrophobicContact CD2-CG1 3.54Å; I922-V978 HydrophobicContact CD1-CG1 4.31Å; I952-V978 HydrophobicContact CD1-CG1 3.87Å; I952-V978 HydrophobicContact CD1-CG2 4.26Å; I974-V978 WeakPolarHBondContact O-CB 3.46Å; I974-V978 VanDerWaalsContact O-CG2 3.29Å; I974-V978 WeakPolarHBondContact O-CG2 3.14Å; I974-V978 PolarHBondContact O-N 2.76Å; I974-V978 VanDerWaalsContact O-N 3.09Å; L976-V978 PolarHBondContact O-N 3.2Å; V978-C980 VanDerWaalsContact C-N 3.33Å; V978-C980 PolarHBondContact O-N 3.14Å; V978-E981 PolarHBondContact O-N 3.42Å; V978-F982 WeakPolarHBondContact O-CB 3.38Å; V978-F982 PolarHBondContact O-N 3.17Å; V978-W1105 HydrophobicContact CG1-CD2 3.85Å; V978-W1105 HydrophobicContact CG1-CE3 3.8Å; V978-W1105 HydrophobicContact CG1-CH2 3.88Å; V978-W1105 HydrophobicContact CG1-CZ2 3.92Å; V978-W1105 HydrophobicContact CG1-CZ3 3.82Å; V978-W1105 HydrophobicContact CG2-CD2 4.28Å; V978-W1105 HydrophobicContact CG2-CG 4.31Å; V978-F1108 HydrophobicContact CG2-CE1 4.27Å; V978-F1108 HydrophobicContact CG2-CE2 3.58Å; V978-F1108 HydrophobicContact CG2-CZ 3.32Å
979	A	97.5	Very high	97.3	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.6	-38.6	174.6	0	0	0	0	0	112.1	L897 I975 L976 Q983 P984 I1025	L897-A979 HydrophobicContact CD2-CB 3.71Å; I975-A979 WeakPolarHBondContact O-CB 3.35Å; I975-A979 PolarHBondContact O-N 3.02Å; L976-A979 PolarHBondContact O-N 3.44Å; A979-Q983 PolarHBondContact O-N 3.47Å; A979-P984 WeakPolarHBondContact O-CD 3.33Å; A979-I1025 HydrophobicContact CB-CD1 4.07Å; A979-I1025 HydrophobicContact CB-CG1 4.47Å; A979-I1025 HydrophobicContact CB-CG2 4.38Å
980	C	95.6	Very high	97.4	Very high	48 Å²	48	15.5 Å²	15.5	32%	0.324	8%	0.083	S	C	.	.	H	α-helix	trans	-68.6	-36.4	174.7	-73	0	0	0	0	112.8	L976 P977 V978 Q983	L976-C980 WeakPolarHBondContact O-CB 3.43Å; L976-C980 PolarHBondContact O-N 3.01Å; L976-C980 PolarHBondContact O-SG 2.88Å; P977-C980 PolarHBondContact O-N 3.06Å; V978-C980 VanDerWaalsContact C-N 3.33Å; V978-C980 PolarHBondContact O-N 3.14Å; C980-Q983 WeakPolarHBondContact O-CG 3.43Å
981	E	96.6	Very high	97.4	Very high	62 Å²	62	15.5 Å²	15.5	29%	0.29	8%	0.083	S	C	.	.	H	α-helix	trans	-73.6	-43.5	175.5	-175.6	169.3	-175.7	0	0	112	P977 V978 Q983 W1105 T1106 S1107	P977-E981 PolarHBondContact O-N 3.44Å; V978-E981 PolarHBondContact O-N 3.42Å; E981-Q983 VanDerWaalsContact C-N 3.31Å; E981-Q983 PolarHBondContact O-N 3.35Å; E981-W1105 HydrophobicContact CB-CE3 4.15Å; E981-W1105 HydrophobicContact CB-CZ3 4.34Å; E981-W1105 HydrophobicContact CG-CE3 3.93Å; E981-W1105 HydrophobicContact CG-CZ3 4.21Å; E981-T1106 VanDerWaalsContact CD-N 3.31Å; E981-T1106 WeakPolarHBondContact OE1-CB 3.42Å; E981-T1106 PolarHBondContact OE1-N 2.84Å; E981-T1106 PolarHBondContact OE1-OG1 2.8Å; E981-T1106 PolarHBondContact OE2-N 3.22Å; E981-T1106 PolarHBondContact OE2-OG1 3.34Å; E981-S1107 WeakPolarHBondContact OE2-CB 3.45Å; E981-S1107 PolarHBondContact OE2-N 2.92Å
982	F	97.3	Very high	97.4	Very high	10 Å²	10	15.5 Å²	15.5	4%	0.044	8%	0.083	C	C	.	.	H	α-helix	trans	-69.7	-25.5	178.6	-176.2	-117.8	0	0	0	113.1	R895 I896 L897 L920 Y950 V978 P984 W1105	R895-F982 HydrophobicContact CB-CD1 4.48Å; R895-F982 HydrophobicContact CB-CE1 3.79Å; R895-F982 HydrophobicContact CB-CE2 4.17Å; R895-F982 HydrophobicContact CB-CZ 3.63Å; R895-F982 VanDerWaalsContact CD-O 3.3Å; R895-F982 WeakPolarHBondContact CD-O 3.23Å; R895-F982 HydrophobicContact CG-CE2 4.13Å; R895-F982 HydrophobicContact CG-CZ 4.05Å; R895-F982 PolarHBondContact NE-O 3.06Å; I896-F982 WeakPolarHBondContact O-CE1 3.11Å; L897-F982 HydrophobicContact CB-CD1 4.48Å; L920-F982 HydrophobicContact CB-CD1 3.78Å; L920-F982 HydrophobicContact CB-CD2 4.2Å; L920-F982 HydrophobicContact CB-CE1 3.52Å; L920-F982 HydrophobicContact CB-CE2 3.96Å; L920-F982 HydrophobicContact CB-CG 4.11Å; L920-F982 HydrophobicContact CB-CZ 3.6Å; L920-F982 HydrophobicContact CD2-CB 3.83Å; L920-F982 HydrophobicContact CD2-CD1 3.76Å; L920-F982 HydrophobicContact CD2-CD2 4.33Å; L920-F982 HydrophobicContact CD2-CE1 4.37Å; L920-F982 HydrophobicContact CD2-CG 3.72Å; L920-F982 HydrophobicContact CG-CD1 4.44Å; Y950-F982 HydrophobicContact CD1-CD2 4.43Å; Y950-F982 AromaticContact CD1-CE2 3.97Å; Y950-F982 HydrophobicContact CD1-CE2 3.97Å; Y950-F982 HydrophobicContact CE1-CD2 4.13Å; Y950-F982 AromaticContact CE1-CE2 3.83Å; Y950-F982 HydrophobicContact CE1-CE2 3.83Å; V978-F982 WeakPolarHBondContact O-CB 3.38Å; V978-F982 PolarHBondContact O-N 3.17Å; F982-P984 HydrophobicContact CD1-CB 4.03Å; F982-P984 HydrophobicContact CD1-CG 4.46Å; F982-P984 HydrophobicContact CE1-CB 4.19Å; F982-W1105 HydrophobicContact CB-CH2 3.79Å; F982-W1105 HydrophobicContact CB-CZ3 3.76Å; F982-W1105 AromaticContact CD2-CH2 3.79Å; F982-W1105 HydrophobicContact CD2-CH2 3.79Å; F982-W1105 HydrophobicContact CD2-CZ3 4.4Å; F982-W1105 HydrophobicContact CG-CH2 4.1Å
983	Q	96.7	Very high	97.6	Very high	124 Å²	124	15.1 Å²	15.1	58%	0.579	8%	0.082	S	C	*	.			trans	46	65.7	-179.9	-62.4	-177.8	-3.5	0	0	112.6	R895 A979 C980 E981	R895-Q983 PolarHBondContact NE-O 3.37Å; R895-Q983 VanDerWaalsContact NE-O 3.08Å; R895-Q983 VanDerWaalsContact NH2-CB 3.33Å; R895-Q983 PolarHBondContact NH2-O 3.46Å; A979-Q983 PolarHBondContact O-N 3.47Å; C980-Q983 WeakPolarHBondContact O-CG 3.43Å; E981-Q983 VanDerWaalsContact C-N 3.31Å; E981-Q983 PolarHBondContact O-N 3.35Å
984	P	97.5	Very high	97.7	Very high	6 Å²	6	14.9 Å²	14.9	4%	0.039	8%	0.081	C	C	.	.			trans	-63.2	151.2	179.7	27	-33.9	0	0	0	111.8	R895 L897 A979 F982 V987 I1025 A1026	R895-P984 CarbonylContact O-C 3.6Å; L897-P984 HydrophobicContact CB-CB 3.68Å; L897-P984 HydrophobicContact CB-CG 3.83Å; L897-P984 HydrophobicContact CD2-CG 4.28Å; A979-P984 WeakPolarHBondContact O-CD 3.33Å; F982-P984 HydrophobicContact CD1-CB 4.03Å; F982-P984 HydrophobicContact CD1-CG 4.46Å; F982-P984 HydrophobicContact CE1-CB 4.19Å; P984-V987 HydrophobicContact CG-CG2 4.13Å; P984-I1025 HydrophobicContact CG-CG2 4.14Å; P984-A1026 HydrophobicContact CG-CB 4.35Å; P984-A1026 WeakPolarHBondContact O-CA 3.47Å; P984-A1026 VanDerWaalsContact O-CB 3.3Å; P984-A1026 WeakPolarHBondContact O-CB 3.42Å
985	S	96.8	Very high	97.7	Very high	40 Å²	40	15 Å²	15	28%	0.28	8%	0.081	S	C	.	.	S	Bend	trans	-86.1	-19.2	172.8	-48	0	0	0	0	113	R895	R895-S985 PolarHBondContact N-OG 2.67Å; R895-S985 PolarHBondContact O-N 2.94Å
986	I	98.1	Very high	97.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	143.1	171.3	-175.8	166.5	0	0	0	108.7	V814 M815 I896 L897 L988 K1029 V1031	V814-I986 HydrophobicContact CB-CD1 4.25Å; V814-I986 HydrophobicContact CG1-CD1 4.02Å; V814-I986 HydrophobicContact CG1-CG1 4.47Å; M815-I986 HydrophobicContact CB-CD1 4.08Å; M815-I986 HydrophobicContact SD-CB 4.02Å; M815-I986 HydrophobicContact SD-CG2 3.93Å; I896-I986 HydrophobicContact CG1-CG2 4.09Å; I896-I986 HydrophobicContact CG2-CG2 4.24Å; L897-I986 PolarHBondContact N-O 2.68Å; I986-L988 HydrophobicContact CD1-CD2 3.89Å; I986-L988 HydrophobicContact CG1-CD2 4.05Å; I986-K1029 HydrophobicContact CG1-CB 4.38Å; I986-V1031 HydrophobicContact CD1-CG2 4.46Å
987	V	98.7	Very high	97.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.9	167.7	-172.9	0	0	0	0	108.9	L897 P984 I989 L1020 I1025 A1026 K1029 V1030 V1031	L897-V987 HydrophobicContact CB-CG1 4.47Å; L897-V987 HydrophobicContact CB-CG2 4.39Å; L897-V987 HydrophobicContact CD2-CG1 4.13Å; L897-V987 HydrophobicContact CD2-CG2 4.16Å; L897-V987 HydrophobicContact CG-CG1 4.2Å; L897-V987 WeakPolarHBondContact O-CA 3.43Å; P984-V987 HydrophobicContact CG-CG2 4.13Å; V987-I989 HydrophobicContact CG1-CD1 4.5Å; V987-I989 HydrophobicContact CG1-CG1 4.02Å; V987-L1020 HydrophobicContact CG1-CD2 4.49Å; V987-I1025 HydrophobicContact CG2-CG2 3.59Å; V987-A1026 HydrophobicContact CG2-CB 4.09Å; V987-K1029 PolarHBondContact N-O 3.07Å; V987-V1030 HydrophobicContact CB-CG1 4.44Å; V987-V1030 HydrophobicContact CB-CG2 4.21Å; V987-V1030 WeakPolarHBondContact O-CA 3.34Å; V987-V1031 PolarHBondContact O-N 2.8Å
988	L	98.9	Very high	97.7	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.6	166.8	-52.8	-179.3	0	0	0	108.6	A811 V847 A850 A851 I896 L897 I898 V899 I986 V1031	A811-L988 HydrophobicContact CB-CD2 3.94Å; V847-L988 HydrophobicContact CG1-CB 3.93Å; V847-L988 HydrophobicContact CG1-CD1 4.16Å; A850-L988 HydrophobicContact CB-CD1 4.42Å; A851-L988 HydrophobicContact CB-CD1 3.82Å; I896-L988 HydrophobicContact CG2-CD1 4.09Å; I896-L988 HydrophobicContact CG2-CG 4.2Å; L897-L988 PolarHBondContact O-N 3.26Å; I898-L988 WeakPolarHBondContact CA-O 3.41Å; I898-L988 HydrophobicContact CG1-CB 4.45Å; V899-L988 PolarHBondContact N-O 3.42Å; I986-L988 HydrophobicContact CD1-CD2 3.89Å; I986-L988 HydrophobicContact CG1-CD2 4.05Å; L988-V1031 CarbonylContact C-O 3.46Å; L988-V1031 WeakPolarHBondContact CA-O 3.34Å; L988-V1031 HydrophobicContact CD2-CB 3.93Å; L988-V1031 HydrophobicContact CD2-CG1 4.48Å
989	I	98.9	Very high	97.7	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	117.3	179.1	-51.8	-174.3	0	0	0	109.4	V899 W901 V987 A991 L1020 V1030 V1031 L1032 S1033	V899-I989 CarbonylContact O-C 3.19Å; V899-I989 VanDerWaalsContact O-CA 3.25Å; V899-I989 WeakPolarHBondContact O-CA 3.49Å; W901-I989 HydrophobicContact CD2-CG2 3.75Å; W901-I989 HydrophobicContact CE3-CG2 3.8Å; W901-I989 HydrophobicContact CG-CG2 4.47Å; W901-I989 HydrophobicContact CH2-CD1 3.79Å; W901-I989 HydrophobicContact CH2-CG2 3.84Å; W901-I989 HydrophobicContact CZ2-CG2 3.81Å; W901-I989 HydrophobicContact CZ3-CD1 3.77Å; W901-I989 HydrophobicContact CZ3-CG2 3.85Å; V987-I989 HydrophobicContact CG1-CD1 4.5Å; V987-I989 HydrophobicContact CG1-CG1 4.02Å; I989-A991 HydrophobicContact CG2-CB 4.18Å; I989-A991 PolarHBondContact O-N 3.17Å; I989-L1020 HydrophobicContact CD1-CD1 3.63Å; I989-L1020 HydrophobicContact CG1-CD1 4.42Å; I989-V1030 HydrophobicContact CD1-CG1 3.79Å; I989-V1030 HydrophobicContact CG1-CG1 4.2Å; I989-V1031 PolarHBondContact N-O 3.3Å; I989-L1032 HydrophobicContact CB-CD1 4.3Å; I989-L1032 HydrophobicContact CB-CG 4.08Å; I989-L1032 HydrophobicContact CD1-CD1 3.82Å; I989-L1032 HydrophobicContact CD1-CG 4.31Å; I989-L1032 HydrophobicContact CG1-CD1 4.28Å; I989-L1032 HydrophobicContact CG2-CG 4.49Å; I989-S1033 PolarHBondContact O-N 3.11Å
990	S	98.9	Very high	97.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	101.3	163.4	-87.3	0	0	0	0	106.6	V847 V899 D900 W901 E1035	V847-S990 WeakPolarHBondContact CG2-OG 3.37Å; V899-S990 PolarHBondContact O-N 2.97Å; D900-S990 VanDerWaalsContact CG-CB 3.49Å; D900-S990 WeakPolarHBondContact OD1-CB 3.14Å; W901-S990 PolarHBondContact N-O 2.82Å; W901-S990 VanDerWaalsContact N-O 3.14Å; S990-E1035 WeakPolarHBondContact CB-OE1 3.4Å; S990-E1035 PolarHBondContact OG-OE1 2.91Å
991	A	98.8	Very high	97.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	76.4	-164.8	0	0	0	0	0	110.5	F823 W901 I989 F993 L1032 S1033 E1035	F823-A991 HydrophobicContact CE1-CB 4.36Å; F823-A991 HydrophobicContact CZ-CB 4.28Å; W901-A991 HydrophobicContact CZ2-CB 4.28Å; I989-A991 HydrophobicContact CG2-CB 4.18Å; I989-A991 PolarHBondContact O-N 3.17Å; A991-F993 HydrophobicContact CB-CZ 4.43Å; A991-L1032 HydrophobicContact CB-CB 4.24Å; A991-L1032 HydrophobicContact CB-CD2 4.49Å; A991-L1032 HydrophobicContact CB-CG 4.31Å; A991-S1033 WeakPolarHBondContact CA-O 3.49Å; A991-S1033 WeakPolarHBondContact CB-O 3.47Å; A991-S1033 PolarHBondContact N-O 3.18Å; A991-E1035 PolarHBondContact O-N 2.84Å; A991-E1035 VanDerWaalsContact O-N 3.09Å
992	G	98.5	Very high	97.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	18%	0.18	C	C	.	.			trans	-74.5	159.4	161.2	0	0	0	0	0	111.7	W901 D902	W901-G992 PolarHBondContact NE1-O 3.4Å; D902-G992 VanDerWaalsContact OD2-CA 3.26Å; D902-G992 WeakPolarHBondContact OD2-CA 3.36Å
993	F	98.7	Very high	97	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	19%	0.186	C	C	.	.			trans	-133.4	20.7	178.7	-61.8	-57.6	0	0	0	113.2	F823 W901 A991 A996 H999 F1013 L1034 L1043 C1046 T1047	F823-F993 HydrophobicContact CE2-CE2 4.35Å; F823-F993 HydrophobicContact CE2-CZ 4.09Å; F823-F993 AromaticContact CZ-CE2 3.78Å; F823-F993 HydrophobicContact CZ-CE2 3.78Å; F823-F993 AromaticContact CZ-CZ 3.76Å; F823-F993 HydrophobicContact CZ-CZ 3.76Å; W901-F993 AromaticContact NE1-CE1 3.87Å; A991-F993 HydrophobicContact CB-CZ 4.43Å; F993-A996 WeakPolarHBondContact O-CB 3.48Å; F993-A996 PolarHBondContact O-N 3.44Å; F993-H999 PolarHBondContact O-CE1 3.13Å; F993-F1013 HydrophobicContact CD1-CB 4.46Å; F993-F1013 AromaticContact CD1-CD1 3.64Å; F993-F1013 HydrophobicContact CD1-CD1 3.64Å; F993-F1013 HydrophobicContact CD1-CD2 4.16Å; F993-F1013 AromaticContact CD1-CE1 3.77Å; F993-F1013 HydrophobicContact CD1-CE1 3.77Å; F993-F1013 HydrophobicContact CD1-CE2 4.29Å; F993-F1013 AromaticContact CD1-CG 3.83Å; F993-F1013 HydrophobicContact CD1-CG 3.83Å; F993-F1013 HydrophobicContact CD1-CZ 4.09Å; F993-F1013 HydrophobicContact CE1-CB 4.08Å; F993-F1013 AromaticContact CE1-CD1 3.7Å; F993-F1013 HydrophobicContact CE1-CD1 3.7Å; F993-F1013 HydrophobicContact CE1-CE1 4.26Å; F993-F1013 AromaticContact CE1-CG 3.89Å; F993-F1013 HydrophobicContact CE1-CG 3.89Å; F993-L1034 HydrophobicContact CD2-CD1 3.79Å; F993-L1034 HydrophobicContact CE2-CD1 3.82Å; F993-L1043 HydrophobicContact CB-CD1 4.48Å; F993-L1043 HydrophobicContact CD2-CD1 3.84Å; F993-C1046 HydrophobicContact CB-CB 4.12Å; F993-C1046 HydrophobicContact CD1-CB 3.39Å; F993-C1046 HydrophobicContact CD2-CB 4.1Å; F993-C1046 HydrophobicContact CE1-CB 3.67Å; F993-C1046 HydrophobicContact CE2-CB 4.3Å; F993-C1046 HydrophobicContact CG-CB 3.62Å; F993-C1046 HydrophobicContact CZ-CB 4.1Å; F993-T1047 WeakPolarHBondContact CE2-OG1 3.46Å
994	D	98.4	Very high	96.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-9.5	177.4	31	34.5	0	0	0	114.5	I903 H904 A996 H999 G1036 G1037 Y1038	I903-D994 HydrophobicContact CG2-CB 3.91Å; I903-D994 WeakPolarHBondContact CG2-OD1 3.27Å; I903-D994 PolarHBondContact N-OD1 2.98Å; H904-D994 IonicContact CE1-OD2 3.04Å; H904-D994 IonicContact ND1-OD2 3.19Å; D994-A996 PolarHBondContact O-N 2.98Å; D994-H999 WeakPolarHBondContact O-CB 3.29Å; D994-G1036 WeakPolarHBondContact OD2-CA 3.46Å; D994-G1037 PolarHBondContact OD2-N 3.25Å; D994-Y1038 HydrophobicContact CB-CD2 4.2Å; D994-Y1038 HydrophobicContact CB-CE2 4.18Å; D994-Y1038 WeakPolarHBondContact OD2-CE2 3.32Å
995	A	98.3	Very high	96.8	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.008	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-7.5	162.5	0	0	0	0	0	112.9	I903 Y1006 S1007 V1008 F1013	I903-A995 HydrophobicContact CB-CB 3.96Å; I903-A995 HydrophobicContact CD1-CB 4.43Å; I903-A995 HydrophobicContact CG1-CB 3.95Å; A995-Y1006 HydrophobicContact CB-CD2 4.5Å; A995-Y1006 CarbonylContact O-C 3.57Å; A995-Y1006 VanDerWaalsContact O-CB 3.27Å; A995-Y1006 WeakPolarHBondContact O-CB 3.3Å; A995-S1007 PolarHBondContact O-N 3.29Å; A995-V1008 HydrophobicContact CB-CB 4.41Å; A995-V1008 HydrophobicContact CB-CG2 4.08Å; A995-V1008 WeakPolarHBondContact O-CB 3.42Å; A995-V1008 PolarHBondContact O-N 3.2Å; A995-F1013 HydrophobicContact CB-CZ 4.25Å
996	A	98.3	Very high	96.8	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	-80.8	163	177.8	0	0	0	0	0	112.9	F993 D994 H999 V1008 F1013	F993-A996 WeakPolarHBondContact O-CB 3.48Å; F993-A996 PolarHBondContact O-N 3.44Å; D994-A996 PolarHBondContact O-N 2.98Å; A996-H999 PolarHBondContact O-ND1 3.47Å; A996-V1008 VanDerWaalsContact CA-O 3.23Å; A996-V1008 WeakPolarHBondContact CA-O 3.48Å; A996-V1008 WeakPolarHBondContact CB-O 3.45Å; A996-F1013 HydrophobicContact CB-CE2 4.02Å
997	P	97.2	Very high	96.8	Very high	50 Å²	50	24.1 Å²	24.1	33%	0.325	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	165.3	172.5	-27.2	35.9	0	0	0	114.3	H999 V1008 S1042	P997-H999 PolarHBondContact O-N 3.37Å; P997-H999 PolarHBondContact O-ND1 3.02Å; P997-V1008 WeakPolarHBondContact CD-O 3.34Å; P997-S1042 PolarHBondContact O-OG 3.15Å
998	G	95.6	Very high	96.8	Very high	67 Å²	67	24.1 Å²	24.1	69%	0.691	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.7	-21.7	-180	0	0	0	0	0	114.9
999	H	96.8	Very high	96.8	Very high	15 Å²	15	24.6 Å²	24.6	7%	0.069	17%	0.174	C	C	.	.			trans	-76.8	126.3	176	-59.1	88.8	0	0	0	111.6	F993 D994 A996 P997 G1005 Y1038 D1039	F993-H999 PolarHBondContact O-CE1 3.13Å; D994-H999 WeakPolarHBondContact O-CB 3.29Å; A996-H999 PolarHBondContact O-ND1 3.47Å; P997-H999 PolarHBondContact O-N 3.37Å; P997-H999 PolarHBondContact O-ND1 3.02Å; H999-G1005 PolarHBondContact O-N 3Å; H999-Y1038 PolarHBondContact NE2-N 2.93Å; H999-D1039 PolarHBondContact NE2-N 3.14Å
1000	S	93.8	Very high	96.8	Very high	61 Å²	61	25.8 Å²	25.8	43%	0.427	18%	0.181	S	C	.	.			trans	-65.7	154.4	179.9	54.7	0	0	0	0	112.2	N1002 L1003 G1004 G1005	S1000-N1002 VanDerWaalsContact CB-OD1 3.27Å; S1000-N1002 WeakPolarHBondContact CB-OD1 3.47Å; S1000-N1002 PolarHBondContact O-N 2.84Å; S1000-N1002 PolarHBondContact OG-OD1 3.46Å; S1000-L1003 PolarHBondContact O-N 3.22Å; S1000-G1004 PolarHBondContact O-N 2.93Å; S1000-G1005 PolarHBondContact O-N 3.06Å
1001	A	93.5	Very high	96.7	Very high	72 Å²	72	26 Å²	26	60%	0.595	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-7	-172.2	0	0	0	0	0	116	R926	R926-A1001 PolarHBondContact NH1-O 3.43Å
1002	N	91.5	Very high	96.7	Very high	131 Å²	131	26 Å²	26	70%	0.701	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100	-9.3	173.1	68.6	-51.4	0	0	0	114.2	S1000	S1000-N1002 VanDerWaalsContact CB-OD1 3.27Å; S1000-N1002 WeakPolarHBondContact CB-OD1 3.47Å; S1000-N1002 PolarHBondContact O-N 2.84Å; S1000-N1002 PolarHBondContact OG-OD1 3.46Å
1003	L	92.4	Very high	96.7	Very high	32 Å²	32	26 Å²	26	17%	0.168	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123	-14.9	-177.8	-173.6	60.6	0	0	0	112.3	P707 H904 S1000 Y1038	P707-L1003 HydrophobicContact CB-CD2 4.19Å; P707-L1003 HydrophobicContact CG-CD2 4.37Å; H904-L1003 PolarHBondContact CE1-O 3.14Å; H904-L1003 VanDerWaalsContact CE1-O 3.29Å; H904-L1003 PolarHBondContact NE2-O 3Å; S1000-L1003 PolarHBondContact O-N 3.22Å; L1003-Y1038 HydrophobicContact CD1-CD2 3.81Å; L1003-Y1038 HydrophobicContact CD1-CE2 3.7Å; L1003-Y1038 HydrophobicContact CD2-CD2 3.61Å; L1003-Y1038 HydrophobicContact CD2-CE2 4.36Å; L1003-Y1038 HydrophobicContact CD2-CG 3.99Å; L1003-Y1038 HydrophobicContact CG-CD2 3.68Å; L1003-Y1038 HydrophobicContact CG-CE2 4.05Å
1004	G	94.9	Very high	96.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	18%	0.184	C	C	.	.			trans	-170.4	-86.1	170.2	0	0	0	0	0	110.2	I903 R926 S1000	I903-G1004 VanDerWaalsContact CD1-C 3.47Å; I903-G1004 VanDerWaalsContact CD1-CA 3.45Å; I903-G1004 WeakPolarHBondContact CD1-O 3.41Å; R926-G1004 PolarHBondContact NH1-O 2.69Å; S1000-G1004 PolarHBondContact O-N 2.93Å
1005	G	95.2	Very high	96.6	Very high	19 Å²	19	26.6 Å²	26.6	20%	0.196	19%	0.186	C	C	.	.			trans	86	13.5	175.6	0	0	0	0	0	115.2	H999 S1000	H999-G1005 PolarHBondContact O-N 3Å; S1000-G1005 PolarHBondContact O-N 3.06Å
1006	Y	97.9	Very high	96.6	Very high	5 Å²	5	26.5 Å²	26.5	2%	0.02	19%	0.185	C	C	.	.			trans	-96.3	177.7	169.6	-73.4	-1.5	0	0	0	111.1	I903 R926 W956 I960 M962 Y967 A995	I903-Y1006 HydrophobicContact CD1-CD1 4.2Å; I903-Y1006 HydrophobicContact CD1-CD2 3.57Å; I903-Y1006 HydrophobicContact CD1-CE2 4.06Å; I903-Y1006 HydrophobicContact CD1-CG 3.67Å; I903-Y1006 HydrophobicContact CG1-CD2 3.78Å; I903-Y1006 HydrophobicContact CG1-CE2 4.1Å; I903-Y1006 HydrophobicContact CG1-CG 4.37Å; R926-Y1006 HydrophobicContact CB-CE1 4.46Å; R926-Y1006 HydrophobicContact CB-CE2 3.93Å; R926-Y1006 HydrophobicContact CG-CE1 4.22Å; R926-Y1006 WeakPolarHBondContact CG-OH 3.38Å; W956-Y1006 HydrophobicContact CB-CE2 4.35Å; W956-Y1006 WeakPolarHBondContact CB-OH 3.06Å; W956-Y1006 AromaticContact CD1-CE2 3.74Å; W956-Y1006 HydrophobicContact CG-CE2 4.26Å; I960-Y1006 WeakPolarHBondContact O-CE1 3.26Å; M962-Y1006 HydrophobicContact CB-CD1 4.33Å; M962-Y1006 HydrophobicContact CB-CD2 3.69Å; M962-Y1006 HydrophobicContact CB-CE1 4.35Å; M962-Y1006 HydrophobicContact CB-CE2 3.72Å; M962-Y1006 HydrophobicContact CB-CG 4.01Å; M962-Y1006 HydrophobicContact CG-CD2 4.08Å; M962-Y1006 HydrophobicContact CG-CE1 4.05Å; M962-Y1006 HydrophobicContact CG-CE2 3.55Å; M962-Y1006 WeakPolarHBondContact O-CB 3.47Å; Y967-Y1006 HydrophobicContact CE2-CD2 4.2Å; A995-Y1006 HydrophobicContact CB-CD2 4.5Å; A995-Y1006 CarbonylContact O-C 3.57Å; A995-Y1006 VanDerWaalsContact O-CB 3.27Å; A995-Y1006 WeakPolarHBondContact O-CB 3.3Å
1007	S	97.7	Very high	96.6	Very high	51 Å²	51	26.5 Å²	26.5	36%	0.357	19%	0.185	S	C	.	.			trans	-131.2	22.3	-171.9	-63.9	0	0	0	0	114.3	M962 A995 S1009	M962-S1007 PolarHBondContact O-N 3.01Å; A995-S1007 PolarHBondContact O-N 3.29Å; S1007-S1009 PolarHBondContact O-N 3.03Å
1008	V	98.5	Very high	96.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	17%	0.17	C	C	.	.			trans	-61.2	117.6	-178.4	-175.4	0	0	0	0	110.4	Y967 A995 A996 P997 A1012 F1013 M1016	Y967-V1008 HydrophobicContact CD1-CG1 4.47Å; Y967-V1008 HydrophobicContact CD1-CG2 4.26Å; Y967-V1008 HydrophobicContact CD2-CG2 3.49Å; Y967-V1008 VanDerWaalsContact CD2-CG2 3.49Å; Y967-V1008 HydrophobicContact CE1-CG2 4.33Å; Y967-V1008 HydrophobicContact CE2-CG2 3.58Å; Y967-V1008 HydrophobicContact CG-CG1 4.35Å; Y967-V1008 HydrophobicContact CG-CG2 3.87Å; A995-V1008 HydrophobicContact CB-CB 4.41Å; A995-V1008 HydrophobicContact CB-CG2 4.08Å; A995-V1008 WeakPolarHBondContact O-CB 3.42Å; A995-V1008 PolarHBondContact O-N 3.2Å; A996-V1008 VanDerWaalsContact CA-O 3.23Å; A996-V1008 WeakPolarHBondContact CA-O 3.48Å; A996-V1008 WeakPolarHBondContact CB-O 3.45Å; P997-V1008 WeakPolarHBondContact CD-O 3.34Å; V1008-A1012 HydrophobicContact CG1-CB 3.81Å; V1008-F1013 HydrophobicContact CB-CE2 3.9Å; V1008-F1013 HydrophobicContact CB-CZ 4.2Å; V1008-F1013 HydrophobicContact CG1-CD2 4.09Å; V1008-F1013 HydrophobicContact CG1-CE2 3.64Å; V1008-F1013 HydrophobicContact CG1-CZ 3.96Å; V1008-M1016 HydrophobicContact CG1-CE 4.23Å
1009	S	98.5	Very high	96.6	Very high	12 Å²	12	21.1 Å²	21.1	8%	0.084	14%	0.138	C	C	.	.			trans	-71.6	152	-170.9	78.9	0	0	0	0	112.3	D964 S1007 A1011 A1012 F1013	D964-S1009 VanDerWaalsContact CG-OG 3.26Å; D964-S1009 WeakPolarHBondContact OD1-CB 3.35Å; D964-S1009 PolarHBondContact OD1-N 3.17Å; D964-S1009 PolarHBondContact OD1-OG 2.87Å; D964-S1009 VanDerWaalsContact OD1-OG 3.13Å; D964-S1009 WeakPolarHBondContact OD2-CB 3.49Å; D964-S1009 PolarHBondContact OD2-OG 3.08Å; S1007-S1009 PolarHBondContact O-N 3.03Å; S1009-A1011 PolarHBondContact O-N 2.94Å; S1009-A1011 VanDerWaalsContact O-N 3.14Å; S1009-A1011 PolarHBondContact OG-N 3.38Å; S1009-A1012 WeakPolarHBondContact O-CB 3.41Å; S1009-A1012 PolarHBondContact O-N 3.14Å; S1009-A1012 PolarHBondContact OG-N 3.22Å; S1009-F1013 WeakPolarHBondContact O-CD2 3.47Å; S1009-F1013 PolarHBondContact O-N 3.3Å
1010	P	98.5	Very high	96.6	Very high	25 Å²	25	20.4 Å²	20.4	16%	0.162	13%	0.134	C	C	.	.	H	α-helix	trans	-48.9	-37.3	168.5	-31.8	37.2	0	0	0	113.9	F1013 G1014 D1045 A1049	P1010-F1013 PolarHBondContact O-N 2.82Å; P1010-G1014 PolarHBondContact O-N 3.3Å; P1010-G1014 VanDerWaalsContact O-N 3.15Å; P1010-D1045 HydrophobicContact CB-CB 3.68Å; P1010-D1045 HydrophobicContact CG-CB 3.46Å; P1010-D1045 VanDerWaalsContact CG-CB 3.46Å; P1010-A1049 WeakPolarHBondContact O-CB 3.22Å
1011	A	97.9	Very high	96.7	Very high	5 Å²	5	17.5 Å²	17.5	4%	0.041	11%	0.114	C	C	.	.	H	α-helix	trans	-61.5	-45.3	175.6	0	0	0	0	0	111.4	S1009 F1013 G1014 W1015 I1075 P1076 L1077	S1009-A1011 PolarHBondContact O-N 2.94Å; S1009-A1011 VanDerWaalsContact O-N 3.14Å; S1009-A1011 PolarHBondContact OG-N 3.38Å; A1011-F1013 VanDerWaalsContact C-N 3.34Å; A1011-F1013 PolarHBondContact O-N 2.63Å; A1011-G1014 WeakPolarHBondContact O-CA 3.5Å; A1011-G1014 PolarHBondContact O-N 2.94Å; A1011-G1014 VanDerWaalsContact O-N 3.08Å; A1011-W1015 VanDerWaalsContact O-CD1 3.24Å; A1011-W1015 PolarHBondContact O-N 2.78Å; A1011-I1075 HydrophobicContact CB-CB 4.17Å; A1011-I1075 HydrophobicContact CB-CG2 3.96Å; A1011-P1076 WeakPolarHBondContact CB-O 3.35Å; A1011-L1077 HydrophobicContact CB-CD2 3.96Å; A1011-L1077 HydrophobicContact CB-CG 4.13Å
1012	A	98.2	Very high	96.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59.1	-40.9	177.2	0	0	0	0	0	112.7	D964 V1008 S1009 G1014 W1015 M1016 L1077	D964-A1012 HydrophobicContact CB-CB 4.18Å; D964-A1012 WeakPolarHBondContact OD1-CB 3.4Å; V1008-A1012 HydrophobicContact CG1-CB 3.81Å; S1009-A1012 WeakPolarHBondContact O-CB 3.41Å; S1009-A1012 PolarHBondContact O-N 3.14Å; S1009-A1012 PolarHBondContact OG-N 3.22Å; A1012-G1014 PolarHBondContact O-N 3.3Å; A1012-W1015 PolarHBondContact O-N 2.83Å; A1012-M1016 WeakPolarHBondContact O-CB 3.36Å; A1012-M1016 VanDerWaalsContact O-CG 3.28Å; A1012-M1016 WeakPolarHBondContact O-CG 3.18Å; A1012-M1016 PolarHBondContact O-N 3.25Å; A1012-L1077 HydrophobicContact CB-CD2 3.98Å
1013	F	98.7	Very high	96.4	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62.1	-39.7	173.3	-71.5	-77.7	0	0	0	112.9	W901 F993 A995 A996 V1008 S1009 P1010 A1011 M1016 T1017 C1046	W901-F1013 AromaticContact CD1-CD1 3.96Å; W901-F1013 AromaticContact CD1-CE1 3.6Å; W901-F1013 HydrophobicContact CD2-CD1 4.27Å; W901-F1013 HydrophobicContact CD2-CE1 4.48Å; W901-F1013 AromaticContact CE2-CD1 3.78Å; W901-F1013 HydrophobicContact CG-CD1 4.39Å; W901-F1013 HydrophobicContact CG-CE1 4.12Å; W901-F1013 HydrophobicContact CZ2-CD1 4.23Å; W901-F1013 AromaticContact NE1-CD1 3.55Å; W901-F1013 AromaticContact NE1-CE1 3.65Å; F993-F1013 HydrophobicContact CD1-CB 4.46Å; F993-F1013 AromaticContact CD1-CD1 3.64Å; F993-F1013 HydrophobicContact CD1-CD1 3.64Å; F993-F1013 HydrophobicContact CD1-CD2 4.16Å; F993-F1013 AromaticContact CD1-CE1 3.77Å; F993-F1013 HydrophobicContact CD1-CE1 3.77Å; F993-F1013 HydrophobicContact CD1-CE2 4.29Å; F993-F1013 AromaticContact CD1-CG 3.83Å; F993-F1013 HydrophobicContact CD1-CG 3.83Å; F993-F1013 HydrophobicContact CD1-CZ 4.09Å; F993-F1013 HydrophobicContact CE1-CB 4.08Å; F993-F1013 AromaticContact CE1-CD1 3.7Å; F993-F1013 HydrophobicContact CE1-CD1 3.7Å; F993-F1013 HydrophobicContact CE1-CE1 4.26Å; F993-F1013 AromaticContact CE1-CG 3.89Å; F993-F1013 HydrophobicContact CE1-CG 3.89Å; A995-F1013 HydrophobicContact CB-CZ 4.25Å; A996-F1013 HydrophobicContact CB-CE2 4.02Å; V1008-F1013 HydrophobicContact CB-CE2 3.9Å; V1008-F1013 HydrophobicContact CB-CZ 4.2Å; V1008-F1013 HydrophobicContact CG1-CD2 4.09Å; V1008-F1013 HydrophobicContact CG1-CE2 3.64Å; V1008-F1013 HydrophobicContact CG1-CZ 3.96Å; S1009-F1013 WeakPolarHBondContact O-CD2 3.47Å; S1009-F1013 PolarHBondContact O-N 3.3Å; P1010-F1013 PolarHBondContact O-N 2.82Å; A1011-F1013 VanDerWaalsContact C-N 3.34Å; A1011-F1013 PolarHBondContact O-N 2.63Å; F1013-M1016 HydrophobicContact CB-CE 4.46Å; F1013-M1016 HydrophobicContact CD1-CE 3.55Å; F1013-M1016 HydrophobicContact CE1-CE 3.91Å; F1013-M1016 HydrophobicContact CG-CE 4.01Å; F1013-T1017 WeakPolarHBondContact O-CB 3.26Å; F1013-T1017 PolarHBondContact O-N 3.04Å; F1013-T1017 PolarHBondContact O-OG1 2.93Å; F1013-C1046 HydrophobicContact CB-CB 4.43Å; F1013-C1046 HydrophobicContact CD2-CB 4.16Å; F1013-C1046 WeakPolarHBondContact CD2-SG 3.47Å; F1013-C1046 HydrophobicContact CG-CB 4.41Å
1014	G	98.3	Very high	96.3	Very high	2 Å²	2	15.3 Å²	15.3	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-61.9	-43.4	171.7	0	0	0	0	0	113.1	P1010 A1011 A1012 T1017 R1018 A1053	P1010-G1014 PolarHBondContact O-N 3.3Å; P1010-G1014 VanDerWaalsContact O-N 3.15Å; A1011-G1014 WeakPolarHBondContact O-CA 3.5Å; A1011-G1014 PolarHBondContact O-N 2.94Å; A1011-G1014 VanDerWaalsContact O-N 3.08Å; A1012-G1014 PolarHBondContact O-N 3.3Å; G1014-T1017 WeakPolarHBondContact O-CB 3.34Å; G1014-T1017 PolarHBondContact O-N 3.43Å; G1014-R1018 WeakPolarHBondContact O-CB 3.25Å; G1014-R1018 PolarHBondContact O-N 3.13Å; G1014-A1053 WeakPolarHBondContact O-CB 3.34Å
1015	W	97.5	Very high	96.3	Very high	10 Å²	10	15.3 Å²	15.3	4%	0.038	8%	0.084	C	C	.	.	H	α-helix	trans	-71	-39.2	178.1	-80.4	93.8	0	0	0	113.1	A1011 A1012 R1018 L1019 L1074 I1075 L1077 L1125 P1126 I1128	A1011-W1015 VanDerWaalsContact O-CD1 3.24Å; A1011-W1015 PolarHBondContact O-N 2.78Å; A1012-W1015 PolarHBondContact O-N 2.83Å; W1015-R1018 PolarHBondContact O-N 2.73Å; W1015-L1019 WeakPolarHBondContact O-CB 3.47Å; W1015-L1019 VanDerWaalsContact O-CG 3.26Å; W1015-L1019 WeakPolarHBondContact O-CG 3.38Å; W1015-L1019 PolarHBondContact O-N 3.02Å; W1015-L1074 HydrophobicContact CD2-CD1 4.31Å; W1015-L1074 HydrophobicContact CE3-CD1 4.37Å; W1015-L1074 HydrophobicContact CH2-CD1 4.03Å; W1015-L1074 HydrophobicContact CZ2-CD1 3.91Å; W1015-L1074 HydrophobicContact CZ3-CD1 4.25Å; W1015-I1075 PolarHBondContact NE1-O 2.69Å; W1015-I1075 VanDerWaalsContact NE1-O 3.15Å; W1015-L1077 HydrophobicContact CB-CD1 4.19Å; W1015-L1077 HydrophobicContact CD2-CD1 4.23Å; W1015-L1077 HydrophobicContact CG-CD1 3.72Å; W1015-L1077 HydrophobicContact CG-CG 4.27Å; W1015-L1125 HydrophobicContact CD2-CD2 4.06Å; W1015-L1125 HydrophobicContact CE3-CD1 3.88Å; W1015-L1125 HydrophobicContact CE3-CD2 3.89Å; W1015-L1125 HydrophobicContact CE3-CG 3.97Å; W1015-L1125 HydrophobicContact CZ3-CD1 4.18Å; W1015-L1125 HydrophobicContact CZ3-CD2 4.22Å; W1015-L1125 HydrophobicContact CZ3-CG 3.98Å; W1015-P1126 WeakPolarHBondContact CH2-O 3.45Å; W1015-I1128 HydrophobicContact CZ2-CG1 3.85Å
1016	M	98.2	Very high	96.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.4	-43.8	171.7	-73.3	-172.6	-59.9	0	0	111.5	W901 Y967 F971 V1008 A1012 F1013 R1018 L1019 L1020	W901-M1016 HydrophobicContact CE3-CB 4.24Å; W901-M1016 HydrophobicContact CE3-CE 4.48Å; W901-M1016 HydrophobicContact CH2-CB 4.38Å; W901-M1016 HydrophobicContact CZ3-CB 3.77Å; Y967-M1016 HydrophobicContact CD1-CE 4.13Å; Y967-M1016 HydrophobicContact CD1-SD 3.93Å; Y967-M1016 HydrophobicContact CG-SD 4.46Å; F971-M1016 HydrophobicContact CD1-CB 4.33Å; F971-M1016 HydrophobicContact CD1-CG 4.13Å; F971-M1016 HydrophobicContact CD2-CG 3.93Å; F971-M1016 HydrophobicContact CD2-SD 3.8Å; F971-M1016 HydrophobicContact CE1-CB 3.65Å; F971-M1016 HydrophobicContact CE1-CG 3.85Å; F971-M1016 HydrophobicContact CE2-CB 4.11Å; F971-M1016 HydrophobicContact CE2-CG 3.68Å; F971-M1016 HydrophobicContact CE2-SD 3.36Å; F971-M1016 WeakPolarHBondContact CE2-SD 3.16Å; F971-M1016 HydrophobicContact CG-CG 4.17Å; F971-M1016 HydrophobicContact CZ-CB 3.55Å; F971-M1016 HydrophobicContact CZ-CG 3.64Å; F971-M1016 HydrophobicContact CZ-SD 3.83Å; V1008-M1016 HydrophobicContact CG1-CE 4.23Å; A1012-M1016 WeakPolarHBondContact O-CB 3.36Å; A1012-M1016 VanDerWaalsContact O-CG 3.28Å; A1012-M1016 WeakPolarHBondContact O-CG 3.18Å; A1012-M1016 PolarHBondContact O-N 3.25Å; F1013-M1016 HydrophobicContact CB-CE 4.46Å; F1013-M1016 HydrophobicContact CD1-CE 3.55Å; F1013-M1016 HydrophobicContact CE1-CE 3.91Å; F1013-M1016 HydrophobicContact CG-CE 4.01Å; M1016-R1018 VanDerWaalsContact C-N 3.33Å; M1016-R1018 PolarHBondContact O-N 3.29Å; M1016-L1019 PolarHBondContact O-N 2.96Å; M1016-L1020 PolarHBondContact O-N 3.26Å
1017	T	98.4	Very high	96	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-56.3	-48	171.1	-58.3	0	0	0	0	111.1	W901 F1013 G1014 L1020 S1021 L1032 C1050 A1053 L1054	W901-T1017 WeakPolarHBondContact CH2-OG1 3.44Å; F1013-T1017 WeakPolarHBondContact O-CB 3.26Å; F1013-T1017 PolarHBondContact O-N 3.04Å; F1013-T1017 PolarHBondContact O-OG1 2.93Å; G1014-T1017 WeakPolarHBondContact O-CB 3.34Å; G1014-T1017 PolarHBondContact O-N 3.43Å; T1017-L1020 PolarHBondContact O-N 2.81Å; T1017-S1021 VanDerWaalsContact O-CB 3.32Å; T1017-S1021 WeakPolarHBondContact O-CB 3.17Å; T1017-S1021 PolarHBondContact O-N 2.71Å; T1017-S1021 VanDerWaalsContact O-N 3.11Å; T1017-S1021 PolarHBondContact O-OG 3.34Å; T1017-L1032 HydrophobicContact CG2-CD1 4.23Å; T1017-L1032 HydrophobicContact CG2-CD2 4.33Å; T1017-C1050 HydrophobicContact CG2-CB 4.49Å; T1017-C1050 PolarHBondContact OG1-SG 3.03Å; T1017-A1053 HydrophobicContact CG2-CB 3.81Å; T1017-L1054 HydrophobicContact CG2-CD2 3.85Å; T1017-L1054 HydrophobicContact CG2-CG 3.88Å
1018	R	96.4	Very high	95.9	Very high	3 Å²	3	17.2 Å²	17.2	1%	0.011	9%	0.087	C	C	.	.	H	α-helix	trans	-64.1	-42.7	-178.8	176.6	56.8	-174.8	148.7	6.2	112.5	G1014 W1015 M1016 L1020 S1021 A1053 S1057 E1060 L1074 I1134	G1014-R1018 WeakPolarHBondContact O-CB 3.25Å; G1014-R1018 PolarHBondContact O-N 3.13Å; W1015-R1018 PolarHBondContact O-N 2.73Å; M1016-R1018 VanDerWaalsContact C-N 3.33Å; M1016-R1018 PolarHBondContact O-N 3.29Å; R1018-L1020 VanDerWaalsContact C-N 3.33Å; R1018-L1020 PolarHBondContact O-N 3.44Å; R1018-S1021 PolarHBondContact O-N 3.32Å; R1018-A1053 HydrophobicContact CB-CB 4Å; R1018-S1057 PolarHBondContact NH1-OG 3.12Å; R1018-E1060 IonicContact CZ-OE1 2.68Å; R1018-E1060 IonicContact CZ-OE2 3.74Å; R1018-E1060 IonicContact NE-OE1 3.05Å; R1018-E1060 IonicContact NH1-OE1 2.85Å; R1018-E1060 PolarHBondContact NH1-OE1 2.89Å; R1018-E1060 IonicContact NH1-OE2 3.74Å; R1018-E1060 PolarHBondContact NH1-OE2 2.97Å; R1018-E1060 IonicContact NH2-OE1 3.77Å; R1018-E1060 PolarHBondContact NH2-OE1 3.38Å; R1018-E1060 IonicContact NH2-OE2 3.21Å; R1018-E1060 PolarHBondContact NH2-OE2 3.23Å; R1018-L1074 HydrophobicContact CB-CD2 4.5Å; R1018-L1074 HydrophobicContact CG-CD1 4.14Å; R1018-I1134 HydrophobicContact CG-CD1 3.74Å; R1018-I1134 VanDerWaalsContact NE-CD1 3.28Å
1019	L	96.1	Very high	95.8	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-63.8	-35.1	-179.8	-74.7	166.7	0	0	0	112.6	L968 F971 L976 W1015 M1016 W1124 L1125 I1136	L968-L1019 HydrophobicContact CD2-CD1 4.36Å; F971-L1019 HydrophobicContact CD1-CB 4.26Å; F971-L1019 HydrophobicContact CD1-CD1 4.23Å; L976-L1019 HydrophobicContact CD1-CB 4.31Å; L976-L1019 HydrophobicContact CD1-CD1 4.35Å; L976-L1019 HydrophobicContact CD1-CD2 4.17Å; L976-L1019 HydrophobicContact CD2-CB 4.16Å; W1015-L1019 WeakPolarHBondContact O-CB 3.47Å; W1015-L1019 VanDerWaalsContact O-CG 3.26Å; W1015-L1019 WeakPolarHBondContact O-CG 3.38Å; W1015-L1019 PolarHBondContact O-N 3.02Å; M1016-L1019 PolarHBondContact O-N 2.96Å; L1019-W1124 HydrophobicContact CD1-CH2 4.05Å; L1019-W1124 HydrophobicContact CD1-CZ3 4.39Å; L1019-W1124 HydrophobicContact CD2-CZ3 4.24Å; L1019-L1125 HydrophobicContact CD1-CD1 4.01Å; L1019-L1125 HydrophobicContact CD2-CD1 4.09Å; L1019-L1125 HydrophobicContact CG-CD1 4.39Å; L1019-I1136 HydrophobicContact CD2-CD1 4.47Å
1020	L	97.2	Very high	95.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-79.4	-17.6	172.3	-72.5	165.6	0	0	0	113.5	L897 V899 W901 F971 I975 V987 I989 M1016 T1017 R1018 I1025 V1030	L897-L1020 HydrophobicContact CD2-CD2 4.24Å; V899-L1020 HydrophobicContact CB-CD1 4.36Å; V899-L1020 HydrophobicContact CG1-CD1 4.49Å; V899-L1020 HydrophobicContact CG2-CD1 3.98Å; V899-L1020 HydrophobicContact CG2-CD2 4.39Å; W901-L1020 HydrophobicContact CZ3-CD1 4.31Å; F971-L1020 HydrophobicContact CE1-CD1 3.75Å; F971-L1020 HydrophobicContact CE1-CG 3.88Å; F971-L1020 HydrophobicContact CZ-CD1 3.95Å; I975-L1020 HydrophobicContact CG2-CD2 4.15Å; V987-L1020 HydrophobicContact CG1-CD2 4.49Å; I989-L1020 HydrophobicContact CD1-CD1 3.63Å; I989-L1020 HydrophobicContact CG1-CD1 4.42Å; M1016-L1020 PolarHBondContact O-N 3.26Å; T1017-L1020 PolarHBondContact O-N 2.81Å; R1018-L1020 VanDerWaalsContact C-N 3.33Å; R1018-L1020 PolarHBondContact O-N 3.44Å; L1020-I1025 HydrophobicContact CD2-CD1 4.44Å; L1020-V1030 WeakPolarHBondContact O-CG2 3.35Å
1021	S	95.6	Very high	95.8	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	18.7	-177.5	-55.7	0	0	0	0	114.1	T1017 R1018 S1028 V1030 S1057	T1017-S1021 VanDerWaalsContact O-CB 3.32Å; T1017-S1021 WeakPolarHBondContact O-CB 3.17Å; T1017-S1021 PolarHBondContact O-N 2.71Å; T1017-S1021 VanDerWaalsContact O-N 3.11Å; T1017-S1021 PolarHBondContact O-OG 3.34Å; R1018-S1021 PolarHBondContact O-N 3.32Å; S1021-S1028 VanDerWaalsContact O-CB 3.26Å; S1021-S1028 WeakPolarHBondContact O-CB 3.14Å; S1021-S1028 PolarHBondContact O-OG 3.43Å; S1021-V1030 WeakPolarHBondContact OG-CG2 3.44Å; S1021-S1057 VanDerWaalsContact CB-OG 3.23Å; S1021-S1057 WeakPolarHBondContact CB-OG 3.36Å
1022	I	90.7	Very high	95.9	Very high	7 Å²	7	18 Å²	18	4%	0.036	9%	0.086	C	C	.	.	S	Bend	trans	-82.4	156.2	175.2	67.8	177.1	0	0	0	111.9	R1024 I1025 S1028 I1134 I1136	I1022-R1024 VanDerWaalsContact C-N 3.28Å; I1022-R1024 HydrophobicContact CD1-CB 4.43Å; I1022-R1024 PolarHBondContact O-N 3.23Å; I1022-I1025 HydrophobicContact CD1-CD1 4.13Å; I1022-I1025 HydrophobicContact CD1-CG1 4.21Å; I1022-I1025 HydrophobicContact CG1-CB 4.22Å; I1022-I1025 HydrophobicContact CG1-CD1 4.1Å; I1022-I1025 HydrophobicContact CG1-CG1 3.95Å; I1022-I1025 PolarHBondContact O-N 3.08Å; I1022-S1028 VanDerWaalsContact C-OG 3.32Å; I1022-S1028 PolarHBondContact O-N 3.34Å; I1022-I1134 HydrophobicContact CG2-CB 4Å; I1022-I1134 HydrophobicContact CG2-CG2 4.2Å; I1022-I1136 HydrophobicContact CD1-CD1 3.58Å; I1022-I1136 HydrophobicContact CD1-CG1 4.13Å
1023	D	88.3	Confident	95.9	Very high	70 Å²	70	18 Å²	18	37%	0.374	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-32.6	-174.8	-165.4	68.2	0	0	0	114.1	I1025 N1027 S1028 R1064	D1023-I1025 PolarHBondContact O-N 3.19Å; D1023-N1027 WeakPolarHBondContact O-CA 3.47Å; D1023-N1027 PolarHBondContact O-N 2.77Å; D1023-N1027 VanDerWaalsContact O-N 3.16Å; D1023-S1028 PolarHBondContact N-OG 2.91Å; D1023-R1064 IonicContact OD1-CZ 2.91Å; D1023-R1064 IonicContact OD1-NH1 3.91Å; D1023-R1064 PolarHBondContact OD1-NH1 3.37Å; D1023-R1064 IonicContact OD1-NH2 3.58Å; D1023-R1064 IonicContact OD2-NH1 2.93Å
1024	R	90.3	Very high	95.9	Very high	111 Å²	111	18 Å²	18	42%	0.419	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-13.5	177	-78.2	-179.5	-72.6	176.9	1.5	114.1	I1022 I1134 I1136 D1138	I1022-R1024 VanDerWaalsContact C-N 3.28Å; I1022-R1024 HydrophobicContact CD1-CB 4.43Å; I1022-R1024 PolarHBondContact O-N 3.23Å; R1024-I1134 PolarHBondContact NH2-O 3.4Å; R1024-I1136 VanDerWaalsContact CZ-O 3.31Å; R1024-I1136 PolarHBondContact NH1-O 3.42Å; R1024-I1136 PolarHBondContact NH2-O 2.91Å; R1024-D1138 IonicContact NH1-OD1 3.77Å
1025	I	94.2	Very high	95.9	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	108	176.4	-59.3	178.3	0	0	0	107.8	L976 A979 P984 V987 L1020 I1022 D1023 N1027 S1028	L976-I1025 HydrophobicContact CD2-CD1 3.71Å; A979-I1025 HydrophobicContact CB-CD1 4.07Å; A979-I1025 HydrophobicContact CB-CG1 4.47Å; A979-I1025 HydrophobicContact CB-CG2 4.38Å; P984-I1025 HydrophobicContact CG-CG2 4.14Å; V987-I1025 HydrophobicContact CG2-CG2 3.59Å; L1020-I1025 HydrophobicContact CD2-CD1 4.44Å; I1022-I1025 HydrophobicContact CD1-CD1 4.13Å; I1022-I1025 HydrophobicContact CD1-CG1 4.21Å; I1022-I1025 HydrophobicContact CG1-CB 4.22Å; I1022-I1025 HydrophobicContact CG1-CD1 4.1Å; I1022-I1025 HydrophobicContact CG1-CG1 3.95Å; I1022-I1025 PolarHBondContact O-N 3.08Å; D1023-I1025 PolarHBondContact O-N 3.19Å; I1025-N1027 PolarHBondContact O-N 2.8Å; I1025-S1028 PolarHBondContact O-N 3.47Å
1026	A	94.8	Very high	95.9	Very high	8 Å²	8	17.6 Å²	17.6	7%	0.066	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	52	23.9	-179.7	0	0	0	0	0	116.3	P984 V987 S1028 K1029	P984-A1026 HydrophobicContact CG-CB 4.35Å; P984-A1026 WeakPolarHBondContact O-CA 3.47Å; P984-A1026 VanDerWaalsContact O-CB 3.3Å; P984-A1026 WeakPolarHBondContact O-CB 3.42Å; V987-A1026 HydrophobicContact CG2-CB 4.09Å; A1026-S1028 VanDerWaalsContact C-N 3.27Å; A1026-S1028 PolarHBondContact O-N 3.3Å; A1026-K1029 HydrophobicContact CB-CB 4.21Å; A1026-K1029 WeakPolarHBondContact O-CB 3.47Å; A1026-K1029 VanDerWaalsContact O-CG 3.31Å; A1026-K1029 WeakPolarHBondContact O-CG 3.3Å; A1026-K1029 PolarHBondContact O-N 3.1Å; A1026-K1029 VanDerWaalsContact O-N 3.1Å
1027	N	93	Very high	95.9	Very high	107 Å²	107	17.6 Å²	17.6	57%	0.572	8%	0.084	S	C	*	.	G	3₁₀ helix	trans	52	46.1	-171.7	-59.8	110.5	0	0	0	112.2	D1023 I1025 K1029	D1023-N1027 WeakPolarHBondContact O-CA 3.47Å; D1023-N1027 PolarHBondContact O-N 2.77Å; D1023-N1027 VanDerWaalsContact O-N 3.16Å; I1025-N1027 PolarHBondContact O-N 2.8Å; N1027-K1029 PolarHBondContact O-N 3.4Å; N1027-K1029 VanDerWaalsContact O-N 3.1Å
1028	S	93.8	Very high	95.8	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.007	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	61.7	10.5	-177.5	-59.6	0	0	0	0	115.7	S1021 I1022 D1023 I1025 A1026 V1030	S1021-S1028 VanDerWaalsContact O-CB 3.26Å; S1021-S1028 WeakPolarHBondContact O-CB 3.14Å; S1021-S1028 PolarHBondContact O-OG 3.43Å; I1022-S1028 VanDerWaalsContact C-OG 3.32Å; I1022-S1028 PolarHBondContact O-N 3.34Å; D1023-S1028 PolarHBondContact N-OG 2.91Å; I1025-S1028 PolarHBondContact O-N 3.47Å; A1026-S1028 VanDerWaalsContact C-N 3.27Å; A1026-S1028 PolarHBondContact O-N 3.3Å; S1028-V1030 PolarHBondContact O-N 3.02Å
1029	K	97.5	Very high	95.8	Very high	55 Å²	55	20.7 Å²	20.7	24%	0.239	10%	0.1	C	C	.	.			trans	-72	88.9	175.7	-70.4	-179.5	175.5	-176.6	0	111.5	V814 M815 I986 V987 A1026 N1027	V814-K1029 HydrophobicContact CG1-CB 3.66Å; V814-K1029 HydrophobicContact CG1-CG 3.98Å; V814-K1029 WeakPolarHBondContact O-CD 3.36Å; V814-K1029 WeakPolarHBondContact O-CE 3.47Å; M815-K1029 PolarHBondContact O-NZ 3.03Å; I986-K1029 HydrophobicContact CG1-CB 4.38Å; V987-K1029 PolarHBondContact N-O 3.07Å; A1026-K1029 HydrophobicContact CB-CB 4.21Å; A1026-K1029 WeakPolarHBondContact O-CB 3.47Å; A1026-K1029 VanDerWaalsContact O-CG 3.31Å; A1026-K1029 WeakPolarHBondContact O-CG 3.3Å; A1026-K1029 PolarHBondContact O-N 3.1Å; A1026-K1029 VanDerWaalsContact O-N 3.1Å; N1027-K1029 PolarHBondContact O-N 3.4Å; N1027-K1029 VanDerWaalsContact O-N 3.1Å
1030	V	98.4	Very high	95.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.8	-178.6	-173.5	0	0	0	0	111	N821 G822 V987 I989 L1020 S1021 S1028 L1032	N821-V1030 VanDerWaalsContact CA-O 3.25Å; N821-V1030 WeakPolarHBondContact CA-O 3.2Å; N821-V1030 VanDerWaalsContact CB-O 3.24Å; N821-V1030 WeakPolarHBondContact CB-O 3.46Å; G822-V1030 PolarHBondContact N-O 3.12Å; G822-V1030 VanDerWaalsContact N-O 3.07Å; V987-V1030 HydrophobicContact CB-CG1 4.44Å; V987-V1030 HydrophobicContact CB-CG2 4.21Å; V987-V1030 WeakPolarHBondContact O-CA 3.34Å; I989-V1030 HydrophobicContact CD1-CG1 3.79Å; I989-V1030 HydrophobicContact CG1-CG1 4.2Å; L1020-V1030 WeakPolarHBondContact O-CG2 3.35Å; S1021-V1030 WeakPolarHBondContact OG-CG2 3.44Å; S1028-V1030 PolarHBondContact O-N 3.02Å; V1030-L1032 HydrophobicContact CG1-CD1 3.74Å
1031	V	98.8	Very high	95.9	Very high	2 Å²	2	28 Å²	28	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	120.8	172	172.4	0	0	0	0	110.2	L810 V814 G822 I986 V987 L988 I989	L810-V1031 HydrophobicContact CB-CG1 4.41Å; L810-V1031 HydrophobicContact CD2-CG1 3.77Å; L810-V1031 HydrophobicContact CG-CG1 3.81Å; L810-V1031 HydrophobicContact CG-CG2 4.03Å; V814-V1031 HydrophobicContact CB-CG2 3.76Å; V814-V1031 HydrophobicContact CG1-CG2 4.06Å; V814-V1031 HydrophobicContact CG2-CG2 3.57Å; G822-V1031 WeakPolarHBondContact O-CA 3.29Å; I986-V1031 HydrophobicContact CD1-CG2 4.46Å; V987-V1031 PolarHBondContact O-N 2.8Å; L988-V1031 CarbonylContact C-O 3.46Å; L988-V1031 WeakPolarHBondContact CA-O 3.34Å; L988-V1031 HydrophobicContact CD2-CB 3.93Å; L988-V1031 HydrophobicContact CD2-CG1 4.48Å; I989-V1031 PolarHBondContact N-O 3.3Å
1032	L	98.9	Very high	96	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	144.6	170.3	-77	60.4	0	0	0	109.7	G822 F823 A824 W901 I989 A991 T1017 V1030 C1050 L1054	G822-L1032 PolarHBondContact O-N 2.88Å; F823-L1032 CarbonylContact C-O 3.57Å; F823-L1032 WeakPolarHBondContact CA-O 3.28Å; F823-L1032 HydrophobicContact CB-CB 4.31Å; F823-L1032 HydrophobicContact CD1-CB 3.44Å; F823-L1032 VanDerWaalsContact CD1-CB 3.44Å; F823-L1032 HydrophobicContact CD2-CB 4.11Å; F823-L1032 HydrophobicContact CD2-CD2 3.77Å; F823-L1032 HydrophobicContact CE1-CB 3.65Å; F823-L1032 HydrophobicContact CE1-CD2 4.39Å; F823-L1032 HydrophobicContact CE2-CB 4.28Å; F823-L1032 HydrophobicContact CE2-CD2 3.61Å; F823-L1032 HydrophobicContact CG-CB 3.69Å; F823-L1032 HydrophobicContact CG-CD2 4.24Å; F823-L1032 HydrophobicContact CZ-CB 4.06Å; F823-L1032 HydrophobicContact CZ-CD2 3.94Å; A824-L1032 PolarHBondContact N-O 2.99Å; W901-L1032 HydrophobicContact CZ2-CD2 4.22Å; I989-L1032 HydrophobicContact CB-CD1 4.3Å; I989-L1032 HydrophobicContact CB-CG 4.08Å; I989-L1032 HydrophobicContact CD1-CD1 3.82Å; I989-L1032 HydrophobicContact CD1-CG 4.31Å; I989-L1032 HydrophobicContact CG1-CD1 4.28Å; I989-L1032 HydrophobicContact CG2-CG 4.49Å; A991-L1032 HydrophobicContact CB-CB 4.24Å; A991-L1032 HydrophobicContact CB-CD2 4.49Å; A991-L1032 HydrophobicContact CB-CG 4.31Å; T1017-L1032 HydrophobicContact CG2-CD1 4.23Å; T1017-L1032 HydrophobicContact CG2-CD2 4.33Å; V1030-L1032 HydrophobicContact CG1-CD1 3.74Å; L1032-C1050 HydrophobicContact CD2-CB 3.66Å; L1032-L1054 HydrophobicContact CD1-CD1 4.35Å; L1032-L1054 HydrophobicContact CD1-CD2 4.16Å
1033	S	98.8	Very high	96.3	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.014	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.7	169.9	176	0	0	0	0	108.6	V807 V847 I989 A991 E1035	V807-S1033 VanDerWaalsContact CG2-OG 3.28Å; V807-S1033 WeakPolarHBondContact CG2-OG 3.03Å; V847-S1033 VanDerWaalsContact CG2-CB 3.45Å; I989-S1033 PolarHBondContact O-N 3.11Å; A991-S1033 WeakPolarHBondContact CA-O 3.49Å; A991-S1033 WeakPolarHBondContact CB-O 3.47Å; A991-S1033 PolarHBondContact N-O 3.18Å; S1033-E1035 PolarHBondContact O-N 2.92Å
1034	L	98.8	Very high	96.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	127.6	179	-174.8	69	0	0	0	110.7	L713 I716 F823 A824 F993 L1043	L713-L1034 HydrophobicContact CD2-CD2 3.67Å; I716-L1034 HydrophobicContact CD1-CD2 3.72Å; F823-L1034 HydrophobicContact CE1-CB 4.22Å; A824-L1034 PolarHBondContact O-N 2.92Å; F993-L1034 HydrophobicContact CD2-CD1 3.79Å; F993-L1034 HydrophobicContact CE2-CD1 3.82Å; L1034-L1043 HydrophobicContact CD1-CD1 3.95Å
1035	E	98.8	Very high	97.2	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.119	C	C	.	.			trans	-108.8	-109.6	172.9	-56.9	-73.9	177.7	0	0	109.3	R712 P829 G830 H831 S990 A991 S1033	R712-E1035 PolarHBondContact NH1-O 3.37Å; R712-E1035 PolarHBondContact NH2-O 3.16Å; P829-E1035 HydrophobicContact CB-CB 4.37Å; G830-E1035 PolarHBondContact N-OE2 3.33Å; H831-E1035 HydrophobicContact CB-CG 4.41Å; H831-E1035 IonicContact CD2-OE2 2.77Å; H831-E1035 IonicContact CG-OE2 2.8Å; H831-E1035 PolarHBondContact N-OE2 3.1Å; S990-E1035 WeakPolarHBondContact CB-OE1 3.4Å; S990-E1035 PolarHBondContact OG-OE1 2.91Å; A991-E1035 PolarHBondContact O-N 2.84Å; A991-E1035 VanDerWaalsContact O-N 3.09Å; S1033-E1035 PolarHBondContact O-N 2.92Å
1036	G	96.7	Very high	97.4	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.01	12%	0.119	C	C	.	.			trans	-80.7	-153.9	175.7	0	0	0	0	0	115.3	R712 D902 D994 Y1038	R712-G1036 VanDerWaalsContact NH2-C 3.26Å; R712-G1036 PolarHBondContact NH2-O 3.16Å; D902-G1036 WeakPolarHBondContact OD2-CA 3.42Å; D902-G1036 PolarHBondContact OD2-N 3.07Å; D994-G1036 WeakPolarHBondContact OD2-CA 3.46Å; G1036-Y1038 WeakPolarHBondContact CA-OH 3.42Å
1037	G	97.4	Very high	97.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.			trans	83.3	125.6	-166.8	0	0	0	0	0	113.2	R712 D994	R712-G1037 PolarHBondContact NE-O 3.3Å; R712-G1037 PolarHBondContact NH2-O 2.87Å; D994-G1037 PolarHBondContact OD2-N 3.25Å
1038	Y	97.1	Very high	97.9	Very high	27 Å²	27	18 Å²	18	11%	0.106	9%	0.093	C	C	.	.			trans	-140.8	-20.5	-161.2	-48.3	-77.3	0	0	0	115	P707 E708 F841 D994 H999 L1003 G1036 M1040	P707-Y1038 HydrophobicContact CB-CD1 3.66Å; P707-Y1038 HydrophobicContact CB-CE1 4.24Å; P707-Y1038 HydrophobicContact CB-CG 3.91Å; P707-Y1038 WeakPolarHBondContact O-CD1 3.34Å; E708-Y1038 HydrophobicContact CB-CE1 4.26Å; E708-Y1038 HydrophobicContact CG-CE1 4.44Å; F841-Y1038 HydrophobicContact CD2-CE1 4.35Å; F841-Y1038 WeakPolarHBondContact CD2-OH 3.31Å; F841-Y1038 HydrophobicContact CE2-CE1 4.14Å; F841-Y1038 AromaticContact CE2-CZ 3.91Å; D994-Y1038 HydrophobicContact CB-CD2 4.2Å; D994-Y1038 HydrophobicContact CB-CE2 4.18Å; D994-Y1038 WeakPolarHBondContact OD2-CE2 3.32Å; H999-Y1038 PolarHBondContact NE2-N 2.93Å; L1003-Y1038 HydrophobicContact CD1-CD2 3.81Å; L1003-Y1038 HydrophobicContact CD1-CE2 3.7Å; L1003-Y1038 HydrophobicContact CD2-CD2 3.61Å; L1003-Y1038 HydrophobicContact CD2-CE2 4.36Å; L1003-Y1038 HydrophobicContact CD2-CG 3.99Å; L1003-Y1038 HydrophobicContact CG-CD2 3.68Å; L1003-Y1038 HydrophobicContact CG-CE2 4.05Å; G1036-Y1038 WeakPolarHBondContact CA-OH 3.42Å; Y1038-M1040 WeakPolarHBondContact O-CE 3.38Å; Y1038-M1040 PolarHBondContact O-N 2.78Å
1039	D	97.3	Very high	98.1	Very high	42 Å²	42	18 Å²	18	23%	0.225	9%	0.093	C	C	.	.			trans	-70.7	122.7	163.9	169.7	51.1	0	0	0	109.5	H999 N1041 S1042 L1043	H999-D1039 PolarHBondContact NE2-N 3.14Å; D1039-N1041 VanDerWaalsContact C-N 3.31Å; D1039-N1041 PolarHBondContact O-N 3.07Å; D1039-N1041 PolarHBondContact OD2-N 3.32Å; D1039-S1042 VanDerWaalsContact OD2-CB 3.23Å; D1039-S1042 WeakPolarHBondContact OD2-CB 3.39Å; D1039-S1042 PolarHBondContact OD2-N 3.26Å; D1039-S1042 PolarHBondContact OD2-OG 3.13Å; D1039-L1043 WeakPolarHBondContact O-CB 3.46Å; D1039-L1043 PolarHBondContact O-N 3.02Å
1040	M	96.7	Very high	98.1	Very high	47 Å²	47	15.4 Å²	15.4	23%	0.232	8%	0.081	C	C	.	.	H	α-helix	trans	-62.9	-35.6	-173.1	-66.8	-61.8	101.1	0	0	113.3	Q711 R712 S715 Y1038 L1043 C1044	Q711-M1040 HydrophobicContact CB-SD 4.21Å; Q711-M1040 HydrophobicContact CG-SD 3.82Å; R712-M1040 HydrophobicContact CG-CE 3.8Å; S715-M1040 PolarHBondContact OG-SD 3.45Å; Y1038-M1040 WeakPolarHBondContact O-CE 3.38Å; Y1038-M1040 PolarHBondContact O-N 2.78Å; M1040-L1043 HydrophobicContact CE-CD2 4.04Å; M1040-C1044 WeakPolarHBondContact O-CB 3.42Å; M1040-C1044 PolarHBondContact O-N 3.13Å; M1040-C1044 PolarHBondContact O-SG 3.03Å
1041	N	97.3	Very high	98.1	Very high	107 Å²	107	15.4 Å²	15.4	57%	0.572	8%	0.081	S	C	*	.	H	α-helix	trans	-73.1	-54.6	-176.4	-65.2	-52	0	0	0	110.5	D1039 L1043 C1044 D1045	D1039-N1041 VanDerWaalsContact C-N 3.31Å; D1039-N1041 PolarHBondContact O-N 3.07Å; D1039-N1041 PolarHBondContact OD2-N 3.32Å; N1041-L1043 VanDerWaalsContact C-N 3.32Å; N1041-L1043 PolarHBondContact O-N 3.33Å; N1041-C1044 WeakPolarHBondContact O-CB 3.48Å; N1041-C1044 PolarHBondContact O-N 3.33Å; N1041-C1044 VanDerWaalsContact O-N 3.11Å; N1041-D1045 VanDerWaalsContact O-CG 3.31Å; N1041-D1045 PolarHBondContact O-N 3.4Å
1042	S	97.6	Very high	98.1	Very high	13 Å²	13	17.8 Å²	17.8	9%	0.091	9%	0.09	C	C	.	.	H	α-helix	trans	-62.6	-38.7	179.5	-50.7	0	0	0	0	111.5	P997 D1039 C1044 D1045 C1046	P997-S1042 PolarHBondContact O-OG 3.15Å; D1039-S1042 VanDerWaalsContact OD2-CB 3.23Å; D1039-S1042 WeakPolarHBondContact OD2-CB 3.39Å; D1039-S1042 PolarHBondContact OD2-N 3.26Å; D1039-S1042 PolarHBondContact OD2-OG 3.13Å; S1042-C1044 VanDerWaalsContact C-N 3.34Å; S1042-C1044 PolarHBondContact O-N 3.35Å; S1042-D1045 PolarHBondContact O-N 2.82Å; S1042-C1046 VanDerWaalsContact O-CB 3.29Å; S1042-C1046 WeakPolarHBondContact O-CB 3.28Å; S1042-C1046 PolarHBondContact O-N 3.49Å; S1042-C1046 PolarHBondContact O-SG 3.34Å
1043	L	98.3	Very high	98	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-57.9	-43	172.9	177.5	60.9	0	0	0	112.5	R712 I716 F993 L1034 D1039 M1040 N1041 T1047	R712-L1043 HydrophobicContact CB-CD2 3.78Å; R712-L1043 HydrophobicContact CG-CD2 3.94Å; I716-L1043 HydrophobicContact CD1-CD1 3.88Å; I716-L1043 HydrophobicContact CD1-CD2 4.13Å; I716-L1043 HydrophobicContact CD1-CG 3.81Å; I716-L1043 HydrophobicContact CG1-CD2 4.41Å; I716-L1043 HydrophobicContact CG1-CG 3.97Å; F993-L1043 HydrophobicContact CB-CD1 4.48Å; F993-L1043 HydrophobicContact CD2-CD1 3.84Å; L1034-L1043 HydrophobicContact CD1-CD1 3.95Å; D1039-L1043 WeakPolarHBondContact O-CB 3.46Å; D1039-L1043 PolarHBondContact O-N 3.02Å; M1040-L1043 HydrophobicContact CE-CD2 4.04Å; N1041-L1043 VanDerWaalsContact C-N 3.32Å; N1041-L1043 PolarHBondContact O-N 3.33Å; L1043-T1047 WeakPolarHBondContact O-CB 3.29Å; L1043-T1047 PolarHBondContact O-N 3.41Å; L1043-T1047 PolarHBondContact O-OG1 2.98Å
1044	C	98.6	Very high	97.9	Very high	9 Å²	9	17.7 Å²	17.7	6%	0.061	9%	0.089	C	C	.	.	H	α-helix	trans	-70.1	-45.2	176.5	-69.9	0	0	0	0	112.1	S715 R719 M1040 N1041 S1042 T1047 E1048	S715-C1044 VanDerWaalsContact CB-SG 3.54Å; R719-C1044 HydrophobicContact CB-CB 4.12Å; R719-C1044 HydrophobicContact CG-CB 4.12Å; M1040-C1044 WeakPolarHBondContact O-CB 3.42Å; M1040-C1044 PolarHBondContact O-N 3.13Å; M1040-C1044 PolarHBondContact O-SG 3.03Å; N1041-C1044 WeakPolarHBondContact O-CB 3.48Å; N1041-C1044 PolarHBondContact O-N 3.33Å; N1041-C1044 VanDerWaalsContact O-N 3.11Å; S1042-C1044 VanDerWaalsContact C-N 3.34Å; S1042-C1044 PolarHBondContact O-N 3.35Å; C1044-T1047 PolarHBondContact O-N 2.91Å; C1044-E1048 WeakPolarHBondContact O-CB 3.49Å; C1044-E1048 PolarHBondContact O-N 3.23Å
1045	D	98.5	Very high	97.8	Very high	53 Å²	53	18.1 Å²	18.1	28%	0.283	9%	0.092	S	C	.	.	H	α-helix	trans	-63.9	-45.8	-179.1	-67.6	-12.9	0	0	0	111.6	R719 P1010 N1041 S1042 E1048 A1049	R719-D1045 IonicContact CZ-OD1 2.74Å; R719-D1045 IonicContact NH1-OD1 2.68Å; R719-D1045 PolarHBondContact NH1-OD1 2.68Å; R719-D1045 IonicContact NH2-OD1 3.08Å; R719-D1045 PolarHBondContact NH2-OD1 3.46Å; P1010-D1045 HydrophobicContact CB-CB 3.68Å; P1010-D1045 HydrophobicContact CG-CB 3.46Å; P1010-D1045 VanDerWaalsContact CG-CB 3.46Å; N1041-D1045 VanDerWaalsContact O-CG 3.31Å; N1041-D1045 PolarHBondContact O-N 3.4Å; S1042-D1045 PolarHBondContact O-N 2.82Å; D1045-E1048 PolarHBondContact O-N 3.14Å; D1045-A1049 WeakPolarHBondContact O-CB 3.48Å; D1045-A1049 PolarHBondContact O-N 2.91Å
1046	C	98.7	Very high	97.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.3	-42.7	177.1	-66.6	0	0	0	0	111.3	F993 F1013 S1042 A1049 C1050	F993-C1046 HydrophobicContact CB-CB 4.12Å; F993-C1046 HydrophobicContact CD1-CB 3.39Å; F993-C1046 HydrophobicContact CD2-CB 4.1Å; F993-C1046 HydrophobicContact CE1-CB 3.67Å; F993-C1046 HydrophobicContact CE2-CB 4.3Å; F993-C1046 HydrophobicContact CG-CB 3.62Å; F993-C1046 HydrophobicContact CZ-CB 4.1Å; F1013-C1046 HydrophobicContact CB-CB 4.43Å; F1013-C1046 HydrophobicContact CD2-CB 4.16Å; F1013-C1046 WeakPolarHBondContact CD2-SG 3.47Å; F1013-C1046 HydrophobicContact CG-CB 4.41Å; S1042-C1046 VanDerWaalsContact O-CB 3.29Å; S1042-C1046 WeakPolarHBondContact O-CB 3.28Å; S1042-C1046 PolarHBondContact O-N 3.49Å; S1042-C1046 PolarHBondContact O-SG 3.34Å; C1046-A1049 PolarHBondContact O-N 3.32Å; C1046-C1050 PolarHBondContact O-N 2.78Å; C1046-C1050 PolarHBondContact O-SG 3.26Å
1047	T	98.7	Very high	97.3	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.006	10%	0.096	C	C	.	.	H	α-helix	trans	-64.1	-43	177.2	-56	0	0	0	0	111.3	I716 L720 F823 L825 F993 L1043 C1044 C1050 V1051	I716-T1047 HydrophobicContact CG2-CG2 3.65Å; L720-T1047 HydrophobicContact CD1-CG2 4.2Å; F823-T1047 HydrophobicContact CD2-CG2 4.24Å; F823-T1047 HydrophobicContact CE2-CG2 3.8Å; F823-T1047 HydrophobicContact CZ-CG2 4.36Å; L825-T1047 HydrophobicContact CD2-CG2 3.81Å; F993-T1047 WeakPolarHBondContact CE2-OG1 3.46Å; L1043-T1047 WeakPolarHBondContact O-CB 3.29Å; L1043-T1047 PolarHBondContact O-N 3.41Å; L1043-T1047 PolarHBondContact O-OG1 2.98Å; C1044-T1047 PolarHBondContact O-N 2.91Å; T1047-C1050 PolarHBondContact O-N 3.45Å; T1047-V1051 HydrophobicContact CG2-CG2 4.43Å; T1047-V1051 WeakPolarHBondContact O-CG2 3.45Å; T1047-V1051 PolarHBondContact O-N 3.44Å
1048	E	98.6	Very high	97.1	Very high	18 Å²	18	19.4 Å²	19.4	8%	0.084	10%	0.096	C	C	.	.	H	α-helix	trans	-58.8	-46.1	173.9	166.8	162.8	-168.1	0	0	112	R719 L725 C1044 D1045 C1050 V1051 R1052	R719-E1048 IonicContact CZ-OE2 3.13Å; R719-E1048 IonicContact NH1-OE2 3.94Å; R719-E1048 PolarHBondContact NH1-OE2 2.86Å; L725-E1048 HydrophobicContact CD1-CB 4.48Å; L725-E1048 HydrophobicContact CD1-CG 3.77Å; C1044-E1048 WeakPolarHBondContact O-CB 3.49Å; C1044-E1048 PolarHBondContact O-N 3.23Å; D1045-E1048 PolarHBondContact O-N 3.14Å; E1048-C1050 PolarHBondContact O-N 3.19Å; E1048-V1051 PolarHBondContact O-N 2.91Å; E1048-R1052 VanDerWaalsContact O-CG 3.26Å; E1048-R1052 WeakPolarHBondContact O-CG 3.27Å; E1048-R1052 PolarHBondContact O-N 3.23Å; E1048-R1052 IonicContact OE1-CZ 2.85Å; E1048-R1052 VanDerWaalsContact OE1-CZ 3.29Å; E1048-R1052 IonicContact OE1-NE 3.94Å; E1048-R1052 PolarHBondContact OE1-NE 3.49Å; E1048-R1052 IonicContact OE1-NH2 3.62Å; E1048-R1052 PolarHBondContact OE1-NH2 3.28Å
1049	A	98.5	Very high	96.8	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.008	9%	0.092	C	C	.	.	H	α-helix	trans	-60.6	-43.1	178	0	0	0	0	0	112.6	P1010 D1045 C1046 R1052 A1053 I1075	P1010-A1049 WeakPolarHBondContact O-CB 3.22Å; D1045-A1049 WeakPolarHBondContact O-CB 3.48Å; D1045-A1049 PolarHBondContact O-N 2.91Å; C1046-A1049 PolarHBondContact O-N 3.32Å; A1049-R1052 PolarHBondContact O-N 3.12Å; A1049-A1053 PolarHBondContact O-N 3.39Å; A1049-A1053 VanDerWaalsContact O-N 3.16Å; A1049-I1075 HydrophobicContact CB-CD1 3.79Å; A1049-I1075 HydrophobicContact CB-CG1 4.23Å
1050	C	98.7	Very high	96.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.7	-45.1	176.4	-63.7	0	0	0	0	111.7	F823 T1017 L1032 C1046 T1047 E1048 R1052 A1053 L1054	F823-C1050 HydrophobicContact CD2-CB 4.18Å; F823-C1050 HydrophobicContact CE2-CB 3.78Å; T1017-C1050 HydrophobicContact CG2-CB 4.49Å; T1017-C1050 PolarHBondContact OG1-SG 3.03Å; L1032-C1050 HydrophobicContact CD2-CB 3.66Å; C1046-C1050 PolarHBondContact O-N 2.78Å; C1046-C1050 PolarHBondContact O-SG 3.26Å; T1047-C1050 PolarHBondContact O-N 3.45Å; E1048-C1050 PolarHBondContact O-N 3.19Å; C1050-R1052 VanDerWaalsContact C-N 3.32Å; C1050-R1052 PolarHBondContact O-N 3.08Å; C1050-A1053 WeakPolarHBondContact O-CB 3.4Å; C1050-A1053 PolarHBondContact O-N 3.04Å; C1050-A1053 VanDerWaalsContact O-N 3.16Å; C1050-L1054 WeakPolarHBondContact O-CG 3.4Å; C1050-L1054 PolarHBondContact O-N 3.19Å
1051	V	98.5	Very high	95.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.3	-37.3	178.5	171.8	0	0	0	0	111.6	L687 L720 L725 F823 T1047 E1048 L1054 L1055	L687-V1051 HydrophobicContact CD2-CG2 3.89Å; L720-V1051 HydrophobicContact CD1-CG2 4.28Å; L720-V1051 HydrophobicContact CD2-CB 4.18Å; L720-V1051 HydrophobicContact CD2-CG1 4.32Å; L720-V1051 HydrophobicContact CD2-CG2 4.05Å; L725-V1051 HydrophobicContact CB-CG1 4.1Å; L725-V1051 HydrophobicContact CD1-CG1 4.4Å; F823-V1051 HydrophobicContact CD2-CG2 4.04Å; T1047-V1051 HydrophobicContact CG2-CG2 4.43Å; T1047-V1051 WeakPolarHBondContact O-CG2 3.45Å; T1047-V1051 PolarHBondContact O-N 3.44Å; E1048-V1051 PolarHBondContact O-N 2.91Å; V1051-L1054 PolarHBondContact O-N 2.84Å; V1051-L1055 HydrophobicContact CG1-CD1 3.96Å; V1051-L1055 HydrophobicContact CG1-CG 4.45Å; V1051-L1055 WeakPolarHBondContact O-CB 3.41Å; V1051-L1055 WeakPolarHBondContact O-CG 3.12Å; V1051-L1055 PolarHBondContact O-N 2.96Å
1052	R	97.6	Very high	95.3	Very high	52 Å²	52	12 Å²	12	20%	0.196	6%	0.059	C	C	.	.	H	α-helix	trans	-60.5	-44.5	172.5	-70.2	166.2	172.9	-80.8	-3.9	112	L725 E1048 A1049 C1050 L1055 R1056 P1072 D1073	L725-R1052 HydrophobicContact CD1-CG 3.88Å; L725-R1052 HydrophobicContact CD2-CG 4.17Å; E1048-R1052 VanDerWaalsContact O-CG 3.26Å; E1048-R1052 WeakPolarHBondContact O-CG 3.27Å; E1048-R1052 PolarHBondContact O-N 3.23Å; E1048-R1052 IonicContact OE1-CZ 2.85Å; E1048-R1052 VanDerWaalsContact OE1-CZ 3.29Å; E1048-R1052 IonicContact OE1-NE 3.94Å; E1048-R1052 PolarHBondContact OE1-NE 3.49Å; E1048-R1052 IonicContact OE1-NH2 3.62Å; E1048-R1052 PolarHBondContact OE1-NH2 3.28Å; A1049-R1052 PolarHBondContact O-N 3.12Å; C1050-R1052 VanDerWaalsContact C-N 3.32Å; C1050-R1052 PolarHBondContact O-N 3.08Å; R1052-L1055 PolarHBondContact O-N 2.95Å; R1052-R1056 PolarHBondContact O-N 2.97Å; R1052-P1072 HydrophobicContact CB-CG 4.43Å; R1052-P1072 HydrophobicContact CG-CB 4.2Å; R1052-P1072 HydrophobicContact CG-CG 4.4Å; R1052-D1073 WeakPolarHBondContact CD-O 3.45Å; R1052-D1073 PolarHBondContact NH1-O 2.91Å
1053	A	96.9	Very high	94.5	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-66.1	-38.7	177.8	0	0	0	0	0	114	G1014 T1017 R1018 A1049 C1050 S1057 L1074	G1014-A1053 WeakPolarHBondContact O-CB 3.34Å; T1017-A1053 HydrophobicContact CG2-CB 3.81Å; R1018-A1053 HydrophobicContact CB-CB 4Å; A1049-A1053 PolarHBondContact O-N 3.39Å; A1049-A1053 VanDerWaalsContact O-N 3.16Å; C1050-A1053 WeakPolarHBondContact O-CB 3.4Å; C1050-A1053 PolarHBondContact O-N 3.04Å; C1050-A1053 VanDerWaalsContact O-N 3.16Å; A1053-S1057 PolarHBondContact O-N 3.14Å; A1053-S1057 PolarHBondContact O-OG 3.23Å; A1053-L1074 HydrophobicContact CB-CD2 3.71Å
1054	L	97.4	Very high	93.4	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66	-45.2	174.4	-67.2	172.9	0	0	0	111.4	T685 N821 F823 T1017 L1032 C1050 V1051 R1056 S1057 A1058	T685-L1054 HydrophobicContact CG2-CB 3.64Å; T685-L1054 HydrophobicContact CG2-CD1 4.03Å; T685-L1054 HydrophobicContact CG2-CG 4.47Å; T685-L1054 PolarHBondContact OG1-O 2.89Å; N821-L1054 HydrophobicContact CB-CD2 4.02Å; N821-L1054 PolarHBondContact ND2-O 3.32Å; F823-L1054 HydrophobicContact CB-CD1 4.03Å; F823-L1054 HydrophobicContact CD2-CD1 4.5Å; T1017-L1054 HydrophobicContact CG2-CD2 3.85Å; T1017-L1054 HydrophobicContact CG2-CG 3.88Å; L1032-L1054 HydrophobicContact CD1-CD1 4.35Å; L1032-L1054 HydrophobicContact CD1-CD2 4.16Å; C1050-L1054 WeakPolarHBondContact O-CG 3.4Å; C1050-L1054 PolarHBondContact O-N 3.19Å; V1051-L1054 PolarHBondContact O-N 2.84Å; L1054-R1056 VanDerWaalsContact C-N 3.34Å; L1054-R1056 PolarHBondContact O-N 3.34Å; L1054-S1057 PolarHBondContact O-N 2.99Å; L1054-A1058 WeakPolarHBondContact O-CB 3.49Å; L1054-A1058 PolarHBondContact O-N 3.28Å
1055	L	95.9	Very high	92	Very high	9 Å²	9	26.4 Å²	26.4	5%	0.047	12%	0.122	C	C	.	.	H	α-helix	trans	-62.6	-38.2	177	-78.8	169.9	0	0	0	112.4	T684 T685 L725 K728 V1051 R1052 A1058 A1059 P1072	T684-L1055 WeakPolarHBondContact OG1-CD2 3.28Å; T685-L1055 PolarHBondContact OG1-N 3.46Å; L725-L1055 HydrophobicContact CD2-CD1 3.98Å; K728-L1055 HydrophobicContact CB-CD1 3.89Å; K728-L1055 HydrophobicContact CB-CD2 3.98Å; K728-L1055 WeakPolarHBondContact O-CD2 3.37Å; V1051-L1055 HydrophobicContact CG1-CD1 3.96Å; V1051-L1055 HydrophobicContact CG1-CG 4.45Å; V1051-L1055 WeakPolarHBondContact O-CB 3.41Å; V1051-L1055 WeakPolarHBondContact O-CG 3.12Å; V1051-L1055 PolarHBondContact O-N 2.96Å; R1052-L1055 PolarHBondContact O-N 2.95Å; L1055-A1058 PolarHBondContact O-N 3.01Å; L1055-A1059 WeakPolarHBondContact O-CB 3.3Å; L1055-A1059 PolarHBondContact O-N 3.22Å; L1055-P1072 HydrophobicContact CB-CG 3.77Å; L1055-P1072 HydrophobicContact CD1-CG 3.97Å
1056	R	93.2	Very high	90.7	Very high	27 Å²	27	29 Å²	29	10%	0.102	14%	0.144	C	C	.	.	H	α-helix	trans	-63.3	-45.8	172.6	179.8	155.5	-175.6	145.9	-1.8	112.2	R1052 L1054 A1058 A1059 E1060 V1071 N1131	R1052-R1056 PolarHBondContact O-N 2.97Å; L1054-R1056 VanDerWaalsContact C-N 3.34Å; L1054-R1056 PolarHBondContact O-N 3.34Å; R1056-A1058 VanDerWaalsContact C-N 3.29Å; R1056-A1058 PolarHBondContact O-N 2.98Å; R1056-A1059 PolarHBondContact O-N 3.4Å; R1056-E1060 WeakPolarHBondContact CG-OE1 3.19Å; R1056-E1060 IonicContact NE-OE1 2.69Å; R1056-E1060 PolarHBondContact NE-OE1 2.92Å; R1056-E1060 WeakPolarHBondContact O-CG 3.45Å; R1056-E1060 PolarHBondContact O-N 3.4Å; R1056-V1071 HydrophobicContact CB-CG1 3.62Å; R1056-V1071 HydrophobicContact CG-CG1 3.81Å; R1056-N1131 PolarHBondContact NH2-OD1 2.95Å
1057	S	92.5	Very high	89	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.6	-30	178.3	-49.5	0	0	0	0	112.4	R1018 S1021 A1053 L1054 I1061	R1018-S1057 PolarHBondContact NH1-OG 3.12Å; S1021-S1057 VanDerWaalsContact CB-OG 3.23Å; S1021-S1057 WeakPolarHBondContact CB-OG 3.36Å; A1053-S1057 PolarHBondContact O-N 3.14Å; A1053-S1057 PolarHBondContact O-OG 3.23Å; L1054-S1057 PolarHBondContact O-N 2.99Å; S1057-I1061 WeakPolarHBondContact O-CD1 3.21Å; S1057-I1061 WeakPolarHBondContact O-CG1 3.34Å; S1057-I1061 PolarHBondContact O-N 3.46Å
1058	A	93	Very high	87.4	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-70.1	-42.4	171.4	0	0	0	0	0	112.4	P820 L1054 L1055 R1056 I1061 N1062	P820-A1058 HydrophobicContact CB-CB 4.22Å; P820-A1058 HydrophobicContact CG-CB 3.69Å; L1054-A1058 WeakPolarHBondContact O-CB 3.49Å; L1054-A1058 PolarHBondContact O-N 3.28Å; L1055-A1058 PolarHBondContact O-N 3.01Å; R1056-A1058 VanDerWaalsContact C-N 3.29Å; R1056-A1058 PolarHBondContact O-N 2.98Å; A1058-I1061 PolarHBondContact O-N 3.35Å; A1058-N1062 PolarHBondContact O-N 3.47Å; A1058-N1062 VanDerWaalsContact O-N 3.16Å; A1058-N1062 PolarHBondContact O-ND2 2.87Å; A1058-N1062 VanDerWaalsContact O-ND2 3.15Å
1059	A	90.7	Very high	86	Confident	3 Å²	3	41.3 Å²	41.3	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-61.4	-43.1	174.8	0	0	0	0	0	112.1	L1055 R1056 I1061 N1062 E1063 I1069 V1071	L1055-A1059 WeakPolarHBondContact O-CB 3.3Å; L1055-A1059 PolarHBondContact O-N 3.22Å; R1056-A1059 PolarHBondContact O-N 3.4Å; A1059-I1061 PolarHBondContact O-N 2.79Å; A1059-N1062 CarbonylContact O-C 3.18Å; A1059-N1062 WeakPolarHBondContact O-CA 3.34Å; A1059-N1062 PolarHBondContact O-N 3.44Å; A1059-E1063 WeakPolarHBondContact O-CG 3.29Å; A1059-E1063 PolarHBondContact O-N 3.4Å; A1059-I1069 HydrophobicContact CB-CB 4.43Å; A1059-V1071 HydrophobicContact CB-CB 4.49Å; A1059-V1071 HydrophobicContact CB-CG1 4.31Å; A1059-V1071 HydrophobicContact CB-CG2 3.55Å
1060	E	87.8	Confident	85.1	Confident	32 Å²	32	45.6 Å²	45.6	15%	0.15	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-18.4	176.2	-70.7	170.4	-161.8	0	0	114	R1018 R1056 R1064	R1018-E1060 IonicContact CZ-OE1 2.68Å; R1018-E1060 IonicContact CZ-OE2 3.74Å; R1018-E1060 IonicContact NE-OE1 3.05Å; R1018-E1060 IonicContact NH1-OE1 2.85Å; R1018-E1060 PolarHBondContact NH1-OE1 2.89Å; R1018-E1060 IonicContact NH1-OE2 3.74Å; R1018-E1060 PolarHBondContact NH1-OE2 2.97Å; R1018-E1060 IonicContact NH2-OE1 3.77Å; R1018-E1060 PolarHBondContact NH2-OE1 3.38Å; R1018-E1060 IonicContact NH2-OE2 3.21Å; R1018-E1060 PolarHBondContact NH2-OE2 3.23Å; R1056-E1060 WeakPolarHBondContact CG-OE1 3.19Å; R1056-E1060 IonicContact NE-OE1 2.69Å; R1056-E1060 PolarHBondContact NE-OE1 2.92Å; R1056-E1060 WeakPolarHBondContact O-CG 3.45Å; R1056-E1060 PolarHBondContact O-N 3.4Å; E1060-R1064 WeakPolarHBondContact O-CG 3.42Å; E1060-R1064 PolarHBondContact O-NE 3.09Å
1061	I	86.2	Confident	84.4	Confident	26 Å²	26	47.7 Å²	47.7	13%	0.133	26%	0.257	C	S	.	.	H	α-helix	trans	-81.4	-38.8	168.8	-63	159	0	0	0	110.2	F683 P820 S1057 A1058 A1059 R1064 N1065	F683-I1061 HydrophobicContact CD1-CG2 4.19Å; F683-I1061 HydrophobicContact CE1-CG2 3.9Å; P820-I1061 HydrophobicContact CB-CD1 3.59Å; S1057-I1061 WeakPolarHBondContact O-CD1 3.21Å; S1057-I1061 WeakPolarHBondContact O-CG1 3.34Å; S1057-I1061 PolarHBondContact O-N 3.46Å; A1058-I1061 PolarHBondContact O-N 3.35Å; A1059-I1061 PolarHBondContact O-N 2.79Å; I1061-R1064 PolarHBondContact O-N 2.88Å; I1061-N1065 PolarHBondContact O-N 3.43Å; I1061-N1065 PolarHBondContact O-ND2 3.3Å
1062	N	85.2	Confident	83.9	Confident	7 Å²	7	48.3 Å²	48.3	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-72.9	-32.4	179.3	-67.5	-37.4	0	0	0	113.4	F683 A1058 A1059 N1065 S1066 I1067 I1069	F683-N1062 PolarHBondContact O-ND2 2.91Å; A1058-N1062 PolarHBondContact O-N 3.47Å; A1058-N1062 VanDerWaalsContact O-N 3.16Å; A1058-N1062 PolarHBondContact O-ND2 2.87Å; A1058-N1062 VanDerWaalsContact O-ND2 3.15Å; A1059-N1062 CarbonylContact O-C 3.18Å; A1059-N1062 WeakPolarHBondContact O-CA 3.34Å; A1059-N1062 PolarHBondContact O-N 3.44Å; N1062-N1065 CarbonylContact O-C 3.56Å; N1062-N1065 VanDerWaalsContact O-CA 3.27Å; N1062-N1065 WeakPolarHBondContact O-CA 3.41Å; N1062-N1065 WeakPolarHBondContact O-CB 3.17Å; N1062-N1065 PolarHBondContact O-N 3.01Å; N1062-S1066 PolarHBondContact O-N 2.93Å; N1062-I1067 CarbonylContact C-O 3.46Å; N1062-I1067 HydrophobicContact CB-CB 4.38Å; N1062-I1067 PolarHBondContact O-N 3.3Å; N1062-I1069 HydrophobicContact CB-CD1 3.7Å; N1062-I1069 WeakPolarHBondContact ND2-CD1 3.44Å
1063	E	80.9	Confident	83.5	Confident	93 Å²	93	50.8 Å²	50.8	44%	0.435	28%	0.278	S	S	.	.	H	α-helix	trans	-68.4	-35.4	173.6	-73.5	175.8	175.1	0	0	111.6	A1059 N1065 S1066	A1059-E1063 WeakPolarHBondContact O-CG 3.29Å; A1059-E1063 PolarHBondContact O-N 3.4Å; E1063-N1065 PolarHBondContact O-N 3.32Å; E1063-S1066 WeakPolarHBondContact O-CA 3.5Å; E1063-S1066 PolarHBondContact O-N 3.07Å
1064	R	75.6	Confident	83.4	Confident	129 Å²	129	51.4 Å²	51.4	49%	0.487	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-25.8	166.8	-74.9	-178.7	-81.5	166.8	-8.8	112.7	D1023 E1060 I1061 S1066	D1023-R1064 IonicContact OD1-CZ 2.91Å; D1023-R1064 IonicContact OD1-NH1 3.91Å; D1023-R1064 PolarHBondContact OD1-NH1 3.37Å; D1023-R1064 IonicContact OD1-NH2 3.58Å; D1023-R1064 IonicContact OD2-NH1 2.93Å; E1060-R1064 WeakPolarHBondContact O-CG 3.42Å; E1060-R1064 PolarHBondContact O-NE 3.09Å; I1061-R1064 PolarHBondContact O-N 2.88Å; R1064-S1066 VanDerWaalsContact C-N 3.33Å
1065	N	69.9	Low	83.2	Confident	103 Å²	103	53.9 Å²	53.9	55%	0.551	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	15.8	170.6	-60.8	-35.4	0	0	0	113.3	I1061 N1062 E1063 I1067	I1061-N1065 PolarHBondContact O-N 3.43Å; I1061-N1065 PolarHBondContact O-ND2 3.3Å; N1062-N1065 CarbonylContact O-C 3.56Å; N1062-N1065 VanDerWaalsContact O-CA 3.27Å; N1062-N1065 WeakPolarHBondContact O-CA 3.41Å; N1062-N1065 WeakPolarHBondContact O-CB 3.17Å; N1062-N1065 PolarHBondContact O-N 3.01Å; E1063-N1065 PolarHBondContact O-N 3.32Å; N1065-I1067 PolarHBondContact O-N 3.4Å
1066	S	69.2	Low	83.2	Confident	108 Å²	108	57.3 Å²	57.3	76%	0.755	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	27.1	179.8	-53.1	0	0	0	0	116.6	N1062 E1063 R1064	N1062-S1066 PolarHBondContact O-N 2.93Å; E1063-S1066 WeakPolarHBondContact O-CA 3.5Å; E1063-S1066 PolarHBondContact O-N 3.07Å; R1064-S1066 VanDerWaalsContact C-N 3.33Å
1067	I	64.7	Low	83.3	Confident	90 Å²	90	56.8 Å²	56.8	46%	0.462	32%	0.316	S	S	.	.			trans	-113.9	101.8	174.9	-53.4	176.5	0	0	0	110	N1062 N1065 I1069	N1062-I1067 CarbonylContact C-O 3.46Å; N1062-I1067 HydrophobicContact CB-CB 4.38Å; N1062-I1067 PolarHBondContact O-N 3.3Å; N1065-I1067 PolarHBondContact O-N 3.4Å; I1067-I1069 HydrophobicContact CG2-CD1 4.34Å; I1067-I1069 HydrophobicContact CG2-CG1 4.07Å
1068	P	64	Low	83.4	Confident	112 Å²	112	63.1 Å²	63.1	73%	0.727	34%	0.344	S	S	*	.			trans	-68.5	134.4	172.1	-17.7	31.9	0	0	0	111.5
1069	I	70.2	Confident	83.5	Confident	74 Å²	74	68.5 Å²	68.5	38%	0.379	37%	0.369	S	S	.	.			trans	-131.7	144.6	-177.3	-61.7	179.4	0	0	0	110.1	A1059 N1062 I1067 V1071	A1059-I1069 HydrophobicContact CB-CB 4.43Å; N1062-I1069 HydrophobicContact CB-CD1 3.7Å; N1062-I1069 WeakPolarHBondContact ND2-CD1 3.44Å; I1067-I1069 HydrophobicContact CG2-CD1 4.34Å; I1067-I1069 HydrophobicContact CG2-CG1 4.07Å; I1069-V1071 VanDerWaalsContact O-CG2 3.31Å; I1069-V1071 WeakPolarHBondContact O-CG2 3.48Å; I1069-V1071 PolarHBondContact O-N 2.84Å
1070	S	78.9	Confident	83.7	Confident	91 Å²	91	72.4 Å²	72.4	64%	0.636	40%	0.396	S	S	*	.			trans	-67.2	94	171.1	172.8	0	0	0	0	110.8	K728	K728-S1070 PolarHBondContact NZ-O 3.5Å; K728-S1070 PolarHBondContact NZ-OG 3Å
1071	V	83.6	Confident	84.1	Confident	45 Å²	45	72.2 Å²	72.2	27%	0.273	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-72.5	138.8	177.6	-163	0	0	0	0	110.7	R1056 A1059 I1069	R1056-V1071 HydrophobicContact CB-CG1 3.62Å; R1056-V1071 HydrophobicContact CG-CG1 3.81Å; A1059-V1071 HydrophobicContact CB-CB 4.49Å; A1059-V1071 HydrophobicContact CB-CG1 4.31Å; A1059-V1071 HydrophobicContact CB-CG2 3.55Å; I1069-V1071 VanDerWaalsContact O-CG2 3.31Å; I1069-V1071 WeakPolarHBondContact O-CG2 3.48Å; I1069-V1071 PolarHBondContact O-N 2.84Å
1072	P	89.2	Confident	84.5	Confident	12 Å²	12	72.2 Å²	72.2	8%	0.078	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-78.8	138.6	165.2	33	-33.2	0	0	0	111	L725 R1052 L1055	L725-P1072 HydrophobicContact CD2-CB 4.04Å; L725-P1072 HydrophobicContact CD2-CG 4.23Å; R1052-P1072 HydrophobicContact CB-CG 4.43Å; R1052-P1072 HydrophobicContact CG-CB 4.2Å; R1052-P1072 HydrophobicContact CG-CG 4.4Å; L1055-P1072 HydrophobicContact CB-CG 3.77Å; L1055-P1072 HydrophobicContact CD1-CG 3.97Å
1073	D	89.4	Confident	85	Confident	104 Å²	104	75.9 Å²	75.9	56%	0.556	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-64.4	149.5	174.7	-60.6	-61.3	0	0	0	112.6	R1052	R1052-D1073 WeakPolarHBondContact CD-O 3.45Å; R1052-D1073 PolarHBondContact NH1-O 2.91Å
1074	L	93.2	Very high	85.8	Confident	13 Å²	13	74.8 Å²	74.8	7%	0.068	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-68.4	146.6	167	-66	174.4	0	0	0	109.6	W1015 R1018 A1053	W1015-L1074 HydrophobicContact CD2-CD1 4.31Å; W1015-L1074 HydrophobicContact CE3-CD1 4.37Å; W1015-L1074 HydrophobicContact CH2-CD1 4.03Å; W1015-L1074 HydrophobicContact CZ2-CD1 3.91Å; W1015-L1074 HydrophobicContact CZ3-CD1 4.25Å; R1018-L1074 HydrophobicContact CB-CD2 4.5Å; R1018-L1074 HydrophobicContact CG-CD1 4.14Å; A1053-L1074 HydrophobicContact CB-CD2 3.71Å
1075	I	94.5	Very high	86.7	Confident	52 Å²	52	72.4 Å²	72.4	27%	0.267	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-69.4	129.6	172.6	-52.9	-170.3	0	0	0	108.4	A1011 W1015 A1049 L1077	A1011-I1075 HydrophobicContact CB-CB 4.17Å; A1011-I1075 HydrophobicContact CB-CG2 3.96Å; W1015-I1075 PolarHBondContact NE1-O 2.69Å; W1015-I1075 VanDerWaalsContact NE1-O 3.15Å; A1049-I1075 HydrophobicContact CB-CD1 3.79Å; A1049-I1075 HydrophobicContact CB-CG1 4.23Å; I1075-L1077 PolarHBondContact O-N 2.91Å
1076	P	94.4	Very high	88	Confident	82 Å²	82	67.7 Å²	67.7	53%	0.532	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-65	134.9	177.8	25.4	-34	0	0	0	111.3	A1011 I1128	A1011-P1076 WeakPolarHBondContact CB-O 3.35Å; P1076-I1128 HydrophobicContact CB-CD1 3.63Å
1077	L	95.4	Very high	89.3	Confident	15 Å²	15	66.1 Å²	66.1	8%	0.079	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-66.9	150.1	164.1	-78	159.4	0	0	0	109.6	D964 L968 A1011 A1012 W1015 I1075 Q1079 L1082 L1125	D964-L1077 HydrophobicContact CB-CD2 4.32Å; D964-L1077 VanDerWaalsContact OD2-CD2 3.26Å; D964-L1077 WeakPolarHBondContact OD2-CD2 3.46Å; L968-L1077 HydrophobicContact CD1-CD1 3.9Å; L968-L1077 HydrophobicContact CD1-CD2 4.37Å; A1011-L1077 HydrophobicContact CB-CD2 3.96Å; A1011-L1077 HydrophobicContact CB-CG 4.13Å; A1012-L1077 HydrophobicContact CB-CD2 3.98Å; W1015-L1077 HydrophobicContact CB-CD1 4.19Å; W1015-L1077 HydrophobicContact CD2-CD1 4.23Å; W1015-L1077 HydrophobicContact CG-CD1 3.72Å; W1015-L1077 HydrophobicContact CG-CG 4.27Å; I1075-L1077 PolarHBondContact O-N 2.91Å; L1077-Q1079 PolarHBondContact O-N 3.16Å; L1077-L1082 HydrophobicContact CB-CD1 4.03Å; L1077-L1082 HydrophobicContact CB-CD2 3.78Å; L1077-L1082 HydrophobicContact CB-CG 3.75Å; L1077-L1082 HydrophobicContact CD1-CD2 3.67Å; L1077-L1082 HydrophobicContact CG-CD2 4.34Å; L1077-L1125 HydrophobicContact CD1-CD2 3.47Å; L1077-L1125 VanDerWaalsContact CD1-CD2 3.47Å
1078	K	94.8	Very high	90.8	Very high	134 Å²	134	66.4 Å²	66.4	58%	0.583	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-68.7	129.8	175	-65.7	176.1	-177.4	170.9	0	109	S1080 E1081 L1082	K1078-S1080 PolarHBondContact O-N 3.35Å; K1078-S1080 VanDerWaalsContact O-N 3.15Å; K1078-E1081 HydrophobicContact CB-CB 4.42Å; K1078-E1081 HydrophobicContact CB-CG 4.42Å; K1078-E1081 PolarHBondContact O-N 2.94Å; K1078-L1082 PolarHBondContact O-N 3.38Å
1079	Q	94.6	Very high	92.3	Very high	114 Å²	114	62.7 Å²	62.7	53%	0.533	35%	0.347	S	S	.	.	H	α-helix	trans	-54.8	-36.9	177.1	-167.8	62.6	38.3	0	0	112.2	L1077 E1081 L1082 D1083	L1077-Q1079 PolarHBondContact O-N 3.16Å; Q1079-E1081 PolarHBondContact O-N 3.38Å; Q1079-L1082 PolarHBondContact O-N 3.2Å; Q1079-L1082 VanDerWaalsContact O-N 3.16Å; Q1079-D1083 WeakPolarHBondContact CG-OD2 3.46Å; Q1079-D1083 VanDerWaalsContact NE2-CG 3.26Å; Q1079-D1083 PolarHBondContact NE2-OD1 2.79Å; Q1079-D1083 PolarHBondContact NE2-OD2 3.33Å; Q1079-D1083 PolarHBondContact O-N 2.97Å
1080	S	96.1	Very high	93.6	Very high	85 Å²	85	59.2 Å²	59.2	59%	0.594	33%	0.328	S	S	*	.	H	α-helix	trans	-61.1	-26.1	175.4	63.1	0	0	0	0	114.7	K1078 R1084	K1078-S1080 PolarHBondContact O-N 3.35Å; K1078-S1080 VanDerWaalsContact O-N 3.15Å; S1080-R1084 WeakPolarHBondContact O-CB 3.46Å
1081	E	96	Very high	94.4	Very high	27 Å²	27	55.4 Å²	55.4	13%	0.126	30%	0.301	C	S	.	.	H	α-helix	trans	-93	-31.3	173.5	-73.5	-61.4	97	0	0	111.7	S963 D964 K1078 Q1079 R1084	S963-E1081 VanDerWaalsContact CB-OE2 3.3Å; S963-E1081 WeakPolarHBondContact CB-OE2 3.46Å; S963-E1081 PolarHBondContact OG-OE2 3.27Å; D964-E1081 HydrophobicContact CB-CB 3.89Å; D964-E1081 HydrophobicContact CB-CG 4.11Å; D964-E1081 PolarHBondContact N-OE2 3.48Å; K1078-E1081 HydrophobicContact CB-CB 4.42Å; K1078-E1081 HydrophobicContact CB-CG 4.42Å; K1078-E1081 PolarHBondContact O-N 2.94Å; Q1079-E1081 PolarHBondContact O-N 3.38Å; E1081-R1084 PolarHBondContact O-N 2.98Å; E1081-R1084 IonicContact OE1-CZ 2.8Å; E1081-R1084 IonicContact OE1-NE 3.5Å; E1081-R1084 PolarHBondContact OE1-NE 2.81Å; E1081-R1084 IonicContact OE1-NH2 3.37Å; E1081-R1084 IonicContact OE2-CZ 3.55Å; E1081-R1084 IonicContact OE2-NE 2.69Å; E1081-R1084 PolarHBondContact OE2-NE 3.05Å; E1081-R1084 IonicContact OE2-NH2 3.03Å; E1081-R1084 PolarHBondContact OE2-NH2 3.05Å
1082	L	94.6	Very high	95	Very high	27 Å²	27	59.9 Å²	59.9	14%	0.141	32%	0.319	C	S	.	.	H	α-helix	trans	-62.4	-43.5	175.4	-75.5	174.5	0	0	0	112	L1077 K1078 Q1079 R1084 P1120 A1121 S1122 L1125	L1077-L1082 HydrophobicContact CB-CD1 4.03Å; L1077-L1082 HydrophobicContact CB-CD2 3.78Å; L1077-L1082 HydrophobicContact CB-CG 3.75Å; L1077-L1082 HydrophobicContact CD1-CD2 3.67Å; L1077-L1082 HydrophobicContact CG-CD2 4.34Å; K1078-L1082 PolarHBondContact O-N 3.38Å; Q1079-L1082 PolarHBondContact O-N 3.2Å; Q1079-L1082 VanDerWaalsContact O-N 3.16Å; L1082-R1084 VanDerWaalsContact C-N 3.3Å; L1082-P1120 WeakPolarHBondContact O-CB 3.39Å; L1082-A1121 HydrophobicContact CD2-CB 3.91Å; L1082-A1121 WeakPolarHBondContact O-CA 3.28Å; L1082-A1121 PolarHBondContact O-N 3.41Å; L1082-S1122 PolarHBondContact O-N 3.25Å; L1082-S1122 PolarHBondContact O-OG 2.88Å; L1082-L1125 HydrophobicContact CD2-CD2 3.97Å
1083	D	96.2	Very high	95.3	Very high	84 Å²	84	60.1 Å²	60.1	45%	0.449	32%	0.32	S	S	.	.	S	Bend	trans	-83.1	-4.7	179.1	-64.5	-36.9	0	0	0	113.3	Q1079 V1085 S1122	Q1079-D1083 WeakPolarHBondContact CG-OD2 3.46Å; Q1079-D1083 VanDerWaalsContact NE2-CG 3.26Å; Q1079-D1083 PolarHBondContact NE2-OD1 2.79Å; Q1079-D1083 PolarHBondContact NE2-OD2 3.33Å; Q1079-D1083 PolarHBondContact O-N 2.97Å; D1083-V1085 PolarHBondContact O-N 3.46Å; D1083-S1122 WeakPolarHBondContact OD1-CB 3.44Å; D1083-S1122 PolarHBondContact OD1-OG 3.48Å
1084	R	96.3	Very high	95.7	Very high	69 Å²	69	55.2 Å²	55.2	26%	0.26	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-77.8	126.1	-176	-163.1	167.3	61.3	70	-2	111.1	A965 E966 S1080 E1081 L1082	A965-R1084 HydrophobicContact CB-CB 4.26Å; E966-R1084 IonicContact OE1-CZ 3.57Å; E966-R1084 IonicContact OE1-NH1 3.42Å; E966-R1084 PolarHBondContact OE1-NH1 3.42Å; E966-R1084 IonicContact OE1-NH2 3.67Å; E966-R1084 IonicContact OE2-CZ 3.98Å; E966-R1084 IonicContact OE2-NH1 2.67Å; E966-R1084 IonicContact OE2-NH2 2.86Å; E966-R1084 PolarHBondContact OE2-NH2 3.36Å; S1080-R1084 WeakPolarHBondContact O-CB 3.46Å; E1081-R1084 PolarHBondContact O-N 2.98Å; E1081-R1084 IonicContact OE1-CZ 2.8Å; E1081-R1084 IonicContact OE1-NE 3.5Å; E1081-R1084 PolarHBondContact OE1-NE 2.81Å; E1081-R1084 IonicContact OE1-NH2 3.37Å; E1081-R1084 IonicContact OE2-CZ 3.55Å; E1081-R1084 IonicContact OE2-NE 2.69Å; E1081-R1084 PolarHBondContact OE2-NE 3.05Å; E1081-R1084 IonicContact OE2-NH2 3.03Å; E1081-R1084 PolarHBondContact OE2-NH2 3.05Å; L1082-R1084 VanDerWaalsContact C-N 3.3Å
1085	V	96.3	Very high	95.8	Very high	80 Å²	80	57.1 Å²	57.1	49%	0.485	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-63.4	129.4	165.9	170	0	0	0	0	108.7	D1083 S1118	D1083-V1085 PolarHBondContact O-N 3.46Å; V1085-S1118 WeakPolarHBondContact CG1-O 3.5Å
1086	P	96.5	Very high	95.9	Very high	4 Å²	4	58.7 Å²	58.7	3%	0.026	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-62.8	146.8	178.3	-17.3	28.8	0	0	0	111.7	A965 E966 A969 I1091	A965-P1086 HydrophobicContact CB-CG 4.38Å; E966-P1086 HydrophobicContact CG-CB 4.41Å; E966-P1086 WeakPolarHBondContact OE1-CA 3.44Å; A969-P1086 HydrophobicContact CB-CB 3.98Å; A969-P1086 HydrophobicContact CB-CG 3.55Å; P1086-I1091 HydrophobicContact CB-CD1 3.82Å; P1086-I1091 HydrophobicContact CB-CG1 4.15Å; P1086-I1091 HydrophobicContact CG-CD1 4.08Å
1087	H	96.7	Very high	96	Very high	74 Å²	74	54.9 Å²	54.9	34%	0.343	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-56.6	135	-173.2	-170.2	-93.7	0	0	0	112.4	E966 S1089 A1090 I1091	E966-H1087 HydrophobicContact CG-CB 4.36Å; E966-H1087 PolarHBondContact OE1-N 3.24Å; H1087-S1089 VanDerWaalsContact C-N 3.29Å; H1087-S1089 PolarHBondContact CE1-OG 3.11Å; H1087-S1089 PolarHBondContact ND1-N 2.86Å; H1087-S1089 PolarHBondContact ND1-OG 2.86Å; H1087-S1089 PolarHBondContact O-N 2.95Å; H1087-S1089 VanDerWaalsContact O-N 3.11Å; H1087-A1090 HydrophobicContact CB-CB 4.31Å; H1087-A1090 WeakPolarHBondContact O-CA 3.43Å; H1087-A1090 VanDerWaalsContact O-CB 3.29Å; H1087-A1090 WeakPolarHBondContact O-CB 3.27Å; H1087-A1090 PolarHBondContact O-N 2.95Å; H1087-I1091 PolarHBondContact O-N 3.23Å
1088	P	95.6	Very high	96.1	Very high	96 Å²	96	54.4 Å²	54.4	62%	0.623	28%	0.282	S	S	*	.	H	α-helix	trans	-53.9	-38.3	-173.3	-31	36.7	0	0	0	115.1	A1090 I1091 Q1092	P1088-A1090 VanDerWaalsContact C-N 3.35Å; P1088-I1091 PolarHBondContact O-N 3.24Å; P1088-Q1092 PolarHBondContact O-N 2.73Å
1089	S	96	Very high	96.1	Very high	35 Å²	35	54.6 Å²	54.6	25%	0.245	29%	0.285	C	S	.	.	H	α-helix	trans	-71.6	-28	176.6	-31.1	0	0	0	0	113.2	I960 H1087 Q1092 T1093	I960-S1089 VanDerWaalsContact CD1-CB 3.45Å; I960-S1089 WeakPolarHBondContact CD1-OG 3.41Å; H1087-S1089 VanDerWaalsContact C-N 3.29Å; H1087-S1089 PolarHBondContact CE1-OG 3.11Å; H1087-S1089 PolarHBondContact ND1-N 2.86Å; H1087-S1089 PolarHBondContact ND1-OG 2.86Å; H1087-S1089 PolarHBondContact O-N 2.95Å; H1087-S1089 VanDerWaalsContact O-N 3.11Å; S1089-Q1092 PolarHBondContact O-N 3.25Å; S1089-T1093 PolarHBondContact O-N 3.27Å; S1089-T1093 PolarHBondContact O-OG1 3.42Å
1090	A	96.6	Very high	96.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-69.4	-43.2	172.2	0	0	0	0	0	110	W956 M962 E966 H1087 P1088 Q1092 T1093 L1094	W956-A1090 HydrophobicContact CE3-CB 4.15Å; W956-A1090 HydrophobicContact CH2-CB 4.37Å; W956-A1090 HydrophobicContact CZ3-CB 3.63Å; M962-A1090 HydrophobicContact CE-CB 4.17Å; M962-A1090 HydrophobicContact SD-CB 4.1Å; E966-A1090 HydrophobicContact CB-CB 4.22Å; E966-A1090 HydrophobicContact CG-CB 3.58Å; H1087-A1090 HydrophobicContact CB-CB 4.31Å; H1087-A1090 WeakPolarHBondContact O-CA 3.43Å; H1087-A1090 VanDerWaalsContact O-CB 3.29Å; H1087-A1090 WeakPolarHBondContact O-CB 3.27Å; H1087-A1090 PolarHBondContact O-N 2.95Å; P1088-A1090 VanDerWaalsContact C-N 3.35Å; A1090-Q1092 VanDerWaalsContact C-N 3.33Å; A1090-Q1092 PolarHBondContact O-N 2.6Å; A1090-T1093 PolarHBondContact O-N 3.35Å; A1090-L1094 WeakPolarHBondContact O-CG 3.32Å; A1090-L1094 PolarHBondContact O-N 2.67Å
1091	I	96.1	Very high	96.3	Very high	12 Å²	12	47.7 Å²	47.7	6%	0.062	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-43.6	170	-64	-57.2	0	0	0	111.3	A969 L973 P1086 H1087 P1088 T1093 L1094 L1095 A1117	A969-I1091 HydrophobicContact CB-CD1 4.49Å; L973-I1091 HydrophobicContact CD1-CD1 4.26Å; P1086-I1091 HydrophobicContact CB-CD1 3.82Å; P1086-I1091 HydrophobicContact CB-CG1 4.15Å; P1086-I1091 HydrophobicContact CG-CD1 4.08Å; H1087-I1091 PolarHBondContact O-N 3.23Å; P1088-I1091 PolarHBondContact O-N 3.24Å; I1091-T1093 VanDerWaalsContact C-N 3.34Å; I1091-T1093 PolarHBondContact O-N 3.39Å; I1091-L1094 PolarHBondContact O-N 2.92Å; I1091-L1095 HydrophobicContact CG2-CD1 3.84Å; I1091-L1095 HydrophobicContact CG2-CG 4.2Å; I1091-L1095 WeakPolarHBondContact O-CB 3.08Å; I1091-L1095 WeakPolarHBondContact O-CG 3.28Å; I1091-L1095 PolarHBondContact O-N 3.21Å; I1091-A1117 VanDerWaalsContact CD1-O 3.26Å; I1091-A1117 WeakPolarHBondContact CD1-O 3.49Å; I1091-A1117 HydrophobicContact CG2-CB 3.86Å
1092	Q	95.6	Very high	96.3	Very high	139 Å²	139	48.4 Å²	48.4	65%	0.65	25%	0.253	S	S	*	.	H	α-helix	trans	-60.3	-41.3	176.3	-170.8	-179.2	8.9	0	0	112.3	P1088 S1089 A1090 K1096	P1088-Q1092 PolarHBondContact O-N 2.73Å; S1089-Q1092 PolarHBondContact O-N 3.25Å; A1090-Q1092 VanDerWaalsContact C-N 3.33Å; A1090-Q1092 PolarHBondContact O-N 2.6Å; Q1092-K1096 WeakPolarHBondContact O-CB 3.39Å; Q1092-K1096 PolarHBondContact O-N 3.31Å
1093	T	96.9	Very high	96.3	Very high	16 Å²	16	52.7 Å²	52.7	10%	0.098	28%	0.28	C	S	.	.	H	α-helix	trans	-62.2	-46.4	172.6	-71.3	0	0	0	0	111.6	A955 W956 S1089 A1090 I1091 L1095 K1096 V1097	A955-T1093 WeakPolarHBondContact O-CG2 3.39Å; W956-T1093 HydrophobicContact CE3-CG2 4.26Å; S1089-T1093 PolarHBondContact O-N 3.27Å; S1089-T1093 PolarHBondContact O-OG1 3.42Å; A1090-T1093 PolarHBondContact O-N 3.35Å; I1091-T1093 VanDerWaalsContact C-N 3.34Å; I1091-T1093 PolarHBondContact O-N 3.39Å; T1093-L1095 PolarHBondContact O-N 3.08Å; T1093-K1096 WeakPolarHBondContact O-CB 3.47Å; T1093-K1096 PolarHBondContact O-N 3.29Å; T1093-V1097 WeakPolarHBondContact O-CG2 3.48Å; T1093-V1097 PolarHBondContact O-N 2.94Å
1094	L	96.9	Very high	96.4	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-41.7	179.5	-66.5	173.1	0	0	0	112.2	I954 W956 A969 A970 L973 I974 A1090 I1091 V1097 A1098	I954-L1094 HydrophobicContact CD1-CD2 4Å; I954-L1094 HydrophobicContact CG1-CD2 4.43Å; I954-L1094 HydrophobicContact CG2-CD2 3.64Å; W956-L1094 HydrophobicContact CH2-CD1 4.24Å; W956-L1094 HydrophobicContact CH2-CD2 4.17Å; W956-L1094 HydrophobicContact CH2-CG 4.23Å; W956-L1094 HydrophobicContact CZ3-CD2 4.42Å; W956-L1094 HydrophobicContact CZ3-CG 4.22Å; A969-L1094 HydrophobicContact CB-CD1 4.08Å; A970-L1094 HydrophobicContact CB-CD1 4.31Å; A970-L1094 HydrophobicContact CB-CD2 3.78Å; L973-L1094 HydrophobicContact CD1-CB 4.3Å; L973-L1094 HydrophobicContact CD1-CD1 3.98Å; I974-L1094 HydrophobicContact CG1-CD2 3.85Å; A1090-L1094 WeakPolarHBondContact O-CG 3.32Å; A1090-L1094 PolarHBondContact O-N 2.67Å; I1091-L1094 PolarHBondContact O-N 2.92Å; L1094-V1097 PolarHBondContact O-N 3.42Å; L1094-A1098 WeakPolarHBondContact O-CB 3.36Å; L1094-A1098 PolarHBondContact O-N 3.39Å
1095	L	96	Very high	96.4	Very high	52 Å²	52	49.9 Å²	49.9	27%	0.272	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-37.9	174	-67.7	174.6	0	0	0	112	I1091 T1093 H1099 I1112 A1117	I1091-L1095 HydrophobicContact CG2-CD1 3.84Å; I1091-L1095 HydrophobicContact CG2-CG 4.2Å; I1091-L1095 WeakPolarHBondContact O-CB 3.08Å; I1091-L1095 WeakPolarHBondContact O-CG 3.28Å; I1091-L1095 PolarHBondContact O-N 3.21Å; T1093-L1095 PolarHBondContact O-N 3.08Å; L1095-H1099 VanDerWaalsContact O-CB 3.32Å; L1095-H1099 WeakPolarHBondContact O-CB 3.47Å; L1095-H1099 PolarHBondContact O-N 2.88Å; L1095-I1112 HydrophobicContact CD2-CB 3.76Å; L1095-I1112 HydrophobicContact CD2-CG2 3.93Å; L1095-A1117 HydrophobicContact CD2-CB 4.23Å
1096	K	95.8	Very high	96.3	Very high	86 Å²	86	50.7 Å²	50.7	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-61.9	-45.6	172.9	-178.6	-168.4	172.8	-168	0	111.4	P939 E940 Q1092 T1093 H1099 L1100	P939-K1096 HydrophobicContact CB-CD 4.5Å; E940-K1096 WeakPolarHBondContact OE1-CE 3.47Å; E940-K1096 IonicContact OE1-NZ 3.15Å; E940-K1096 PolarHBondContact OE1-NZ 2.84Å; E940-K1096 IonicContact OE2-NZ 3.81Å; Q1092-K1096 WeakPolarHBondContact O-CB 3.39Å; Q1092-K1096 PolarHBondContact O-N 3.31Å; T1093-K1096 WeakPolarHBondContact O-CB 3.47Å; T1093-K1096 PolarHBondContact O-N 3.29Å; K1096-H1099 PolarHBondContact O-N 2.85Å; K1096-L1100 HydrophobicContact CG-CD1 4.14Å; K1096-L1100 WeakPolarHBondContact O-CG 3.27Å; K1096-L1100 PolarHBondContact O-N 3.41Å
1097	V	97.6	Very high	96.1	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-50	177.6	172.5	0	0	0	0	110.4	P939 I952 N953 I974 T1093 L1094 H1099 L1100 H1101	P939-V1097 HydrophobicContact CB-CG2 4.31Å; I952-V1097 HydrophobicContact CG2-CG1 3.6Å; N953-V1097 WeakPolarHBondContact O-CG2 3.34Å; I974-V1097 HydrophobicContact CD1-CB 4.36Å; I974-V1097 HydrophobicContact CD1-CG1 4.03Å; I974-V1097 HydrophobicContact CG1-CG1 4.42Å; I974-V1097 HydrophobicContact CG2-CG1 4.46Å; T1093-V1097 WeakPolarHBondContact O-CG2 3.48Å; T1093-V1097 PolarHBondContact O-N 2.94Å; L1094-V1097 PolarHBondContact O-N 3.42Å; V1097-H1099 VanDerWaalsContact C-N 3.31Å; V1097-H1099 PolarHBondContact O-N 3.36Å; V1097-L1100 PolarHBondContact O-N 3.27Å; V1097-H1101 WeakPolarHBondContact O-CB 3.49Å; V1097-H1101 PolarHBondContact O-CD2 3.48Å; V1097-H1101 VanDerWaalsContact O-CD2 3.29Å; V1097-H1101 PolarHBondContact O-N 3.1Å
1098	A	97.1	Very high	96	Very high	5 Å²	5	49.4 Å²	49.4	4%	0.041	27%	0.267	C	S	.	.	H	α-helix	trans	-57	-43.3	176.2	0	0	0	0	0	112.2	I974 L1094 H1101 S1102 F1108 I1112	I974-A1098 HydrophobicContact CD1-CB 3.92Å; L1094-A1098 WeakPolarHBondContact O-CB 3.36Å; L1094-A1098 PolarHBondContact O-N 3.39Å; A1098-H1101 CarbonylContact O-C 3.57Å; A1098-H1101 PolarHBondContact O-N 2.94Å; A1098-S1102 PolarHBondContact O-N 3.19Å; A1098-F1108 HydrophobicContact CB-CD1 3.98Å; A1098-F1108 HydrophobicContact CB-CD2 4.48Å; A1098-F1108 HydrophobicContact CB-CE1 4.33Å; A1098-F1108 HydrophobicContact CB-CG 4.08Å; A1098-I1112 HydrophobicContact CB-CD1 3.51Å; A1098-I1112 HydrophobicContact CB-CG1 4.48Å
1099	H	95.6	Very high	95.4	Very high	138 Å²	138	48.6 Å²	48.6	64%	0.639	26%	0.263	S	S	*	.	H	α-helix	trans	-62.4	-46.2	176.8	-178.5	74.6	0	0	0	112.6	L1095 K1096 V1097 H1101 S1102	L1095-H1099 VanDerWaalsContact O-CB 3.32Å; L1095-H1099 WeakPolarHBondContact O-CB 3.47Å; L1095-H1099 PolarHBondContact O-N 2.88Å; K1096-H1099 PolarHBondContact O-N 2.85Å; V1097-H1099 VanDerWaalsContact C-N 3.31Å; V1097-H1099 PolarHBondContact O-N 3.36Å; H1099-H1101 VanDerWaalsContact C-N 3.26Å; H1099-H1101 PolarHBondContact O-N 3.28Å; H1099-S1102 WeakPolarHBondContact O-CB 3.21Å; H1099-S1102 PolarHBondContact O-N 3.09Å; H1099-S1102 PolarHBondContact O-OG 2.8Å
1100	L	96.2	Very high	94.7	Very high	55 Å²	55	51 Å²	51	29%	0.288	27%	0.273	S	S	.	.	H	α-helix	trans	-61.3	-35.6	176.2	-72.3	169.8	0	0	0	112.1	P939 K1096 V1097	P939-L1100 HydrophobicContact CB-CD1 3.88Å; P939-L1100 WeakPolarHBondContact O-CD1 3.37Å; K1096-L1100 HydrophobicContact CG-CD1 4.14Å; K1096-L1100 WeakPolarHBondContact O-CG 3.27Å; K1096-L1100 PolarHBondContact O-N 3.41Å; V1097-L1100 PolarHBondContact O-N 3.27Å
1101	H	97.6	Very high	93.9	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-88.9	-8.3	-178.6	-77.7	-76	0	0	0	115.1	T951 V1097 A1098 H1099 V1103 Y1104 W1105 F1108	T951-H1101 PolarHBondContact O-CE1 2.95Å; V1097-H1101 WeakPolarHBondContact O-CB 3.49Å; V1097-H1101 PolarHBondContact O-CD2 3.48Å; V1097-H1101 VanDerWaalsContact O-CD2 3.29Å; V1097-H1101 PolarHBondContact O-N 3.1Å; A1098-H1101 CarbonylContact O-C 3.57Å; A1098-H1101 PolarHBondContact O-N 2.94Å; H1099-H1101 VanDerWaalsContact C-N 3.26Å; H1099-H1101 PolarHBondContact O-N 3.28Å; H1101-V1103 PolarHBondContact O-N 2.9Å; H1101-Y1104 PolarHBondContact O-N 3.23Å; H1101-W1105 PolarHBondContact O-N 3.01Å; H1101-W1105 VanDerWaalsContact O-N 3.1Å; H1101-F1108 HydrophobicContact CB-CD2 3.69Å; H1101-F1108 HydrophobicContact CB-CE2 3.76Å
1102	S	96.6	Very high	93.4	Very high	42 Å²	42	60.8 Å²	60.8	29%	0.294	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.5	179.7	66.9	0	0	0	0	116.1	A1098 H1099 Y1104 F1108	A1098-S1102 PolarHBondContact O-N 3.19Å; H1099-S1102 WeakPolarHBondContact O-CB 3.21Å; H1099-S1102 PolarHBondContact O-N 3.09Å; H1099-S1102 PolarHBondContact O-OG 2.8Å; S1102-Y1104 VanDerWaalsContact C-N 3.34Å; S1102-F1108 VanDerWaalsContact CB-O 3.26Å; S1102-F1108 WeakPolarHBondContact CB-O 3.24Å
1103	V	95.1	Very high	93	Very high	117 Å²	117	57.6 Å²	57.6	71%	0.709	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-19.1	175.7	-177.7	0	0	0	0	112.1	H1101	H1101-V1103 PolarHBondContact O-N 2.9Å
1104	Y	96.4	Very high	92.4	Very high	80 Å²	80	61.1 Å²	61.1	31%	0.314	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-25.9	-170.4	-49.6	-89.2	0	0	0	113.4	I942 E948 H1101 S1102	I942-Y1104 HydrophobicContact CD1-CE2 3.77Å; I942-Y1104 VanDerWaalsContact CD1-OH 3.31Å; I942-Y1104 WeakPolarHBondContact CD1-OH 3.19Å; E948-Y1104 HydrophobicContact CB-CE1 4.29Å; E948-Y1104 HydrophobicContact CG-CE1 3.82Å; E948-Y1104 WeakPolarHBondContact O-CD1 3.49Å; E948-Y1104 PolarHBondContact OE1-OH 3.28Å; H1101-Y1104 PolarHBondContact O-N 3.23Å; S1102-Y1104 VanDerWaalsContact C-N 3.34Å
1105	W	97	Very high	91.9	Very high	13 Å²	13	68.1 Å²	68.1	5%	0.049	36%	0.361	C	S	.	.			trans	-124.7	123.6	-174.1	-61.3	93.4	0	0	0	111.3	L920 G949 Y950 V978 E981 F982 H1101 S1107 F1108	L920-W1105 HydrophobicContact CD1-CZ2 4.01Å; L920-W1105 HydrophobicContact CD2-CH2 4.01Å; L920-W1105 HydrophobicContact CD2-CZ2 4.26Å; G949-W1105 PolarHBondContact O-NE1 3.42Å; Y950-W1105 HydrophobicContact CD1-CH2 4.43Å; Y950-W1105 HydrophobicContact CD1-CZ2 4.24Å; Y950-W1105 HydrophobicContact CE1-CH2 4.26Å; Y950-W1105 HydrophobicContact CE1-CZ2 4.35Å; V978-W1105 HydrophobicContact CG1-CD2 3.85Å; V978-W1105 HydrophobicContact CG1-CE3 3.8Å; V978-W1105 HydrophobicContact CG1-CH2 3.88Å; V978-W1105 HydrophobicContact CG1-CZ2 3.92Å; V978-W1105 HydrophobicContact CG1-CZ3 3.82Å; V978-W1105 HydrophobicContact CG2-CD2 4.28Å; V978-W1105 HydrophobicContact CG2-CG 4.31Å; E981-W1105 HydrophobicContact CB-CE3 4.15Å; E981-W1105 HydrophobicContact CB-CZ3 4.34Å; E981-W1105 HydrophobicContact CG-CE3 3.93Å; E981-W1105 HydrophobicContact CG-CZ3 4.21Å; F982-W1105 HydrophobicContact CB-CH2 3.79Å; F982-W1105 HydrophobicContact CB-CZ3 3.76Å; F982-W1105 AromaticContact CD2-CH2 3.79Å; F982-W1105 HydrophobicContact CD2-CH2 3.79Å; F982-W1105 HydrophobicContact CD2-CZ3 4.4Å; F982-W1105 HydrophobicContact CG-CH2 4.1Å; H1101-W1105 PolarHBondContact O-N 3.01Å; H1101-W1105 VanDerWaalsContact O-N 3.1Å; W1105-S1107 PolarHBondContact O-N 3.48Å; W1105-F1108 HydrophobicContact CB-CD2 3.87Å; W1105-F1108 HydrophobicContact CB-CE2 4.19Å; W1105-F1108 HydrophobicContact CG-CE2 4.47Å; W1105-F1108 PolarHBondContact O-N 2.94Å; W1105-F1108 VanDerWaalsContact O-N 3.14Å
1106	T	95.4	Very high	91.6	Very high	98 Å²	98	68.4 Å²	68.4	60%	0.601	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-69.1	-22.5	-179.4	63.4	0	0	0	0	112.6	E981 F1108 S1109	E981-T1106 VanDerWaalsContact CD-N 3.31Å; E981-T1106 WeakPolarHBondContact OE1-CB 3.42Å; E981-T1106 PolarHBondContact OE1-N 2.84Å; E981-T1106 PolarHBondContact OE1-OG1 2.8Å; E981-T1106 PolarHBondContact OE2-N 3.22Å; E981-T1106 PolarHBondContact OE2-OG1 3.34Å; T1106-F1108 PolarHBondContact O-N 2.92Å; T1106-F1108 VanDerWaalsContact O-N 3.09Å; T1106-S1109 VanDerWaalsContact O-CB 3.3Å; T1106-S1109 WeakPolarHBondContact O-CB 3.42Å; T1106-S1109 PolarHBondContact O-N 3.17Å; T1106-S1109 PolarHBondContact O-OG 3.44Å
1107	S	91.5	Very high	91.4	Very high	41 Å²	41	64.3 Å²	64.3	29%	0.287	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-56.3	-20.8	169.3	68.9	0	0	0	0	114.2	E981 W1105	E981-S1107 WeakPolarHBondContact OE2-CB 3.45Å; E981-S1107 PolarHBondContact OE2-N 2.92Å; W1105-S1107 PolarHBondContact O-N 3.48Å
1108	F	93.5	Very high	91.1	Very high	9 Å²	9	66.4 Å²	66.4	4%	0.039	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-115	14.2	179	-50.8	-37	0	0	0	112.8	L973 I974 V978 A1098 H1101 S1102 W1105 T1106 N1110 I1112	L973-F1108 WeakPolarHBondContact O-CE1 3.5Å; I974-F1108 HydrophobicContact CB-CZ 4.47Å; I974-F1108 HydrophobicContact CD1-CE1 3.97Å; I974-F1108 HydrophobicContact CD1-CE2 4.43Å; I974-F1108 HydrophobicContact CD1-CZ 3.68Å; I974-F1108 HydrophobicContact CG2-CZ 4.2Å; V978-F1108 HydrophobicContact CG2-CE1 4.27Å; V978-F1108 HydrophobicContact CG2-CE2 3.58Å; V978-F1108 HydrophobicContact CG2-CZ 3.32Å; A1098-F1108 HydrophobicContact CB-CD1 3.98Å; A1098-F1108 HydrophobicContact CB-CD2 4.48Å; A1098-F1108 HydrophobicContact CB-CE1 4.33Å; A1098-F1108 HydrophobicContact CB-CG 4.08Å; H1101-F1108 HydrophobicContact CB-CD2 3.69Å; H1101-F1108 HydrophobicContact CB-CE2 3.76Å; S1102-F1108 VanDerWaalsContact CB-O 3.26Å; S1102-F1108 WeakPolarHBondContact CB-O 3.24Å; W1105-F1108 HydrophobicContact CB-CD2 3.87Å; W1105-F1108 HydrophobicContact CB-CE2 4.19Å; W1105-F1108 HydrophobicContact CG-CE2 4.47Å; W1105-F1108 PolarHBondContact O-N 2.94Å; W1105-F1108 VanDerWaalsContact O-N 3.14Å; T1106-F1108 PolarHBondContact O-N 2.92Å; T1106-F1108 VanDerWaalsContact O-N 3.09Å; F1108-N1110 VanDerWaalsContact C-N 3.29Å; F1108-N1110 PolarHBondContact O-N 2.86Å; F1108-I1112 HydrophobicContact CD1-CD1 4.23Å
1109	S	83.2	Confident	90.9	Very high	79 Å²	79	68.3 Å²	68.3	55%	0.552	37%	0.365	S	S	*	.	S	Bend	trans	-71	-23.7	-179.1	61.1	0	0	0	0	113.9	T1106	T1106-S1109 VanDerWaalsContact O-CB 3.3Å; T1106-S1109 WeakPolarHBondContact O-CB 3.42Å; T1106-S1109 PolarHBondContact O-N 3.17Å; T1106-S1109 PolarHBondContact O-OG 3.44Å
1110	N	82.1	Confident	90.9	Very high	85 Å²	85	63.2 Å²	63.2	46%	0.455	34%	0.344	S	S	.	.	S	Bend	trans	-99.8	147.6	168.1	-64.5	-45.6	0	0	0	109.5	F1108 I1112 I1146	F1108-N1110 VanDerWaalsContact C-N 3.29Å; F1108-N1110 PolarHBondContact O-N 2.86Å; N1110-I1112 PolarHBondContact O-N 2.66Å; N1110-I1146 HydrophobicContact CB-CD1 3.66Å; N1110-I1146 WeakPolarHBondContact ND2-CD1 3.5Å
1111	E	80.6	Confident	90.9	Very high	187 Å²	187	60.8 Å²	60.8	87%	0.874	33%	0.332	S	S	*	.			trans	-64.5	125.8	173.8	-172.1	164.8	-154.4	0	0	110.1	D1113	E1111-D1113 PolarHBondContact O-N 3.24Å
1112	I	85.7	Confident	90.7	Very high	32 Å²	32	63.3 Å²	63.3	16%	0.164	35%	0.349	C	S	.	.			trans	-70.1	113.3	179.9	-60.3	-178.7	0	0	0	108	L973 L1095 A1098 F1108 N1110 T1114 Y1116 A1117	L973-I1112 HydrophobicContact CD2-CG2 3.93Å; L1095-I1112 HydrophobicContact CD2-CB 3.76Å; L1095-I1112 HydrophobicContact CD2-CG2 3.93Å; A1098-I1112 HydrophobicContact CB-CD1 3.51Å; A1098-I1112 HydrophobicContact CB-CG1 4.48Å; F1108-I1112 HydrophobicContact CD1-CD1 4.23Å; N1110-I1112 PolarHBondContact O-N 2.66Å; I1112-T1114 PolarHBondContact O-N 2.72Å; I1112-Y1116 HydrophobicContact CG2-CD1 4.12Å; I1112-A1117 HydrophobicContact CG2-CB 4.21Å
1113	D	86	Confident	90.5	Very high	72 Å²	72	64.7 Å²	64.7	39%	0.385	36%	0.359	S	S	.	.			trans	-56.4	134.3	177.4	163.9	46.1	0	0	0	111.7	E1111 Q1115 Y1116 A1117	E1111-D1113 PolarHBondContact O-N 3.24Å; D1113-Q1115 VanDerWaalsContact C-N 3.27Å; D1113-Q1115 VanDerWaalsContact CG-N 3.28Å; D1113-Q1115 PolarHBondContact O-N 3.47Å; D1113-Q1115 PolarHBondContact OD1-N 2.99Å; D1113-Q1115 VanDerWaalsContact OD1-N 3.08Å; D1113-Q1115 WeakPolarHBondContact OD2-CA 3.17Å; D1113-Q1115 WeakPolarHBondContact OD2-CB 3.22Å; D1113-Q1115 PolarHBondContact OD2-N 2.81Å; D1113-Q1115 VanDerWaalsContact OD2-N 3.12Å; D1113-Y1116 PolarHBondContact O-N 3.04Å; D1113-Y1116 PolarHBondContact OD2-N 2.89Å; D1113-A1117 WeakPolarHBondContact O-CB 3.39Å; D1113-A1117 PolarHBondContact O-N 3.32Å
1114	T	84.3	Confident	90.3	Very high	90 Å²	90	61.8 Å²	61.8	55%	0.552	34%	0.335	S	S	*	.	H	α-helix	trans	-52.2	-35.3	173.7	56.3	0	0	0	0	114.8	I1112 S1118	I1112-T1114 PolarHBondContact O-N 2.72Å; T1114-S1118 WeakPolarHBondContact O-CB 3.43Å; T1114-S1118 PolarHBondContact O-N 2.74Å; T1114-S1118 PolarHBondContact O-OG 3.35Å
1115	Q	87	Confident	90	Very high	148 Å²	148	58.7 Å²	58.7	69%	0.692	32%	0.324	S	S	*	.	H	α-helix	trans	-73.7	-48	178.5	-43	-177.5	18.5	0	0	110.2	D1113 A1117 S1118 M1119	D1113-Q1115 VanDerWaalsContact C-N 3.27Å; D1113-Q1115 VanDerWaalsContact CG-N 3.28Å; D1113-Q1115 PolarHBondContact O-N 3.47Å; D1113-Q1115 PolarHBondContact OD1-N 2.99Å; D1113-Q1115 VanDerWaalsContact OD1-N 3.08Å; D1113-Q1115 WeakPolarHBondContact OD2-CA 3.17Å; D1113-Q1115 WeakPolarHBondContact OD2-CB 3.22Å; D1113-Q1115 PolarHBondContact OD2-N 2.81Å; D1113-Q1115 VanDerWaalsContact OD2-N 3.12Å; Q1115-A1117 VanDerWaalsContact C-N 3.3Å; Q1115-A1117 PolarHBondContact O-N 3.32Å; Q1115-S1118 PolarHBondContact O-N 3.26Å; Q1115-M1119 PolarHBondContact O-N 2.91Å; Q1115-M1119 VanDerWaalsContact O-N 3.13Å
1116	Y	89.7	Confident	89	Confident	58 Å²	58	59.7 Å²	59.7	23%	0.227	33%	0.332	C	S	.	.	H	α-helix	trans	-58.1	-42.2	171.2	-179.8	-110.6	0	0	0	111.6	R972 L973 I1112 D1113 S1118 M1119 T1142	R972-Y1116 VanDerWaalsContact CG-OH 3.31Å; R972-Y1116 WeakPolarHBondContact CG-OH 3.5Å; R972-Y1116 VanDerWaalsContact CZ-O 3.27Å; R972-Y1116 PolarHBondContact NH1-O 3.33Å; R972-Y1116 PolarHBondContact NH2-O 3.45Å; L973-Y1116 HydrophobicContact CD2-CD1 3.79Å; L973-Y1116 HydrophobicContact CD2-CE1 3.55Å; I1112-Y1116 HydrophobicContact CG2-CD1 4.12Å; D1113-Y1116 PolarHBondContact O-N 3.04Å; D1113-Y1116 PolarHBondContact OD2-N 2.89Å; Y1116-S1118 PolarHBondContact O-N 3.49Å; Y1116-M1119 HydrophobicContact CD2-CE 3.65Å; Y1116-M1119 HydrophobicContact CD2-SD 4.4Å; Y1116-M1119 HydrophobicContact CE2-CE 3.5Å; Y1116-M1119 WeakPolarHBondContact O-CB 3.32Å; Y1116-M1119 PolarHBondContact O-N 3.14Å; Y1116-T1142 HydrophobicContact CE1-CG2 4.48Å; Y1116-T1142 HydrophobicContact CE2-CG2 4.18Å
1117	A	91	Very high	87.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-57.4	-52.4	177.1	0	0	0	0	0	111.3	R972 L973 I1091 L1095 I1112 D1113 Q1115 M1119	R972-A1117 PolarHBondContact NH2-O 3.34Å; L973-A1117 HydrophobicContact CD1-CB 4.2Å; I1091-A1117 VanDerWaalsContact CD1-O 3.26Å; I1091-A1117 WeakPolarHBondContact CD1-O 3.49Å; I1091-A1117 HydrophobicContact CG2-CB 3.86Å; L1095-A1117 HydrophobicContact CD2-CB 4.23Å; I1112-A1117 HydrophobicContact CG2-CB 4.21Å; D1113-A1117 WeakPolarHBondContact O-CB 3.39Å; D1113-A1117 PolarHBondContact O-N 3.32Å; Q1115-A1117 VanDerWaalsContact C-N 3.3Å; Q1115-A1117 PolarHBondContact O-N 3.32Å; A1117-M1119 PolarHBondContact O-N 3.41Å; A1117-M1119 VanDerWaalsContact O-N 3.15Å
1118	S	91.9	Very high	85.9	Confident	46 Å²	46	59.4 Å²	59.4	32%	0.322	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	0.9	-178.2	-47.7	0	0	0	0	114.7	V1085 T1114 Q1115 Y1116	V1085-S1118 WeakPolarHBondContact CG1-O 3.5Å; T1114-S1118 WeakPolarHBondContact O-CB 3.43Å; T1114-S1118 PolarHBondContact O-N 2.74Å; T1114-S1118 PolarHBondContact O-OG 3.35Å; Q1115-S1118 PolarHBondContact O-N 3.26Å; Y1116-S1118 PolarHBondContact O-N 3.49Å
1119	M	93.2	Very high	83.5	Confident	44 Å²	44	67.8 Å²	67.8	22%	0.217	36%	0.363	C	S	.	.			trans	-65.9	129.1	-174.8	-174.9	174.7	64	0	0	112.3	R972 Q1115 Y1116 A1117 S1123 W1124	R972-M1119 PolarHBondContact NH2-O 3.32Å; Q1115-M1119 PolarHBondContact O-N 2.91Å; Q1115-M1119 VanDerWaalsContact O-N 3.13Å; Y1116-M1119 HydrophobicContact CD2-CE 3.65Å; Y1116-M1119 HydrophobicContact CD2-SD 4.4Å; Y1116-M1119 HydrophobicContact CE2-CE 3.5Å; Y1116-M1119 WeakPolarHBondContact O-CB 3.32Å; Y1116-M1119 PolarHBondContact O-N 3.14Å; A1117-M1119 PolarHBondContact O-N 3.41Å; A1117-M1119 VanDerWaalsContact O-N 3.15Å; M1119-S1123 WeakPolarHBondContact CG-OG 3.44Å; M1119-S1123 PolarHBondContact SD-OG 3.07Å; M1119-W1124 HydrophobicContact CE-CB 3.93Å; M1119-W1124 HydrophobicContact CE-CG 4.07Å
1120	P	95.6	Very high	81.8	Confident	32 Å²	32	67.3 Å²	67.3	21%	0.208	36%	0.355	C	S	.	.			trans	-65.8	171.6	178.5	29.9	-37	0	0	0	112.2	L1082 S1123 W1124	L1082-P1120 WeakPolarHBondContact O-CB 3.39Å; P1120-S1123 PolarHBondContact O-OG 3.44Å; P1120-W1124 PolarHBondContact O-NE1 2.84Å
1121	A	95	Very high	79.8	Confident	4 Å²	4	69.2 Å²	69.2	3%	0.033	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-75	-33	-178	0	0	0	0	0	113.9	L968 L1082 S1123 W1124 L1125	L968-A1121 HydrophobicContact CD1-CB 3.93Å; L1082-A1121 HydrophobicContact CD2-CB 3.91Å; L1082-A1121 WeakPolarHBondContact O-CA 3.28Å; L1082-A1121 PolarHBondContact O-N 3.41Å; A1121-S1123 PolarHBondContact O-N 3.31Å; A1121-S1123 VanDerWaalsContact O-N 3.12Å; A1121-W1124 PolarHBondContact O-N 2.85Å; A1121-L1125 VanDerWaalsContact O-CB 3.27Å; A1121-L1125 WeakPolarHBondContact O-CB 3.41Å; A1121-L1125 PolarHBondContact O-N 3.18Å
1122	S	93.5	Very high	77.8	Confident	52 Å²	52	64 Å²	64	36%	0.364	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-62.8	-16.2	-177	51.9	0	0	0	0	115.6	L1082 D1083	L1082-S1122 PolarHBondContact O-N 3.25Å; L1082-S1122 PolarHBondContact O-OG 2.88Å; D1083-S1122 WeakPolarHBondContact OD1-CB 3.44Å; D1083-S1122 PolarHBondContact OD1-OG 3.48Å
1123	S	91.8	Very high	75.9	Confident	71 Å²	71	66.2 Å²	66.2	50%	0.497	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-92.8	-9.5	179.8	63.1	0	0	0	0	114.9	M1119 P1120 A1121	M1119-S1123 WeakPolarHBondContact CG-OG 3.44Å; M1119-S1123 PolarHBondContact SD-OG 3.07Å; P1120-S1123 PolarHBondContact O-OG 3.44Å; A1121-S1123 PolarHBondContact O-N 3.31Å; A1121-S1123 VanDerWaalsContact O-N 3.12Å
1124	W	91.3	Very high	74.2	Confident	56 Å²	56	63.9 Å²	63.9	21%	0.212	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.8	-24.3	-177	72.1	-90.7	0	0	0	114.8	L968 R972 L976 L1019 M1119 P1120 A1121	L968-W1124 HydrophobicContact CB-CZ2 4.25Å; L968-W1124 WeakPolarHBondContact O-CZ2 3.3Å; R972-W1124 HydrophobicContact CB-CD2 4.45Å; R972-W1124 HydrophobicContact CB-CH2 4Å; R972-W1124 HydrophobicContact CB-CZ2 3.74Å; R972-W1124 HydrophobicContact CB-CZ3 4.46Å; R972-W1124 HydrophobicContact CG-CD2 4.36Å; R972-W1124 VanDerWaalsContact NE-NE1 3.19Å; L976-W1124 HydrophobicContact CD1-CZ3 4.44Å; L1019-W1124 HydrophobicContact CD1-CH2 4.05Å; L1019-W1124 HydrophobicContact CD1-CZ3 4.39Å; L1019-W1124 HydrophobicContact CD2-CZ3 4.24Å; M1119-W1124 HydrophobicContact CE-CB 3.93Å; M1119-W1124 HydrophobicContact CE-CG 4.07Å; P1120-W1124 PolarHBondContact O-NE1 2.84Å; A1121-W1124 PolarHBondContact O-N 2.85Å
1125	L	89.9	Confident	71.9	Confident	16 Å²	16	66.7 Å²	66.7	8%	0.084	36%	0.361	C	S	.	.	S	Bend	trans	-76.3	132.7	176.2	-164.8	70.6	0	0	0	109.3	W1015 L1019 L1077 L1082 A1121	W1015-L1125 HydrophobicContact CD2-CD2 4.06Å; W1015-L1125 HydrophobicContact CE3-CD1 3.88Å; W1015-L1125 HydrophobicContact CE3-CD2 3.89Å; W1015-L1125 HydrophobicContact CE3-CG 3.97Å; W1015-L1125 HydrophobicContact CZ3-CD1 4.18Å; W1015-L1125 HydrophobicContact CZ3-CD2 4.22Å; W1015-L1125 HydrophobicContact CZ3-CG 3.98Å; L1019-L1125 HydrophobicContact CD1-CD1 4.01Å; L1019-L1125 HydrophobicContact CD2-CD1 4.09Å; L1019-L1125 HydrophobicContact CG-CD1 4.39Å; L1077-L1125 HydrophobicContact CD1-CD2 3.47Å; L1077-L1125 VanDerWaalsContact CD1-CD2 3.47Å; L1082-L1125 HydrophobicContact CD2-CD2 3.97Å; A1121-L1125 VanDerWaalsContact O-CB 3.27Å; A1121-L1125 WeakPolarHBondContact O-CB 3.41Å; A1121-L1125 PolarHBondContact O-N 3.18Å
1126	P	77.1	Confident	69.9	Low	33 Å²	33	60.9 Å²	60.9	21%	0.214	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-58.6	148.9	176.7	-23	32.7	0	0	0	112.2	W1015 D1130 I1134	W1015-P1126 WeakPolarHBondContact CH2-O 3.45Å; P1126-D1130 HydrophobicContact CB-CB 4.32Å; P1126-I1134 HydrophobicContact CG-CD1 4.43Å; P1126-I1134 HydrophobicContact CG-CG1 4.13Å; P1126-I1134 HydrophobicContact CG-CG2 3.89Å
1127	T	65.1	Low	67.3	Low	79 Å²	79	66.5 Å²	66.5	49%	0.485	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-74.5	158.5	172.7	76.9	0	0	0	0	110.3	F1129 D1130	T1127-F1129 PolarHBondContact O-N 2.73Å; T1127-F1129 VanDerWaalsContact O-N 3.15Å; T1127-F1129 PolarHBondContact OG1-N 3.27Å; T1127-D1130 WeakPolarHBondContact CA-OD2 3.29Å; T1127-D1130 VanDerWaalsContact CB-OD2 3.29Å; T1127-D1130 WeakPolarHBondContact CB-OD2 3.35Å; T1127-D1130 PolarHBondContact N-OD2 2.93Å; T1127-D1130 WeakPolarHBondContact O-CB 3.24Å; T1127-D1130 PolarHBondContact O-N 2.84Å; T1127-D1130 VanDerWaalsContact O-N 3.08Å; T1127-D1130 VanDerWaalsContact OG1-CG 3.3Å; T1127-D1130 PolarHBondContact OG1-N 3.25Å; T1127-D1130 PolarHBondContact OG1-OD2 3.26Å
1128	I	56.8	Low	64.5	Low	55 Å²	55	70.4 Å²	70.4	28%	0.282	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.9	177.5	-63	162.6	0	0	0	111.8	W1015 P1076	W1015-I1128 HydrophobicContact CZ2-CG1 3.85Å; P1076-I1128 HydrophobicContact CB-CD1 3.63Å
1129	F	41.6	Very low	62	Low	184 Å²	184	71 Å²	71	81%	0.807	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-10.1	-179.5	-54.9	-69.2	0	0	0	113.3	T1127 N1131	T1127-F1129 PolarHBondContact O-N 2.73Å; T1127-F1129 VanDerWaalsContact O-N 3.15Å; T1127-F1129 PolarHBondContact OG1-N 3.27Å; F1129-N1131 PolarHBondContact O-N 3.27Å
1130	D	49.4	Very low	59	Low	70 Å²	70	72.3 Å²	72.3	37%	0.374	39%	0.394	S	S	.	.			trans	-73.1	80.4	168.9	-66	-60.4	0	0	0	109.2	P1126 T1127 S1132	P1126-D1130 HydrophobicContact CB-CB 4.32Å; T1127-D1130 WeakPolarHBondContact CA-OD2 3.29Å; T1127-D1130 VanDerWaalsContact CB-OD2 3.29Å; T1127-D1130 WeakPolarHBondContact CB-OD2 3.35Å; T1127-D1130 PolarHBondContact N-OD2 2.93Å; T1127-D1130 WeakPolarHBondContact O-CB 3.24Å; T1127-D1130 PolarHBondContact O-N 2.84Å; T1127-D1130 VanDerWaalsContact O-N 3.08Å; T1127-D1130 VanDerWaalsContact OG1-CG 3.3Å; T1127-D1130 PolarHBondContact OG1-N 3.25Å; T1127-D1130 PolarHBondContact OG1-OD2 3.26Å; D1130-S1132 PolarHBondContact O-N 3.17Å
1131	N	39.9	Very low	55.8	Low	125 Å²	125	72.6 Å²	72.6	67%	0.668	40%	0.397	S	S	*	.			trans	-73.5	1.7	171.2	-81.2	-19.4	0	0	0	113.1	R1056 F1129	R1056-N1131 PolarHBondContact NH2-OD1 2.95Å; F1129-N1131 PolarHBondContact O-N 3.27Å
1132	S	37.2	Very low	53.1	Low	77 Å²	77	74.4 Å²	74.4	54%	0.538	41%	0.407	S	S	.	.	S	Bend	trans	-60.1	143.7	159	37.7	0	0	0	0	110.3	D1130	D1130-S1132 PolarHBondContact O-N 3.17Å
1133	S	46.9	Very low	50.3	Low	79 Å²	79	76.3 Å²	76.3	55%	0.552	42%	0.417	S	S	*	.			trans	-50.7	142.7	166	48	0	0	0	0	110.2	E1135	S1133-E1135 VanDerWaalsContact C-N 3.27Å; S1133-E1135 PolarHBondContact O-N 2.9Å
1134	I	50.5	Low	47.3	Very low	22 Å²	22	80.9 Å²	80.9	11%	0.113	43%	0.43	C	S	.	.			trans	-66.5	86.8	-174.4	-64.2	179.4	0	0	0	111.4	R1018 I1022 R1024 P1126 I1136	R1018-I1134 HydrophobicContact CG-CD1 3.74Å; R1018-I1134 VanDerWaalsContact NE-CD1 3.28Å; I1022-I1134 HydrophobicContact CG2-CB 4Å; I1022-I1134 HydrophobicContact CG2-CG2 4.2Å; R1024-I1134 PolarHBondContact NH2-O 3.4Å; P1126-I1134 HydrophobicContact CG-CD1 4.43Å; P1126-I1134 HydrophobicContact CG-CG1 4.13Å; P1126-I1134 HydrophobicContact CG-CG2 3.89Å; I1134-I1136 HydrophobicContact CG2-CG1 3.76Å; I1134-I1136 PolarHBondContact O-N 2.88Å
1135	E	36.4	Very low	44.5	Very low	149 Å²	149	85.7 Å²	85.7	70%	0.696	46%	0.455	S	S	*	.			trans	-71.2	78.8	157.2	-71.4	-171.6	-171.1	0	0	108.1	S1133 K1137	S1133-E1135 VanDerWaalsContact C-N 3.27Å; S1133-E1135 PolarHBondContact O-N 2.9Å; E1135-K1137 PolarHBondContact O-N 3.41Å
1136	I	44.7	Very low	41.7	Very low	26 Å²	26	88.9 Å²	88.9	13%	0.133	47%	0.471	C	S	.	.			trans	-49.6	103.1	144.4	-49.9	-172.1	0	0	0	105	L976 L1019 I1022 R1024 I1134 D1138 L1139	L976-I1136 HydrophobicContact CD1-CD1 4.16Å; L1019-I1136 HydrophobicContact CD2-CD1 4.47Å; I1022-I1136 HydrophobicContact CD1-CD1 3.58Å; I1022-I1136 HydrophobicContact CD1-CG1 4.13Å; R1024-I1136 VanDerWaalsContact CZ-O 3.31Å; R1024-I1136 PolarHBondContact NH1-O 3.42Å; R1024-I1136 PolarHBondContact NH2-O 2.91Å; I1134-I1136 HydrophobicContact CG2-CG1 3.76Å; I1134-I1136 PolarHBondContact O-N 2.88Å; I1136-D1138 PolarHBondContact O-N 3.38Å; I1136-L1139 HydrophobicContact CG2-CD1 3.6Å
1137	K	35	Very low	39.2	Very low	177 Å²	177	91.9 Å²	91.9	77%	0.77	49%	0.493	S	S	*	.			trans	-56.6	126	178	-74	176.1	-179.6	168.4	0	106.8	E1135 L1139	E1135-K1137 PolarHBondContact O-N 3.41Å; K1137-L1139 PolarHBondContact O-N 2.85Å
1138	D	32.3	Very low	37.3	Very low	82 Å²	82	93.8 Å²	93.8	44%	0.439	51%	0.505	S	S	.	.			trans	-23.7	116.4	-169.3	-96.1	22	0	0	0	114.5	R1024 I1136 S1140 S1141 T1142	R1024-D1138 IonicContact NH1-OD1 3.77Å; I1136-D1138 PolarHBondContact O-N 3.38Å; D1138-S1140 VanDerWaalsContact CB-OG 3.25Å; D1138-S1140 WeakPolarHBondContact CB-OG 3.41Å; D1138-S1140 PolarHBondContact O-N 2.92Å; D1138-S1140 PolarHBondContact OD2-OG 3.43Å; D1138-S1141 VanDerWaalsContact O-CA 3.32Å; D1138-S1141 WeakPolarHBondContact O-CA 3.26Å; D1138-S1141 WeakPolarHBondContact O-CB 3.39Å; D1138-S1141 PolarHBondContact O-N 2.89Å; D1138-S1141 PolarHBondContact O-OG 3.38Å; D1138-T1142 PolarHBondContact O-N 2.79Å
1139	L	38.4	Very low	35.8	Very low	57 Å²	57	97.1 Å²	97.1	30%	0.298	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-1.5	161.5	-98.8	69.3	0	0	0	111.9	P977 I1136 K1137 T1142	P977-L1139 HydrophobicContact CB-CD2 3.81Å; P977-L1139 HydrophobicContact CG-CD2 3.79Å; I1136-L1139 HydrophobicContact CG2-CD1 3.6Å; K1137-L1139 PolarHBondContact O-N 2.85Å; L1139-T1142 VanDerWaalsContact C-OG1 3.24Å; L1139-T1142 VanDerWaalsContact CA-OG1 3.25Å; L1139-T1142 WeakPolarHBondContact CA-OG1 3.36Å; L1139-T1142 PolarHBondContact O-OG1 2.91Å
1140	S	30.3	Very low	34.9	Very low	73 Å²	73	93.2 Å²	93.2	51%	0.51	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-38.7	154.6	3.3	0	0	0	0	112	D1138 T1142 T1143	D1138-S1140 VanDerWaalsContact CB-OG 3.25Å; D1138-S1140 WeakPolarHBondContact CB-OG 3.41Å; D1138-S1140 PolarHBondContact O-N 2.92Å; D1138-S1140 PolarHBondContact OD2-OG 3.43Å; S1140-T1142 VanDerWaalsContact C-N 3.34Å; S1140-T1143 WeakPolarHBondContact O-CB 3.36Å; S1140-T1143 PolarHBondContact O-N 3.37Å; S1140-T1143 PolarHBondContact O-OG1 3.35Å
1141	S	29.2	Very low	34	Very low	37 Å²	37	95.2 Å²	95.2	26%	0.259	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-79.6	-9.7	178.7	77.4	0	0	0	0	114.2	D1138 T1143 E1144 H1145	D1138-S1141 VanDerWaalsContact O-CA 3.32Å; D1138-S1141 WeakPolarHBondContact O-CA 3.26Å; D1138-S1141 WeakPolarHBondContact O-CB 3.39Å; D1138-S1141 PolarHBondContact O-N 2.89Å; D1138-S1141 PolarHBondContact O-OG 3.38Å; S1141-T1143 PolarHBondContact O-N 2.96Å; S1141-T1143 VanDerWaalsContact O-N 3.16Å; S1141-E1144 PolarHBondContact O-N 3.36Å; S1141-H1145 PolarHBondContact O-N 3.44Å
1142	T	37.3	Very low	33.3	Very low	42 Å²	42	97.3 Å²	97.3	26%	0.258	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-64.1	-5.3	156.9	30.5	0	0	0	0	113.2	Y1116 D1138 L1139 S1140 I1146	Y1116-T1142 HydrophobicContact CE1-CG2 4.48Å; Y1116-T1142 HydrophobicContact CE2-CG2 4.18Å; D1138-T1142 PolarHBondContact O-N 2.79Å; L1139-T1142 VanDerWaalsContact C-OG1 3.24Å; L1139-T1142 VanDerWaalsContact CA-OG1 3.25Å; L1139-T1142 WeakPolarHBondContact CA-OG1 3.36Å; L1139-T1142 PolarHBondContact O-OG1 2.91Å; S1140-T1142 VanDerWaalsContact C-N 3.34Å; T1142-I1146 WeakPolarHBondContact O-CD1 3.47Å; T1142-I1146 VanDerWaalsContact O-CG1 3.28Å; T1142-I1146 WeakPolarHBondContact O-CG1 3.47Å
1143	T	35.1	Very low	33.1	Very low	93 Å²	93	100 Å²	100	57%	0.571	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-76.1	-29.1	162.1	-41.9	0	0	0	0	112.5	S1140 S1141	S1140-T1143 WeakPolarHBondContact O-CB 3.36Å; S1140-T1143 PolarHBondContact O-N 3.37Å; S1140-T1143 PolarHBondContact O-OG1 3.35Å; S1141-T1143 PolarHBondContact O-N 2.96Å; S1141-T1143 VanDerWaalsContact O-N 3.16Å
1144	E	28.5	Very low	32.1	Very low	166 Å²	166	101.8 Å²	101.8	78%	0.776	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-30.4	-179.6	-62.7	-165.6	144.6	0	0	112.7	S1141 I1146	S1141-E1144 PolarHBondContact O-N 3.36Å; E1144-I1146 PolarHBondContact O-N 3.48Å
1145	H	31.6	Very low	31	Very low	157 Å²	157	107 Å²	107	73%	0.727	61%	0.605	S	S	*	*	S	Bend	trans	-74.7	1.3	172.5	-90.4	-75.4	0	0	0	114.5	S1141 S1147	S1141-H1145 PolarHBondContact O-N 3.44Å; H1145-S1147 PolarHBondContact O-N 3.36Å
1146	I	32.1	Very low	30.7	Very low	83 Å²	83	108 Å²	108	43%	0.426	61%	0.614	S	S	.	*			trans	-77.7	69.1	163.7	-63.2	160.7	0	0	0	108.1	N1110 T1142 E1144 V1148	N1110-I1146 HydrophobicContact CB-CD1 3.66Å; N1110-I1146 WeakPolarHBondContact ND2-CD1 3.5Å; T1142-I1146 WeakPolarHBondContact O-CD1 3.47Å; T1142-I1146 VanDerWaalsContact O-CG1 3.28Å; T1142-I1146 WeakPolarHBondContact O-CG1 3.47Å; E1144-I1146 PolarHBondContact O-N 3.48Å; I1146-V1148 PolarHBondContact O-N 2.92Å
1147	S	24.5	Very low	29.9	Very low	96 Å²	96	112.3 Å²	112.3	67%	0.671	65%	0.647	S	S	*	*			trans	-79.1	89.9	-174.9	60.4	0	0	0	0	111.7	H1145 V1149	H1145-S1147 PolarHBondContact O-N 3.36Å; S1147-V1149 PolarHBondContact O-N 3.28Å
1148	V	24.6	Very low	29.6	Very low	120 Å²	120	107.8 Å²	107.8	73%	0.727	64%	0.642	S	S	*	*			trans	-9.4	102.5	167.6	-173.7	0	0	0	0	115.9	I1146 S1150	I1146-V1148 PolarHBondContact O-N 2.92Å; V1148-S1150 VanDerWaalsContact CG1-OG 3.3Å; V1148-S1150 WeakPolarHBondContact CG1-OG 3.34Å; V1148-S1150 PolarHBondContact O-N 3.38Å
1149	V	26.4	Very low	29.6	Very low	125 Å²	125	111.3 Å²	111.3	76%	0.758	66%	0.661	S	S	*	*			trans	-81.8	88.7	161.2	-179.9	0	0	0	0	108.9	S1147 T1151	S1147-V1149 PolarHBondContact O-N 3.28Å; V1149-T1151 HydrophobicContact CG1-CG2 4.32Å; V1149-T1151 PolarHBondContact O-N 2.86Å; V1149-T1151 VanDerWaalsContact O-N 3.14Å
1150	S	23.4	Very low	29.4	Very low	101 Å²	101	117.6 Å²	117.6	71%	0.706	69%	0.686	S	S	*	*			trans	-73.9	97.5	176.1	-80.9	0	0	0	0	111.8	V1148	V1148-S1150 VanDerWaalsContact CG1-OG 3.3Å; V1148-S1150 WeakPolarHBondContact CG1-OG 3.34Å; V1148-S1150 PolarHBondContact O-N 3.38Å
1151	T	29.4	Very low	29.5	Very low	113 Å²	113	125.2 Å²	125.2	69%	0.693	70%	0.703	S	S	*	*			trans	-114.2	125.9	163.9	52.7	0	0	0	0	110.9	V1149 V1153	V1149-T1151 HydrophobicContact CG1-CG2 4.32Å; V1149-T1151 PolarHBondContact O-N 2.86Å; V1149-T1151 VanDerWaalsContact O-N 3.14Å; T1151-V1153 PolarHBondContact O-N 3.47Å
1152	N	25.8	Very low	29.5	Very low	168 Å²	168	132.7 Å²	132.7	90%	0.898	73%	0.732	S	S	*	*			trans	-70.6	108.2	-167.4	-63.4	-56.9	0	0	0	113.6
1153	V	31.6	Very low	29.3	Very low	133 Å²	133	138.7 Å²	138.7	81%	0.806	76%	0.761	S	S	*	*			trans	-134.2	146.9	164.4	-171.3	0	0	0	0	109.8	T1151	T1151-V1153 PolarHBondContact O-N 3.47Å
1154	T	27.9	Very low	29.1	Very low	118 Å²	118	142.4 Å²	142.4	72%	0.724	77%	0.769	S	S	*	*			trans	-73.3	146.4	-165.4	34.2	0	0	0	0	115.2	L1156	T1154-L1156 PolarHBondContact O-N 3.45Å; T1154-L1156 VanDerWaalsContact O-N 3.09Å
1155	P	27.4	Very low	29.1	Very low	131 Å²	131	139.5 Å²	139.5	85%	0.851	77%	0.767	S	S	*	*			trans	-79.3	94.3	-175.7	31.9	-35.6	0	0	0	112.6
1156	L	29	Very low	29.2	Very low	169 Å²	169	139.8 Å²	139.8	89%	0.885	77%	0.773	S	S	*	*			trans	-83.6	128.6	172.6	-105.4	160	0	0	0	111.8	T1154	T1154-L1156 PolarHBondContact O-N 3.45Å; T1154-L1156 VanDerWaalsContact O-N 3.09Å
1157	S	28.8	Very low	29.1	Very low	118 Å²	118	142.8 Å²	142.8	83%	0.825	79%	0.789	S	S	*	*			trans	-93.4	117.1	-163.8	57.6	0	0	0	0	114.4
1158	A	28.3	Very low	29.4	Very low	82 Å²	82	147.8 Å²	147.8	68%	0.678	80%	0.798	S	S	*	*			trans	-143.1	159	166.2	0	0	0	0	0	112.7	K1160	A1158-K1160 VanDerWaalsContact C-N 3.32Å; A1158-K1160 PolarHBondContact O-N 2.83Å
1159	N	33.1	Very low	29.8	Very low	156 Å²	156	149.8 Å²	149.8	83%	0.834	80%	0.8	S	S	*	*			trans	57.5	7.8	163	-64	-14	0	0	0	121.5	R1161	N1159-R1161 PolarHBondContact O-N 3.28Å
1160	K	32.9	Very low	30	Very low	188 Å²	188	149.9 Å²	149.9	82%	0.817	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	31.4	162.2	-103.7	177.2	-178.8	170.6	0	114.5	A1158	A1158-K1160 VanDerWaalsContact C-N 3.32Å; A1158-K1160 PolarHBondContact O-N 2.83Å
1161	R	31.8	Very low	30.5	Very low	233 Å²	233	150.9 Å²	150.9	88%	0.879	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-12.2	-176.4	-76.5	-171.6	179.7	167.8	1.6	115.7	N1159	N1159-R1161 PolarHBondContact O-N 3.28Å
1162	F	31	Very low	30.4	Very low	195 Å²	195	152.4 Å²	152.4	86%	0.855	81%	0.808	S	S	*	*	S	Bend	trans	-101.4	-4.5	-179.7	-128.7	-92.2	0	0	0	114.9
1163	L	32.4	Very low	30.6	Very low	167 Å²	167	151.5 Å²	151.5	87%	0.874	81%	0.809	S	S	*	*	S	Bend	trans	-120.9	31	-178.3	-86.5	165.1	0	0	0	112.7
1164	K	29.7	Very low	30.4	Very low	172 Å²	172	150.6 Å²	150.6	75%	0.748	80%	0.804	S	S	*	*	S	Bend	trans	-133.1	5.3	177.8	-86.6	-165.5	170.9	-171.3	0	115.4
1165	S	30.3	Very low	30.4	Very low	104 Å²	104	152.2 Å²	152.2	73%	0.727	81%	0.808	S	S	*	*	S	Bend	trans	-95.6	3.4	176.8	52.1	0	0	0	0	114.4
1166	L	32.3	Very low	30.6	Very low	164 Å²	164	153 Å²	153	86%	0.859	80%	0.804	S	S	*	*	S	Bend	trans	-115.2	8.5	-176.2	-133.5	75.9	0	0	0	114.3
1167	I	31.4	Very low	30.4	Very low	146 Å²	146	152.6 Å²	152.6	75%	0.749	80%	0.803	S	S	*	*	S	Bend	trans	-141.1	82.1	-176.6	-49.7	178.4	0	0	0	110.7
1168	K	29.6	Very low	30.4	Very low	201 Å²	201	153 Å²	153	87%	0.874	80%	0.8	S	S	*	*			trans	-178.5	156.3	150.5	-107.9	170.8	-178	-169.4	0	113
1169	Q	33.5	Very low	30.5	Very low	161 Å²	161	155.9 Å²	155.9	75%	0.752	80%	0.803	S	S	*	*			trans	84.5	100.9	-178.5	-58.2	174.1	-15.9	0	0	113.7
1170	T	31.2	Very low	30.2	Very low	128 Å²	128	154 Å²	154	79%	0.785	80%	0.798	S	S	*	*			cis	80.2	145	39.8	75	0	0	0	0	114.4
1171	P	32.4	Very low	29.9	Very low	122 Å²	122	150.8 Å²	150.8	79%	0.792	80%	0.799	S	S	*	*			cis	-133.4	-169.2	19.7	42.9	-25.2	0	0	0	116.5
1172	L	27.2	Very low	29.8	Very low	145 Å²	145	143.3 Å²	143.3	76%	0.759	79%	0.794	S	S	*	*			trans	-77.5	154.6	178.1	-70.5	65.9	0	0	0	112.9
1173	T	31.4	Very low	29.5	Very low	148 Å²	148	141.6 Å²	141.6	91%	0.908	79%	0.794	S	S	*	*				-131.7	144.5	124.7	41.3	0	0	0	0	110.1
1174	T	26.1	Very low	29.5	Very low	115 Å²	115	140.5 Å²	140.5	71%	0.706	79%	0.794	S	S	*	*			trans	-97.6	145.7	174.9	46.6	0	0	0	0	110.3
1175	D	29.6	Very low	29.4	Very low	152 Å²	152	137.6 Å²	137.6	81%	0.813	79%	0.791	S	S	*	*			trans	-158.8	153.3	140.8	-114.7	-27.1	0	0	0	115.5
1176	L	31.1	Very low	29.4	Very low	146 Å²	146	140.7 Å²	140.7	76%	0.764	79%	0.794	S	S	*	*			trans	43	102	169.3	-80.1	73.8	0	0	0	120.3
1177	N	24.7	Very low	29.3	Very low	161 Å²	161	140 Å²	140	86%	0.861	79%	0.791	S	S	*	*			trans	-66.6	143.4	137.8	-71.5	-57.4	0	0	0	110
1178	V	29.1	Very low	29.1	Very low	127 Å²	127	140.3 Å²	140.3	77%	0.77	80%	0.795	S	S	*	*			trans	-163.3	127.6	147.1	128.8	0	0	0	0	112.9
1179	L	29	Very low	29	Very low	142 Å²	142	141.3 Å²	141.3	74%	0.743	79%	0.793	S	S	*	*			trans	50.9	93	152.8	-60.2	175.5	0	0	0	123.1
1180	T	27	Very low	28.8	Very low	116 Å²	116	142.5 Å²	142.5	71%	0.712	79%	0.792	S	S	*	*				57.9	126.7	115.2	57.7	0	0	0	0	124
1181	S	26.5	Very low	28.6	Very low	121 Å²	121	145.2 Å²	145.2	85%	0.846	79%	0.789	S	S	*	*			trans	69.7	114.6	135.7	64.5	0	0	0	0	121.3
1182	G	29.6	Very low	28.4	Very low	76 Å²	76	145.8 Å²	145.8	78%	0.784	79%	0.785	S	S	*	*			trans	-176.4	109	160.9	0	0	0	0	0	110.7
1183	N	26	Very low	28.4	Very low	159 Å²	159	148 Å²	148	85%	0.85	79%	0.789	S	S	*	*			trans	-79.5	128.9	-175	-70.7	-5.4	0	0	0	112.4
1184	V	31.6	Very low	28.3	Very low	144 Å²	144	146.3 Å²	146.3	87%	0.873	78%	0.778	S	S	*	*			trans	-135.6	149.7	145	-175.8	0	0	0	0	107.2
1185	T	28.6	Very low	28.3	Very low	112 Å²	112	149.4 Å²	149.4	69%	0.687	79%	0.787	S	S	*	*			trans	-106.5	169.8	-158.3	46.1	0	0	0	0	114.6
1186	E	30.2	Very low	28.2	Very low	168 Å²	168	151.9 Å²	151.9	79%	0.785	79%	0.785	S	S	*	*			trans	72.9	143.6	159	-71.8	-179.1	171.4	0	0	119.1
1187	N	29	Very low	28.2	Very low	150 Å²	150	152 Å²	152	80%	0.802	78%	0.782	S	S	*	*			cis	-158	114.1	-28.4	-131.9	-5.3	0	0	0	109.4
1188	N	28.4	Very low	28.3	Very low	153 Å²	153	148.5 Å²	148.5	82%	0.818	78%	0.775	S	S	*	*			trans	-165.6	95.4	176.3	-163.1	-14.1	0	0	0	112.7
1189	R	27.1	Very low	28.2	Very low	221 Å²	221	147.5 Å²	147.5	83%	0.834	77%	0.773	S	S	*	*			trans	177	150.3	154.1	-104.3	168.5	-167.2	-166.6	3.7	115.4
1190	Y	28.1	Very low	28.1	Very low	187 Å²	187	145.9 Å²	145.9	73%	0.733	77%	0.774	S	S	*	*			trans	91.1	105.8	147.7	-88.4	-132.9	0	0	0	122.2
1191	Y	28.4	Very low	28.3	Very low	184 Å²	184	147.5 Å²	147.5	72%	0.722	78%	0.776	S	S	*	*				58.1	125.6	113.1	-88	-87.6	0	0	0	121.8
1192	N	27.6	Very low	28.5	Very low	134 Å²	134	148.1 Å²	148.1	72%	0.717	77%	0.769	S	S	*	*			trans	26.6	136.4	138.5	-55.3	8.7	0	0	0	120
1193	F	27	Very low	28.5	Very low	191 Å²	191	152.3 Å²	152.3	84%	0.838	77%	0.769	S	S	*	*				167.1	145.8	91.1	-160.3	-129	0	0	0	113.5
1194	V	30	Very low	28.7	Very low	114 Å²	114	150.1 Å²	150.1	69%	0.691	76%	0.761	S	S	*	*			trans	65.8	131.3	160.5	160.3	0	0	0	0	121.4
1195	M	25.8	Very low	28.7	Very low	180 Å²	180	148.6 Å²	148.6	89%	0.887	75%	0.748	S	S	*	*			trans	-101.7	127.4	163.1	-109.6	-94.8	-84.2	0	0	110
1196	R	28	Very low	28.7	Very low	203 Å²	203	150.6 Å²	150.6	77%	0.766	75%	0.749	S	S	*	*			trans	-168.9	132.2	146.2	-115.3	-170	-175.8	-134.9	7.6	115.5
1197	Q	30	Very low	28.8	Very low	150 Å²	150	148.4 Å²	148.4	70%	0.701	75%	0.748	S	S	*	*			trans	61.5	107.3	142.4	-77.6	177.8	-31.6	0	0	121.8
1198	A	27.7	Very low	28.8	Very low	86 Å²	86	148 Å²	148	71%	0.711	74%	0.741	S	S	*	*				100	132.7	106.2	0	0	0	0	0	121.6
1199	S	26.7	Very low	28.9	Very low	106 Å²	106	149.8 Å²	149.8	74%	0.741	75%	0.747	S	S	*	*			trans	54.6	103.8	145	57.5	0	0	0	0	120.8
1200	S	27.6	Very low	29.1	Very low	109 Å²	109	147.2 Å²	147.2	76%	0.762	74%	0.742	S	S	*	*				46.8	117.4	110.8	-174.9	0	0	0	0	119.3
1201	M	29.8	Very low	29.5	Very low	150 Å²	150	144 Å²	144	74%	0.739	74%	0.744	S	S	*	*				-171.2	148.2	106.8	-100.3	174.7	73.6	0	0	112.5
1202	D	31.3	Very low	29.6	Very low	134 Å²	134	143.1 Å²	143.1	72%	0.717	75%	0.751	S	S	*	*			trans	53.2	172.3	152.3	-49.7	-5.4	0	0	0	121.7
1203	E	29.1	Very low	29.6	Very low	164 Å²	164	141.6 Å²	141.6	77%	0.766	75%	0.751	S	S	*	*				-168.7	159.1	-63.5	-153.5	-176.6	-140.5	0	0	106.7
1204	T	30.6	Very low	29.9	Very low	113 Å²	113	140.3 Å²	140.3	69%	0.693	75%	0.751	S	S	*	*			trans	66.3	157.2	169.8	77	0	0	0	0	116.2
1205	N	30.7	Very low	29.7	Very low	112 Å²	112	145 Å²	145	60%	0.599	76%	0.757	S	S	*	*			cis	-154.8	151.1	-2.2	-134.7	16.5	0	0	0	111.8
1206	E	30.4	Very low	30	Very low	153 Å²	153	147.8 Å²	147.8	72%	0.715	76%	0.757	S	S	*	*			trans	54.8	157.5	141.8	-68.7	173.5	-163	0	0	121.4
1207	T	32.2	Very low	30	Very low	122 Å²	122	148.3 Å²	148.3	75%	0.748	76%	0.759	S	S	*	*			cis	-149.5	176.6	-4	1.6	0	0	0	0	112.2
1208	E	27.6	Very low	30.1	Very low	142 Å²	142	146.1 Å²	146.1	66%	0.664	76%	0.76	S	S	*	*			trans	-44.9	154.9	178.6	-53.9	-174.3	95.8	0	0	118.6	K1210	E1208-K1210 IonicContact OE1-NZ 2.86Å; E1208-K1210 PolarHBondContact OE1-NZ 2.89Å
1209	M	31.4	Very low	30.4	Very low	191 Å²	191	147.5 Å²	147.5	94%	0.941	76%	0.76	S	S	*	*				-162.1	162.3	106	-103.6	-164.8	-173.6	0	0	114.3
1210	K	31.7	Very low	30.6	Very low	166 Å²	166	148.6 Å²	148.6	72%	0.722	76%	0.763	S	S	*	*			trans	-102.3	154.9	-166.2	-78.5	167	-179.9	116.8	0	113.8	E1208	E1208-K1210 IonicContact OE1-NZ 2.86Å; E1208-K1210 PolarHBondContact OE1-NZ 2.89Å
1211	P	34.9	Very low	30.7	Very low	120 Å²	120	146.7 Å²	146.7	78%	0.779	76%	0.76	S	S	*	*			trans	-79.3	159.3	-179.5	33.9	-37.1	0	0	0	113
1212	N	31.9	Very low	30.8	Very low	165 Å²	165	148 Å²	148	88%	0.882	77%	0.768	S	S	*	*			trans	-154.3	152.1	160.2	-125.7	-39	0	0	0	113
1213	S	27.4	Very low	30.8	Very low	102 Å²	102	147.9 Å²	147.9	71%	0.713	77%	0.773	S	S	*	*			trans	-86.7	143.4	-171.5	67.4	0	0	0	0	113.7
1214	I	33.1	Very low	31.1	Very low	164 Å²	164	145.9 Å²	145.9	84%	0.841	77%	0.774	S	S	*	*			trans	-120.7	119.3	156	-64.3	-176.4	0	0	0	109.9
1215	R	25.7	Very low	31.2	Very low	214 Å²	214	145.2 Å²	145.2	81%	0.808	77%	0.774	S	S	*	*			trans	-104.4	118.9	179.4	-172.8	-169.7	-159.7	-178.5	10.4	108.8
1216	R	32	Very low	31.3	Very low	238 Å²	238	147 Å²	147	90%	0.898	78%	0.783	S	S	*	*			trans	-119.2	159.4	160.8	-74.3	-166.3	175	-170.2	0.2	110.7
1217	R	28.9	Very low	31.3	Very low	214 Å²	214	147 Å²	147	81%	0.808	79%	0.785	S	S	*	*			trans	-149.6	175.9	-154	-157.9	-172.8	-161.4	-168	6	108
1218	S	32	Very low	31.2	Very low	103 Å²	103	147.3 Å²	147.3	72%	0.72	78%	0.782	S	S	*	*			trans	83.6	147.7	168.5	97.3	0	0	0	0	114.5
1219	T	32.8	Very low	31.3	Very low	115 Å²	115	145.5 Å²	145.5	71%	0.706	79%	0.785	S	S	*	*			cis	-152.5	156.3	3.9	-13.5	0	0	0	0	112.6
1220	T	32	Very low	31.2	Very low	130 Å²	130	143.5 Å²	143.5	80%	0.798	78%	0.777	S	S	*	*			trans	3.1	145.5	152.6	54	0	0	0	0	120.3
1221	G	28.7	Very low	31.1	Very low	68 Å²	68	141.2 Å²	141.2	70%	0.701	78%	0.777	S	S	*	*			cis	115.4	151.1	10.8	0	0	0	0	0	112.7
1222	I	31.4	Very low	31	Very low	178 Å²	178	139.7 Å²	139.7	91%	0.913	77%	0.769	S	S	*	*			trans	-163.9	162.3	167.6	-104.7	153.2	0	0	0	109.6
1223	T	32	Very low	30.9	Very low	132 Å²	132	139.8 Å²	139.8	81%	0.81	77%	0.768	S	S	*	*			trans	-114	167.1	-155.4	41.1	0	0	0	0	116.1
1224	P	34.8	Very low	31.1	Very low	121 Å²	121	141.2 Å²	141.2	79%	0.786	77%	0.767	S	S	*	*			trans	-105.7	169.7	-166.8	41.1	-36	0	0	0	115.1
1225	S	33.3	Very low	31.4	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	75%	0.753	S	S	*	*			trans	-170.5	138	152.5	57.5	0	0	0	0	113.4
1226	N	32.4	Very low	32.2	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	75%	0.749	S	S	*	*			trans	65.9	150.4	157.1	-56.3	-1.7	0	0	0	117.5
1227	M	31.1	Very low	32.5	Very low	154 Å²	154	128 Å²	128	76%	0.759	74%	0.737	S	S	*	*			cis	-147.8	146.4	-0.4	-142.5	165.8	173.4	0	0	112.2
1228	D	29.6	Very low	33.1	Very low	128 Å²	128	120.9 Å²	120.9	68%	0.684	71%	0.713	S	S	*	*			trans	22.4	132.5	154.4	-53.4	-21.2	0	0	0	123
1229	S	29.6	Very low	33.7	Very low	105 Å²	105	119.9 Å²	119.9	73%	0.734	70%	0.703	S	S	*	*				122.8	148.3	125.5	78.3	0	0	0	0	118.4
1230	I	29.8	Very low	34.4	Very low	148 Å²	148	119.9 Å²	119.9	76%	0.759	70%	0.697	S	S	*	*			trans	69.2	91.3	163.9	-55.9	171.1	0	0	0	117.1
1231	T	29.5	Very low	35.1	Very low	118 Å²	118	117 Å²	117	72%	0.724	68%	0.68	S	S	*	*			trans	-2.7	122.9	133.4	50.8	0	0	0	0	116
1232	S	31.8	Very low	35.8	Very low	88 Å²	88	120.8 Å²	120.8	62%	0.615	67%	0.672	S	S	*	*				-164.5	155.5	67.7	50.3	0	0	0	0	112.5
1233	I	30.1	Very low	36.7	Very low	168 Å²	168	117.7 Å²	117.7	86%	0.862	66%	0.657	S	S	*	*			trans	-111.6	95.2	174.5	-59.9	175.1	0	0	0	109.4
1234	N	32.7	Very low	37.2	Very low	131 Å²	131	113.8 Å²	113.8	70%	0.701	64%	0.638	S	S	*	*			trans	179.5	122.4	165.2	-88.8	-37.5	0	0	0	106.1
1235	D	38.8	Very low	37.6	Very low	100 Å²	100	112.8 Å²	112.8	54%	0.535	63%	0.626	S	S	.	*			trans	-179.6	2.6	160.5	-97.9	-12.9	0	0	0	115.9	N1237 E1238 T1239	D1235-N1237 PolarHBondContact O-N 3.38Å; D1235-E1238 HydrophobicContact CB-CB 4.16Å; D1235-E1238 WeakPolarHBondContact O-CA 3.23Å; D1235-E1238 PolarHBondContact O-N 3.45Å; D1235-E1238 WeakPolarHBondContact OD1-CB 3.33Å; D1235-T1239 PolarHBondContact O-N 3.39Å; D1235-T1239 VanDerWaalsContact O-N 3.07Å
1236	T	43	Very low	38	Very low	117 Å²	117	112.4 Å²	112.4	72%	0.718	62%	0.619	S	S	*	*	H	α-helix	trans	-57.8	-34.9	167.8	38.3	0	0	0	0	112.2	I1240	T1236-I1240 PolarHBondContact O-N 3.43Å
1237	N	38.4	Very low	38.4	Very low	123 Å²	123	113.3 Å²	113.3	66%	0.658	61%	0.611	S	S	*	*	H	α-helix	trans	-64.6	-39.8	169.5	-74.9	-6.3	0	0	0	111.8	D1235 T1239 I1240 T1241	D1235-N1237 PolarHBondContact O-N 3.38Å; N1237-T1239 VanDerWaalsContact C-N 3.32Å; N1237-T1239 PolarHBondContact O-N 2.81Å; N1237-I1240 PolarHBondContact O-N 3.28Å; N1237-I1240 VanDerWaalsContact O-N 3.15Å; N1237-T1241 WeakPolarHBondContact O-CB 3.23Å; N1237-T1241 PolarHBondContact O-N 2.84Å; N1237-T1241 PolarHBondContact O-OG1 2.95Å
1238	E	40.5	Very low	38.9	Very low	63 Å²	63	111 Å²	111	29%	0.294	60%	0.601	S	S	.	*	H	α-helix	trans	-69.1	-29.6	-177.4	-157.2	-109.3	179.8	0	0	112.3	D1235 T1241 R1242	D1235-E1238 HydrophobicContact CB-CB 4.16Å; D1235-E1238 WeakPolarHBondContact O-CA 3.23Å; D1235-E1238 PolarHBondContact O-N 3.45Å; D1235-E1238 WeakPolarHBondContact OD1-CB 3.33Å; E1238-T1241 PolarHBondContact O-N 2.83Å; E1238-R1242 VanDerWaalsContact O-CB 3.32Å; E1238-R1242 WeakPolarHBondContact O-CB 3.37Å; E1238-R1242 VanDerWaalsContact O-CG 3.29Å; E1238-R1242 WeakPolarHBondContact O-CG 3.42Å; E1238-R1242 PolarHBondContact O-N 3.45Å; E1238-R1242 IonicContact OE1-CZ 2.7Å; E1238-R1242 IonicContact OE1-NE 2.69Å; E1238-R1242 PolarHBondContact OE1-NE 2.87Å; E1238-R1242 IonicContact OE1-NH2 2.84Å; E1238-R1242 PolarHBondContact OE1-NH2 3.38Å; E1238-R1242 IonicContact OE2-CZ 3.93Å; E1238-R1242 IonicContact OE2-NE 3.15Å; E1238-R1242 PolarHBondContact OE2-NE 3.38Å; E1238-R1242 IonicContact OE2-NH1 3.87Å; E1238-R1242 IonicContact OE2-NH2 2.78Å; E1238-R1242 PolarHBondContact OE2-NH2 2.99Å
1239	T	44.5	Very low	39.5	Very low	83 Å²	83	108.6 Å²	108.6	51%	0.509	60%	0.599	S	S	.	*	H	α-helix	trans	-66.5	-42.3	169.5	-61.1	0	0	0	0	112.1	D1235 N1237 R1242 I1243	D1235-T1239 PolarHBondContact O-N 3.39Å; D1235-T1239 VanDerWaalsContact O-N 3.07Å; N1237-T1239 VanDerWaalsContact C-N 3.32Å; N1237-T1239 PolarHBondContact O-N 2.81Å; T1239-R1242 PolarHBondContact O-N 3.47Å; T1239-I1243 HydrophobicContact CG2-CD1 4.43Å; T1239-I1243 WeakPolarHBondContact O-CG1 3.47Å; T1239-I1243 PolarHBondContact O-N 2.93Å
1240	I	48.8	Very low	40.1	Very low	115 Å²	115	108.8 Å²	108.8	59%	0.59	59%	0.589	S	S	*	*	H	α-helix	trans	-66.5	-42.8	175.1	-64.7	169.2	0	0	0	110.3	T1236 N1237 R1242 I1243 A1244	T1236-I1240 PolarHBondContact O-N 3.43Å; N1237-I1240 PolarHBondContact O-N 3.28Å; N1237-I1240 VanDerWaalsContact O-N 3.15Å; I1240-R1242 PolarHBondContact O-N 3.43Å; I1240-I1243 PolarHBondContact O-N 3.21Å; I1240-A1244 PolarHBondContact O-N 3.22Å
1241	T	45.2	Very low	40.2	Very low	70 Å²	70	107.8 Å²	107.8	43%	0.429	58%	0.584	S	S	.	*	H	α-helix	trans	-64.1	-36.7	174.6	-59.2	0	0	0	0	111.9	N1237 E1238 A1244 L1245	N1237-T1241 WeakPolarHBondContact O-CB 3.23Å; N1237-T1241 PolarHBondContact O-N 2.84Å; N1237-T1241 PolarHBondContact O-OG1 2.95Å; E1238-T1241 PolarHBondContact O-N 2.83Å; T1241-A1244 PolarHBondContact O-N 3.35Å; T1241-L1245 HydrophobicContact CG2-CD1 3.78Å; T1241-L1245 HydrophobicContact CG2-CG 4.1Å; T1241-L1245 VanDerWaalsContact O-CB 3.22Å; T1241-L1245 WeakPolarHBondContact O-CB 3.34Å; T1241-L1245 VanDerWaalsContact O-CG 3.22Å; T1241-L1245 WeakPolarHBondContact O-CG 3.33Å; T1241-L1245 PolarHBondContact O-N 3.1Å
1242	R	43.7	Very low	40.4	Very low	146 Å²	146	110.3 Å²	110.3	55%	0.551	59%	0.587	S	S	*	*	H	α-helix	trans	-67	-38.2	173	-79.8	-177.5	-172.1	175.4	16.5	112.1	E1238 T1239 I1240 L1245 T1246	E1238-R1242 VanDerWaalsContact O-CB 3.32Å; E1238-R1242 WeakPolarHBondContact O-CB 3.37Å; E1238-R1242 VanDerWaalsContact O-CG 3.29Å; E1238-R1242 WeakPolarHBondContact O-CG 3.42Å; E1238-R1242 PolarHBondContact O-N 3.45Å; E1238-R1242 IonicContact OE1-CZ 2.7Å; E1238-R1242 IonicContact OE1-NE 2.69Å; E1238-R1242 PolarHBondContact OE1-NE 2.87Å; E1238-R1242 IonicContact OE1-NH2 2.84Å; E1238-R1242 PolarHBondContact OE1-NH2 3.38Å; E1238-R1242 IonicContact OE2-CZ 3.93Å; E1238-R1242 IonicContact OE2-NE 3.15Å; E1238-R1242 PolarHBondContact OE2-NE 3.38Å; E1238-R1242 IonicContact OE2-NH1 3.87Å; E1238-R1242 IonicContact OE2-NH2 2.78Å; E1238-R1242 PolarHBondContact OE2-NH2 2.99Å; T1239-R1242 PolarHBondContact O-N 3.47Å; I1240-R1242 PolarHBondContact O-N 3.43Å; R1242-L1245 PolarHBondContact O-N 3.48Å; R1242-T1246 VanDerWaalsContact O-CB 3.27Å; R1242-T1246 WeakPolarHBondContact O-CB 3.48Å; R1242-T1246 PolarHBondContact O-N 3.3Å; R1242-T1246 PolarHBondContact O-OG1 3.35Å
1243	I	51.8	Low	40.4	Very low	113 Å²	113	112.8 Å²	112.8	58%	0.579	60%	0.599	S	S	*	*	H	α-helix	trans	-65.1	-43.6	173.7	-68.2	166.8	0	0	0	110.3	T1239 I1240 T1246 R1247	T1239-I1243 HydrophobicContact CG2-CD1 4.43Å; T1239-I1243 WeakPolarHBondContact O-CG1 3.47Å; T1239-I1243 PolarHBondContact O-N 2.93Å; I1240-I1243 PolarHBondContact O-N 3.21Å; I1243-T1246 PolarHBondContact O-N 3.29Å; I1243-R1247 PolarHBondContact O-N 2.9Å; I1243-R1247 VanDerWaalsContact O-N 3.15Å
1244	A	41.7	Very low	40.5	Very low	51 Å²	51	111 Å²	111	42%	0.421	60%	0.595	S	S	.	*	H	α-helix	trans	-64.3	-43.9	174.9	0	0	0	0	0	112.9	I1240 T1241 R1247 L1248	I1240-A1244 PolarHBondContact O-N 3.22Å; T1241-A1244 PolarHBondContact O-N 3.35Å; A1244-R1247 PolarHBondContact O-N 3.45Å; A1244-L1248 WeakPolarHBondContact O-CG 3.3Å; A1244-L1248 PolarHBondContact O-N 3.29Å
1245	L	42.4	Very low	40.6	Very low	100 Å²	100	109.9 Å²	109.9	52%	0.524	60%	0.598	S	S	.	*	H	α-helix	trans	-68.6	-34.2	177.6	-75.5	174.6	0	0	0	112.4	T1241 R1242 R1247 L1248 A1249	T1241-L1245 HydrophobicContact CG2-CD1 3.78Å; T1241-L1245 HydrophobicContact CG2-CG 4.1Å; T1241-L1245 VanDerWaalsContact O-CB 3.22Å; T1241-L1245 WeakPolarHBondContact O-CB 3.34Å; T1241-L1245 VanDerWaalsContact O-CG 3.22Å; T1241-L1245 WeakPolarHBondContact O-CG 3.33Å; T1241-L1245 PolarHBondContact O-N 3.1Å; R1242-L1245 PolarHBondContact O-N 3.48Å; L1245-R1247 VanDerWaalsContact C-N 3.33Å; L1245-L1248 HydrophobicContact CD2-CD1 4.28Å; L1245-L1248 PolarHBondContact O-N 3.13Å; L1245-A1249 WeakPolarHBondContact O-CB 3.41Å; L1245-A1249 PolarHBondContact O-N 3.1Å
1246	T	43	Very low	40.2	Very low	91 Å²	91	114 Å²	114	56%	0.558	61%	0.614	S	S	*	*	H	α-helix	trans	-66.2	-38.3	174.4	-55.5	0	0	0	0	110.6	R1242 I1243 A1249 E1250	R1242-T1246 VanDerWaalsContact O-CB 3.27Å; R1242-T1246 WeakPolarHBondContact O-CB 3.48Å; R1242-T1246 PolarHBondContact O-N 3.3Å; R1242-T1246 PolarHBondContact O-OG1 3.35Å; I1243-T1246 PolarHBondContact O-N 3.29Å; T1246-A1249 PolarHBondContact O-N 3.29Å; T1246-E1250 PolarHBondContact O-N 2.93Å
1247	R	41.2	Very low	40.1	Very low	167 Å²	167	114.1 Å²	114.1	63%	0.63	62%	0.617	S	S	*	*	H	α-helix	trans	-71.4	-31.3	172	-70.6	-55.7	-166.8	-173.2	-0.8	113.7	I1243 A1244 L1245 E1250	I1243-R1247 PolarHBondContact O-N 2.9Å; I1243-R1247 VanDerWaalsContact O-N 3.15Å; A1244-R1247 PolarHBondContact O-N 3.45Å; L1245-R1247 VanDerWaalsContact C-N 3.33Å; R1247-E1250 WeakPolarHBondContact CD-OE2 3.33Å; R1247-E1250 IonicContact CZ-OE2 3.97Å; R1247-E1250 IonicContact NE-OE2 3.12Å; R1247-E1250 VanDerWaalsContact NH1-CD 3.3Å; R1247-E1250 IonicContact NH1-OE1 3.55Å; R1247-E1250 PolarHBondContact NH1-OE1 3.33Å; R1247-E1250 VanDerWaalsContact NH1-OE1 3.07Å; R1247-E1250 IonicContact NH1-OE2 2.73Å; R1247-E1250 PolarHBondContact NH1-OE2 2.88Å
1248	L	41.1	Very low	39.6	Very low	106 Å²	106	121.3 Å²	121.3	56%	0.555	65%	0.646	S	S	*	*	H	α-helix	trans	-70.6	-30.4	170.3	-77.9	161.4	0	0	0	112.4	A1244 L1245 E1250 L1251	A1244-L1248 WeakPolarHBondContact O-CG 3.3Å; A1244-L1248 PolarHBondContact O-N 3.29Å; L1245-L1248 HydrophobicContact CD2-CD1 4.28Å; L1245-L1248 PolarHBondContact O-N 3.13Å; L1248-E1250 VanDerWaalsContact C-N 3.28Å; L1248-E1250 PolarHBondContact O-N 2.84Å; L1248-L1251 HydrophobicContact CD2-CD1 4.44Å; L1248-L1251 WeakPolarHBondContact O-CB 3.46Å; L1248-L1251 PolarHBondContact O-N 3.06Å
1249	A	42.6	Very low	39.5	Very low	77 Å²	77	124.2 Å²	124.2	64%	0.636	66%	0.664	S	S	*	*	H	α-helix	trans	-71.8	-18	178.2	0	0	0	0	0	113.9	L1245 T1246 L1251	L1245-A1249 WeakPolarHBondContact O-CB 3.41Å; L1245-A1249 PolarHBondContact O-N 3.1Å; T1246-A1249 PolarHBondContact O-N 3.29Å; A1249-L1251 VanDerWaalsContact C-N 3.29Å
1250	E	41.1	Very low	39.3	Very low	110 Å²	110	126.4 Å²	126.4	51%	0.514	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.8	-22.8	172.5	-68.7	174.3	138.6	0	0	111.9	T1246 R1247 L1248 H1252	T1246-E1250 PolarHBondContact O-N 2.93Å; R1247-E1250 WeakPolarHBondContact CD-OE2 3.33Å; R1247-E1250 IonicContact CZ-OE2 3.97Å; R1247-E1250 IonicContact NE-OE2 3.12Å; R1247-E1250 VanDerWaalsContact NH1-CD 3.3Å; R1247-E1250 IonicContact NH1-OE1 3.55Å; R1247-E1250 PolarHBondContact NH1-OE1 3.33Å; R1247-E1250 VanDerWaalsContact NH1-OE1 3.07Å; R1247-E1250 IonicContact NH1-OE2 2.73Å; R1247-E1250 PolarHBondContact NH1-OE2 2.88Å; L1248-E1250 VanDerWaalsContact C-N 3.28Å; L1248-E1250 PolarHBondContact O-N 2.84Å; E1250-H1252 PolarHBondContact O-N 2.86Å; E1250-H1252 VanDerWaalsContact O-N 3.11Å; E1250-H1252 PolarHBondContact O-ND1 2.81Å; E1250-H1252 VanDerWaalsContact O-ND1 3.11Å
1251	L	32.5	Very low	38.7	Very low	127 Å²	127	127 Å²	127	67%	0.665	68%	0.677	S	S	*	*	S	Bend	trans	-77.2	95.4	175.1	-70.9	168.8	0	0	0	111.1	L1248 A1249 V1253	L1248-L1251 HydrophobicContact CD2-CD1 4.44Å; L1248-L1251 WeakPolarHBondContact O-CB 3.46Å; L1248-L1251 PolarHBondContact O-N 3.06Å; A1249-L1251 VanDerWaalsContact C-N 3.29Å; L1251-V1253 PolarHBondContact O-N 3.39Å
1252	H	33.1	Very low	38.4	Very low	171 Å²	171	130.4 Å²	130.4	79%	0.792	69%	0.691	S	S	*	*			trans	-60.7	105.7	-178.3	-80.2	55.9	0	0	0	113.1	E1250 T1254	E1250-H1252 PolarHBondContact O-N 2.86Å; E1250-H1252 VanDerWaalsContact O-N 3.11Å; E1250-H1252 PolarHBondContact O-ND1 2.81Å; E1250-H1252 VanDerWaalsContact O-ND1 3.11Å; H1252-T1254 PolarHBondContact O-N 2.85Å
1253	V	31.7	Very low	38	Very low	140 Å²	140	129.4 Å²	129.4	85%	0.848	70%	0.7	S	S	*	*			trans	-75.2	102	164.7	178.6	0	0	0	0	108.8	L1251 S1255	L1251-V1253 PolarHBondContact O-N 3.39Å; V1253-S1255 PolarHBondContact O-N 2.8Å
1254	T	33.3	Very low	37.1	Very low	129 Å²	129	130.5 Å²	130.5	79%	0.791	71%	0.708	S	S	*	*			trans	-78.5	111.9	168.1	41.2	0	0	0	0	110.1	H1252	H1252-T1254 PolarHBondContact O-N 2.85Å
1255	S	34.8	Very low	36.8	Very low	108 Å²	108	136.1 Å²	136.1	76%	0.755	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-62.8	132.4	178.4	53.1	0	0	0	0	112.3	V1253	V1253-S1255 PolarHBondContact O-N 2.8Å
1256	Q	30	Very low	36.3	Very low	188 Å²	188	138.9 Å²	138.9	88%	0.879	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-77.9	138.3	161.9	-65.7	-163.4	-78.9	0	0	110.4
1257	P	39.9	Very low	35.8	Very low	119 Å²	119	142.9 Å²	142.9	77%	0.773	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-88.1	129.4	161.3	32.9	-28.1	0	0	0	110.9
1258	E	28.2	Very low	35.3	Very low	273 Å²	273	140.7 Å²	140.7	100%	1.276	77%	0.771	S	S	*	*			trans	60.6	0	175.7	-57	-164.4	157.8	0	0	118.1

Retrieved 1,258 of 1,258 residues in 257.5 ms (Link to these results)

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